A0A3Q0KK44_SCHMA Loading...

Peptidase A2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KK44, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 438 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.8	Very low	36.9	Very low	233 Å²	233	156.3 Å²	156.3	100%	1.148	78%	0.78	S	S	*	*				0	141.8	0	-76.1	156.5	165.5	0	0	107.4
2	E	38.6	Very low	37.3	Very low	184 Å²	184	157.6 Å²	157.6	86%	0.86	79%	0.79	S	S	*	*			trans	46.1	104.8	158.8	-65.2	163.1	-174.1	0	0	117.1
3	V	31.4	Very low	37.2	Very low	115 Å²	115	156.9 Å²	156.9	70%	0.697	79%	0.791	S	S	*	*			cis	79.2	136.2	38.9	-160.6	0	0	0	0	114.5
4	F	36.7	Very low	37.4	Very low	176 Å²	176	158.3 Å²	158.3	77%	0.772	79%	0.793	S	S	*	*			trans	81	108.7	178.5	-55	-74.1	0	0	0	115.7
5	T	36.5	Very low	37.7	Very low	112 Å²	112	154.7 Å²	154.7	69%	0.687	79%	0.785	S	S	*	*				57.4	140.6	58.3	81.2	0	0	0	0	112.5
6	K	39.4	Very low	37.8	Very low	189 Å²	189	152.5 Å²	152.5	82%	0.822	79%	0.785	S	S	*	*			cis	-175.4	171.1	24.8	-118.1	161.7	177.8	179.7	0	105.4
7	K	36.4	Very low	38.1	Very low	172 Å²	172	151.1 Å²	151.1	75%	0.748	78%	0.784	S	S	*	*			cis	-167.9	158.3	-14.8	-154.8	-158.6	167.8	-137.2	0	107
8	C	35.9	Very low	38.3	Very low	73 Å²	73	150.7 Å²	150.7	49%	0.493	78%	0.782	S	S	.	*			trans	64.7	117.7	156.6	-73.1	0	0	0	0	118.3
9	D	35.6	Very low	38.3	Very low	139 Å²	139	148.9 Å²	148.9	74%	0.743	78%	0.781	S	S	*	*				78.1	112.1	72.3	-65.6	-45.2	0	0	0	112.3
10	E	41.4	Very low	38.5	Very low	191 Å²	191	148.4 Å²	148.4	89%	0.893	78%	0.783	S	S	*	*				-164.9	155.3	101.7	-104.3	179	174.2	0	0	112.3
11	N	36.7	Very low	38.3	Very low	135 Å²	135	150 Å²	150	72%	0.722	78%	0.784	S	S	*	*			trans	-74.1	159.9	-175.7	-73.4	-89.7	0	0	0	112.4
12	L	41.3	Very low	38.3	Very low	172 Å²	172	144.3 Å²	144.3	90%	0.901	76%	0.764	S	S	*	*				-161.8	136.2	119.8	-103.2	162.4	0	0	0	110.9
13	N	35.7	Very low	38.4	Very low	149 Å²	149	140.1 Å²	140.1	80%	0.797	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-74.4	124.6	-171.7	-65	-69.1	0	0	0	112.4
14	E	39.9	Very low	38.8	Very low	176 Å²	176	141.3 Å²	141.3	82%	0.822	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-101.8	130.7	162.3	-166.7	172.5	-159.8	0	0	109.2
15	P	42.7	Very low	38.6	Very low	104 Å²	104	136.6 Å²	136.6	68%	0.675	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-71.8	153.2	-178.1	30.2	-35.1	0	0	0	111.6	V17	P15-V17 PolarHBondContact O-N 3.1Å
16	P	39.1	Very low	38.9	Very low	120 Å²	120	136.5 Å²	136.5	78%	0.779	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-65.1	126.7	-171.6	26.3	-34.8	0	0	0	112	I18	P16-I18 PolarHBondContact O-N 3.39Å
17	V	42.9	Very low	39.4	Very low	128 Å²	128	131.5 Å²	131.5	78%	0.776	77%	0.767	S	S	*	*			trans	-62.2	104.3	171.5	178.6	0	0	0	0	108.9	P15 P19	P15-V17 PolarHBondContact O-N 3.1Å; V17-P19 WeakPolarHBondContact O-CD 3.47Å
18	I	41.4	Very low	40.2	Very low	144 Å²	144	126.2 Å²	126.2	74%	0.738	75%	0.751	S	S	*	*			trans	-63.7	122.5	173.5	-59.2	175.3	0	0	0	107.7	P16 V20	P16-I18 PolarHBondContact O-N 3.39Å; I18-V20 PolarHBondContact O-N 3.49Å
19	P	38.6	Very low	41.7	Very low	117 Å²	117	134.4 Å²	134.4	76%	0.76	77%	0.771	S	S	*	*			trans	-63.2	114.6	176.7	-20.9	32.9	0	0	0	109.8	V17 K21	V17-P19 WeakPolarHBondContact O-CD 3.47Å; P19-K21 VanDerWaalsContact C-N 3.33Å; P19-K21 PolarHBondContact O-N 3.46Å
20	V	42.3	Very low	43.9	Very low	138 Å²	138	134.4 Å²	134.4	84%	0.836	77%	0.767	S	S	*	*			trans	-66.7	97.4	170.8	179.7	0	0	0	0	107.3	I18 P22	I18-V20 PolarHBondContact O-N 3.49Å; V20-P22 VanDerWaalsContact O-N 3.15Å
21	K	33.9	Very low	46	Very low	184 Å²	184	125.9 Å²	125.9	80%	0.8	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-52.8	119.7	173.7	-175	175.2	-176.4	175.5	0	107.8	P19 A23	P19-K21 VanDerWaalsContact C-N 3.33Å; P19-K21 PolarHBondContact O-N 3.46Å; K21-A23 PolarHBondContact O-N 3.07Å
22	P	37.4	Very low	48.5	Very low	112 Å²	112	122.5 Å²	122.5	73%	0.727	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-60.1	130.1	179.9	24.5	-32.8	0	0	0	108.2	V20 T24	V20-P22 VanDerWaalsContact O-N 3.15Å; P22-T24 PolarHBondContact O-N 2.96Å
23	A	40.9	Very low	51	Low	96 Å²	96	117.9 Å²	117.9	79%	0.793	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-54.7	126.9	174.7	0	0	0	0	0	108.3	K21 G25	K21-A23 PolarHBondContact O-N 3.07Å; A23-G25 PolarHBondContact O-N 3.41Å
24	T	40.9	Very low	53.7	Low	141 Å²	141	110.8 Å²	110.8	87%	0.865	65%	0.651	S	S	*	*			trans	-51.4	113.6	-178.9	-11.3	0	0	0	0	108.4	P22 S26	P22-T24 PolarHBondContact O-N 2.96Å; T24-S26 PolarHBondContact O-N 3.2Å
25	G	32.2	Very low	56	Low	76 Å²	76	107.3 Å²	107.3	78%	0.784	64%	0.635	S	S	*	*			trans	-59.6	107	-171.2	0	0	0	0	0	110.3	A23 A27	A23-G25 PolarHBondContact O-N 3.41Å; G25-A27 PolarHBondContact O-N 3.24Å; G25-A27 VanDerWaalsContact O-N 3.07Å
26	S	42.2	Very low	57.6	Low	111 Å²	111	108 Å²	108	78%	0.776	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-60.9	116.7	171.9	59.9	0	0	0	0	107.4	T24	T24-S26 PolarHBondContact O-N 3.2Å
27	A	49.6	Very low	59.4	Low	83 Å²	83	107.5 Å²	107.5	69%	0.686	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-48.6	132.9	170.6	0	0	0	0	0	108.3	G25 R29	G25-A27 PolarHBondContact O-N 3.24Å; G25-A27 VanDerWaalsContact O-N 3.07Å; A27-R29 PolarHBondContact O-N 2.98Å; A27-R29 VanDerWaalsContact O-N 3.09Å
28	P	53.1	Low	61.4	Low	62 Å²	62	103.5 Å²	103.5	40%	0.403	61%	0.61	S	S	.	*	P	Polyproline II helix	trans	-57.4	123.5	-177.4	24.1	-33.2	0	0	0	108.5	Q30 K53	P28-Q30 PolarHBondContact O-N 3.25Å; P28-K53 HydrophobicContact CG-CD 4.25Å
29	R	67	Low	63.5	Low	244 Å²	244	101.1 Å²	101.1	92%	0.921	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-50.7	119.8	179.4	-71.7	-173.2	-179.7	-170.1	0.4	108.5	A27	A27-R29 PolarHBondContact O-N 2.98Å; A27-R29 VanDerWaalsContact O-N 3.09Å
30	Q	82.1	Confident	66	Low	140 Å²	140	96 Å²	96	65%	0.654	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-57.3	141.3	175.6	-74.2	171.2	-40.8	0	0	109.1	P28 Y50 Y66	P28-Q30 PolarHBondContact O-N 3.25Å; Q30-Y50 HydrophobicContact CG-CE2 4.15Å; Q30-Y66 HydrophobicContact CB-CE1 4.24Å
31	P	85.9	Confident	68.2	Low	11 Å²	11	94.5 Å²	94.5	7%	0.071	56%	0.556	C	S	.	*	P	Polyproline II helix	trans	-52	146.7	169.7	-26.1	32.8	0	0	0	111.9	K46 V47 Y50 Y66	P31-K46 HydrophobicContact CB-CB 4.34Å; P31-K46 HydrophobicContact CG-CB 4.47Å; P31-V47 HydrophobicContact CB-CG2 3.54Å; P31-V47 HydrophobicContact CG-CB 4.42Å; P31-V47 HydrophobicContact CG-CG2 3.79Å; P31-Y50 HydrophobicContact CG-CD2 4.4Å; P31-Y50 HydrophobicContact CG-CG 4.08Å; P31-Y66 HydrophobicContact CB-CD1 3.89Å; P31-Y66 HydrophobicContact CB-CD2 4.47Å; P31-Y66 HydrophobicContact CB-CE1 4.02Å; P31-Y66 HydrophobicContact CB-CG 4.16Å; P31-Y66 HydrophobicContact CG-CD1 4.43Å; P31-Y66 HydrophobicContact CG-CD2 4.39Å; P31-Y66 HydrophobicContact CG-CE1 4.2Å; P31-Y66 HydrophobicContact CG-CE2 4.16Å; P31-Y66 WeakPolarHBondContact O-CD1 3.18Å; P31-Y66 VanDerWaalsContact O-CE1 3.28Å; P31-Y66 WeakPolarHBondContact O-CE1 3.37Å
32	P	89.6	Confident	70.8	Confident	64 Å²	64	88.9 Å²	88.9	42%	0.416	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-69.3	161.3	169.1	32.2	-34.6	0	0	0	110.5	W43 K46	P32-W43 PolarHBondContact O-NE1 3.03Å; P32-K46 HydrophobicContact CG-CD 4.48Å
33	L	93.3	Very high	73.4	Confident	75 Å²	75	83.7 Å²	83.7	39%	0.393	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-62.7	143	169.7	-160.4	70	0	0	0	110.5	E35 Y66 L67	L33-E35 PolarHBondContact O-N 2.67Å; L33-Y66 CarbonylContact C-O 3.38Å; L33-L67 VanDerWaalsContact CD1-C 3.48Å; L33-L67 WeakPolarHBondContact CD1-O 3.48Å
34	L	93	Very high	76	Confident	1 Å²	1	81.7 Å²	81.7	1%	0.005	48%	0.476	C	S	.	.	B	Isolated β-bridge	trans	-81.9	107.2	171.6	-170.4	70.4	0	0	0	109.6	Y40 W43 Y66 L67 S68 A71 F97	L34-Y40 HydrophobicContact CD1-CD2 4.05Å; L34-Y40 HydrophobicContact CD2-CD2 3.96Å; L34-Y40 HydrophobicContact CD2-CE2 4.38Å; L34-W43 HydrophobicContact CB-CD2 4.04Å; L34-W43 HydrophobicContact CB-CG 4.25Å; L34-W43 HydrophobicContact CB-CZ2 4.05Å; L34-W43 HydrophobicContact CD1-CB 3.87Å; L34-W43 HydrophobicContact CD1-CD2 3.81Å; L34-W43 HydrophobicContact CD1-CE3 4.17Å; L34-W43 HydrophobicContact CD1-CG 3.66Å; L34-W43 HydrophobicContact CD2-CD2 4.38Å; L34-W43 HydrophobicContact CD2-CE3 4.24Å; L34-W43 HydrophobicContact CD2-CZ3 4.3Å; L34-W43 HydrophobicContact CG-CD2 4.3Å; L34-W43 HydrophobicContact CG-CG 4.49Å; L34-Y66 PolarHBondContact N-O 3.43Å; L34-L67 HydrophobicContact CB-CD2 3.99Å; L34-L67 HydrophobicContact CD2-CD2 3.61Å; L34-L67 HydrophobicContact CG-CD2 4.45Å; L34-S68 VanDerWaalsContact O-CB 3.26Å; L34-S68 WeakPolarHBondContact O-CB 3.41Å; L34-S68 PolarHBondContact O-N 3.28Å; L34-S68 VanDerWaalsContact O-N 3.15Å; L34-S68 PolarHBondContact O-OG 3.2Å; L34-A71 HydrophobicContact CD2-CB 4.43Å; L34-F97 HydrophobicContact CD2-CB 4.35Å; L34-F97 HydrophobicContact CD2-CD1 3.96Å; L34-F97 HydrophobicContact CD2-CD2 3.76Å; L34-F97 HydrophobicContact CD2-CE1 4.2Å; L34-F97 HydrophobicContact CD2-CE2 4.04Å; L34-F97 HydrophobicContact CD2-CG 3.75Å; L34-F97 HydrophobicContact CD2-CZ 4.26Å
35	E	86.9	Confident	78.4	Confident	103 Å²	103	82.4 Å²	82.4	48%	0.481	47%	0.467	S	S	.	.			trans	-102.3	162.6	171.3	-63.1	176.3	-177.8	0	0	110.7	L33 S37 S38	L33-E35 PolarHBondContact O-N 2.67Å; E35-S37 PolarHBondContact O-N 2.87Å; E35-S38 PolarHBondContact N-OG 3.36Å; E35-S38 VanDerWaalsContact O-CB 3.24Å; E35-S38 WeakPolarHBondContact O-CB 2.82Å; E35-S38 PolarHBondContact O-N 2.98Å; E35-S38 PolarHBondContact O-OG 3.01Å
36	N	76.3	Confident	81.3	Confident	119 Å²	119	83.5 Å²	83.5	64%	0.636	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-21.9	-177.6	-72.3	-31	0	0	0	114.7
37	S	77.6	Confident	83.7	Confident	108 Å²	108	78.2 Å²	78.2	76%	0.755	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	1.5	175.8	49.1	0	0	0	0	114.3	E35	E35-S37 PolarHBondContact O-N 2.87Å
38	S	84.2	Confident	85.8	Confident	44 Å²	44	76.5 Å²	76.5	31%	0.308	39%	0.394	S	S	.	.	S	Bend	trans	-75	142.5	-179.7	-69.6	0	0	0	0	112	E35 Y40	E35-S38 PolarHBondContact N-OG 3.36Å; E35-S38 VanDerWaalsContact O-CB 3.24Å; E35-S38 WeakPolarHBondContact O-CB 2.82Å; E35-S38 PolarHBondContact O-N 2.98Å; E35-S38 PolarHBondContact O-OG 3.01Å; S38-Y40 PolarHBondContact O-N 3.25Å
39	D	86.2	Confident	87.7	Confident	95 Å²	95	75.4 Å²	75.4	51%	0.508	39%	0.391	S	S	.	.			trans	-68.1	100.5	166.7	-177.5	-29	0	0	0	109.1	T41 V42 W43	D39-T41 PolarHBondContact O-N 3.28Å; D39-T41 WeakPolarHBondContact OD1-CA 3.24Å; D39-T41 VanDerWaalsContact OD1-CB 3.3Å; D39-T41 WeakPolarHBondContact OD1-CB 3.27Å; D39-T41 PolarHBondContact OD1-N 3.41Å; D39-V42 HydrophobicContact CB-CB 4.07Å; D39-V42 HydrophobicContact CB-CG2 4.18Å; D39-V42 PolarHBondContact O-N 3.21Å; D39-V42 PolarHBondContact OD1-N 2.9Å; D39-V42 WeakPolarHBondContact OD2-CG2 3.19Å; D39-W43 WeakPolarHBondContact O-CB 3.42Å; D39-W43 PolarHBondContact O-N 2.85Å
40	Y	91.9	Very high	88.9	Confident	10 Å²	10	65.5 Å²	65.5	4%	0.039	35%	0.354	C	S	.	.	H	α-helix	trans	-58.5	-33.7	179.6	175.2	-108.6	0	0	0	113.1	L34 S38 W43 K44 L93 D94 F97 S98	L34-Y40 HydrophobicContact CD1-CD2 4.05Å; L34-Y40 HydrophobicContact CD2-CD2 3.96Å; L34-Y40 HydrophobicContact CD2-CE2 4.38Å; S38-Y40 PolarHBondContact O-N 3.25Å; Y40-W43 AromaticContact CD2-CE3 3.87Å; Y40-W43 HydrophobicContact CD2-CE3 3.87Å; Y40-W43 HydrophobicContact CD2-CZ3 4.33Å; Y40-W43 AromaticContact CE2-CE3 3.76Å; Y40-W43 HydrophobicContact CE2-CE3 3.76Å; Y40-W43 AromaticContact CE2-CZ3 3.8Å; Y40-W43 HydrophobicContact CE2-CZ3 3.8Å; Y40-W43 PolarHBondContact O-N 3.25Å; Y40-K44 HydrophobicContact CE1-CD 4.17Å; Y40-K44 HydrophobicContact CE2-CB 4.46Å; Y40-K44 WeakPolarHBondContact O-CB 3.49Å; Y40-K44 PolarHBondContact O-N 2.89Å; Y40-L93 HydrophobicContact CE2-CB 4.1Å; Y40-L93 VanDerWaalsContact OH-C 3.24Å; Y40-L93 VanDerWaalsContact OH-CB 3.29Å; Y40-L93 WeakPolarHBondContact OH-CB 3.46Å; Y40-D94 WeakPolarHBondContact CE1-OD1 3.06Å; Y40-D94 PolarHBondContact OH-N 2.8Å; Y40-D94 PolarHBondContact OH-OD1 2.83Å; Y40-F97 WeakPolarHBondContact CB-O 3.21Å; Y40-F97 HydrophobicContact CD1-CB 4.04Å; Y40-F97 HydrophobicContact CD2-CB 3.37Å; Y40-F97 HydrophobicContact CD2-CD2 4.49Å; Y40-F97 HydrophobicContact CD2-CG 4.2Å; Y40-F97 HydrophobicContact CE1-CB 4.46Å; Y40-F97 HydrophobicContact CE2-CB 3.86Å; Y40-F97 HydrophobicContact CE2-CD2 4.38Å; Y40-F97 HydrophobicContact CG-CB 3.48Å; Y40-F97 VanDerWaalsContact CG-CB 3.48Å; Y40-S98 WeakPolarHBondContact CE1-OG 3.32Å
41	T	87.5	Confident	89.4	Confident	105 Å²	105	59.2 Å²	59.2	64%	0.644	32%	0.324	S	S	*	.	H	α-helix	trans	-67	-44.9	179.2	-52.7	0	0	0	0	110.4	D39 F45	D39-T41 PolarHBondContact O-N 3.28Å; D39-T41 WeakPolarHBondContact OD1-CA 3.24Å; D39-T41 VanDerWaalsContact OD1-CB 3.3Å; D39-T41 WeakPolarHBondContact OD1-CB 3.27Å; D39-T41 PolarHBondContact OD1-N 3.41Å; T41-F45 WeakPolarHBondContact O-CB 3.45Å; T41-F45 PolarHBondContact O-N 3.25Å; T41-F45 VanDerWaalsContact O-N 3.08Å
42	V	87.8	Confident	89.6	Confident	66 Å²	66	68.4 Å²	68.4	40%	0.4	36%	0.358	S	S	.	.	H	α-helix	trans	-68	-38.3	176.1	173	0	0	0	0	111.5	D39 K46	D39-V42 HydrophobicContact CB-CB 4.07Å; D39-V42 HydrophobicContact CB-CG2 4.18Å; D39-V42 PolarHBondContact O-N 3.21Å; D39-V42 PolarHBondContact OD1-N 2.9Å; D39-V42 WeakPolarHBondContact OD2-CG2 3.19Å; V42-K46 HydrophobicContact CG1-CD 4.29Å; V42-K46 WeakPolarHBondContact O-CG 3.36Å; V42-K46 PolarHBondContact O-N 3.25Å; V42-K46 VanDerWaalsContact O-N 3.15Å
43	W	93.7	Very high	89.6	Confident	4 Å²	4	72.4 Å²	72.4	2%	0.015	37%	0.369	C	S	.	.	H	α-helix	trans	-63.1	-52.4	175.1	178.6	90.9	0	0	0	111.4	P32 L34 D39 Y40 F45 K46 V47 L63 Y66 L67 W90 L93	P32-W43 PolarHBondContact O-NE1 3.03Å; L34-W43 HydrophobicContact CB-CD2 4.04Å; L34-W43 HydrophobicContact CB-CG 4.25Å; L34-W43 HydrophobicContact CB-CZ2 4.05Å; L34-W43 HydrophobicContact CD1-CB 3.87Å; L34-W43 HydrophobicContact CD1-CD2 3.81Å; L34-W43 HydrophobicContact CD1-CE3 4.17Å; L34-W43 HydrophobicContact CD1-CG 3.66Å; L34-W43 HydrophobicContact CD2-CD2 4.38Å; L34-W43 HydrophobicContact CD2-CE3 4.24Å; L34-W43 HydrophobicContact CD2-CZ3 4.3Å; L34-W43 HydrophobicContact CG-CD2 4.3Å; L34-W43 HydrophobicContact CG-CG 4.49Å; D39-W43 WeakPolarHBondContact O-CB 3.42Å; D39-W43 PolarHBondContact O-N 2.85Å; Y40-W43 AromaticContact CD2-CE3 3.87Å; Y40-W43 HydrophobicContact CD2-CE3 3.87Å; Y40-W43 HydrophobicContact CD2-CZ3 4.33Å; Y40-W43 AromaticContact CE2-CE3 3.76Å; Y40-W43 HydrophobicContact CE2-CE3 3.76Å; Y40-W43 AromaticContact CE2-CZ3 3.8Å; Y40-W43 HydrophobicContact CE2-CZ3 3.8Å; Y40-W43 PolarHBondContact O-N 3.25Å; W43-F45 VanDerWaalsContact C-N 3.28Å; W43-F45 PolarHBondContact O-N 3.01Å; W43-K46 PolarHBondContact O-N 3.25Å; W43-V47 HydrophobicContact CD2-CG2 3.9Å; W43-V47 HydrophobicContact CE3-CG2 4.41Å; W43-V47 HydrophobicContact CG-CG2 4.39Å; W43-V47 HydrophobicContact CH2-CG2 4.25Å; W43-V47 HydrophobicContact CZ2-CG2 3.73Å; W43-V47 PolarHBondContact O-N 3.16Å; W43-L63 HydrophobicContact CH2-CD2 4.33Å; W43-Y66 WeakPolarHBondContact CZ2-O 3.2Å; W43-Y66 PolarHBondContact NE1-O 3.13Å; W43-L67 HydrophobicContact CH2-CD2 3.72Å; W43-L67 HydrophobicContact CH2-CG 4.48Å; W43-L67 HydrophobicContact CZ2-CD2 3.88Å; W43-W90 HydrophobicContact CH2-CZ3 4.49Å; W43-W90 HydrophobicContact CZ3-CH2 4.09Å; W43-W90 AromaticContact CZ3-CZ3 3.76Å; W43-W90 HydrophobicContact CZ3-CZ3 3.76Å; W43-L93 HydrophobicContact CH2-CD1 4.14Å; W43-L93 HydrophobicContact CZ3-CD1 4.17Å
44	K	94.2	Very high	89.4	Confident	54 Å²	54	69.8 Å²	69.8	24%	0.235	36%	0.356	C	S	.	.	H	α-helix	trans	-55.2	-42.9	177.8	176.6	169.4	-169	-177.9	0	111.7	Y40 T48 W90 D94	Y40-K44 HydrophobicContact CE1-CD 4.17Å; Y40-K44 HydrophobicContact CE2-CB 4.46Å; Y40-K44 WeakPolarHBondContact O-CB 3.49Å; Y40-K44 PolarHBondContact O-N 2.89Å; K44-T48 WeakPolarHBondContact O-CB 3.46Å; K44-T48 PolarHBondContact O-N 3.46Å; K44-T48 PolarHBondContact O-OG1 3.06Å; K44-W90 HydrophobicContact CB-CH2 4.49Å; K44-W90 HydrophobicContact CB-CZ3 4.08Å; K44-W90 HydrophobicContact CD-CE3 4.01Å; K44-W90 HydrophobicContact CD-CZ3 4Å; K44-W90 HydrophobicContact CG-CE3 4.04Å; K44-W90 HydrophobicContact CG-CH2 3.98Å; K44-W90 HydrophobicContact CG-CZ3 3.56Å; K44-D94 WeakPolarHBondContact CD-OD1 3.33Å; K44-D94 IonicContact NZ-OD1 2.64Å; K44-D94 PolarHBondContact NZ-OD1 2.79Å; K44-D94 IonicContact NZ-OD2 2.67Å; K44-D94 PolarHBondContact NZ-OD2 2.94Å
45	F	91.7	Very high	89.4	Confident	155 Å²	155	73.9 Å²	73.9	68%	0.68	38%	0.381	S	S	*	.	H	α-helix	trans	-60.1	-48	175.4	179	-93.6	0	0	0	112.3	T41 W43 A49	T41-F45 WeakPolarHBondContact O-CB 3.45Å; T41-F45 PolarHBondContact O-N 3.25Å; T41-F45 VanDerWaalsContact O-N 3.08Å; W43-F45 VanDerWaalsContact C-N 3.28Å; W43-F45 PolarHBondContact O-N 3.01Å; F45-A49 WeakPolarHBondContact O-CB 3.32Å; F45-A49 PolarHBondContact O-N 3.1Å
46	K	93	Very high	89.5	Confident	99 Å²	99	72.9 Å²	72.9	43%	0.43	39%	0.39	S	S	.	.	H	α-helix	trans	-63.1	-46.9	178.9	-72.3	171.3	-178.5	172.9	0	112	P31 P32 V42 W43 A49 Y50	P31-K46 HydrophobicContact CB-CB 4.34Å; P31-K46 HydrophobicContact CG-CB 4.47Å; P32-K46 HydrophobicContact CG-CD 4.48Å; V42-K46 HydrophobicContact CG1-CD 4.29Å; V42-K46 WeakPolarHBondContact O-CG 3.36Å; V42-K46 PolarHBondContact O-N 3.25Å; V42-K46 VanDerWaalsContact O-N 3.15Å; W43-K46 PolarHBondContact O-N 3.25Å; K46-A49 PolarHBondContact O-N 3.24Å; K46-Y50 PolarHBondContact O-N 3.48Å
47	V	93.7	Very high	90.3	Very high	0 Å²	0	71.8 Å²	71.8	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-66	-43.5	179.4	175.5	0	0	0	0	111.1	P31 W43 A49 Y50 L51 L63 Y66 W90	P31-V47 HydrophobicContact CB-CG2 3.54Å; P31-V47 HydrophobicContact CG-CB 4.42Å; P31-V47 HydrophobicContact CG-CG2 3.79Å; W43-V47 HydrophobicContact CD2-CG2 3.9Å; W43-V47 HydrophobicContact CE3-CG2 4.41Å; W43-V47 HydrophobicContact CG-CG2 4.39Å; W43-V47 HydrophobicContact CH2-CG2 4.25Å; W43-V47 HydrophobicContact CZ2-CG2 3.73Å; W43-V47 PolarHBondContact O-N 3.16Å; V47-A49 VanDerWaalsContact C-N 3.29Å; V47-A49 PolarHBondContact O-N 3.14Å; V47-Y50 WeakPolarHBondContact O-CB 3.32Å; V47-Y50 PolarHBondContact O-N 2.81Å; V47-L51 HydrophobicContact CG1-CD1 3.98Å; V47-L51 HydrophobicContact CG1-CG 4.09Å; V47-L51 WeakPolarHBondContact O-CG 3.26Å; V47-L51 PolarHBondContact O-N 3.11Å; V47-L63 HydrophobicContact CG1-CD2 3.82Å; V47-Y66 HydrophobicContact CG2-CD2 4.34Å; V47-Y66 HydrophobicContact CG2-CG 4.39Å; V47-W90 HydrophobicContact CB-CH2 4.13Å; V47-W90 HydrophobicContact CG1-CH2 3.89Å; V47-W90 HydrophobicContact CG1-CZ2 4.14Å
48	T	93.4	Very high	91	Very high	47 Å²	47	70.1 Å²	70.1	29%	0.288	37%	0.372	S	S	.	.	H	α-helix	trans	-58.6	-40.5	174.4	-59.3	0	0	0	0	111.8	K44 Y50 R52	K44-T48 WeakPolarHBondContact O-CB 3.46Å; K44-T48 PolarHBondContact O-N 3.46Å; K44-T48 PolarHBondContact O-OG1 3.06Å; T48-Y50 VanDerWaalsContact C-N 3.33Å; T48-R52 WeakPolarHBondContact O-CG 3.3Å
49	A	92.2	Very high	91.4	Very high	39 Å²	39	69.3 Å²	69.3	32%	0.322	36%	0.363	S	S	.	.	H	α-helix	trans	-68.9	-29.6	175.9	0	0	0	0	0	113.3	F45 K46 V47	F45-A49 WeakPolarHBondContact O-CB 3.32Å; F45-A49 PolarHBondContact O-N 3.1Å; K46-A49 PolarHBondContact O-N 3.24Å; V47-A49 VanDerWaalsContact C-N 3.29Å; V47-A49 PolarHBondContact O-N 3.14Å
50	Y	91.6	Very high	91.9	Very high	37 Å²	37	67 Å²	67	15%	0.145	35%	0.349	C	S	.	.	H	α-helix	trans	-74.8	-49.1	175.4	-172.9	-89.6	0	0	0	111.9	Q30 P31 K46 V47 T48 R52 K53 V54 Y62 Y66	Q30-Y50 HydrophobicContact CG-CE2 4.15Å; P31-Y50 HydrophobicContact CG-CD2 4.4Å; P31-Y50 HydrophobicContact CG-CG 4.08Å; K46-Y50 PolarHBondContact O-N 3.48Å; V47-Y50 WeakPolarHBondContact O-CB 3.32Å; V47-Y50 PolarHBondContact O-N 2.81Å; T48-Y50 VanDerWaalsContact C-N 3.33Å; Y50-R52 PolarHBondContact O-N 3.44Å; Y50-R52 VanDerWaalsContact O-N 3.1Å; Y50-K53 WeakPolarHBondContact O-CB 3.4Å; Y50-K53 PolarHBondContact O-N 3.36Å; Y50-V54 HydrophobicContact CD1-CG2 4.01Å; Y50-V54 HydrophobicContact CE1-CG2 3.76Å; Y50-Y62 HydrophobicContact CD1-CD1 4.5Å; Y50-Y62 AromaticContact CE1-CD1 3.68Å; Y50-Y62 HydrophobicContact CE1-CD1 3.68Å; Y50-Y62 AromaticContact CE1-CE1 3.72Å; Y50-Y62 HydrophobicContact CE1-CE1 3.72Å; Y50-Y66 HydrophobicContact CD1-CE2 4.06Å; Y50-Y66 HydrophobicContact CE1-CE2 4.12Å
51	L	92.6	Very high	92	Very high	7 Å²	7	71.4 Å²	71.4	4%	0.037	37%	0.373	C	S	.	.	H	α-helix	trans	-59.2	-24.3	-178.7	-70	178.9	0	0	0	113.8	V47 K53 V54 H59 L63 W90	V47-L51 HydrophobicContact CG1-CD1 3.98Å; V47-L51 HydrophobicContact CG1-CG 4.09Å; V47-L51 WeakPolarHBondContact O-CG 3.26Å; V47-L51 PolarHBondContact O-N 3.11Å; L51-K53 PolarHBondContact O-N 3.15Å; L51-V54 HydrophobicContact CD2-CB 4.49Å; L51-V54 HydrophobicContact CD2-CG2 4.5Å; L51-V54 PolarHBondContact O-N 3.39Å; L51-H59 HydrophobicContact CD2-CB 4.29Å; L51-H59 PolarHBondContact O-CE1 2.71Å; L51-H59 PolarHBondContact O-NE2 3Å; L51-L63 HydrophobicContact CD1-CD2 4.11Å; L51-L63 HydrophobicContact CD1-CG 4.14Å; L51-W90 HydrophobicContact CD1-CZ2 4.03Å
52	R	91.4	Very high	92.3	Very high	204 Å²	204	69.9 Å²	69.9	77%	0.77	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-13.9	170.2	-73.6	173.4	-177.2	164	1.2	114.5	T48 Y50	T48-R52 WeakPolarHBondContact O-CG 3.3Å; Y50-R52 PolarHBondContact O-N 3.44Å; Y50-R52 VanDerWaalsContact O-N 3.1Å
53	K	89.5	Confident	92.6	Very high	149 Å²	149	66.7 Å²	66.7	65%	0.648	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-1.2	178.9	-55.2	-177.9	179.5	-175	0	113.3	P28 Y50 L51	P28-K53 HydrophobicContact CG-CD 4.25Å; Y50-K53 WeakPolarHBondContact O-CB 3.4Å; Y50-K53 PolarHBondContact O-N 3.36Å; L51-K53 PolarHBondContact O-N 3.15Å
54	V	89.1	Confident	92.6	Very high	20 Å²	20	68.9 Å²	68.9	12%	0.121	35%	0.35	C	S	.	.	S	Bend	trans	-109.7	147.3	-173.8	179.2	0	0	0	0	108.8	Y50 L51 E58 H59 Y62	Y50-V54 HydrophobicContact CD1-CG2 4.01Å; Y50-V54 HydrophobicContact CE1-CG2 3.76Å; L51-V54 HydrophobicContact CD2-CB 4.49Å; L51-V54 HydrophobicContact CD2-CG2 4.5Å; L51-V54 PolarHBondContact O-N 3.39Å; V54-E58 HydrophobicContact CG1-CB 3.74Å; V54-H59 PolarHBondContact O-NE2 2.86Å; V54-Y62 HydrophobicContact CB-CD2 4.44Å; V54-Y62 HydrophobicContact CG1-CD2 3.36Å; V54-Y62 HydrophobicContact CG1-CE2 3.45Å; V54-Y62 VanDerWaalsContact CG1-CE2 3.45Å; V54-Y62 HydrophobicContact CG1-CG 4.17Å; V54-Y62 HydrophobicContact CG2-CD2 4.24Å; V54-Y62 HydrophobicContact CG2-CE2 4.21Å; V54-Y62 HydrophobicContact CG2-CG 4.4Å
55	T	92.1	Very high	92.6	Very high	87 Å²	87	69.4 Å²	69.4	53%	0.534	36%	0.361	S	S	.	.			trans	-66.1	138.3	176.4	-40.2	0	0	0	0	109.9	S57 E58 H59	T55-S57 WeakPolarHBondContact CG2-OG 3.37Å; T55-S57 PolarHBondContact O-N 3.04Å; T55-E58 WeakPolarHBondContact CB-OE2 3.31Å; T55-E58 PolarHBondContact N-OE2 3.49Å; T55-E58 PolarHBondContact O-N 2.97Å; T55-E58 PolarHBondContact OG1-OE2 2.8Å; T55-H59 PolarHBondContact O-CD2 2.81Å
56	A	90.6	Very high	92.7	Very high	81 Å²	81	62.8 Å²	62.8	67%	0.669	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-55.4	-29.2	-175.6	0	0	0	0	0	114.2	E58 H59	A56-E58 VanDerWaalsContact C-N 3.29Å; A56-E58 PolarHBondContact O-N 3.46Å; A56-H59 PolarHBondContact O-N 2.79Å
57	S	91.5	Very high	92.8	Very high	96 Å²	96	58.4 Å²	58.4	67%	0.671	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-65.2	-25.8	175.1	50	0	0	0	0	114.4	T55	T55-S57 WeakPolarHBondContact CG2-OG 3.37Å; T55-S57 PolarHBondContact O-N 3.04Å
58	E	92.6	Very high	92.9	Very high	74 Å²	74	59.1 Å²	59.1	35%	0.346	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-97.4	-5.9	-176.5	-53	167.7	111.7	0	0	111.7	V54 T55 A56 F60 D61 Y62	V54-E58 HydrophobicContact CG1-CB 3.74Å; T55-E58 WeakPolarHBondContact CB-OE2 3.31Å; T55-E58 PolarHBondContact N-OE2 3.49Å; T55-E58 PolarHBondContact O-N 2.97Å; T55-E58 PolarHBondContact OG1-OE2 2.8Å; A56-E58 VanDerWaalsContact C-N 3.29Å; A56-E58 PolarHBondContact O-N 3.46Å; E58-F60 PolarHBondContact O-N 3.25Å; E58-F60 VanDerWaalsContact O-N 3.16Å; E58-D61 PolarHBondContact O-N 2.78Å; E58-D61 VanDerWaalsContact O-N 3.16Å; E58-Y62 HydrophobicContact CB-CD2 3.91Å; E58-Y62 HydrophobicContact CB-CE2 4Å; E58-Y62 WeakPolarHBondContact O-CD2 3.47Å; E58-Y62 PolarHBondContact O-N 2.85Å; E58-Y62 VanDerWaalsContact O-N 3.1Å
59	H	94.1	Very high	92.9	Very high	26 Å²	26	62.8 Å²	62.8	12%	0.12	34%	0.336	C	S	.	.	H	α-helix	trans	-60.2	-31.3	-170.9	-76.4	-167.6	0	0	0	113.4	L51 V54 T55 A56 L63 L86	L51-H59 HydrophobicContact CD2-CB 4.29Å; L51-H59 PolarHBondContact O-CE1 2.71Å; L51-H59 PolarHBondContact O-NE2 3Å; V54-H59 PolarHBondContact O-NE2 2.86Å; T55-H59 PolarHBondContact O-CD2 2.81Å; A56-H59 PolarHBondContact O-N 2.79Å; H59-L63 WeakPolarHBondContact O-CB 3.4Å; H59-L63 WeakPolarHBondContact O-CG 3.26Å; H59-L63 PolarHBondContact O-N 2.9Å; H59-L86 HydrophobicContact CB-CD1 4.02Å; H59-L86 HydrophobicContact CB-CD2 4.4Å; H59-L86 WeakPolarHBondContact ND1-CD2 3.37Å
60	F	95.1	Very high	93	Very high	47 Å²	47	65.7 Å²	65.7	21%	0.206	34%	0.342	C	S	.	.	H	α-helix	trans	-66.9	-50.6	175.4	178.7	-99.7	0	0	0	111.9	E58 Y62 L63 V64 F80 A81 A82 N89	E58-F60 PolarHBondContact O-N 3.25Å; E58-F60 VanDerWaalsContact O-N 3.16Å; F60-Y62 VanDerWaalsContact C-N 3.28Å; F60-Y62 PolarHBondContact O-N 3.03Å; F60-L63 WeakPolarHBondContact O-CA 3.32Å; F60-L63 WeakPolarHBondContact O-CB 3.45Å; F60-L63 PolarHBondContact O-N 3.02Å; F60-V64 HydrophobicContact CD1-CG2 4.18Å; F60-V64 HydrophobicContact CE1-CG2 3.64Å; F60-V64 HydrophobicContact CE2-CG2 4.09Å; F60-V64 HydrophobicContact CZ-CG2 3.6Å; F60-V64 WeakPolarHBondContact O-CG2 3.42Å; F60-V64 PolarHBondContact O-N 3.2Å; F60-F80 HydrophobicContact CD2-CE1 4.13Å; F60-F80 HydrophobicContact CD2-CZ 4.23Å; F60-F80 AromaticContact CE2-CD1 3.84Å; F60-F80 HydrophobicContact CE2-CD1 3.84Å; F60-F80 AromaticContact CE2-CE1 3.34Å; F60-F80 HydrophobicContact CE2-CE1 3.34Å; F60-F80 AromaticContact CE2-CZ 3.87Å; F60-F80 HydrophobicContact CE2-CZ 3.87Å; F60-F80 HydrophobicContact CZ-CD1 4.33Å; F60-F80 AromaticContact CZ-CE1 3.93Å; F60-F80 HydrophobicContact CZ-CE1 3.93Å; F60-A81 VanDerWaalsContact CE2-O 3.26Å; F60-A81 WeakPolarHBondContact CE2-O 3.48Å; F60-A82 HydrophobicContact CD1-CB 3.66Å; F60-A82 HydrophobicContact CD2-CB 4.44Å; F60-A82 HydrophobicContact CE1-CB 3.59Å; F60-A82 HydrophobicContact CE2-CB 4.38Å; F60-A82 HydrophobicContact CG-CB 4.09Å; F60-A82 HydrophobicContact CZ-CB 3.97Å; F60-N89 WeakPolarHBondContact CD2-ND2 3.47Å
61	D	94	Very high	93.1	Very high	103 Å²	103	63.9 Å²	63.9	55%	0.551	34%	0.336	S	S	*	.	H	α-helix	trans	-61.4	-40.1	-178.4	-55.2	-41.2	0	0	0	111.2	E58 V64 S65	E58-D61 PolarHBondContact O-N 2.78Å; E58-D61 VanDerWaalsContact O-N 3.16Å; D61-V64 PolarHBondContact O-N 3.1Å; D61-S65 WeakPolarHBondContact O-CB 3.44Å; D61-S65 PolarHBondContact O-N 3.23Å
62	Y	93.5	Very high	93.3	Very high	72 Å²	72	64.8 Å²	64.8	28%	0.282	34%	0.341	S	S	.	.	H	α-helix	trans	-65.7	-40.8	172.8	-83.5	-81.6	0	0	0	112.6	Y50 V54 E58 F60 S65 Y66	Y50-Y62 HydrophobicContact CD1-CD1 4.5Å; Y50-Y62 AromaticContact CE1-CD1 3.68Å; Y50-Y62 HydrophobicContact CE1-CD1 3.68Å; Y50-Y62 AromaticContact CE1-CE1 3.72Å; Y50-Y62 HydrophobicContact CE1-CE1 3.72Å; V54-Y62 HydrophobicContact CB-CD2 4.44Å; V54-Y62 HydrophobicContact CG1-CD2 3.36Å; V54-Y62 HydrophobicContact CG1-CE2 3.45Å; V54-Y62 VanDerWaalsContact CG1-CE2 3.45Å; V54-Y62 HydrophobicContact CG1-CG 4.17Å; V54-Y62 HydrophobicContact CG2-CD2 4.24Å; V54-Y62 HydrophobicContact CG2-CE2 4.21Å; V54-Y62 HydrophobicContact CG2-CG 4.4Å; E58-Y62 HydrophobicContact CB-CD2 3.91Å; E58-Y62 HydrophobicContact CB-CE2 4Å; E58-Y62 WeakPolarHBondContact O-CD2 3.47Å; E58-Y62 PolarHBondContact O-N 2.85Å; E58-Y62 VanDerWaalsContact O-N 3.1Å; F60-Y62 VanDerWaalsContact C-N 3.28Å; F60-Y62 PolarHBondContact O-N 3.03Å; Y62-S65 WeakPolarHBondContact CA-OG 3.15Å; Y62-S65 PolarHBondContact O-N 3Å; Y62-S65 PolarHBondContact O-OG 2.8Å; Y62-Y66 HydrophobicContact CD1-CE2 4.09Å; Y62-Y66 WeakPolarHBondContact O-CD2 3.47Å; Y62-Y66 PolarHBondContact O-N 2.81Å
63	L	94.5	Very high	93.4	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-58.4	-49.2	173.9	-81.2	173.2	0	0	0	111.2	W43 V47 L51 H59 F60 S65 Y66 L67 F80 L86 W90 L93	W43-L63 HydrophobicContact CH2-CD2 4.33Å; V47-L63 HydrophobicContact CG1-CD2 3.82Å; L51-L63 HydrophobicContact CD1-CD2 4.11Å; L51-L63 HydrophobicContact CD1-CG 4.14Å; H59-L63 WeakPolarHBondContact O-CB 3.4Å; H59-L63 WeakPolarHBondContact O-CG 3.26Å; H59-L63 PolarHBondContact O-N 2.9Å; F60-L63 WeakPolarHBondContact O-CA 3.32Å; F60-L63 WeakPolarHBondContact O-CB 3.45Å; F60-L63 PolarHBondContact O-N 3.02Å; L63-S65 VanDerWaalsContact C-N 3.31Å; L63-S65 PolarHBondContact O-N 2.77Å; L63-Y66 PolarHBondContact O-N 3.13Å; L63-Y66 VanDerWaalsContact O-N 3.15Å; L63-L67 WeakPolarHBondContact O-CG 3.41Å; L63-L67 PolarHBondContact O-N 3.34Å; L63-F80 HydrophobicContact CB-CZ 4.06Å; L63-F80 HydrophobicContact CD1-CE2 4.5Å; L63-F80 HydrophobicContact CD1-CZ 4.41Å; L63-L86 HydrophobicContact CD1-CD1 3.54Å; L63-W90 HydrophobicContact CD2-CH2 3.69Å; L63-W90 HydrophobicContact CD2-CZ2 3.66Å; L63-W90 HydrophobicContact CD2-CZ3 4.27Å; L63-L93 HydrophobicContact CD2-CD1 4.21Å
64	V	94.5	Very high	93.7	Very high	50 Å²	50	59.3 Å²	59.3	30%	0.303	32%	0.32	S	S	.	.	H	α-helix	trans	-56.3	-45.2	176.2	175.4	0	0	0	0	110.8	F60 D61 Y66 L67 F80	F60-V64 HydrophobicContact CD1-CG2 4.18Å; F60-V64 HydrophobicContact CE1-CG2 3.64Å; F60-V64 HydrophobicContact CE2-CG2 4.09Å; F60-V64 HydrophobicContact CZ-CG2 3.6Å; F60-V64 WeakPolarHBondContact O-CG2 3.42Å; F60-V64 PolarHBondContact O-N 3.2Å; D61-V64 PolarHBondContact O-N 3.1Å; V64-Y66 PolarHBondContact O-N 3.39Å; V64-Y66 VanDerWaalsContact O-N 3.07Å; V64-L67 PolarHBondContact O-N 2.93Å; V64-F80 HydrophobicContact CG2-CE1 3.85Å
65	S	93.9	Very high	94	Very high	65 Å²	65	58.4 Å²	58.4	46%	0.455	31%	0.314	S	S	.	.	H	α-helix	trans	-62	-17.8	-179.1	78.6	0	0	0	0	114.9	D61 Y62 L63	D61-S65 WeakPolarHBondContact O-CB 3.44Å; D61-S65 PolarHBondContact O-N 3.23Å; Y62-S65 WeakPolarHBondContact CA-OG 3.15Å; Y62-S65 PolarHBondContact O-N 3Å; Y62-S65 PolarHBondContact O-OG 2.8Å; L63-S65 VanDerWaalsContact C-N 3.31Å; L63-S65 PolarHBondContact O-N 2.77Å
66	Y	94.7	Very high	94.2	Very high	15 Å²	15	60 Å²	60	6%	0.059	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	7	177	-64.6	-60.6	0	0	0	113.6	Q30 P31 L33 L34 W43 V47 Y50 Y62 L63 V64	Q30-Y66 HydrophobicContact CB-CE1 4.24Å; P31-Y66 HydrophobicContact CB-CD1 3.89Å; P31-Y66 HydrophobicContact CB-CD2 4.47Å; P31-Y66 HydrophobicContact CB-CE1 4.02Å; P31-Y66 HydrophobicContact CB-CG 4.16Å; P31-Y66 HydrophobicContact CG-CD1 4.43Å; P31-Y66 HydrophobicContact CG-CD2 4.39Å; P31-Y66 HydrophobicContact CG-CE1 4.2Å; P31-Y66 HydrophobicContact CG-CE2 4.16Å; P31-Y66 WeakPolarHBondContact O-CD1 3.18Å; P31-Y66 VanDerWaalsContact O-CE1 3.28Å; P31-Y66 WeakPolarHBondContact O-CE1 3.37Å; L33-Y66 CarbonylContact C-O 3.38Å; L34-Y66 PolarHBondContact N-O 3.43Å; W43-Y66 WeakPolarHBondContact CZ2-O 3.2Å; W43-Y66 PolarHBondContact NE1-O 3.13Å; V47-Y66 HydrophobicContact CG2-CD2 4.34Å; V47-Y66 HydrophobicContact CG2-CG 4.39Å; Y50-Y66 HydrophobicContact CD1-CE2 4.06Å; Y50-Y66 HydrophobicContact CE1-CE2 4.12Å; Y62-Y66 HydrophobicContact CD1-CE2 4.09Å; Y62-Y66 WeakPolarHBondContact O-CD2 3.47Å; Y62-Y66 PolarHBondContact O-N 2.81Å; L63-Y66 PolarHBondContact O-N 3.13Å; L63-Y66 VanDerWaalsContact O-N 3.15Å; V64-Y66 PolarHBondContact O-N 3.39Å; V64-Y66 VanDerWaalsContact O-N 3.07Å
67	L	95	Very high	94.5	Very high	7 Å²	7	62.2 Å²	62.2	4%	0.037	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-101.1	133.5	169.9	-62.9	174.1	0	0	0	109.7	L33 L34 W43 L63 V64 A71 T72 F80 L93	L33-L67 VanDerWaalsContact CD1-C 3.48Å; L33-L67 WeakPolarHBondContact CD1-O 3.48Å; L34-L67 HydrophobicContact CB-CD2 3.99Å; L34-L67 HydrophobicContact CD2-CD2 3.61Å; L34-L67 HydrophobicContact CG-CD2 4.45Å; W43-L67 HydrophobicContact CH2-CD2 3.72Å; W43-L67 HydrophobicContact CH2-CG 4.48Å; W43-L67 HydrophobicContact CZ2-CD2 3.88Å; L63-L67 WeakPolarHBondContact O-CG 3.41Å; L63-L67 PolarHBondContact O-N 3.34Å; V64-L67 PolarHBondContact O-N 2.93Å; L67-A71 HydrophobicContact CB-CB 4.18Å; L67-A71 HydrophobicContact CD2-CB 4.21Å; L67-T72 VanDerWaalsContact CB-OG1 3.23Å; L67-T72 WeakPolarHBondContact CB-OG1 3.24Å; L67-F80 HydrophobicContact CD1-CE1 4.17Å; L67-F80 HydrophobicContact CD1-CZ 4.15Å; L67-L93 HydrophobicContact CD1-CD2 3.98Å; L67-L93 HydrophobicContact CD2-CD2 4Å
68	S	94.8	Very high	94.7	Very high	16 Å²	16	62 Å²	62	11%	0.112	31%	0.313	C	S	.	.			trans	-62.9	158.5	166.9	59	0	0	0	0	110.7	L34 E70 A71 T72	L34-S68 VanDerWaalsContact O-CB 3.26Å; L34-S68 WeakPolarHBondContact O-CB 3.41Å; L34-S68 PolarHBondContact O-N 3.28Å; L34-S68 VanDerWaalsContact O-N 3.15Å; L34-S68 PolarHBondContact O-OG 3.2Å; S68-E70 PolarHBondContact O-N 2.9Å; S68-A71 CarbonylContact O-C 3.52Å; S68-A71 PolarHBondContact O-N 3.23Å; S68-A71 WeakPolarHBondContact OG-CB 3.4Å; S68-A71 PolarHBondContact OG-N 2.9Å; S68-T72 WeakPolarHBondContact O-CB 3.32Å; S68-T72 PolarHBondContact O-N 3.18Å; S68-T72 PolarHBondContact O-OG1 3.34Å; S68-T72 VanDerWaalsContact O-OG1 3.13Å
69	D	94.5	Very high	94.9	Very high	124 Å²	124	60.4 Å²	60.4	66%	0.663	32%	0.317	S	S	*	.	H	α-helix	trans	-48.6	-37.5	176.4	-69.1	-1.8	0	0	0	112.3	T72 K73	D69-T72 PolarHBondContact O-N 3.21Å; D69-K73 WeakPolarHBondContact O-CB 3.48Å; D69-K73 WeakPolarHBondContact O-CD 3.45Å; D69-K73 WeakPolarHBondContact O-CG 3.42Å; D69-K73 PolarHBondContact O-N 3.5Å
70	E	93.7	Very high	95	Very high	99 Å²	99	59.6 Å²	59.6	46%	0.463	31%	0.313	S	S	.	.	H	α-helix	trans	-79.1	-34.6	-175.5	-43	-53.5	-115.8	0	0	111.3	S68 K73 R74	S68-E70 PolarHBondContact O-N 2.9Å; E70-K73 IonicContact OE1-NZ 2.68Å; E70-K73 WeakPolarHBondContact OE2-CD 3.25Å; E70-K73 WeakPolarHBondContact OE2-CE 3.46Å; E70-K73 IonicContact OE2-NZ 3.99Å; E70-K73 PolarHBondContact OE2-NZ 3.21Å; E70-R74 WeakPolarHBondContact O-CB 3.35Å; E70-R74 PolarHBondContact O-N 2.86Å; E70-R74 VanDerWaalsContact O-N 3.08Å
71	A	94.3	Very high	95.1	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-67.5	-41.2	169.8	0	0	0	0	0	111.3	L34 L67 S68 R74 A75 F97	L34-A71 HydrophobicContact CD2-CB 4.43Å; L67-A71 HydrophobicContact CB-CB 4.18Å; L67-A71 HydrophobicContact CD2-CB 4.21Å; S68-A71 CarbonylContact O-C 3.52Å; S68-A71 PolarHBondContact O-N 3.23Å; S68-A71 WeakPolarHBondContact OG-CB 3.4Å; S68-A71 PolarHBondContact OG-N 2.9Å; A71-R74 PolarHBondContact O-N 2.84Å; A71-A75 WeakPolarHBondContact O-CB 3.32Å; A71-A75 PolarHBondContact O-N 3.25Å; A71-F97 HydrophobicContact CB-CE1 3.89Å; A71-F97 HydrophobicContact CB-CE2 4.49Å; A71-F97 HydrophobicContact CB-CZ 3.61Å; A71-F97 WeakPolarHBondContact O-CZ 3.26Å
72	T	95.1	Very high	95.1	Very high	26 Å²	26	57.4 Å²	57.4	16%	0.16	32%	0.318	C	S	.	.	H	α-helix	trans	-60.9	-50.7	175.4	-63.8	0	0	0	0	110.9	L67 S68 D69 R74 A75 M76	L67-T72 VanDerWaalsContact CB-OG1 3.23Å; L67-T72 WeakPolarHBondContact CB-OG1 3.24Å; S68-T72 WeakPolarHBondContact O-CB 3.32Å; S68-T72 PolarHBondContact O-N 3.18Å; S68-T72 PolarHBondContact O-OG1 3.34Å; S68-T72 VanDerWaalsContact O-OG1 3.13Å; D69-T72 PolarHBondContact O-N 3.21Å; T72-R74 VanDerWaalsContact C-N 3.32Å; T72-R74 PolarHBondContact O-N 2.98Å; T72-A75 PolarHBondContact O-N 2.07Å; T72-M76 HydrophobicContact CG2-CG 4.35Å; T72-M76 HydrophobicContact CG2-SD 3.84Å; T72-M76 WeakPolarHBondContact O-CB 3.41Å; T72-M76 VanDerWaalsContact O-CG 3.28Å; T72-M76 WeakPolarHBondContact O-CG 3.1Å; T72-M76 PolarHBondContact O-N 3.36Å
73	K	95.3	Very high	95.2	Very high	117 Å²	117	60.7 Å²	60.7	51%	0.509	34%	0.34	S	S	.	.	H	α-helix	trans	-54.5	-46.8	174.4	-73	162.8	-167.7	163.7	0	111.7	D69 E70 M76 V77	D69-K73 WeakPolarHBondContact O-CB 3.48Å; D69-K73 WeakPolarHBondContact O-CD 3.45Å; D69-K73 WeakPolarHBondContact O-CG 3.42Å; D69-K73 PolarHBondContact O-N 3.5Å; E70-K73 IonicContact OE1-NZ 2.68Å; E70-K73 WeakPolarHBondContact OE2-CD 3.25Å; E70-K73 WeakPolarHBondContact OE2-CE 3.46Å; E70-K73 IonicContact OE2-NZ 3.99Å; E70-K73 PolarHBondContact OE2-NZ 3.21Å; K73-M76 PolarHBondContact O-N 3.34Å; K73-V77 WeakPolarHBondContact O-CG2 3.32Å; K73-V77 PolarHBondContact O-N 3.16Å; K73-V77 VanDerWaalsContact O-N 3.11Å
74	R	94.4	Very high	95.3	Very high	121 Å²	121	62.4 Å²	62.4	46%	0.457	35%	0.35	S	S	.	.	H	α-helix	trans	-63.1	-43.8	178.6	-174.6	177.2	-176.7	-177.9	-1.7	112.4	E70 A71 T72 N78 C96 F97	E70-R74 WeakPolarHBondContact O-CB 3.35Å; E70-R74 PolarHBondContact O-N 2.86Å; E70-R74 VanDerWaalsContact O-N 3.08Å; A71-R74 PolarHBondContact O-N 2.84Å; T72-R74 VanDerWaalsContact C-N 3.32Å; T72-R74 PolarHBondContact O-N 2.98Å; R74-N78 PolarHBondContact O-N 3.01Å; R74-N78 PolarHBondContact O-ND2 3.07Å; R74-C96 PolarHBondContact NE-O 2.94Å; R74-C96 PolarHBondContact NH1-O 3.39Å; R74-C96 PolarHBondContact NH2-O 2.72Å; R74-F97 HydrophobicContact CB-CZ 4.23Å; R74-F97 HydrophobicContact CG-CZ 4.41Å
75	A	95.5	Very high	95.3	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-65.2	-44.8	178.5	0	0	0	0	0	111.4	A71 T72 V77 N78 G79 F80 L93 F97	A71-A75 WeakPolarHBondContact O-CB 3.32Å; A71-A75 PolarHBondContact O-N 3.25Å; T72-A75 PolarHBondContact O-N 2.07Å; A75-V77 PolarHBondContact O-N 3.46Å; A75-N78 CarbonylContact O-C 3.53Å; A75-N78 WeakPolarHBondContact O-CA 3.45Å; A75-N78 PolarHBondContact O-N 3.06Å; A75-G79 PolarHBondContact O-N 3.47Å; A75-F80 HydrophobicContact CB-CB 3.62Å; A75-F80 HydrophobicContact CB-CD1 4.3Å; A75-F80 HydrophobicContact CB-CD2 4.31Å; A75-F80 HydrophobicContact CB-CG 3.85Å; A75-F80 WeakPolarHBondContact O-CB 3.48Å; A75-F80 PolarHBondContact O-N 3.48Å; A75-L93 HydrophobicContact CB-CD2 3.92Å; A75-F97 HydrophobicContact CB-CE2 4.44Å
76	M	96.5	Very high	95.3	Very high	121 Å²	121	63.9 Å²	63.9	60%	0.596	35%	0.353	S	S	*	.	H	α-helix	trans	-60	-41.7	178.1	-72.6	175.3	70.9	0	0	112.5	T72 K73 N78 G79	T72-M76 HydrophobicContact CG2-CG 4.35Å; T72-M76 HydrophobicContact CG2-SD 3.84Å; T72-M76 WeakPolarHBondContact O-CB 3.41Å; T72-M76 VanDerWaalsContact O-CG 3.28Å; T72-M76 WeakPolarHBondContact O-CG 3.1Å; T72-M76 PolarHBondContact O-N 3.36Å; K73-M76 PolarHBondContact O-N 3.34Å; M76-N78 PolarHBondContact O-N 2.91Å; M76-G79 PolarHBondContact O-N 3Å
77	V	96.2	Very high	95.3	Very high	127 Å²	127	66.5 Å²	66.5	77%	0.77	38%	0.378	S	S	*	.	H	α-helix	trans	-61.2	-24.7	175	169.2	0	0	0	0	112.4	K73 A75	K73-V77 WeakPolarHBondContact O-CG2 3.32Å; K73-V77 PolarHBondContact O-N 3.16Å; K73-V77 VanDerWaalsContact O-N 3.11Å; A75-V77 PolarHBondContact O-N 3.46Å
78	N	95.6	Very high	95.4	Very high	91 Å²	91	70.7 Å²	70.7	49%	0.487	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	16.5	175.5	-67.4	-88.6	0	0	0	112.9	R74 A75 M76 I92	R74-N78 PolarHBondContact O-N 3.01Å; R74-N78 PolarHBondContact O-ND2 3.07Å; A75-N78 CarbonylContact O-C 3.53Å; A75-N78 WeakPolarHBondContact O-CA 3.45Å; A75-N78 PolarHBondContact O-N 3.06Å; M76-N78 PolarHBondContact O-N 2.91Å; N78-I92 HydrophobicContact CB-CG2 3.87Å; N78-I92 WeakPolarHBondContact O-CG2 3.3Å
79	G	97	Very high	95.6	Very high	41 Å²	41	70 Å²	70	42%	0.423	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.7	15.1	172.2	0	0	0	0	0	115.9	A75 M76 A81 N84 I92	A75-G79 PolarHBondContact O-N 3.47Å; M76-G79 PolarHBondContact O-N 3Å; G79-A81 PolarHBondContact O-N 3Å; G79-N84 PolarHBondContact O-ND2 3.23Å; G79-I92 WeakPolarHBondContact O-CD1 3.41Å
80	F	96.9	Very high	95.7	Very high	10 Å²	10	65.5 Å²	65.5	4%	0.044	37%	0.366	C	S	.	.			trans	-67.5	120.7	175.2	-174.4	-90.2	0	0	0	110.9	F60 L63 V64 L67 A75 N89 I92 L93	F60-F80 HydrophobicContact CD2-CE1 4.13Å; F60-F80 HydrophobicContact CD2-CZ 4.23Å; F60-F80 AromaticContact CE2-CD1 3.84Å; F60-F80 HydrophobicContact CE2-CD1 3.84Å; F60-F80 AromaticContact CE2-CE1 3.34Å; F60-F80 HydrophobicContact CE2-CE1 3.34Å; F60-F80 AromaticContact CE2-CZ 3.87Å; F60-F80 HydrophobicContact CE2-CZ 3.87Å; F60-F80 HydrophobicContact CZ-CD1 4.33Å; F60-F80 AromaticContact CZ-CE1 3.93Å; F60-F80 HydrophobicContact CZ-CE1 3.93Å; L63-F80 HydrophobicContact CB-CZ 4.06Å; L63-F80 HydrophobicContact CD1-CE2 4.5Å; L63-F80 HydrophobicContact CD1-CZ 4.41Å; V64-F80 HydrophobicContact CG2-CE1 3.85Å; L67-F80 HydrophobicContact CD1-CE1 4.17Å; L67-F80 HydrophobicContact CD1-CZ 4.15Å; A75-F80 HydrophobicContact CB-CB 3.62Å; A75-F80 HydrophobicContact CB-CD1 4.3Å; A75-F80 HydrophobicContact CB-CD2 4.31Å; A75-F80 HydrophobicContact CB-CG 3.85Å; A75-F80 WeakPolarHBondContact O-CB 3.48Å; A75-F80 PolarHBondContact O-N 3.48Å; F80-N89 HydrophobicContact CD2-CB 3.87Å; F80-N89 WeakPolarHBondContact CD2-OD1 3.43Å; F80-N89 HydrophobicContact CE2-CB 3.61Å; F80-N89 HydrophobicContact CZ-CB 4.46Å; F80-I92 HydrophobicContact CB-CG2 3.96Å; F80-L93 HydrophobicContact CD2-CD2 4.04Å; F80-L93 HydrophobicContact CD2-CG 4.01Å; F80-L93 HydrophobicContact CE2-CD1 3.81Å; F80-L93 HydrophobicContact CE2-CD2 3.97Å; F80-L93 HydrophobicContact CE2-CG 3.78Å
81	A	96.8	Very high	95.8	Very high	32 Å²	32	67.1 Å²	67.1	26%	0.264	37%	0.372	S	S	.	.			trans	-157.8	163.1	-168.8	0	0	0	0	0	112.3	F60 G79 D83 N84 N89	F60-A81 VanDerWaalsContact CE2-O 3.26Å; F60-A81 WeakPolarHBondContact CE2-O 3.48Å; G79-A81 PolarHBondContact O-N 3Å; A81-D83 WeakPolarHBondContact CB-OD1 3.5Å; A81-N84 PolarHBondContact N-ND2 3.4Å; A81-N84 WeakPolarHBondContact O-CB 3.39Å; A81-N89 PolarHBondContact N-OD1 2.93Å; A81-N89 PolarHBondContact O-ND2 3.31Å; A81-N89 PolarHBondContact O-OD1 3.02Å
82	A	95.4	Very high	95.9	Very high	72 Å²	72	68.2 Å²	68.2	60%	0.595	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-22.7	-173.1	0	0	0	0	0	114.4	F60	F60-A82 HydrophobicContact CD1-CB 3.66Å; F60-A82 HydrophobicContact CD2-CB 4.44Å; F60-A82 HydrophobicContact CE1-CB 3.59Å; F60-A82 HydrophobicContact CE2-CB 4.38Å; F60-A82 HydrophobicContact CG-CB 4.09Å; F60-A82 HydrophobicContact CZ-CB 3.97Å
83	D	95.1	Very high	95.9	Very high	141 Å²	141	67 Å²	67	75%	0.754	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-18.2	178.1	60.4	-30.9	0	0	0	113.3	A81	A81-D83 WeakPolarHBondContact CB-OD1 3.5Å
84	N	95.4	Very high	95.8	Very high	36 Å²	36	63.6 Å²	63.6	19%	0.193	36%	0.357	C	S	.	.	S	Bend	trans	-64.3	143.3	169.1	-75.5	-30.3	0	0	0	111.7	G79 A81 Q88 N89 I92	G79-N84 PolarHBondContact O-ND2 3.23Å; A81-N84 PolarHBondContact N-ND2 3.4Å; A81-N84 WeakPolarHBondContact O-CB 3.39Å; N84-Q88 HydrophobicContact CB-CB 4.01Å; N84-N89 WeakPolarHBondContact CB-OD1 3.4Å; N84-N89 PolarHBondContact ND2-OD1 3.31Å; N84-I92 WeakPolarHBondContact ND2-CD1 3.5Å
85	T	95.2	Very high	95.7	Very high	80 Å²	80	63.2 Å²	63.2	49%	0.491	36%	0.364	S	S	.	.			trans	-60.8	152.7	163.9	65.6	0	0	0	0	111	A87 Q88 N89	T85-A87 PolarHBondContact O-N 3.35Å; T85-A87 VanDerWaalsContact O-N 3.08Å; T85-Q88 WeakPolarHBondContact O-CB 3.21Å; T85-Q88 PolarHBondContact O-N 3.21Å; T85-Q88 WeakPolarHBondContact OG1-CG 3.46Å; T85-Q88 PolarHBondContact OG1-N 2.94Å; T85-Q88 PolarHBondContact OG1-OE1 2.65Å; T85-N89 PolarHBondContact O-N 3.43Å
86	L	94.2	Very high	95.5	Very high	65 Å²	65	63.4 Å²	63.4	34%	0.34	37%	0.366	S	S	.	.	H	α-helix	trans	-52.4	-34.9	176.1	-175.6	63.2	0	0	0	112.8	H59 L63 W90	H59-L86 HydrophobicContact CB-CD1 4.02Å; H59-L86 HydrophobicContact CB-CD2 4.4Å; H59-L86 WeakPolarHBondContact ND1-CD2 3.37Å; L63-L86 HydrophobicContact CD1-CD1 3.54Å; L86-W90 WeakPolarHBondContact O-CB 3.46Å; L86-W90 PolarHBondContact O-N 3.32Å
87	A	95.3	Very high	95.3	Very high	71 Å²	71	58.7 Å²	58.7	59%	0.587	34%	0.342	S	S	*	.	H	α-helix	trans	-69.7	-38.3	177.4	0	0	0	0	0	113	T85 K91	T85-A87 PolarHBondContact O-N 3.35Å; T85-A87 VanDerWaalsContact O-N 3.08Å; A87-K91 PolarHBondContact O-N 2.96Å
88	Q	97.2	Very high	94.9	Very high	94 Å²	94	55 Å²	55	44%	0.439	32%	0.322	S	S	.	.	H	α-helix	trans	-65.5	-46.3	173.2	-74.2	161.1	-68.8	0	0	110.8	N84 T85 W90 K91 I92	N84-Q88 HydrophobicContact CB-CB 4.01Å; T85-Q88 WeakPolarHBondContact O-CB 3.21Å; T85-Q88 PolarHBondContact O-N 3.21Å; T85-Q88 WeakPolarHBondContact OG1-CG 3.46Å; T85-Q88 PolarHBondContact OG1-N 2.94Å; T85-Q88 PolarHBondContact OG1-OE1 2.65Å; Q88-W90 PolarHBondContact O-N 2.88Å; Q88-K91 WeakPolarHBondContact O-CB 3.4Å; Q88-K91 PolarHBondContact O-N 3.34Å; Q88-K91 VanDerWaalsContact O-N 3.12Å; Q88-I92 WeakPolarHBondContact O-CD1 3.48Å; Q88-I92 WeakPolarHBondContact O-CG1 3.38Å; Q88-I92 PolarHBondContact O-N 2.91Å
89	N	97.3	Very high	93.9	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.011	34%	0.337	C	S	.	.	H	α-helix	trans	-61.5	-41.3	176.7	-83.1	-25.4	0	0	0	112.3	F60 F80 A81 N84 T85 K91 I92 L93	F60-N89 WeakPolarHBondContact CD2-ND2 3.47Å; F80-N89 HydrophobicContact CD2-CB 3.87Å; F80-N89 WeakPolarHBondContact CD2-OD1 3.43Å; F80-N89 HydrophobicContact CE2-CB 3.61Å; F80-N89 HydrophobicContact CZ-CB 4.46Å; A81-N89 PolarHBondContact N-OD1 2.93Å; A81-N89 PolarHBondContact O-ND2 3.31Å; A81-N89 PolarHBondContact O-OD1 3.02Å; N84-N89 WeakPolarHBondContact CB-OD1 3.4Å; N84-N89 PolarHBondContact ND2-OD1 3.31Å; T85-N89 PolarHBondContact O-N 3.43Å; N89-K91 PolarHBondContact O-N 2.93Å; N89-I92 PolarHBondContact O-N 3.46Å; N89-L93 WeakPolarHBondContact O-CG 3.47Å; N89-L93 PolarHBondContact O-N 2.81Å
90	W	96.4	Very high	92.5	Very high	30 Å²	30	62.3 Å²	62.3	11%	0.114	35%	0.354	C	S	.	.	H	α-helix	trans	-61.5	-40.3	171.6	-84.3	123	0	0	0	113.3	W43 K44 V47 L51 L63 L86 Q88 L93 D94	W43-W90 HydrophobicContact CH2-CZ3 4.49Å; W43-W90 HydrophobicContact CZ3-CH2 4.09Å; W43-W90 AromaticContact CZ3-CZ3 3.76Å; W43-W90 HydrophobicContact CZ3-CZ3 3.76Å; K44-W90 HydrophobicContact CB-CH2 4.49Å; K44-W90 HydrophobicContact CB-CZ3 4.08Å; K44-W90 HydrophobicContact CD-CE3 4.01Å; K44-W90 HydrophobicContact CD-CZ3 4Å; K44-W90 HydrophobicContact CG-CE3 4.04Å; K44-W90 HydrophobicContact CG-CH2 3.98Å; K44-W90 HydrophobicContact CG-CZ3 3.56Å; V47-W90 HydrophobicContact CB-CH2 4.13Å; V47-W90 HydrophobicContact CG1-CH2 3.89Å; V47-W90 HydrophobicContact CG1-CZ2 4.14Å; L51-W90 HydrophobicContact CD1-CZ2 4.03Å; L63-W90 HydrophobicContact CD2-CH2 3.69Å; L63-W90 HydrophobicContact CD2-CZ2 3.66Å; L63-W90 HydrophobicContact CD2-CZ3 4.27Å; L86-W90 WeakPolarHBondContact O-CB 3.46Å; L86-W90 PolarHBondContact O-N 3.32Å; Q88-W90 PolarHBondContact O-N 2.88Å; W90-L93 HydrophobicContact CE3-CD1 4.05Å; W90-L93 HydrophobicContact CZ3-CD1 4.09Å; W90-L93 PolarHBondContact O-N 3.45Å; W90-D94 WeakPolarHBondContact O-CB 3.45Å; W90-D94 PolarHBondContact O-N 3Å
91	K	96.1	Very high	91.3	Very high	133 Å²	133	64.5 Å²	64.5	58%	0.578	37%	0.369	S	S	*	.	H	α-helix	trans	-62.6	-43.6	176	-175.5	-175.1	172.9	-171.7	0	111.4	A87 Q88 N89 L93 D94 D95	A87-K91 PolarHBondContact O-N 2.96Å; Q88-K91 WeakPolarHBondContact O-CB 3.4Å; Q88-K91 PolarHBondContact O-N 3.34Å; Q88-K91 VanDerWaalsContact O-N 3.12Å; N89-K91 PolarHBondContact O-N 2.93Å; K91-L93 VanDerWaalsContact C-N 3.33Å; K91-L93 PolarHBondContact O-N 3.16Å; K91-D94 WeakPolarHBondContact O-CB 3.4Å; K91-D94 PolarHBondContact O-N 2.85Å; K91-D94 VanDerWaalsContact O-N 3.12Å; K91-D95 VanDerWaalsContact O-CG 3.31Å; K91-D95 PolarHBondContact O-N 2.87Å
92	I	96.2	Very high	90.5	Very high	23 Å²	23	66.6 Å²	66.6	12%	0.118	38%	0.376	C	S	.	.	H	α-helix	trans	-63	-41.2	178	-65.6	157.3	0	0	0	110.9	N78 G79 F80 N84 Q88 N89 D94 D95 C96	N78-I92 HydrophobicContact CB-CG2 3.87Å; N78-I92 WeakPolarHBondContact O-CG2 3.3Å; G79-I92 WeakPolarHBondContact O-CD1 3.41Å; F80-I92 HydrophobicContact CB-CG2 3.96Å; N84-I92 WeakPolarHBondContact ND2-CD1 3.5Å; Q88-I92 WeakPolarHBondContact O-CD1 3.48Å; Q88-I92 WeakPolarHBondContact O-CG1 3.38Å; Q88-I92 PolarHBondContact O-N 2.91Å; N89-I92 PolarHBondContact O-N 3.46Å; I92-D94 VanDerWaalsContact C-N 3.35Å; I92-D95 PolarHBondContact O-N 2.79Å; I92-C96 VanDerWaalsContact O-CB 3.3Å; I92-C96 WeakPolarHBondContact O-CB 3.46Å; I92-C96 PolarHBondContact O-N 3.35Å; I92-C96 PolarHBondContact O-SG 2.98Å
93	L	95.5	Very high	89.6	Confident	0 Å²	0	66 Å²	66	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-65.3	-37.7	173.1	-65.5	178.4	0	0	0	111.9	Y40 W43 L63 L67 A75 F80 N89 W90 K91 C96 F97	Y40-L93 HydrophobicContact CE2-CB 4.1Å; Y40-L93 VanDerWaalsContact OH-C 3.24Å; Y40-L93 VanDerWaalsContact OH-CB 3.29Å; Y40-L93 WeakPolarHBondContact OH-CB 3.46Å; W43-L93 HydrophobicContact CH2-CD1 4.14Å; W43-L93 HydrophobicContact CZ3-CD1 4.17Å; L63-L93 HydrophobicContact CD2-CD1 4.21Å; L67-L93 HydrophobicContact CD1-CD2 3.98Å; L67-L93 HydrophobicContact CD2-CD2 4Å; A75-L93 HydrophobicContact CB-CD2 3.92Å; F80-L93 HydrophobicContact CD2-CD2 4.04Å; F80-L93 HydrophobicContact CD2-CG 4.01Å; F80-L93 HydrophobicContact CE2-CD1 3.81Å; F80-L93 HydrophobicContact CE2-CD2 3.97Å; F80-L93 HydrophobicContact CE2-CG 3.78Å; N89-L93 WeakPolarHBondContact O-CG 3.47Å; N89-L93 PolarHBondContact O-N 2.81Å; W90-L93 HydrophobicContact CE3-CD1 4.05Å; W90-L93 HydrophobicContact CZ3-CD1 4.09Å; W90-L93 PolarHBondContact O-N 3.45Å; K91-L93 VanDerWaalsContact C-N 3.33Å; K91-L93 PolarHBondContact O-N 3.16Å; L93-C96 PolarHBondContact O-N 2.8Å; L93-F97 HydrophobicContact CB-CD2 4.39Å; L93-F97 HydrophobicContact CD2-CD2 4Å; L93-F97 HydrophobicContact CD2-CE2 3.71Å; L93-F97 WeakPolarHBondContact O-CB 3.22Å; L93-F97 WeakPolarHBondContact O-CD2 3.34Å; L93-F97 PolarHBondContact O-N 3.07Å
94	D	93.7	Very high	88.6	Confident	45 Å²	45	66.4 Å²	66.4	24%	0.241	36%	0.363	C	S	.	.	H	α-helix	trans	-62.8	-48.1	175	-69	-21.8	0	0	0	111.3	Y40 K44 W90 K91 I92 C96 S98	Y40-D94 WeakPolarHBondContact CE1-OD1 3.06Å; Y40-D94 PolarHBondContact OH-N 2.8Å; Y40-D94 PolarHBondContact OH-OD1 2.83Å; K44-D94 WeakPolarHBondContact CD-OD1 3.33Å; K44-D94 IonicContact NZ-OD1 2.64Å; K44-D94 PolarHBondContact NZ-OD1 2.79Å; K44-D94 IonicContact NZ-OD2 2.67Å; K44-D94 PolarHBondContact NZ-OD2 2.94Å; W90-D94 WeakPolarHBondContact O-CB 3.45Å; W90-D94 PolarHBondContact O-N 3Å; K91-D94 WeakPolarHBondContact O-CB 3.4Å; K91-D94 PolarHBondContact O-N 2.85Å; K91-D94 VanDerWaalsContact O-N 3.12Å; I92-D94 VanDerWaalsContact C-N 3.35Å; D94-C96 VanDerWaalsContact C-N 3.27Å; D94-C96 PolarHBondContact O-N 2.83Å; D94-S98 WeakPolarHBondContact CA-OG 3.34Å; D94-S98 WeakPolarHBondContact O-CA 3.34Å; D94-S98 WeakPolarHBondContact O-CB 3.5Å; D94-S98 PolarHBondContact O-N 2.87Å; D94-S98 PolarHBondContact O-OG 3.32Å
95	D	92.1	Very high	88	Confident	113 Å²	113	68.7 Å²	68.7	60%	0.604	37%	0.373	S	S	*	.	H	α-helix	trans	-65.4	-29.7	178.3	-66.2	-26	0	0	0	111.8	K91 I92	K91-D95 VanDerWaalsContact O-CG 3.31Å; K91-D95 PolarHBondContact O-N 2.87Å; I92-D95 PolarHBondContact O-N 2.79Å
96	C	92.1	Very high	87.6	Confident	5 Å²	5	65.1 Å²	65.1	3%	0.034	35%	0.351	C	S	.	.	H	α-helix	trans	-80.6	-42.1	176.9	-72.5	0	0	0	0	114.3	R74 I92 L93 D94	R74-C96 PolarHBondContact NE-O 2.94Å; R74-C96 PolarHBondContact NH1-O 3.39Å; R74-C96 PolarHBondContact NH2-O 2.72Å; I92-C96 VanDerWaalsContact O-CB 3.3Å; I92-C96 WeakPolarHBondContact O-CB 3.46Å; I92-C96 PolarHBondContact O-N 3.35Å; I92-C96 PolarHBondContact O-SG 2.98Å; L93-C96 PolarHBondContact O-N 2.8Å; D94-C96 VanDerWaalsContact C-N 3.27Å; D94-C96 PolarHBondContact O-N 2.83Å
97	F	92.2	Very high	87.1	Confident	22 Å²	22	62.8 Å²	62.8	10%	0.096	34%	0.341	C	S	.	.	H	α-helix	trans	-123	-11.9	-163.1	-59.3	-73.6	0	0	0	114.7	L34 Y40 A71 R74 A75 L93 M99	L34-F97 HydrophobicContact CD2-CB 4.35Å; L34-F97 HydrophobicContact CD2-CD1 3.96Å; L34-F97 HydrophobicContact CD2-CD2 3.76Å; L34-F97 HydrophobicContact CD2-CE1 4.2Å; L34-F97 HydrophobicContact CD2-CE2 4.04Å; L34-F97 HydrophobicContact CD2-CG 3.75Å; L34-F97 HydrophobicContact CD2-CZ 4.26Å; Y40-F97 WeakPolarHBondContact CB-O 3.21Å; Y40-F97 HydrophobicContact CD1-CB 4.04Å; Y40-F97 HydrophobicContact CD2-CB 3.37Å; Y40-F97 HydrophobicContact CD2-CD2 4.49Å; Y40-F97 HydrophobicContact CD2-CG 4.2Å; Y40-F97 HydrophobicContact CE1-CB 4.46Å; Y40-F97 HydrophobicContact CE2-CB 3.86Å; Y40-F97 HydrophobicContact CE2-CD2 4.38Å; Y40-F97 HydrophobicContact CG-CB 3.48Å; Y40-F97 VanDerWaalsContact CG-CB 3.48Å; A71-F97 HydrophobicContact CB-CE1 3.89Å; A71-F97 HydrophobicContact CB-CE2 4.49Å; A71-F97 HydrophobicContact CB-CZ 3.61Å; A71-F97 WeakPolarHBondContact O-CZ 3.26Å; R74-F97 HydrophobicContact CB-CZ 4.23Å; R74-F97 HydrophobicContact CG-CZ 4.41Å; A75-F97 HydrophobicContact CB-CE2 4.44Å; L93-F97 HydrophobicContact CB-CD2 4.39Å; L93-F97 HydrophobicContact CD2-CD2 4Å; L93-F97 HydrophobicContact CD2-CE2 3.71Å; L93-F97 WeakPolarHBondContact O-CB 3.22Å; L93-F97 WeakPolarHBondContact O-CD2 3.34Å; L93-F97 PolarHBondContact O-N 3.07Å; F97-M99 PolarHBondContact O-N 3.41Å
98	S	86.9	Confident	86.3	Confident	50 Å²	50	64 Å²	64	35%	0.35	34%	0.337	S	S	.	.			trans	-69.6	121.5	167.5	-50.7	0	0	0	0	108.5	Y40 D94 P100	Y40-S98 WeakPolarHBondContact CE1-OG 3.32Å; D94-S98 WeakPolarHBondContact CA-OG 3.34Å; D94-S98 WeakPolarHBondContact O-CA 3.34Å; D94-S98 WeakPolarHBondContact O-CB 3.5Å; D94-S98 PolarHBondContact O-N 2.87Å; D94-S98 PolarHBondContact O-OG 3.32Å; S98-P100 VanDerWaalsContact O-CD 3.24Å; S98-P100 WeakPolarHBondContact O-CD 3.36Å
99	M	74.5	Confident	86	Confident	161 Å²	161	66.3 Å²	66.3	79%	0.793	34%	0.342	S	S	*	.			trans	-66.8	118.7	163.8	-70.1	-60.6	-64.6	0	0	107.7	F97 V101	F97-M99 PolarHBondContact O-N 3.41Å; M99-V101 PolarHBondContact O-N 2.7Å
100	P	69.1	Low	85.7	Confident	123 Å²	123	66.3 Å²	66.3	80%	0.799	34%	0.341	S	S	*	.			trans	-68	97.8	176.4	27.5	-33.3	0	0	0	108.6	S98 D102	S98-P100 VanDerWaalsContact O-CD 3.24Å; S98-P100 WeakPolarHBondContact O-CD 3.36Å; P100-D102 PolarHBondContact O-N 2.86Å
101	V	71.2	Confident	85.3	Confident	57 Å²	57	69.6 Å²	69.6	35%	0.345	36%	0.36	S	S	.	.			trans	-82.8	106.3	170.8	-178.6	0	0	0	0	107.1	M99 P103 A106 Q134	M99-V101 PolarHBondContact O-N 2.7Å; V101-P103 VanDerWaalsContact O-CD 3.24Å; V101-P103 WeakPolarHBondContact O-CD 3.49Å; V101-A106 HydrophobicContact CG1-CB 3.69Å; V101-Q134 HydrophobicContact CG1-CB 4.18Å
102	D	79.3	Confident	85	Confident	76 Å²	76	67 Å²	67	41%	0.406	36%	0.359	S	S	.	.			trans	-55.9	118.4	168.1	163.9	32.6	0	0	0	109.3	P100 Q104 Q105 A106	P100-D102 PolarHBondContact O-N 2.86Å; D102-Q104 PolarHBondContact O-N 3.3Å; D102-Q104 WeakPolarHBondContact OD1-CB 3.27Å; D102-Q104 PolarHBondContact OD1-N 3.46Å; D102-Q105 HydrophobicContact CB-CB 4.02Å; D102-Q105 PolarHBondContact O-N 3.32Å; D102-Q105 VanDerWaalsContact OD2-CB 3.24Å; D102-Q105 WeakPolarHBondContact OD2-CB 3.42Å; D102-Q105 PolarHBondContact OD2-N 3.36Å; D102-A106 PolarHBondContact O-N 3.1Å
103	P	77.3	Confident	85	Confident	60 Å²	60	67.9 Å²	67.9	39%	0.39	36%	0.361	S	S	.	.	H	α-helix	trans	-59.6	-29	179.5	-24.8	35.7	0	0	0	112.8	V101 A106 A107 P137	V101-P103 VanDerWaalsContact O-CD 3.24Å; V101-P103 WeakPolarHBondContact O-CD 3.49Å; P103-A106 PolarHBondContact O-N 3.49Å; P103-A107 VanDerWaalsContact O-CB 3.28Å; P103-A107 WeakPolarHBondContact O-CB 3.47Å; P103-A107 PolarHBondContact O-N 3.41Å; P103-P137 HydrophobicContact CG-CG 4.44Å
104	Q	74.3	Confident	85	Confident	149 Å²	149	72.6 Å²	72.6	70%	0.696	38%	0.383	S	S	*	.	H	α-helix	trans	-68.7	-49.8	176.4	-54.8	-172.7	7.3	0	0	110.6	D102 A106 A107 I108	D102-Q104 PolarHBondContact O-N 3.3Å; D102-Q104 WeakPolarHBondContact OD1-CB 3.27Å; D102-Q104 PolarHBondContact OD1-N 3.46Å; Q104-A106 VanDerWaalsContact C-N 3.29Å; Q104-A106 PolarHBondContact O-N 3.01Å; Q104-A107 PolarHBondContact O-N 3.04Å; Q104-A107 VanDerWaalsContact O-N 3.17Å; Q104-I108 WeakPolarHBondContact O-CG1 3.32Å; Q104-I108 PolarHBondContact O-N 2.71Å
105	Q	81.4	Confident	85.1	Confident	84 Å²	84	71.5 Å²	71.5	39%	0.393	38%	0.376	S	S	.	.	H	α-helix	trans	-61	-35.6	174.5	-175.6	57	91.5	0	0	112.7	D102 R109	D102-Q105 HydrophobicContact CB-CB 4.02Å; D102-Q105 PolarHBondContact O-N 3.32Å; D102-Q105 VanDerWaalsContact OD2-CB 3.24Å; D102-Q105 WeakPolarHBondContact OD2-CB 3.42Å; D102-Q105 PolarHBondContact OD2-N 3.36Å; Q105-R109 WeakPolarHBondContact O-CG 3.47Å; Q105-R109 PolarHBondContact O-N 3.07Å; Q105-R109 VanDerWaalsContact O-N 3.11Å
106	A	86.5	Confident	85.2	Confident	4 Å²	4	69.5 Å²	69.5	3%	0.033	37%	0.368	C	S	.	.	H	α-helix	trans	-68.4	-41.3	172.8	0	0	0	0	0	112.5	V101 D102 P103 Q104 I108 R109 F110 Q134 A135	V101-A106 HydrophobicContact CG1-CB 3.69Å; D102-A106 PolarHBondContact O-N 3.1Å; P103-A106 PolarHBondContact O-N 3.49Å; Q104-A106 VanDerWaalsContact C-N 3.29Å; Q104-A106 PolarHBondContact O-N 3.01Å; A106-I108 PolarHBondContact O-N 2.81Å; A106-R109 PolarHBondContact O-N 2.81Å; A106-F110 WeakPolarHBondContact O-CB 3.16Å; A106-F110 PolarHBondContact O-N 2.86Å; A106-Q134 HydrophobicContact CB-CB 4.11Å; A106-A135 HydrophobicContact CB-CB 4.12Å
107	A	84	Confident	85.2	Confident	17 Å²	17	75.2 Å²	75.2	14%	0.14	41%	0.405	C	S	.	.	H	α-helix	trans	-62.3	-40.4	173.9	0	0	0	0	0	112	P103 Q104 R109 F110 L111 A135 F136	P103-A107 VanDerWaalsContact O-CB 3.28Å; P103-A107 WeakPolarHBondContact O-CB 3.47Å; P103-A107 PolarHBondContact O-N 3.41Å; Q104-A107 PolarHBondContact O-N 3.04Å; Q104-A107 VanDerWaalsContact O-N 3.17Å; A107-R109 VanDerWaalsContact C-N 3.34Å; A107-R109 PolarHBondContact O-N 2.99Å; A107-F110 PolarHBondContact O-N 2.97Å; A107-L111 WeakPolarHBondContact O-CB 3.47Å; A107-L111 VanDerWaalsContact O-CG 3.26Å; A107-L111 WeakPolarHBondContact O-CG 3.17Å; A107-L111 PolarHBondContact O-N 2.95Å; A107-A135 HydrophobicContact CB-CB 4.17Å; A107-F136 HydrophobicContact CB-CE1 4.01Å; A107-F136 HydrophobicContact CB-CZ 4.1Å
108	I	79.7	Confident	85.2	Confident	95 Å²	95	78.4 Å²	78.4	49%	0.487	44%	0.444	S	S	.	.	H	α-helix	trans	-59.5	-44.9	172.9	-68.8	165.6	0	0	0	110.8	Q104 A106 S112	Q104-I108 WeakPolarHBondContact O-CG1 3.32Å; Q104-I108 PolarHBondContact O-N 2.71Å; A106-I108 PolarHBondContact O-N 2.81Å; I108-S112 VanDerWaalsContact O-CB 3.23Å; I108-S112 WeakPolarHBondContact O-CB 3.29Å; I108-S112 PolarHBondContact O-N 3.48Å; I108-S112 PolarHBondContact O-OG 3.24Å
109	R	89.6	Confident	85.5	Confident	144 Å²	144	77.7 Å²	77.7	54%	0.543	44%	0.435	S	S	.	.	H	α-helix	trans	-63.6	-44.8	177.3	-72.1	170.6	-176.6	177.3	1.8	111.9	Q105 A106 A107 S112 R113	Q105-R109 WeakPolarHBondContact O-CG 3.47Å; Q105-R109 PolarHBondContact O-N 3.07Å; Q105-R109 VanDerWaalsContact O-N 3.11Å; A106-R109 PolarHBondContact O-N 2.81Å; A107-R109 VanDerWaalsContact C-N 3.34Å; A107-R109 PolarHBondContact O-N 2.99Å; R109-S112 PolarHBondContact O-N 3.15Å; R109-R113 PolarHBondContact O-N 3.43Å; R109-R113 VanDerWaalsContact O-N 3.17Å
110	F	92.6	Very high	86.3	Confident	1 Å²	1	72.6 Å²	72.6	0%	0.004	41%	0.411	C	S	.	.	H	α-helix	trans	-60.4	-50.2	176.2	175.1	-90.8	0	0	0	111.9	A106 A107 S112 R113 L128 M131 A132 A135 F136 L147 I148 R151	A106-F110 WeakPolarHBondContact O-CB 3.16Å; A106-F110 PolarHBondContact O-N 2.86Å; A107-F110 PolarHBondContact O-N 2.97Å; F110-S112 VanDerWaalsContact C-N 3.33Å; F110-S112 PolarHBondContact O-N 2.93Å; F110-R113 WeakPolarHBondContact O-CB 3.49Å; F110-R113 PolarHBondContact O-N 3.06Å; F110-L128 HydrophobicContact CD2-CD2 4.07Å; F110-L128 HydrophobicContact CE2-CB 4.2Å; F110-L128 HydrophobicContact CE2-CD2 3.93Å; F110-M131 HydrophobicContact CB-CB 4.24Å; F110-M131 HydrophobicContact CD2-CB 3.92Å; F110-A132 HydrophobicContact CD2-CB 4.16Å; F110-A132 HydrophobicContact CE2-CB 3.81Å; F110-A135 HydrophobicContact CB-CB 4.11Å; F110-F136 AromaticContact CD1-CE2 3.59Å; F110-F136 HydrophobicContact CD1-CE2 3.59Å; F110-F136 AromaticContact CD1-CZ 3.99Å; F110-F136 HydrophobicContact CD1-CZ 3.99Å; F110-F136 AromaticContact CE1-CE2 3.83Å; F110-F136 HydrophobicContact CE1-CE2 3.83Å; F110-F136 HydrophobicContact CE1-CZ 4.38Å; F110-F136 AromaticContact CG-CE2 3.97Å; F110-F136 HydrophobicContact CG-CE2 3.97Å; F110-F136 HydrophobicContact CZ-CE2 4.39Å; F110-L147 HydrophobicContact CE1-CB 4.17Å; F110-L147 HydrophobicContact CZ-CB 4.08Å; F110-I148 HydrophobicContact CE2-CG1 4.18Å; F110-I148 HydrophobicContact CZ-CG1 4.39Å; F110-R151 HydrophobicContact CD1-CG 4.39Å; F110-R151 HydrophobicContact CE1-CB 3.8Å; F110-R151 HydrophobicContact CE1-CG 3.91Å; F110-R151 HydrophobicContact CE2-CB 4.49Å; F110-R151 HydrophobicContact CE2-CG 4.47Å; F110-R151 HydrophobicContact CZ-CB 3.66Å; F110-R151 HydrophobicContact CZ-CG 3.96Å; F110-R151 WeakPolarHBondContact O-CD 3.2Å
111	L	87.6	Confident	87.5	Confident	99 Å²	99	67.6 Å²	67.6	52%	0.518	38%	0.379	S	S	.	.	H	α-helix	trans	-66.2	-34.4	-178.8	-69.7	174	0	0	0	112.4	A107 R113 R151	A107-L111 WeakPolarHBondContact O-CB 3.47Å; A107-L111 VanDerWaalsContact O-CG 3.26Å; A107-L111 WeakPolarHBondContact O-CG 3.17Å; A107-L111 PolarHBondContact O-N 2.95Å; L111-R113 VanDerWaalsContact C-N 3.3Å; L111-R113 PolarHBondContact O-N 3.06Å; L111-R151 PolarHBondContact O-NE 3.11Å; L111-R151 PolarHBondContact O-NH1 3.07Å
112	S	89.5	Confident	88.6	Confident	79 Å²	79	65.4 Å²	65.4	55%	0.552	37%	0.365	S	S	*	.	H	α-helix	trans	-78.4	-12	177.9	-54.6	0	0	0	0	113.4	I108 R109 F110 H114	I108-S112 VanDerWaalsContact O-CB 3.23Å; I108-S112 WeakPolarHBondContact O-CB 3.29Å; I108-S112 PolarHBondContact O-N 3.48Å; I108-S112 PolarHBondContact O-OG 3.24Å; R109-S112 PolarHBondContact O-N 3.15Å; F110-S112 VanDerWaalsContact C-N 3.33Å; F110-S112 PolarHBondContact O-N 2.93Å; S112-H114 PolarHBondContact O-N 2.8Å; S112-H114 PolarHBondContact O-ND1 2.99Å
113	R	95.9	Very high	89.3	Confident	42 Å²	42	65.9 Å²	65.9	16%	0.158	37%	0.368	C	S	.	.			trans	-71.8	121.9	-174.4	-170.9	68.1	160.6	88.4	5.3	111.5	R109 F110 L111 E119 Y124 S127 L128 M131 R151	R109-R113 PolarHBondContact O-N 3.43Å; R109-R113 VanDerWaalsContact O-N 3.17Å; F110-R113 WeakPolarHBondContact O-CB 3.49Å; F110-R113 PolarHBondContact O-N 3.06Å; L111-R113 VanDerWaalsContact C-N 3.3Å; L111-R113 PolarHBondContact O-N 3.06Å; R113-E119 IonicContact CZ-OE1 3.99Å; R113-E119 IonicContact CZ-OE2 3.62Å; R113-E119 IonicContact NH1-OE1 2.71Å; R113-E119 IonicContact NH1-OE2 2.88Å; R113-E119 PolarHBondContact NH1-OE2 3.48Å; R113-E119 IonicContact NH2-OE1 2.71Å; R113-E119 PolarHBondContact NH2-OE1 3.49Å; R113-E119 IonicContact NH2-OE2 3.3Å; R113-E119 PolarHBondContact NH2-OE2 3.42Å; R113-Y124 HydrophobicContact CG-CD2 4.23Å; R113-Y124 HydrophobicContact CG-CE2 3.75Å; R113-Y124 PolarHBondContact O-OH 3.19Å; R113-S127 PolarHBondContact NE-OG 3.34Å; R113-S127 PolarHBondContact NH2-OG 3.48Å; R113-S127 VanDerWaalsContact NH2-OG 3.11Å; R113-L128 HydrophobicContact CB-CD2 3.96Å; R113-L128 HydrophobicContact CG-CD2 3.98Å; R113-M131 HydrophobicContact CB-SD 4.22Å; R113-M131 HydrophobicContact CG-SD 4.22Å; R113-R151 PolarHBondContact O-NE 2.88Å; R113-R151 PolarHBondContact O-NH2 3.36Å
114	H	95	Very high	90.2	Very high	98 Å²	98	63 Å²	63	45%	0.454	35%	0.349	S	S	.	.			trans	-120.6	153.7	168.3	-62.2	74.3	0	0	0	108	S112 T116 R151 G155	S112-H114 PolarHBondContact O-N 2.8Å; S112-H114 PolarHBondContact O-ND1 2.99Å; H114-T116 PolarHBondContact O-N 3.31Å; H114-R151 PolarHBondContact CD2-NH2 2.88Å; H114-R151 VanDerWaalsContact CD2-NH2 3.32Å; H114-R151 PolarHBondContact CE1-NH2 2.79Å; H114-R151 PolarHBondContact ND1-NH2 3.3Å; H114-R151 PolarHBondContact NE2-NH2 2.93Å; H114-G155 CarbonylContact C-O 3.52Å; H114-G155 WeakPolarHBondContact CA-O 3.25Å
115	Q	96.7	Very high	91.2	Very high	23 Å²	23	56 Å²	56	11%	0.107	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-57.4	132.8	170.9	-177.1	-172.3	5.6	0	0	109.4	E119 Y124 G155 I157	Q115-E119 WeakPolarHBondContact CA-OE2 3.45Å; Q115-E119 HydrophobicContact CG-CB 4.39Å; Q115-E119 HydrophobicContact CG-CG 4.37Å; Q115-E119 PolarHBondContact NE2-O 2.8Å; Q115-Y124 HydrophobicContact CB-CD1 3.63Å; Q115-Y124 HydrophobicContact CB-CD2 4.44Å; Q115-Y124 HydrophobicContact CB-CE1 4.03Å; Q115-Y124 HydrophobicContact CB-CG 3.85Å; Q115-Y124 HydrophobicContact CG-CD1 4.24Å; Q115-Y124 HydrophobicContact CG-CG 4.31Å; Q115-G155 PolarHBondContact N-O 3Å; Q115-I157 HydrophobicContact CB-CD1 4.33Å; Q115-I157 HydrophobicContact CB-CG1 4.09Å; Q115-I157 HydrophobicContact CG-CD1 4.02Å; Q115-I157 HydrophobicContact CG-CG1 4.23Å; Q115-I157 WeakPolarHBondContact O-CD1 3.42Å; Q115-I157 WeakPolarHBondContact O-CG1 3.41Å
116	T	94.4	Very high	91.8	Very high	71 Å²	71	54.1 Å²	54.1	44%	0.436	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-88.1	155.8	178.9	57.7	0	0	0	0	111.8	H114 G118 E119 I157	H114-T116 PolarHBondContact O-N 3.31Å; T116-G118 PolarHBondContact O-N 3.06Å; T116-E119 PolarHBondContact N-OE2 2.97Å; T116-E119 WeakPolarHBondContact O-CB 3.48Å; T116-E119 PolarHBondContact O-N 2.7Å; T116-E119 VanDerWaalsContact O-N 3.07Å; T116-E119 VanDerWaalsContact OG1-CB 3.23Å; T116-E119 WeakPolarHBondContact OG1-CB 3.38Å; T116-E119 PolarHBondContact OG1-OE2 2.98Å; T116-I157 WeakPolarHBondContact O-CD1 3.45Å
117	P	92.2	Very high	92.2	Very high	125 Å²	125	55.1 Å²	55.1	81%	0.812	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	124.9	174.8	-24.8	35.1	0	0	0	111.3	E119	P117-E119 VanDerWaalsContact C-N 3.32Å
118	G	90.8	Very high	92.8	Very high	88 Å²	88	54.3 Å²	54.3	91%	0.907	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	-12.4	-177.3	0	0	0	0	0	115.4	T116	T116-G118 PolarHBondContact O-N 3.06Å
119	E	94	Very high	93.6	Very high	35 Å²	35	52.9 Å²	52.9	16%	0.164	30%	0.3	C	S	.	.			trans	-73	130.6	169.9	170.7	176.1	-135.3	0	0	110.2	R113 Q115 T116 P117 D123 Y124	R113-E119 IonicContact CZ-OE1 3.99Å; R113-E119 IonicContact CZ-OE2 3.62Å; R113-E119 IonicContact NH1-OE1 2.71Å; R113-E119 IonicContact NH1-OE2 2.88Å; R113-E119 PolarHBondContact NH1-OE2 3.48Å; R113-E119 IonicContact NH2-OE1 2.71Å; R113-E119 PolarHBondContact NH2-OE1 3.49Å; R113-E119 IonicContact NH2-OE2 3.3Å; R113-E119 PolarHBondContact NH2-OE2 3.42Å; Q115-E119 WeakPolarHBondContact CA-OE2 3.45Å; Q115-E119 HydrophobicContact CG-CB 4.39Å; Q115-E119 HydrophobicContact CG-CG 4.37Å; Q115-E119 PolarHBondContact NE2-O 2.8Å; T116-E119 PolarHBondContact N-OE2 2.97Å; T116-E119 WeakPolarHBondContact O-CB 3.48Å; T116-E119 PolarHBondContact O-N 2.7Å; T116-E119 VanDerWaalsContact O-N 3.07Å; T116-E119 VanDerWaalsContact OG1-CB 3.23Å; T116-E119 WeakPolarHBondContact OG1-CB 3.38Å; T116-E119 PolarHBondContact OG1-OE2 2.98Å; P117-E119 VanDerWaalsContact C-N 3.32Å; E119-D123 HydrophobicContact CG-CB 4.42Å; E119-Y124 WeakPolarHBondContact OE1-CA 3.49Å; E119-Y124 PolarHBondContact OE1-N 2.92Å
120	N	91.4	Very high	93.7	Very high	54 Å²	54	52.7 Å²	52.7	29%	0.289	31%	0.305	S	S	.	.			trans	-76.1	149.7	175.2	73.7	73.2	0	0	0	111.1	I122 D123 Y124 M184	N120-I122 PolarHBondContact O-N 3.37Å; N120-I122 VanDerWaalsContact O-N 3.13Å; N120-I122 WeakPolarHBondContact OD1-CB 3.34Å; N120-I122 PolarHBondContact OD1-N 3.33Å; N120-D123 PolarHBondContact ND2-OD2 2.92Å; N120-D123 PolarHBondContact O-N 2.89Å; N120-D123 PolarHBondContact OD1-N 2.72Å; N120-Y124 PolarHBondContact O-N 2.87Å; N120-M184 HydrophobicContact CB-CE 3.77Å
121	P	93.6	Very high	93.7	Very high	19 Å²	19	55 Å²	55	12%	0.123	32%	0.317	C	S	.	.	H	α-helix	trans	-55.6	-30.2	-178.3	-31.4	37.5	0	0	0	115.6	F125 F152 L156 L161 T180 M184	P121-F125 VanDerWaalsContact O-CB 3.28Å; P121-F125 WeakPolarHBondContact O-CB 3.46Å; P121-F125 PolarHBondContact O-N 3.44Å; P121-F152 HydrophobicContact CB-CZ 4.19Å; P121-F152 VanDerWaalsContact O-CE2 3.26Å; P121-F152 WeakPolarHBondContact O-CE2 3.3Å; P121-L156 HydrophobicContact CB-CD2 4.14Å; P121-L156 HydrophobicContact CG-CD2 4.36Å; P121-L161 HydrophobicContact CB-CD2 3.9Å; P121-L161 HydrophobicContact CG-CD2 3.89Å; P121-T180 HydrophobicContact CB-CG2 3.46Å; P121-T180 VanDerWaalsContact CB-CG2 3.46Å; P121-M184 HydrophobicContact CB-SD 4.3Å; P121-M184 HydrophobicContact CG-SD 4.34Å
122	I	93.8	Very high	94	Very high	11 Å²	11	50.3 Å²	50.3	6%	0.056	29%	0.292	C	S	.	.	H	α-helix	trans	-74.3	-37.6	-179	-66.9	-68.8	0	0	0	111.4	N120 F125 N126 K177 T180 F181 M184	N120-I122 PolarHBondContact O-N 3.37Å; N120-I122 VanDerWaalsContact O-N 3.13Å; N120-I122 WeakPolarHBondContact OD1-CB 3.34Å; N120-I122 PolarHBondContact OD1-N 3.33Å; I122-F125 WeakPolarHBondContact O-CB 3.44Å; I122-F125 PolarHBondContact O-N 2.67Å; I122-N126 WeakPolarHBondContact O-CB 3.23Å; I122-N126 PolarHBondContact O-N 3.43Å; I122-N126 PolarHBondContact O-ND2 3.13Å; I122-N126 VanDerWaalsContact O-ND2 3.09Å; I122-K177 HydrophobicContact CD1-CG 4.07Å; I122-T180 HydrophobicContact CD1-CG2 3.56Å; I122-T180 HydrophobicContact CG1-CG2 3.92Å; I122-F181 HydrophobicContact CB-CE1 4.44Å; I122-F181 HydrophobicContact CB-CZ 4.49Å; I122-F181 HydrophobicContact CD1-CD1 4.06Å; I122-F181 HydrophobicContact CD1-CD2 3.74Å; I122-F181 HydrophobicContact CD1-CE1 3.96Å; I122-F181 HydrophobicContact CD1-CE2 3.64Å; I122-F181 HydrophobicContact CD1-CG 3.95Å; I122-F181 HydrophobicContact CD1-CZ 3.75Å; I122-F181 HydrophobicContact CG1-CD1 3.92Å; I122-F181 HydrophobicContact CG1-CD2 4.48Å; I122-F181 HydrophobicContact CG1-CE1 3.69Å; I122-F181 HydrophobicContact CG1-CE2 4.3Å; I122-F181 HydrophobicContact CG1-CG 4.31Å; I122-F181 HydrophobicContact CG1-CZ 3.9Å; I122-F181 HydrophobicContact CG2-CE1 4.17Å; I122-F181 HydrophobicContact CG2-CZ 3.84Å; I122-M184 HydrophobicContact CB-SD 4.36Å; I122-M184 HydrophobicContact CG1-CE 4.49Å; I122-M184 HydrophobicContact CG1-SD 3.63Å
123	D	94.1	Very high	94.1	Very high	86 Å²	86	50.6 Å²	50.6	46%	0.46	29%	0.291	S	S	.	.	H	α-helix	trans	-69.1	-40.4	174.9	-71.2	-20.5	0	0	0	111.6	E119 N120 F125 N126 S127	E119-D123 HydrophobicContact CG-CB 4.42Å; N120-D123 PolarHBondContact ND2-OD2 2.92Å; N120-D123 PolarHBondContact O-N 2.89Å; N120-D123 PolarHBondContact OD1-N 2.72Å; D123-F125 VanDerWaalsContact C-N 3.32Å; D123-F125 PolarHBondContact O-N 2.96Å; D123-N126 PolarHBondContact O-N 3.19Å; D123-S127 WeakPolarHBondContact O-CB 3.28Å; D123-S127 PolarHBondContact O-N 3.47Å
124	Y	96.3	Very high	93.7	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-56.9	-47.1	170.2	170.3	-136.6	0	0	0	111.3	R113 Q115 E119 N120 S127 L128 R151 F152 G155 L156	R113-Y124 HydrophobicContact CG-CD2 4.23Å; R113-Y124 HydrophobicContact CG-CE2 3.75Å; R113-Y124 PolarHBondContact O-OH 3.19Å; Q115-Y124 HydrophobicContact CB-CD1 3.63Å; Q115-Y124 HydrophobicContact CB-CD2 4.44Å; Q115-Y124 HydrophobicContact CB-CE1 4.03Å; Q115-Y124 HydrophobicContact CB-CG 3.85Å; Q115-Y124 HydrophobicContact CG-CD1 4.24Å; Q115-Y124 HydrophobicContact CG-CG 4.31Å; E119-Y124 WeakPolarHBondContact OE1-CA 3.49Å; E119-Y124 PolarHBondContact OE1-N 2.92Å; N120-Y124 PolarHBondContact O-N 2.87Å; Y124-S127 WeakPolarHBondContact O-CB 3.26Å; Y124-S127 PolarHBondContact O-N 3.06Å; Y124-L128 HydrophobicContact CD2-CD1 4.43Å; Y124-L128 HydrophobicContact CD2-CG 4.18Å; Y124-L128 HydrophobicContact CE1-CD1 4.31Å; Y124-L128 HydrophobicContact CE2-CD1 3.71Å; Y124-L128 HydrophobicContact CE2-CD2 3.88Å; Y124-L128 HydrophobicContact CE2-CG 3.64Å; Y124-L128 PolarHBondContact O-N 3.06Å; Y124-R151 PolarHBondContact OH-O 3.12Å; Y124-F152 AromaticContact CD1-CD2 3.51Å; Y124-F152 HydrophobicContact CD1-CD2 3.51Å; Y124-F152 AromaticContact CD1-CE2 3.54Å; Y124-F152 HydrophobicContact CD1-CE2 3.54Å; Y124-F152 AromaticContact CE1-CD2 3.51Å; Y124-F152 HydrophobicContact CE1-CD2 3.51Å; Y124-F152 AromaticContact CE1-CE2 3.98Å; Y124-F152 HydrophobicContact CE1-CE2 3.98Å; Y124-F152 HydrophobicContact CE1-CG 4.38Å; Y124-F152 HydrophobicContact CG-CD2 4.38Å; Y124-F152 HydrophobicContact CG-CE2 4.39Å; Y124-G155 VanDerWaalsContact OH-CA 3.24Å; Y124-G155 WeakPolarHBondContact OH-CA 3.38Å; Y124-L156 HydrophobicContact CD1-CD2 4.21Å; Y124-L156 HydrophobicContact CE1-CD2 4.44Å; Y124-L156 HydrophobicContact CE1-CG 4.41Å
125	F	95.4	Very high	93.4	Very high	1 Å²	1	49 Å²	49	0%	0.004	29%	0.286	C	S	.	.	H	α-helix	trans	-59.3	-49.1	176.8	-178.4	-89.7	0	0	0	112.2	P121 I122 D123 S127 L128 Q129 I148 F152 I173 L176 K177	P121-F125 VanDerWaalsContact O-CB 3.28Å; P121-F125 WeakPolarHBondContact O-CB 3.46Å; P121-F125 PolarHBondContact O-N 3.44Å; I122-F125 WeakPolarHBondContact O-CB 3.44Å; I122-F125 PolarHBondContact O-N 2.67Å; D123-F125 VanDerWaalsContact C-N 3.32Å; D123-F125 PolarHBondContact O-N 2.96Å; F125-S127 VanDerWaalsContact C-N 3.29Å; F125-S127 PolarHBondContact O-N 3.04Å; F125-L128 WeakPolarHBondContact O-CB 3.47Å; F125-L128 PolarHBondContact O-N 3.06Å; F125-L128 VanDerWaalsContact O-N 3.16Å; F125-Q129 HydrophobicContact CD1-CG 4.18Å; F125-Q129 HydrophobicContact CE1-CG 3.78Å; F125-Q129 VanDerWaalsContact CE1-OE1 3.3Å; F125-Q129 HydrophobicContact CZ-CG 4.27Å; F125-Q129 WeakPolarHBondContact O-CG 3.34Å; F125-Q129 PolarHBondContact O-N 3.33Å; F125-I148 HydrophobicContact CD2-CG2 4.38Å; F125-I148 HydrophobicContact CE2-CG2 3.84Å; F125-I148 HydrophobicContact CZ-CG2 4.21Å; F125-F152 HydrophobicContact CB-CD2 3.96Å; F125-F152 HydrophobicContact CB-CE2 3.64Å; F125-F152 HydrophobicContact CB-CZ 4.24Å; F125-F152 HydrophobicContact CD2-CB 4.49Å; F125-F152 HydrophobicContact CD2-CD1 4.25Å; F125-F152 AromaticContact CD2-CD2 3.87Å; F125-F152 HydrophobicContact CD2-CD2 3.87Å; F125-F152 HydrophobicContact CD2-CE1 4.4Å; F125-F152 HydrophobicContact CD2-CE2 4.09Å; F125-F152 AromaticContact CD2-CG 3.95Å; F125-F152 HydrophobicContact CD2-CG 3.95Å; F125-F152 HydrophobicContact CD2-CZ 4.33Å; F125-F152 HydrophobicContact CG-CD2 4.43Å; F125-F152 HydrophobicContact CG-CE2 4.38Å; F125-I173 HydrophobicContact CE2-CD1 4.36Å; F125-I173 HydrophobicContact CE2-CG1 4.07Å; F125-I173 HydrophobicContact CZ-CD1 3.77Å; F125-I173 HydrophobicContact CZ-CG1 3.53Å; F125-L176 HydrophobicContact CD2-CD2 4.46Å; F125-L176 HydrophobicContact CE2-CD2 3.92Å; F125-L176 HydrophobicContact CE2-CG 4.49Å; F125-K177 HydrophobicContact CD1-CD 4.2Å; F125-K177 HydrophobicContact CE1-CB 4.44Å; F125-K177 HydrophobicContact CE1-CD 3.84Å; F125-K177 HydrophobicContact CE1-CG 4.4Å
126	N	95	Very high	92.9	Very high	45 Å²	45	49.9 Å²	49.9	24%	0.241	29%	0.29	C	S	.	.	H	α-helix	trans	-61.7	-37.6	178.2	-64.4	-31.5	0	0	0	111.4	I122 D123 Q129 Q130 K177	I122-N126 WeakPolarHBondContact O-CB 3.23Å; I122-N126 PolarHBondContact O-N 3.43Å; I122-N126 PolarHBondContact O-ND2 3.13Å; I122-N126 VanDerWaalsContact O-ND2 3.09Å; D123-N126 PolarHBondContact O-N 3.19Å; N126-Q129 PolarHBondContact O-N 3.19Å; N126-Q130 WeakPolarHBondContact O-CG 3.3Å; N126-Q130 PolarHBondContact O-N 3.06Å; N126-Q130 VanDerWaalsContact O-N 3.13Å; N126-K177 PolarHBondContact OD1-NZ 3.31Å
127	S	95.4	Very high	92.5	Very high	24 Å²	24	50.2 Å²	50.2	17%	0.168	29%	0.293	C	S	.	.	H	α-helix	trans	-61.3	-42.1	174.4	-173.6	0	0	0	0	111.8	R113 D123 Y124 F125 Q130 M131	R113-S127 PolarHBondContact NE-OG 3.34Å; R113-S127 PolarHBondContact NH2-OG 3.48Å; R113-S127 VanDerWaalsContact NH2-OG 3.11Å; D123-S127 WeakPolarHBondContact O-CB 3.28Å; D123-S127 PolarHBondContact O-N 3.47Å; Y124-S127 WeakPolarHBondContact O-CB 3.26Å; Y124-S127 PolarHBondContact O-N 3.06Å; F125-S127 VanDerWaalsContact C-N 3.29Å; F125-S127 PolarHBondContact O-N 3.04Å; S127-Q130 PolarHBondContact O-N 3.19Å; S127-M131 WeakPolarHBondContact O-CG 3.33Å; S127-M131 PolarHBondContact O-N 2.87Å
128	L	96.5	Very high	92.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.5	-40.4	173.1	-70.1	179.7	0	0	0	112.7	F110 R113 Y124 F125 Q130 M131 A132 I148 R151 F152	F110-L128 HydrophobicContact CD2-CD2 4.07Å; F110-L128 HydrophobicContact CE2-CB 4.2Å; F110-L128 HydrophobicContact CE2-CD2 3.93Å; R113-L128 HydrophobicContact CB-CD2 3.96Å; R113-L128 HydrophobicContact CG-CD2 3.98Å; Y124-L128 HydrophobicContact CD2-CD1 4.43Å; Y124-L128 HydrophobicContact CD2-CG 4.18Å; Y124-L128 HydrophobicContact CE1-CD1 4.31Å; Y124-L128 HydrophobicContact CE2-CD1 3.71Å; Y124-L128 HydrophobicContact CE2-CD2 3.88Å; Y124-L128 HydrophobicContact CE2-CG 3.64Å; Y124-L128 PolarHBondContact O-N 3.06Å; F125-L128 WeakPolarHBondContact O-CB 3.47Å; F125-L128 PolarHBondContact O-N 3.06Å; F125-L128 VanDerWaalsContact O-N 3.16Å; L128-Q130 VanDerWaalsContact C-N 3.33Å; L128-Q130 PolarHBondContact O-N 2.89Å; L128-M131 PolarHBondContact O-N 3.31Å; L128-A132 VanDerWaalsContact O-CB 3.3Å; L128-A132 WeakPolarHBondContact O-CB 3.4Å; L128-A132 PolarHBondContact O-N 2.76Å; L128-I148 HydrophobicContact CB-CG2 4.23Å; L128-R151 HydrophobicContact CD1-CB 4.22Å; L128-R151 HydrophobicContact CD1-CG 4.12Å; L128-R151 HydrophobicContact CD2-CB 4.44Å; L128-R151 HydrophobicContact CD2-CG 3.65Å; L128-F152 HydrophobicContact CD1-CB 3.76Å; L128-F152 HydrophobicContact CD1-CD2 4.2Å
129	Q	95.2	Very high	91.8	Very high	66 Å²	66	49.6 Å²	49.6	31%	0.308	27%	0.27	S	S	.	.	H	α-helix	trans	-59.7	-44.1	177.1	-61.3	-164.4	-84.9	0	0	111.4	F125 N126 I148	F125-Q129 HydrophobicContact CD1-CG 4.18Å; F125-Q129 HydrophobicContact CE1-CG 3.78Å; F125-Q129 VanDerWaalsContact CE1-OE1 3.3Å; F125-Q129 HydrophobicContact CZ-CG 4.27Å; F125-Q129 WeakPolarHBondContact O-CG 3.34Å; F125-Q129 PolarHBondContact O-N 3.33Å; N126-Q129 PolarHBondContact O-N 3.19Å; Q129-I148 HydrophobicContact CB-CD1 4.5Å; Q129-I148 HydrophobicContact CG-CD1 4.27Å; Q129-I148 HydrophobicContact CG-CG2 4.47Å
130	Q	92.2	Very high	91.6	Very high	139 Å²	139	52.2 Å²	52.2	65%	0.65	29%	0.285	S	S	*	.	H	α-helix	trans	-65.1	-46.2	177.5	-67.5	172.8	4	0	0	111.9	N126 S127 L128 A132 V133	N126-Q130 WeakPolarHBondContact O-CG 3.3Å; N126-Q130 PolarHBondContact O-N 3.06Å; N126-Q130 VanDerWaalsContact O-N 3.13Å; S127-Q130 PolarHBondContact O-N 3.19Å; L128-Q130 VanDerWaalsContact C-N 3.33Å; L128-Q130 PolarHBondContact O-N 2.89Å; Q130-A132 PolarHBondContact O-N 3.15Å; Q130-V133 PolarHBondContact O-N 3.46Å
131	M	93	Very high	91.5	Very high	51 Å²	51	52.4 Å²	52.4	25%	0.251	30%	0.295	S	S	.	.	H	α-helix	trans	-63.8	-38.3	178.5	-72.8	-177.6	177.7	0	0	112.6	F110 R113 S127 L128 V133 Q134 A135	F110-M131 HydrophobicContact CB-CB 4.24Å; F110-M131 HydrophobicContact CD2-CB 3.92Å; R113-M131 HydrophobicContact CB-SD 4.22Å; R113-M131 HydrophobicContact CG-SD 4.22Å; S127-M131 WeakPolarHBondContact O-CG 3.33Å; S127-M131 PolarHBondContact O-N 2.87Å; L128-M131 PolarHBondContact O-N 3.31Å; M131-V133 VanDerWaalsContact C-N 3.3Å; M131-V133 PolarHBondContact O-N 2.94Å; M131-Q134 PolarHBondContact O-N 3.27Å; M131-A135 VanDerWaalsContact O-CB 3.3Å; M131-A135 WeakPolarHBondContact O-CB 3.43Å; M131-A135 PolarHBondContact O-N 3.02Å
132	A	92.8	Very high	91.4	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-62.7	-33.9	-178.4	0	0	0	0	0	113.3	F110 L128 Q130 F136 R144 I148	F110-A132 HydrophobicContact CD2-CB 4.16Å; F110-A132 HydrophobicContact CE2-CB 3.81Å; L128-A132 VanDerWaalsContact O-CB 3.3Å; L128-A132 WeakPolarHBondContact O-CB 3.4Å; L128-A132 PolarHBondContact O-N 2.76Å; Q130-A132 PolarHBondContact O-N 3.15Å; A132-F136 PolarHBondContact O-N 3.32Å; A132-R144 HydrophobicContact CB-CB 4.33Å; A132-R144 HydrophobicContact CB-CG 4.25Å; A132-R144 VanDerWaalsContact O-CD 3.27Å; A132-R144 WeakPolarHBondContact O-CD 3.24Å; A132-I148 HydrophobicContact CB-CD1 3.76Å; A132-I148 HydrophobicContact CB-CG1 3.73Å
133	V	91.8	Very high	90.9	Very high	85 Å²	85	56 Å²	56	52%	0.515	32%	0.321	S	S	.	.	H	α-helix	trans	-65.2	-40	176.8	175	0	0	0	0	111.3	Q130 M131	Q130-V133 PolarHBondContact O-N 3.46Å; M131-V133 VanDerWaalsContact C-N 3.3Å; M131-V133 PolarHBondContact O-N 2.94Å
134	Q	87.6	Confident	90.9	Very high	100 Å²	100	54 Å²	54	47%	0.467	31%	0.307	S	S	.	.	H	α-helix	trans	-77.8	-37.6	178.5	-62.5	-179.7	1.7	0	0	112.6	V101 A106 M131	V101-Q134 HydrophobicContact CG1-CB 4.18Å; A106-Q134 HydrophobicContact CB-CB 4.11Å; M131-Q134 PolarHBondContact O-N 3.27Å
135	A	88.3	Confident	90.8	Very high	6 Å²	6	56.1 Å²	56.1	5%	0.05	32%	0.318	C	S	.	.	H	α-helix	trans	-71.9	-36.7	-180	0	0	0	0	0	113.3	A106 A107 F110 M131 P137	A106-A135 HydrophobicContact CB-CB 4.12Å; A107-A135 HydrophobicContact CB-CB 4.17Å; F110-A135 HydrophobicContact CB-CB 4.11Å; M131-A135 VanDerWaalsContact O-CB 3.3Å; M131-A135 WeakPolarHBondContact O-CB 3.43Å; M131-A135 PolarHBondContact O-N 3.02Å; A135-P137 VanDerWaalsContact C-CD 3.47Å
136	F	87.5	Confident	90.5	Very high	42 Å²	42	61 Å²	61	18%	0.184	34%	0.341	C	S	.	.			trans	-132	64	-172.1	-47.5	-70.3	0	0	0	111.7	A107 F110 A132 C138 L139 R144 L147	A107-F136 HydrophobicContact CB-CE1 4.01Å; A107-F136 HydrophobicContact CB-CZ 4.1Å; F110-F136 AromaticContact CD1-CE2 3.59Å; F110-F136 HydrophobicContact CD1-CE2 3.59Å; F110-F136 AromaticContact CD1-CZ 3.99Å; F110-F136 HydrophobicContact CD1-CZ 3.99Å; F110-F136 AromaticContact CE1-CE2 3.83Å; F110-F136 HydrophobicContact CE1-CE2 3.83Å; F110-F136 HydrophobicContact CE1-CZ 4.38Å; F110-F136 AromaticContact CG-CE2 3.97Å; F110-F136 HydrophobicContact CG-CE2 3.97Å; F110-F136 HydrophobicContact CZ-CE2 4.39Å; A132-F136 PolarHBondContact O-N 3.32Å; F136-C138 PolarHBondContact O-N 2.84Å; F136-L139 HydrophobicContact CB-CB 4.28Å; F136-L139 HydrophobicContact CB-CD1 3.7Å; F136-L139 HydrophobicContact CB-CG 3.96Å; F136-L139 HydrophobicContact CG-CD1 4.1Å; F136-L139 PolarHBondContact O-N 2.93Å; F136-R144 HydrophobicContact CB-CG 4.26Å; F136-R144 PolarHBondContact O-NH1 3.04Å; F136-L147 HydrophobicContact CD1-CD1 4.11Å; F136-L147 HydrophobicContact CD2-CD1 3.61Å; F136-L147 HydrophobicContact CE1-CD1 4.14Å; F136-L147 HydrophobicContact CE2-CD1 3.64Å; F136-L147 HydrophobicContact CG-CD1 3.85Å; F136-L147 HydrophobicContact CZ-CD1 3.92Å
137	P	86.5	Confident	90.3	Very high	77 Å²	77	61.7 Å²	61.7	50%	0.5	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-28.5	-179.1	26.9	-35	0	0	0	112.6	P103 A135 L139	P103-P137 HydrophobicContact CG-CG 4.44Å; A135-P137 VanDerWaalsContact C-CD 3.47Å; P137-L139 VanDerWaalsContact C-N 3.34Å; P137-L139 PolarHBondContact O-N 2.77Å
138	C	83.5	Confident	90.3	Very high	130 Å²	130	60.8 Å²	60.8	88%	0.878	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-8.1	179.9	-54.8	0	0	0	0	114.7	F136	F136-C138 PolarHBondContact O-N 2.84Å
139	L	84.1	Confident	90.1	Very high	70 Å²	70	61.8 Å²	61.8	37%	0.366	34%	0.342	S	S	.	.	S	Bend	trans	-84.8	156.5	173.7	-65.4	-177.3	0	0	0	110.8	F136 P137 R144 L147	F136-L139 HydrophobicContact CB-CB 4.28Å; F136-L139 HydrophobicContact CB-CD1 3.7Å; F136-L139 HydrophobicContact CB-CG 3.96Å; F136-L139 HydrophobicContact CG-CD1 4.1Å; F136-L139 PolarHBondContact O-N 2.93Å; P137-L139 VanDerWaalsContact C-N 3.34Å; P137-L139 PolarHBondContact O-N 2.77Å; L139-R144 HydrophobicContact CB-CG 4.16Å; L139-R144 PolarHBondContact O-NH1 3.22Å; L139-R144 PolarHBondContact O-NH2 3.17Å; L139-L147 HydrophobicContact CD1-CD1 3.56Å
140	D	89.2	Confident	89.8	Confident	90 Å²	90	62.3 Å²	62.3	48%	0.481	35%	0.353	S	S	.	.			trans	-77.5	-176.7	165.9	75.4	-35.4	0	0	0	110.8	T142 G143 R144	D140-T142 VanDerWaalsContact C-N 3.35Å; D140-T142 WeakPolarHBondContact OD2-CB 3.43Å; D140-T142 PolarHBondContact OD2-N 2.73Å; D140-T142 PolarHBondContact OD2-OG1 2.95Å; D140-G143 PolarHBondContact OD1-N 3.44Å; D140-R144 VanDerWaalsContact C-NH2 3.34Å; D140-R144 PolarHBondContact O-N 2.89Å; D140-R144 PolarHBondContact O-NH2 2.66Å
141	A	90.5	Very high	89.9	Confident	59 Å²	59	56.1 Å²	56.1	49%	0.488	32%	0.324	S	S	.	.	H	α-helix	trans	-60.3	-46.5	174.6	0	0	0	0	0	111.1	G143 R144 D145	A141-G143 PolarHBondContact O-N 3.03Å; A141-R144 PolarHBondContact O-N 3.25Å; A141-D145 WeakPolarHBondContact O-CB 3.44Å; A141-D145 PolarHBondContact O-N 3.31Å
142	T	90	Very high	90	Very high	85 Å²	85	53.7 Å²	53.7	52%	0.521	31%	0.312	S	S	.	.	H	α-helix	trans	-56.8	-47.5	-179.1	-33	0	0	0	0	112.4	D140 R144 D145 E146	D140-T142 VanDerWaalsContact C-N 3.35Å; D140-T142 WeakPolarHBondContact OD2-CB 3.43Å; D140-T142 PolarHBondContact OD2-N 2.73Å; D140-T142 PolarHBondContact OD2-OG1 2.95Å; T142-R144 PolarHBondContact O-N 3.48Å; T142-D145 PolarHBondContact O-N 2.85Å; T142-E146 PolarHBondContact O-N 3.4Å; T142-E146 VanDerWaalsContact O-N 3.07Å
143	G	85.1	Confident	90	Very high	20 Å²	20	55 Å²	55	21%	0.206	32%	0.319	C	S	.	.	H	α-helix	trans	-64.7	-37.2	179	0	0	0	0	0	113.1	D140 A141 L147	D140-G143 PolarHBondContact OD1-N 3.44Å; A141-G143 PolarHBondContact O-N 3.03Å; G143-L147 PolarHBondContact O-N 3.36Å
144	R	93.2	Very high	89.9	Confident	44 Å²	44	56.1 Å²	56.1	17%	0.166	32%	0.319	C	S	.	.	H	α-helix	trans	-67.3	-41.3	171.2	-78.3	-173.7	-70.3	-86.5	-10.3	111.8	A132 F136 L139 D140 A141 T142 E146 L147 I148	A132-R144 HydrophobicContact CB-CB 4.33Å; A132-R144 HydrophobicContact CB-CG 4.25Å; A132-R144 VanDerWaalsContact O-CD 3.27Å; A132-R144 WeakPolarHBondContact O-CD 3.24Å; F136-R144 HydrophobicContact CB-CG 4.26Å; F136-R144 PolarHBondContact O-NH1 3.04Å; L139-R144 HydrophobicContact CB-CG 4.16Å; L139-R144 PolarHBondContact O-NH1 3.22Å; L139-R144 PolarHBondContact O-NH2 3.17Å; D140-R144 VanDerWaalsContact C-NH2 3.34Å; D140-R144 PolarHBondContact O-N 2.89Å; D140-R144 PolarHBondContact O-NH2 2.66Å; A141-R144 PolarHBondContact O-N 3.25Å; T142-R144 PolarHBondContact O-N 3.48Å; R144-E146 VanDerWaalsContact C-N 3.34Å; R144-E146 PolarHBondContact O-N 3.48Å; R144-L147 PolarHBondContact O-N 3.04Å; R144-L147 VanDerWaalsContact O-N 3.14Å; R144-I148 HydrophobicContact CB-CD1 4.29Å; R144-I148 WeakPolarHBondContact O-CD1 3.28Å; R144-I148 VanDerWaalsContact O-CG1 3.24Å; R144-I148 WeakPolarHBondContact O-CG1 3.19Å; R144-I148 PolarHBondContact O-N 3.44Å
145	D	94.3	Very high	90.2	Very high	44 Å²	44	51.4 Å²	51.4	24%	0.235	30%	0.297	C	S	.	.	H	α-helix	trans	-63	-38.2	-178.3	-70.7	-13.2	0	0	0	112.2	A141 T142 I148 K149 I173	A141-D145 WeakPolarHBondContact O-CB 3.44Å; A141-D145 PolarHBondContact O-N 3.31Å; T142-D145 PolarHBondContact O-N 2.85Å; D145-I148 PolarHBondContact O-N 3.02Å; D145-K149 WeakPolarHBondContact O-CB 3.23Å; D145-K149 VanDerWaalsContact O-CG 3.28Å; D145-K149 WeakPolarHBondContact O-CG 3.43Å; D145-K149 PolarHBondContact O-N 2.9Å; D145-I173 HydrophobicContact CB-CB 4.25Å; D145-I173 HydrophobicContact CB-CD1 3.81Å; D145-I173 HydrophobicContact CB-CG2 4.33Å; D145-I173 WeakPolarHBondContact OD1-CD1 3.4Å
146	E	89.5	Confident	90.5	Very high	105 Å²	105	51.3 Å²	51.3	49%	0.491	30%	0.296	S	S	.	.	H	α-helix	trans	-60.1	-45.3	171.7	-68.2	-55.6	147	0	0	112.6	T142 R144 K149 S150	T142-E146 PolarHBondContact O-N 3.4Å; T142-E146 VanDerWaalsContact O-N 3.07Å; R144-E146 VanDerWaalsContact C-N 3.34Å; R144-E146 PolarHBondContact O-N 3.48Å; E146-K149 VanDerWaalsContact CD-CE 3.49Å; E146-K149 PolarHBondContact O-N 3.3Å; E146-K149 WeakPolarHBondContact OE1-CE 3.48Å; E146-K149 IonicContact OE1-NZ 3.44Å; E146-K149 PolarHBondContact OE1-NZ 3.39Å; E146-K149 WeakPolarHBondContact OE2-CE 3.14Å; E146-K149 IonicContact OE2-NZ 2.67Å; E146-K149 PolarHBondContact OE2-NZ 2.93Å; E146-S150 PolarHBondContact O-N 3.4Å; E146-S150 VanDerWaalsContact O-N 3.11Å
147	L	90	Very high	90.6	Very high	59 Å²	59	52.6 Å²	52.6	31%	0.309	30%	0.304	S	S	.	.	H	α-helix	trans	-65.6	-42.1	177.3	-65.8	175.4	0	0	0	111.7	F110 F136 L139 G143 R144 S150 R151	F110-L147 HydrophobicContact CE1-CB 4.17Å; F110-L147 HydrophobicContact CZ-CB 4.08Å; F136-L147 HydrophobicContact CD1-CD1 4.11Å; F136-L147 HydrophobicContact CD2-CD1 3.61Å; F136-L147 HydrophobicContact CE1-CD1 4.14Å; F136-L147 HydrophobicContact CE2-CD1 3.64Å; F136-L147 HydrophobicContact CG-CD1 3.85Å; F136-L147 HydrophobicContact CZ-CD1 3.92Å; L139-L147 HydrophobicContact CD1-CD1 3.56Å; G143-L147 PolarHBondContact O-N 3.36Å; R144-L147 PolarHBondContact O-N 3.04Å; R144-L147 VanDerWaalsContact O-N 3.14Å; L147-S150 PolarHBondContact O-N 3.21Å; L147-R151 VanDerWaalsContact O-CB 3.25Å; L147-R151 WeakPolarHBondContact O-CB 3.34Å; L147-R151 PolarHBondContact O-N 3.14Å
148	I	94.9	Very high	90.2	Very high	4 Å²	4	57.6 Å²	57.6	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-61.9	-47.6	177.1	-67.5	157.1	0	0	0	110.3	F110 F125 L128 Q129 A132 R144 D145 S150 R151 F152 I173	F110-I148 HydrophobicContact CE2-CG1 4.18Å; F110-I148 HydrophobicContact CZ-CG1 4.39Å; F125-I148 HydrophobicContact CD2-CG2 4.38Å; F125-I148 HydrophobicContact CE2-CG2 3.84Å; F125-I148 HydrophobicContact CZ-CG2 4.21Å; L128-I148 HydrophobicContact CB-CG2 4.23Å; Q129-I148 HydrophobicContact CB-CD1 4.5Å; Q129-I148 HydrophobicContact CG-CD1 4.27Å; Q129-I148 HydrophobicContact CG-CG2 4.47Å; A132-I148 HydrophobicContact CB-CD1 3.76Å; A132-I148 HydrophobicContact CB-CG1 3.73Å; R144-I148 HydrophobicContact CB-CD1 4.29Å; R144-I148 WeakPolarHBondContact O-CD1 3.28Å; R144-I148 VanDerWaalsContact O-CG1 3.24Å; R144-I148 WeakPolarHBondContact O-CG1 3.19Å; R144-I148 PolarHBondContact O-N 3.44Å; D145-I148 PolarHBondContact O-N 3.02Å; I148-S150 PolarHBondContact O-N 3.16Å; I148-R151 PolarHBondContact O-N 3.07Å; I148-F152 WeakPolarHBondContact O-CB 3.27Å; I148-F152 PolarHBondContact O-N 2.86Å; I148-I173 HydrophobicContact CB-CD1 4.29Å; I148-I173 HydrophobicContact CD1-CD1 4.37Å; I148-I173 HydrophobicContact CG2-CD1 4.03Å
149	K	93.7	Very high	90	Very high	22 Å²	22	53.1 Å²	53.1	10%	0.096	29%	0.289	C	S	.	.	H	α-helix	trans	-56.9	-49.1	177.2	-74.4	-177.3	-65.2	168.1	0	111.7	D145 E146 V153 T171 I173 L176	D145-K149 WeakPolarHBondContact O-CB 3.23Å; D145-K149 VanDerWaalsContact O-CG 3.28Å; D145-K149 WeakPolarHBondContact O-CG 3.43Å; D145-K149 PolarHBondContact O-N 2.9Å; E146-K149 VanDerWaalsContact CD-CE 3.49Å; E146-K149 PolarHBondContact O-N 3.3Å; E146-K149 WeakPolarHBondContact OE1-CE 3.48Å; E146-K149 IonicContact OE1-NZ 3.44Å; E146-K149 PolarHBondContact OE1-NZ 3.39Å; E146-K149 WeakPolarHBondContact OE2-CE 3.14Å; E146-K149 IonicContact OE2-NZ 2.67Å; E146-K149 PolarHBondContact OE2-NZ 2.93Å; K149-V153 WeakPolarHBondContact O-CG2 3.39Å; K149-V153 PolarHBondContact O-N 3.15Å; K149-T171 PolarHBondContact NZ-O 3Å; K149-I173 HydrophobicContact CG-CB 4.43Å; K149-L176 HydrophobicContact CB-CD2 4.13Å; K149-L176 HydrophobicContact CG-CD2 3.76Å
150	S	89.1	Confident	90.1	Very high	76 Å²	76	52.5 Å²	52.5	53%	0.531	29%	0.29	S	S	.	.	H	α-helix	trans	-61.3	-52.7	179.4	-170.9	0	0	0	0	111.4	E146 L147 I148 F152 V153 E154	E146-S150 PolarHBondContact O-N 3.4Å; E146-S150 VanDerWaalsContact O-N 3.11Å; L147-S150 PolarHBondContact O-N 3.21Å; I148-S150 PolarHBondContact O-N 3.16Å; S150-F152 VanDerWaalsContact C-N 3.33Å; S150-F152 PolarHBondContact O-N 2.68Å; S150-V153 PolarHBondContact O-N 3.13Å; S150-E154 WeakPolarHBondContact O-CB 3.22Å; S150-E154 PolarHBondContact O-N 3.32Å
151	R	93	Very high	90.1	Very high	10 Å²	10	48.4 Å²	48.4	4%	0.038	27%	0.268	C	S	.	.	H	α-helix	trans	-63.1	-38.4	-177.9	-172.5	65	-124.9	149	-0.8	112.2	F110 L111 R113 H114 Y124 L128 L147 I148 E154 G155	F110-R151 HydrophobicContact CD1-CG 4.39Å; F110-R151 HydrophobicContact CE1-CB 3.8Å; F110-R151 HydrophobicContact CE1-CG 3.91Å; F110-R151 HydrophobicContact CE2-CB 4.49Å; F110-R151 HydrophobicContact CE2-CG 4.47Å; F110-R151 HydrophobicContact CZ-CB 3.66Å; F110-R151 HydrophobicContact CZ-CG 3.96Å; F110-R151 WeakPolarHBondContact O-CD 3.2Å; L111-R151 PolarHBondContact O-NE 3.11Å; L111-R151 PolarHBondContact O-NH1 3.07Å; R113-R151 PolarHBondContact O-NE 2.88Å; R113-R151 PolarHBondContact O-NH2 3.36Å; H114-R151 PolarHBondContact CD2-NH2 2.88Å; H114-R151 VanDerWaalsContact CD2-NH2 3.32Å; H114-R151 PolarHBondContact CE1-NH2 2.79Å; H114-R151 PolarHBondContact ND1-NH2 3.3Å; H114-R151 PolarHBondContact NE2-NH2 2.93Å; Y124-R151 PolarHBondContact OH-O 3.12Å; L128-R151 HydrophobicContact CD1-CB 4.22Å; L128-R151 HydrophobicContact CD1-CG 4.12Å; L128-R151 HydrophobicContact CD2-CB 4.44Å; L128-R151 HydrophobicContact CD2-CG 3.65Å; L147-R151 VanDerWaalsContact O-CB 3.25Å; L147-R151 WeakPolarHBondContact O-CB 3.34Å; L147-R151 PolarHBondContact O-N 3.14Å; I148-R151 PolarHBondContact O-N 3.07Å; R151-E154 IonicContact CZ-OE1 3.54Å; R151-E154 IonicContact NH1-OE1 3.7Å; R151-E154 PolarHBondContact NH1-OE1 2.98Å; R151-E154 IonicContact NH1-OE2 2.72Å; R151-E154 PolarHBondContact NH1-OE2 3.17Å; R151-E154 IonicContact NH2-OE1 3.53Å; R151-G155 PolarHBondContact O-N 3.4Å
152	F	95.1	Very high	90.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.2	-56	177.3	-177.9	-111.7	0	0	0	111.4	P121 Y124 F125 L128 I148 S150 E154 G155 L156 F165 L176 T180	P121-F152 HydrophobicContact CB-CZ 4.19Å; P121-F152 VanDerWaalsContact O-CE2 3.26Å; P121-F152 WeakPolarHBondContact O-CE2 3.3Å; Y124-F152 AromaticContact CD1-CD2 3.51Å; Y124-F152 HydrophobicContact CD1-CD2 3.51Å; Y124-F152 AromaticContact CD1-CE2 3.54Å; Y124-F152 HydrophobicContact CD1-CE2 3.54Å; Y124-F152 AromaticContact CE1-CD2 3.51Å; Y124-F152 HydrophobicContact CE1-CD2 3.51Å; Y124-F152 AromaticContact CE1-CE2 3.98Å; Y124-F152 HydrophobicContact CE1-CE2 3.98Å; Y124-F152 HydrophobicContact CE1-CG 4.38Å; Y124-F152 HydrophobicContact CG-CD2 4.38Å; Y124-F152 HydrophobicContact CG-CE2 4.39Å; F125-F152 HydrophobicContact CB-CD2 3.96Å; F125-F152 HydrophobicContact CB-CE2 3.64Å; F125-F152 HydrophobicContact CB-CZ 4.24Å; F125-F152 HydrophobicContact CD2-CB 4.49Å; F125-F152 HydrophobicContact CD2-CD1 4.25Å; F125-F152 AromaticContact CD2-CD2 3.87Å; F125-F152 HydrophobicContact CD2-CD2 3.87Å; F125-F152 HydrophobicContact CD2-CE1 4.4Å; F125-F152 HydrophobicContact CD2-CE2 4.09Å; F125-F152 AromaticContact CD2-CG 3.95Å; F125-F152 HydrophobicContact CD2-CG 3.95Å; F125-F152 HydrophobicContact CD2-CZ 4.33Å; F125-F152 HydrophobicContact CG-CD2 4.43Å; F125-F152 HydrophobicContact CG-CE2 4.38Å; L128-F152 HydrophobicContact CD1-CB 3.76Å; L128-F152 HydrophobicContact CD1-CD2 4.2Å; I148-F152 WeakPolarHBondContact O-CB 3.27Å; I148-F152 PolarHBondContact O-N 2.86Å; S150-F152 VanDerWaalsContact C-N 3.33Å; S150-F152 PolarHBondContact O-N 2.68Å; F152-E154 VanDerWaalsContact C-N 3.31Å; F152-E154 PolarHBondContact O-N 2.96Å; F152-G155 PolarHBondContact O-N 3.46Å; F152-L156 HydrophobicContact CD1-CD1 4.35Å; F152-L156 HydrophobicContact CE1-CD1 4.04Å; F152-L156 HydrophobicContact CE1-CD2 4.47Å; F152-L156 HydrophobicContact CE1-CG 4.39Å; F152-L156 HydrophobicContact CE2-CD2 3.98Å; F152-L156 HydrophobicContact CE2-CG 4.35Å; F152-L156 HydrophobicContact CZ-CD1 4.3Å; F152-L156 HydrophobicContact CZ-CD2 3.91Å; F152-L156 HydrophobicContact CZ-CG 4.27Å; F152-L156 WeakPolarHBondContact O-CG 3.47Å; F152-L156 PolarHBondContact O-N 3.41Å; F152-F165 HydrophobicContact CD1-CE2 4.43Å; F152-F165 HydrophobicContact CE1-CD2 4.48Å; F152-F165 AromaticContact CE1-CE2 3.77Å; F152-F165 HydrophobicContact CE1-CE2 3.77Å; F152-F165 HydrophobicContact CE1-CZ 4.49Å; F152-L176 HydrophobicContact CB-CD2 4.41Å; F152-L176 HydrophobicContact CD1-CD1 3.97Å; F152-L176 HydrophobicContact CD1-CD2 3.7Å; F152-L176 HydrophobicContact CD1-CG 3.93Å; F152-L176 HydrophobicContact CE1-CD1 4.15Å; F152-L176 HydrophobicContact CE1-CD2 4.37Å; F152-L176 HydrophobicContact CE1-CG 4.13Å; F152-L176 HydrophobicContact CG-CD2 4.37Å; F152-T180 HydrophobicContact CZ-CG2 4.06Å
153	V	92.6	Very high	90.1	Very high	27 Å²	27	48.7 Å²	48.7	16%	0.164	25%	0.253	C	S	.	.	H	α-helix	trans	-62.1	-40.3	-179	178.1	0	0	0	0	111.3	K149 S150 K162 F165 L166 L176	K149-V153 WeakPolarHBondContact O-CG2 3.39Å; K149-V153 PolarHBondContact O-N 3.15Å; S150-V153 PolarHBondContact O-N 3.13Å; V153-K162 WeakPolarHBondContact O-CE 3.24Å; V153-F165 HydrophobicContact CB-CB 4.47Å; V153-F165 HydrophobicContact CG1-CB 3.86Å; V153-F165 HydrophobicContact CG2-CB 3.74Å; V153-F165 HydrophobicContact CG2-CD2 4.05Å; V153-F165 HydrophobicContact CG2-CG 4.08Å; V153-L166 HydrophobicContact CG1-CD2 4.09Å; V153-L166 HydrophobicContact CG1-CG 4.32Å; V153-L176 HydrophobicContact CG2-CD1 4.28Å
154	E	90.3	Very high	90.3	Very high	108 Å²	108	50.3 Å²	50.3	51%	0.505	26%	0.255	S	S	.	.	H	α-helix	trans	-66	-44	178.1	-164.2	-162.9	134.9	0	0	112.5	S150 R151 F152 K162	S150-E154 WeakPolarHBondContact O-CB 3.22Å; S150-E154 PolarHBondContact O-N 3.32Å; R151-E154 IonicContact CZ-OE1 3.54Å; R151-E154 IonicContact NH1-OE1 3.7Å; R151-E154 PolarHBondContact NH1-OE1 2.98Å; R151-E154 IonicContact NH1-OE2 2.72Å; R151-E154 PolarHBondContact NH1-OE2 3.17Å; R151-E154 IonicContact NH2-OE1 3.53Å; F152-E154 VanDerWaalsContact C-N 3.31Å; F152-E154 PolarHBondContact O-N 2.96Å; E154-K162 PolarHBondContact O-NZ 2.87Å
155	G	94	Very high	90.1	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-91.5	-2.9	-173.8	0	0	0	0	0	116	H114 Q115 Y124 R151 F152	H114-G155 CarbonylContact C-O 3.52Å; H114-G155 WeakPolarHBondContact CA-O 3.25Å; Q115-G155 PolarHBondContact N-O 3Å; Y124-G155 VanDerWaalsContact OH-CA 3.24Å; Y124-G155 WeakPolarHBondContact OH-CA 3.38Å; R151-G155 PolarHBondContact O-N 3.4Å; F152-G155 PolarHBondContact O-N 3.46Å
156	L	94.9	Very high	89.7	Confident	4 Å²	4	51.8 Å²	51.8	2%	0.021	27%	0.265	C	S	.	.	S	Bend	trans	-55.1	141.8	167.2	-85	172.1	0	0	0	110.9	P121 Y124 F152 L161 K162 F165	P121-L156 HydrophobicContact CB-CD2 4.14Å; P121-L156 HydrophobicContact CG-CD2 4.36Å; Y124-L156 HydrophobicContact CD1-CD2 4.21Å; Y124-L156 HydrophobicContact CE1-CD2 4.44Å; Y124-L156 HydrophobicContact CE1-CG 4.41Å; F152-L156 HydrophobicContact CD1-CD1 4.35Å; F152-L156 HydrophobicContact CE1-CD1 4.04Å; F152-L156 HydrophobicContact CE1-CD2 4.47Å; F152-L156 HydrophobicContact CE1-CG 4.39Å; F152-L156 HydrophobicContact CE2-CD2 3.98Å; F152-L156 HydrophobicContact CE2-CG 4.35Å; F152-L156 HydrophobicContact CZ-CD1 4.3Å; F152-L156 HydrophobicContact CZ-CD2 3.91Å; F152-L156 HydrophobicContact CZ-CG 4.27Å; F152-L156 WeakPolarHBondContact O-CG 3.47Å; F152-L156 PolarHBondContact O-N 3.41Å; L156-L161 HydrophobicContact CD1-CD2 4.08Å; L156-L161 HydrophobicContact CD1-CG 4.04Å; L156-L161 HydrophobicContact CD2-CD2 4.1Å; L156-K162 HydrophobicContact CB-CB 4.14Å; L156-K162 HydrophobicContact CB-CD 4.18Å; L156-K162 HydrophobicContact CB-CG 4.25Å; L156-K162 HydrophobicContact CD1-CB 4.29Å; L156-K162 WeakPolarHBondContact O-CD 3.33Å; L156-K162 PolarHBondContact O-NZ 3.18Å; L156-F165 HydrophobicContact CD1-CD2 3.87Å; L156-F165 HydrophobicContact CD1-CE2 4.07Å
157	I	90.1	Very high	89.5	Confident	70 Å²	70	52.7 Å²	52.7	36%	0.359	27%	0.273	S	S	.	.			trans	-62	145.5	166.2	-72.3	168	0	0	0	108.6	Q115 T116 S159	Q115-I157 HydrophobicContact CB-CD1 4.33Å; Q115-I157 HydrophobicContact CB-CG1 4.09Å; Q115-I157 HydrophobicContact CG-CD1 4.02Å; Q115-I157 HydrophobicContact CG-CG1 4.23Å; Q115-I157 WeakPolarHBondContact O-CD1 3.42Å; Q115-I157 WeakPolarHBondContact O-CG1 3.41Å; T116-I157 WeakPolarHBondContact O-CD1 3.45Å; I157-S159 WeakPolarHBondContact O-CB 3.43Å; I157-S159 PolarHBondContact O-N 3.09Å; I157-S159 PolarHBondContact O-OG 2.99Å
158	F	76.5	Confident	89.2	Confident	181 Å²	181	53.8 Å²	53.8	79%	0.794	28%	0.279	S	S	*	.	S	Bend	trans	-59.3	113.5	-177.7	-149.4	-81.2	0	0	0	110.1
159	S	79.7	Confident	88.5	Confident	37 Å²	37	57.2 Å²	57.2	26%	0.259	30%	0.302	S	S	.	.	S	Bend	trans	-156.7	160.8	-166.2	53.8	0	0	0	0	109.5	I157 L161 K162 E163	I157-S159 WeakPolarHBondContact O-CB 3.43Å; I157-S159 PolarHBondContact O-N 3.09Å; I157-S159 PolarHBondContact O-OG 2.99Å; S159-L161 PolarHBondContact O-N 3.39Å; S159-K162 WeakPolarHBondContact O-CB 3.25Å; S159-K162 PolarHBondContact O-N 3.33Å; S159-K162 PolarHBondContact OG-N 3.3Å; S159-E163 PolarHBondContact O-N 2.68Å; S159-E163 VanDerWaalsContact O-N 3.1Å
160	S	86.6	Confident	87.9	Confident	57 Å²	57	58.8 Å²	58.8	40%	0.399	31%	0.311	S	S	.	.	H	α-helix	trans	-56.6	-30.5	173.4	58.8	0	0	0	0	112.3	H164	S160-H164 VanDerWaalsContact O-CB 3.24Å; S160-H164 WeakPolarHBondContact O-CB 3.28Å; S160-H164 PolarHBondContact O-N 3.11Å
161	L	89.8	Confident	87.2	Confident	4 Å²	4	59.7 Å²	59.7	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-63.8	-45.7	172.7	-179	63.9	0	0	0	112.4	P121 L156 S159 H164 F165 T180 F183	P121-L161 HydrophobicContact CB-CD2 3.9Å; P121-L161 HydrophobicContact CG-CD2 3.89Å; L156-L161 HydrophobicContact CD1-CD2 4.08Å; L156-L161 HydrophobicContact CD1-CG 4.04Å; L156-L161 HydrophobicContact CD2-CD2 4.1Å; S159-L161 PolarHBondContact O-N 3.39Å; L161-H164 PolarHBondContact O-N 3.31Å; L161-F165 HydrophobicContact CD1-CD2 4.05Å; L161-F165 HydrophobicContact CD1-CE1 4.27Å; L161-F165 HydrophobicContact CD1-CE2 3.24Å; L161-F165 HydrophobicContact CD1-CZ 3.37Å; L161-F165 HydrophobicContact CD2-CE2 4.13Å; L161-F165 HydrophobicContact CG-CD2 4.06Å; L161-F165 HydrophobicContact CG-CE2 3.49Å; L161-F165 VanDerWaalsContact CG-CE2 3.49Å; L161-F165 HydrophobicContact CG-CZ 4.15Å; L161-F165 VanDerWaalsContact O-CD2 3.26Å; L161-F165 WeakPolarHBondContact O-CD2 3.4Å; L161-F165 PolarHBondContact O-N 3.33Å; L161-F165 VanDerWaalsContact O-N 3.1Å; L161-T180 HydrophobicContact CD2-CG2 4.02Å; L161-F183 HydrophobicContact CB-CD1 4.04Å; L161-F183 HydrophobicContact CB-CG 4.31Å; L161-F183 HydrophobicContact CD1-CB 3.85Å; L161-F183 HydrophobicContact CD1-CD1 4.18Å; L161-F183 HydrophobicContact CD1-CD2 3.74Å; L161-F183 HydrophobicContact CD1-CE2 4.35Å; L161-F183 HydrophobicContact CD1-CG 3.65Å
162	K	91.6	Very high	86.8	Confident	37 Å²	37	61.9 Å²	61.9	16%	0.161	33%	0.325	C	S	.	.	H	α-helix	trans	-63.8	-46.6	177.3	-172.6	174.6	-166	156	0	111.3	V153 E154 L156 S159 H164 F165 L166	V153-K162 WeakPolarHBondContact O-CE 3.24Å; E154-K162 PolarHBondContact O-NZ 2.87Å; L156-K162 HydrophobicContact CB-CB 4.14Å; L156-K162 HydrophobicContact CB-CD 4.18Å; L156-K162 HydrophobicContact CB-CG 4.25Å; L156-K162 HydrophobicContact CD1-CB 4.29Å; L156-K162 WeakPolarHBondContact O-CD 3.33Å; L156-K162 PolarHBondContact O-NZ 3.18Å; S159-K162 WeakPolarHBondContact O-CB 3.25Å; S159-K162 PolarHBondContact O-N 3.33Å; S159-K162 PolarHBondContact OG-N 3.3Å; K162-H164 VanDerWaalsContact C-N 3.32Å; K162-H164 PolarHBondContact O-N 2.88Å; K162-F165 PolarHBondContact O-N 3.03Å; K162-L166 HydrophobicContact CG-CD1 4.3Å; K162-L166 WeakPolarHBondContact O-CG 3.46Å; K162-L166 PolarHBondContact O-N 3.48Å
163	E	87.5	Confident	86.5	Confident	113 Å²	113	62.5 Å²	62.5	53%	0.528	33%	0.329	S	S	.	.	H	α-helix	trans	-58.7	-44.7	175.1	-176.5	176.7	-166.6	0	0	111.4	S159 F165 L166 L167	S159-E163 PolarHBondContact O-N 2.68Å; S159-E163 VanDerWaalsContact O-N 3.1Å; E163-F165 PolarHBondContact O-N 3.38Å; E163-L166 PolarHBondContact O-N 3.28Å; E163-L167 HydrophobicContact CG-CD1 3.99Å; E163-L167 WeakPolarHBondContact O-CG 3.32Å; E163-L167 PolarHBondContact O-N 3.43Å
164	H	89.1	Confident	86.3	Confident	54 Å²	54	65.8 Å²	65.8	25%	0.25	35%	0.345	C	S	.	.	H	α-helix	trans	-57.9	-44.3	177.6	178.4	78.3	0	0	0	112.8	S160 L161 K162 L167 N168 F183	S160-H164 VanDerWaalsContact O-CB 3.24Å; S160-H164 WeakPolarHBondContact O-CB 3.28Å; S160-H164 PolarHBondContact O-N 3.11Å; L161-H164 PolarHBondContact O-N 3.31Å; K162-H164 VanDerWaalsContact C-N 3.32Å; K162-H164 PolarHBondContact O-N 2.88Å; H164-L167 PolarHBondContact O-N 3.09Å; H164-N168 PolarHBondContact ND1-ND2 3.21Å; H164-N168 WeakPolarHBondContact O-CA 3.23Å; H164-N168 WeakPolarHBondContact O-CB 3.27Å; H164-N168 PolarHBondContact O-N 3.34Å; H164-N168 PolarHBondContact O-ND2 3.19Å; H164-F183 HydrophobicContact CB-CE1 4.2Å; H164-F183 HydrophobicContact CB-CE2 4Å; H164-F183 HydrophobicContact CB-CZ 3.46Å; H164-F183 VanDerWaalsContact CB-CZ 3.46Å; H164-F183 AromaticContact CD2-CE2 3.62Å; H164-F183 AromaticContact CD2-CZ 3.99Å; H164-F183 AromaticContact CG-CE2 3.6Å; H164-F183 AromaticContact CG-CZ 3.47Å; H164-F183 VanDerWaalsContact CG-CZ 3.47Å; H164-F183 AromaticContact ND1-CZ 3.85Å
165	F	90.6	Very high	86.3	Confident	6 Å²	6	61.6 Å²	61.6	3%	0.026	33%	0.329	C	S	.	.	H	α-helix	trans	-72.5	-29.5	178.2	-65.8	-42.2	0	0	0	114.1	F152 V153 L156 L161 K162 E163 N168 P169 L170 L176 T179	F152-F165 HydrophobicContact CD1-CE2 4.43Å; F152-F165 HydrophobicContact CE1-CD2 4.48Å; F152-F165 AromaticContact CE1-CE2 3.77Å; F152-F165 HydrophobicContact CE1-CE2 3.77Å; F152-F165 HydrophobicContact CE1-CZ 4.49Å; V153-F165 HydrophobicContact CB-CB 4.47Å; V153-F165 HydrophobicContact CG1-CB 3.86Å; V153-F165 HydrophobicContact CG2-CB 3.74Å; V153-F165 HydrophobicContact CG2-CD2 4.05Å; V153-F165 HydrophobicContact CG2-CG 4.08Å; L156-F165 HydrophobicContact CD1-CD2 3.87Å; L156-F165 HydrophobicContact CD1-CE2 4.07Å; L161-F165 HydrophobicContact CD1-CD2 4.05Å; L161-F165 HydrophobicContact CD1-CE1 4.27Å; L161-F165 HydrophobicContact CD1-CE2 3.24Å; L161-F165 HydrophobicContact CD1-CZ 3.37Å; L161-F165 HydrophobicContact CD2-CE2 4.13Å; L161-F165 HydrophobicContact CG-CD2 4.06Å; L161-F165 HydrophobicContact CG-CE2 3.49Å; L161-F165 VanDerWaalsContact CG-CE2 3.49Å; L161-F165 HydrophobicContact CG-CZ 4.15Å; L161-F165 VanDerWaalsContact O-CD2 3.26Å; L161-F165 WeakPolarHBondContact O-CD2 3.4Å; L161-F165 PolarHBondContact O-N 3.33Å; L161-F165 VanDerWaalsContact O-N 3.1Å; K162-F165 PolarHBondContact O-N 3.03Å; E163-F165 PolarHBondContact O-N 3.38Å; F165-N168 CarbonylContact O-C 3.59Å; F165-P169 WeakPolarHBondContact O-CA 3.47Å; F165-L170 HydrophobicContact CD1-CD1 3.93Å; F165-L170 HydrophobicContact CD1-CG 4.43Å; F165-L170 HydrophobicContact CE1-CD1 3.59Å; F165-L176 HydrophobicContact CD1-CD1 3.83Å; F165-L176 HydrophobicContact CD2-CD1 4Å; F165-L176 HydrophobicContact CE1-CD1 3.56Å; F165-L176 HydrophobicContact CE2-CD1 3.72Å; F165-L176 HydrophobicContact CG-CD1 4.06Å; F165-L176 HydrophobicContact CZ-CD1 3.5Å; F165-L176 VanDerWaalsContact CZ-CD1 3.5Å; F165-L176 HydrophobicContact CZ-CG 4.48Å; F165-T179 HydrophobicContact CE1-CG2 3.56Å; F165-T179 HydrophobicContact CZ-CG2 4.03Å
166	L	85.9	Confident	86	Confident	112 Å²	112	61.7 Å²	61.7	59%	0.586	33%	0.33	S	S	*	.	H	α-helix	trans	-68.6	-36.6	172.5	-69.8	171.7	0	0	0	111.7	V153 K162 E163	V153-L166 HydrophobicContact CG1-CD2 4.09Å; V153-L166 HydrophobicContact CG1-CG 4.32Å; K162-L166 HydrophobicContact CG-CD1 4.3Å; K162-L166 WeakPolarHBondContact O-CG 3.46Å; K162-L166 PolarHBondContact O-N 3.48Å; E163-L166 PolarHBondContact O-N 3.28Å
167	L	84.6	Confident	85.9	Confident	125 Å²	125	64.1 Å²	64.1	65%	0.654	34%	0.34	S	S	*	.	H	α-helix	trans	-80.8	-29.8	176.5	-65.6	174.9	0	0	0	113.1	E163 H164	E163-L167 HydrophobicContact CG-CD1 3.99Å; E163-L167 WeakPolarHBondContact O-CG 3.32Å; E163-L167 PolarHBondContact O-N 3.43Å; H164-L167 PolarHBondContact O-N 3.09Å
168	N	84.5	Confident	85.8	Confident	82 Å²	82	65.9 Å²	65.9	44%	0.439	34%	0.342	S	S	.	.	S	Bend	trans	-129.4	73.4	-177.3	-51.6	-89.1	0	0	0	110.9	H164 F165 L170	H164-N168 PolarHBondContact ND1-ND2 3.21Å; H164-N168 WeakPolarHBondContact O-CA 3.23Å; H164-N168 WeakPolarHBondContact O-CB 3.27Å; H164-N168 PolarHBondContact O-N 3.34Å; H164-N168 PolarHBondContact O-ND2 3.19Å; F165-N168 CarbonylContact O-C 3.59Å; N168-L170 PolarHBondContact O-N 2.82Å
169	P	79	Confident	86.4	Confident	76 Å²	76	58.1 Å²	58.1	49%	0.494	31%	0.31	S	S	.	.			trans	-61.6	126	179.3	-23.6	35	0	0	0	111.9	F165 I279	F165-P169 WeakPolarHBondContact O-CA 3.47Å; P169-I279 HydrophobicContact CB-CD1 4.4Å
170	L	80.5	Confident	87	Confident	55 Å²	55	56.4 Å²	56.4	29%	0.288	30%	0.297	S	S	.	.			trans	-94.2	135.5	-177.2	-61.2	175.3	0	0	0	111.4	F165 N168 A175 L176	F165-L170 HydrophobicContact CD1-CD1 3.93Å; F165-L170 HydrophobicContact CD1-CG 4.43Å; F165-L170 HydrophobicContact CE1-CD1 3.59Å; N168-L170 PolarHBondContact O-N 2.82Å; L170-A175 HydrophobicContact CD1-CB 4.39Å; L170-L176 HydrophobicContact CD1-CB 4.39Å; L170-L176 HydrophobicContact CD1-CD1 4.32Å
171	T	74.3	Confident	87.1	Confident	94 Å²	94	57.7 Å²	57.7	58%	0.577	30%	0.296	S	S	*	.	S	Bend	trans	-79.9	-31.1	-178.8	49.9	0	0	0	0	113.3	K149	K149-T171 PolarHBondContact NZ-O 3Å
172	D	85	Confident	86.9	Confident	56 Å²	56	61.8 Å²	61.8	30%	0.299	31%	0.311	S	S	.	.	S	Bend	trans	-110	141.4	-175.7	159	53.6	0	0	0	111.8	N174 A175 L176 R178	D172-N174 VanDerWaalsContact C-N 3.33Å; D172-N174 VanDerWaalsContact CG-N 3.32Å; D172-N174 PolarHBondContact O-N 2.9Å; D172-N174 PolarHBondContact OD1-N 3.07Å; D172-N174 PolarHBondContact OD1-ND2 3.03Å; D172-N174 WeakPolarHBondContact OD2-CA 3.46Å; D172-N174 WeakPolarHBondContact OD2-CB 3.43Å; D172-N174 PolarHBondContact OD2-N 3.02Å; D172-A175 HydrophobicContact CB-CB 4.18Å; D172-A175 WeakPolarHBondContact O-CB 3.34Å; D172-A175 PolarHBondContact O-N 3.39Å; D172-A175 PolarHBondContact OD2-N 3.49Å; D172-L176 PolarHBondContact O-N 3.16Å; D172-L176 VanDerWaalsContact O-N 3.12Å; D172-R178 IonicContact OD2-NH2 3.78Å
173	I	89.4	Confident	86.8	Confident	13 Å²	13	62.2 Å²	62.2	7%	0.067	31%	0.313	C	S	.	.	H	α-helix	trans	-68.7	-30.6	179.6	-169.2	165	0	0	0	112.4	F125 D145 I148 K149 L176 K177	F125-I173 HydrophobicContact CE2-CD1 4.36Å; F125-I173 HydrophobicContact CE2-CG1 4.07Å; F125-I173 HydrophobicContact CZ-CD1 3.77Å; F125-I173 HydrophobicContact CZ-CG1 3.53Å; D145-I173 HydrophobicContact CB-CB 4.25Å; D145-I173 HydrophobicContact CB-CD1 3.81Å; D145-I173 HydrophobicContact CB-CG2 4.33Å; D145-I173 WeakPolarHBondContact OD1-CD1 3.4Å; I148-I173 HydrophobicContact CB-CD1 4.29Å; I148-I173 HydrophobicContact CD1-CD1 4.37Å; I148-I173 HydrophobicContact CG2-CD1 4.03Å; K149-I173 HydrophobicContact CG-CB 4.43Å; I173-L176 WeakPolarHBondContact O-CB 3.26Å; I173-L176 PolarHBondContact O-N 2.91Å; I173-K177 PolarHBondContact O-N 3.39Å
174	N	89.4	Confident	86.8	Confident	96 Å²	96	58.4 Å²	58.4	51%	0.513	30%	0.296	S	S	.	.	H	α-helix	trans	-75.7	-33	177.2	-54.6	-80	0	0	0	111.5	D172 R178	D172-N174 VanDerWaalsContact C-N 3.33Å; D172-N174 VanDerWaalsContact CG-N 3.32Å; D172-N174 PolarHBondContact O-N 2.9Å; D172-N174 PolarHBondContact OD1-N 3.07Å; D172-N174 PolarHBondContact OD1-ND2 3.03Å; D172-N174 WeakPolarHBondContact OD2-CA 3.46Å; D172-N174 WeakPolarHBondContact OD2-CB 3.43Å; D172-N174 PolarHBondContact OD2-N 3.02Å; N174-R178 WeakPolarHBondContact O-CB 3.21Å; N174-R178 VanDerWaalsContact O-CG 3.29Å; N174-R178 WeakPolarHBondContact O-CG 3.04Å; N174-R178 PolarHBondContact O-N 3.11Å; N174-R178 PolarHBondContact O-NE 3.34Å
175	A	88.5	Confident	86.6	Confident	20 Å²	20	57.4 Å²	57.4	17%	0.165	30%	0.297	C	S	.	.	H	α-helix	trans	-61.6	-44.2	167.8	0	0	0	0	0	111	L170 D172 K177 R178 T179	L170-A175 HydrophobicContact CD1-CB 4.39Å; D172-A175 HydrophobicContact CB-CB 4.18Å; D172-A175 WeakPolarHBondContact O-CB 3.34Å; D172-A175 PolarHBondContact O-N 3.39Å; D172-A175 PolarHBondContact OD2-N 3.49Å; A175-K177 PolarHBondContact O-N 2.91Å; A175-R178 PolarHBondContact O-N 2.87Å; A175-T179 WeakPolarHBondContact O-CB 3.34Å; A175-T179 PolarHBondContact O-N 3.2Å; A175-T179 PolarHBondContact O-OG1 3.46Å; A175-T179 VanDerWaalsContact O-OG1 3.04Å
176	L	89.3	Confident	86.2	Confident	4 Å²	4	58 Å²	58	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-58.7	-47.5	175.3	-175.1	68.5	0	0	0	112	F125 K149 F152 V153 F165 L170 D172 I173 T180	F125-L176 HydrophobicContact CD2-CD2 4.46Å; F125-L176 HydrophobicContact CE2-CD2 3.92Å; F125-L176 HydrophobicContact CE2-CG 4.49Å; K149-L176 HydrophobicContact CB-CD2 4.13Å; K149-L176 HydrophobicContact CG-CD2 3.76Å; F152-L176 HydrophobicContact CB-CD2 4.41Å; F152-L176 HydrophobicContact CD1-CD1 3.97Å; F152-L176 HydrophobicContact CD1-CD2 3.7Å; F152-L176 HydrophobicContact CD1-CG 3.93Å; F152-L176 HydrophobicContact CE1-CD1 4.15Å; F152-L176 HydrophobicContact CE1-CD2 4.37Å; F152-L176 HydrophobicContact CE1-CG 4.13Å; F152-L176 HydrophobicContact CG-CD2 4.37Å; V153-L176 HydrophobicContact CG2-CD1 4.28Å; F165-L176 HydrophobicContact CD1-CD1 3.83Å; F165-L176 HydrophobicContact CD2-CD1 4Å; F165-L176 HydrophobicContact CE1-CD1 3.56Å; F165-L176 HydrophobicContact CE2-CD1 3.72Å; F165-L176 HydrophobicContact CG-CD1 4.06Å; F165-L176 HydrophobicContact CZ-CD1 3.5Å; F165-L176 VanDerWaalsContact CZ-CD1 3.5Å; F165-L176 HydrophobicContact CZ-CG 4.48Å; L170-L176 HydrophobicContact CD1-CB 4.39Å; L170-L176 HydrophobicContact CD1-CD1 4.32Å; D172-L176 PolarHBondContact O-N 3.16Å; D172-L176 VanDerWaalsContact O-N 3.12Å; I173-L176 WeakPolarHBondContact O-CB 3.26Å; I173-L176 PolarHBondContact O-N 2.91Å; L176-T180 WeakPolarHBondContact O-CB 3.45Å; L176-T180 PolarHBondContact O-N 2.86Å; L176-T180 PolarHBondContact O-OG1 3.49Å
177	K	91.4	Very high	86.1	Confident	55 Å²	55	57 Å²	57	24%	0.239	30%	0.295	C	S	.	.	H	α-helix	trans	-63.6	-45.6	177	-168.3	164.4	-172.7	156	0	112.3	I122 F125 N126 I173 A175 T180 F181	I122-K177 HydrophobicContact CD1-CG 4.07Å; F125-K177 HydrophobicContact CD1-CD 4.2Å; F125-K177 HydrophobicContact CE1-CB 4.44Å; F125-K177 HydrophobicContact CE1-CD 3.84Å; F125-K177 HydrophobicContact CE1-CG 4.4Å; N126-K177 PolarHBondContact OD1-NZ 3.31Å; I173-K177 PolarHBondContact O-N 3.39Å; A175-K177 PolarHBondContact O-N 2.91Å; K177-T180 WeakPolarHBondContact O-CB 3.47Å; K177-T180 PolarHBondContact O-N 2.9Å; K177-F181 HydrophobicContact CD-CE2 4.44Å; K177-F181 HydrophobicContact CG-CD2 4.11Å; K177-F181 HydrophobicContact CG-CE2 3.81Å; K177-F181 VanDerWaalsContact O-CD2 3.26Å; K177-F181 WeakPolarHBondContact O-CD2 3.35Å; K177-F181 PolarHBondContact O-N 3.4Å
178	R	88.3	Confident	85.9	Confident	106 Å²	106	56.1 Å²	56.1	40%	0.4	29%	0.288	S	S	.	.	H	α-helix	trans	-61.4	-44.4	176.6	-76.8	-178.1	-67.3	179	-0.2	112.8	D172 N174 A175 T180 F181 R182 A340	D172-R178 IonicContact OD2-NH2 3.78Å; N174-R178 WeakPolarHBondContact O-CB 3.21Å; N174-R178 VanDerWaalsContact O-CG 3.29Å; N174-R178 WeakPolarHBondContact O-CG 3.04Å; N174-R178 PolarHBondContact O-N 3.11Å; N174-R178 PolarHBondContact O-NE 3.34Å; A175-R178 PolarHBondContact O-N 2.87Å; R178-T180 VanDerWaalsContact C-N 3.34Å; R178-F181 PolarHBondContact O-N 3.12Å; R178-R182 WeakPolarHBondContact O-CG 3.48Å; R178-R182 PolarHBondContact O-N 2.95Å; R178-A340 PolarHBondContact NH1-O 3.02Å
179	T	89.3	Confident	85.5	Confident	19 Å²	19	55 Å²	55	12%	0.117	28%	0.282	C	S	.	.	H	α-helix	trans	-65.7	-39	177.7	-59.9	0	0	0	0	111.4	F165 A175 F181 R182 F183	F165-T179 HydrophobicContact CE1-CG2 3.56Å; F165-T179 HydrophobicContact CZ-CG2 4.03Å; A175-T179 WeakPolarHBondContact O-CB 3.34Å; A175-T179 PolarHBondContact O-N 3.2Å; A175-T179 PolarHBondContact O-OG1 3.46Å; A175-T179 VanDerWaalsContact O-OG1 3.04Å; T179-F181 PolarHBondContact O-N 3.36Å; T179-R182 PolarHBondContact O-N 2.89Å; T179-F183 HydrophobicContact CG2-CD2 4.05Å; T179-F183 HydrophobicContact CG2-CE2 4.06Å; T179-F183 WeakPolarHBondContact O-CD2 3.25Å; T179-F183 PolarHBondContact O-N 2.85Å
180	T	91.4	Very high	85.3	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-57.6	-48.1	173.5	-58.3	0	0	0	0	111.7	P121 I122 F152 L161 L176 K177 R178 R182 F183 M184	P121-T180 HydrophobicContact CB-CG2 3.46Å; P121-T180 VanDerWaalsContact CB-CG2 3.46Å; I122-T180 HydrophobicContact CD1-CG2 3.56Å; I122-T180 HydrophobicContact CG1-CG2 3.92Å; F152-T180 HydrophobicContact CZ-CG2 4.06Å; L161-T180 HydrophobicContact CD2-CG2 4.02Å; L176-T180 WeakPolarHBondContact O-CB 3.45Å; L176-T180 PolarHBondContact O-N 2.86Å; L176-T180 PolarHBondContact O-OG1 3.49Å; K177-T180 WeakPolarHBondContact O-CB 3.47Å; K177-T180 PolarHBondContact O-N 2.9Å; R178-T180 VanDerWaalsContact C-N 3.34Å; T180-R182 PolarHBondContact O-N 3.48Å; T180-F183 PolarHBondContact O-N 3.45Å; T180-M184 HydrophobicContact CG2-SD 4.36Å; T180-M184 PolarHBondContact O-N 3.43Å; T180-M184 VanDerWaalsContact O-N 3.12Å
181	F	89.4	Confident	84.8	Confident	85 Å²	85	56.7 Å²	56.7	37%	0.373	29%	0.287	S	S	.	.	H	α-helix	trans	-59.6	-41.4	174.5	-81.7	-64.6	0	0	0	113	I122 K177 R178 T179 F183 M184 A185	I122-F181 HydrophobicContact CB-CE1 4.44Å; I122-F181 HydrophobicContact CB-CZ 4.49Å; I122-F181 HydrophobicContact CD1-CD1 4.06Å; I122-F181 HydrophobicContact CD1-CD2 3.74Å; I122-F181 HydrophobicContact CD1-CE1 3.96Å; I122-F181 HydrophobicContact CD1-CE2 3.64Å; I122-F181 HydrophobicContact CD1-CG 3.95Å; I122-F181 HydrophobicContact CD1-CZ 3.75Å; I122-F181 HydrophobicContact CG1-CD1 3.92Å; I122-F181 HydrophobicContact CG1-CD2 4.48Å; I122-F181 HydrophobicContact CG1-CE1 3.69Å; I122-F181 HydrophobicContact CG1-CE2 4.3Å; I122-F181 HydrophobicContact CG1-CG 4.31Å; I122-F181 HydrophobicContact CG1-CZ 3.9Å; I122-F181 HydrophobicContact CG2-CE1 4.17Å; I122-F181 HydrophobicContact CG2-CZ 3.84Å; K177-F181 HydrophobicContact CD-CE2 4.44Å; K177-F181 HydrophobicContact CG-CD2 4.11Å; K177-F181 HydrophobicContact CG-CE2 3.81Å; K177-F181 VanDerWaalsContact O-CD2 3.26Å; K177-F181 WeakPolarHBondContact O-CD2 3.35Å; K177-F181 PolarHBondContact O-N 3.4Å; R178-F181 PolarHBondContact O-N 3.12Å; T179-F181 PolarHBondContact O-N 3.36Å; F181-F183 PolarHBondContact O-N 3.41Å; F181-M184 PolarHBondContact O-N 3.43Å; F181-A185 WeakPolarHBondContact O-CB 3.44Å; F181-A185 PolarHBondContact O-N 3.11Å
182	R	86.4	Confident	84.5	Confident	89 Å²	89	57.3 Å²	57.3	34%	0.336	29%	0.286	S	S	.	.	H	α-helix	trans	-61	-42.2	177.5	-74.5	176.7	174.3	171.6	-1.8	112.7	R178 T179 T180 A185 A186 G310	R178-R182 WeakPolarHBondContact O-CG 3.48Å; R178-R182 PolarHBondContact O-N 2.95Å; T179-R182 PolarHBondContact O-N 2.89Å; T180-R182 PolarHBondContact O-N 3.48Å; R182-A185 PolarHBondContact O-N 2.75Å; R182-A186 WeakPolarHBondContact O-CB 3.36Å; R182-A186 PolarHBondContact O-N 2.83Å; R182-G310 VanDerWaalsContact CZ-O 3.3Å; R182-G310 PolarHBondContact NE-O 3.21Å; R182-G310 PolarHBondContact NH2-O 3.43Å
183	F	89.6	Confident	83.3	Confident	47 Å²	47	57.8 Å²	57.8	21%	0.206	29%	0.288	C	S	.	.	H	α-helix	trans	-63.5	-46.3	175.2	-91.8	-102.7	0	0	0	111.8	L161 H164 T179 T180 F181 A185 A186 E187	L161-F183 HydrophobicContact CB-CD1 4.04Å; L161-F183 HydrophobicContact CB-CG 4.31Å; L161-F183 HydrophobicContact CD1-CB 3.85Å; L161-F183 HydrophobicContact CD1-CD1 4.18Å; L161-F183 HydrophobicContact CD1-CD2 3.74Å; L161-F183 HydrophobicContact CD1-CE2 4.35Å; L161-F183 HydrophobicContact CD1-CG 3.65Å; H164-F183 HydrophobicContact CB-CE1 4.2Å; H164-F183 HydrophobicContact CB-CE2 4Å; H164-F183 HydrophobicContact CB-CZ 3.46Å; H164-F183 VanDerWaalsContact CB-CZ 3.46Å; H164-F183 AromaticContact CD2-CE2 3.62Å; H164-F183 AromaticContact CD2-CZ 3.99Å; H164-F183 AromaticContact CG-CE2 3.6Å; H164-F183 AromaticContact CG-CZ 3.47Å; H164-F183 VanDerWaalsContact CG-CZ 3.47Å; H164-F183 AromaticContact ND1-CZ 3.85Å; T179-F183 HydrophobicContact CG2-CD2 4.05Å; T179-F183 HydrophobicContact CG2-CE2 4.06Å; T179-F183 WeakPolarHBondContact O-CD2 3.25Å; T179-F183 PolarHBondContact O-N 2.85Å; T180-F183 PolarHBondContact O-N 3.45Å; F181-F183 PolarHBondContact O-N 3.41Å; F183-A185 PolarHBondContact O-N 2.71Å; F183-A186 PolarHBondContact O-N 3.27Å; F183-E187 WeakPolarHBondContact O-CG 3.26Å; F183-E187 PolarHBondContact O-N 3.19Å
184	M	87.7	Confident	81.8	Confident	32 Å²	32	62.7 Å²	62.7	16%	0.158	31%	0.314	C	S	.	.	H	α-helix	trans	-61.4	-41.3	177.6	-70.5	176.5	58.9	0	0	112.6	N120 P121 I122 T180 F181 E187 Q188	N120-M184 HydrophobicContact CB-CE 3.77Å; P121-M184 HydrophobicContact CB-SD 4.3Å; P121-M184 HydrophobicContact CG-SD 4.34Å; I122-M184 HydrophobicContact CB-SD 4.36Å; I122-M184 HydrophobicContact CG1-CE 4.49Å; I122-M184 HydrophobicContact CG1-SD 3.63Å; T180-M184 HydrophobicContact CG2-SD 4.36Å; T180-M184 PolarHBondContact O-N 3.43Å; T180-M184 VanDerWaalsContact O-N 3.12Å; F181-M184 PolarHBondContact O-N 3.43Å; M184-E187 PolarHBondContact O-N 3.2Å; M184-Q188 WeakPolarHBondContact O-CG 3.46Å; M184-Q188 PolarHBondContact O-N 3.41Å
185	A	84.3	Confident	80.3	Confident	34 Å²	34	64.4 Å²	64.4	28%	0.281	32%	0.322	S	S	.	.	H	α-helix	trans	-64.5	-40.3	175.6	0	0	0	0	0	112.1	F181 R182 F183 Q188 L189	F181-A185 WeakPolarHBondContact O-CB 3.44Å; F181-A185 PolarHBondContact O-N 3.11Å; R182-A185 PolarHBondContact O-N 2.75Å; F183-A185 PolarHBondContact O-N 2.71Å; A185-Q188 PolarHBondContact O-N 2.93Å; A185-L189 WeakPolarHBondContact O-CB 3.48Å; A185-L189 PolarHBondContact O-N 3.07Å
186	A	82.8	Confident	78.2	Confident	18 Å²	18	70.6 Å²	70.6	15%	0.149	35%	0.347	C	S	.	.	H	α-helix	trans	-65.6	-37.6	175.6	0	0	0	0	0	113.1	R182 F183 K190 L384	R182-A186 WeakPolarHBondContact O-CB 3.36Å; R182-A186 PolarHBondContact O-N 2.83Å; F183-A186 PolarHBondContact O-N 3.27Å; A186-K190 WeakPolarHBondContact O-CG 3.47Å; A186-K190 PolarHBondContact O-N 2.86Å; A186-K190 VanDerWaalsContact O-N 3.15Å; A186-L384 HydrophobicContact CB-CD1 3.73Å
187	E	81.9	Confident	75.7	Confident	90 Å²	90	77.7 Å²	77.7	42%	0.421	38%	0.38	S	S	.	.	H	α-helix	trans	-69.3	-42	175.5	-73.2	176.5	171.5	0	0	111.9	F183 M184 L189 K190 S191	F183-E187 WeakPolarHBondContact O-CG 3.26Å; F183-E187 PolarHBondContact O-N 3.19Å; M184-E187 PolarHBondContact O-N 3.2Å; E187-L189 PolarHBondContact O-N 3.07Å; E187-K190 PolarHBondContact O-N 3.3Å; E187-S191 PolarHBondContact O-N 2.85Å; E187-S191 VanDerWaalsContact O-N 3.11Å
188	Q	80.4	Confident	73.2	Confident	107 Å²	107	80.7 Å²	80.7	50%	0.5	41%	0.406	S	S	.	.	H	α-helix	trans	-60.4	-44	173.2	-73.2	177	18.1	0	0	111.7	M184 A185 K190 S191 L192	M184-Q188 WeakPolarHBondContact O-CG 3.46Å; M184-Q188 PolarHBondContact O-N 3.41Å; A185-Q188 PolarHBondContact O-N 2.93Å; Q188-K190 PolarHBondContact O-N 3.16Å; Q188-S191 PolarHBondContact O-N 2.81Å; Q188-S191 PolarHBondContact O-OG 2.79Å; Q188-L192 PolarHBondContact O-N 3.15Å; Q188-L192 VanDerWaalsContact O-N 3.16Å
189	L	76.3	Confident	70.6	Confident	60 Å²	60	82.1 Å²	82.1	31%	0.314	43%	0.426	S	S	.	.	H	α-helix	trans	-62.2	-42.3	178.4	-174.4	62.7	0	0	0	112.2	A185 E187 S191 L192 I193 D381	A185-L189 WeakPolarHBondContact O-CB 3.48Å; A185-L189 PolarHBondContact O-N 3.07Å; E187-L189 PolarHBondContact O-N 3.07Å; L189-S191 PolarHBondContact O-N 3.1Å; L189-L192 PolarHBondContact O-N 2.66Å; L189-I193 HydrophobicContact CG-CD1 4.09Å; L189-I193 WeakPolarHBondContact O-CG1 3.21Å; L189-I193 PolarHBondContact O-N 2.93Å; L189-I193 VanDerWaalsContact O-N 3.14Å; L189-D381 HydrophobicContact CD2-CB 3.89Å
190	K	75.1	Confident	68	Low	101 Å²	101	85.7 Å²	85.7	44%	0.439	46%	0.458	S	S	.	.	H	α-helix	trans	-57.8	-46.8	173.9	-73.1	170.9	-177.8	176.5	0	111.8	A186 E187 Q188 L192 I193 D194	A186-K190 WeakPolarHBondContact O-CG 3.47Å; A186-K190 PolarHBondContact O-N 2.86Å; A186-K190 VanDerWaalsContact O-N 3.15Å; E187-K190 PolarHBondContact O-N 3.3Å; Q188-K190 PolarHBondContact O-N 3.16Å; K190-L192 PolarHBondContact O-N 2.93Å; K190-I193 PolarHBondContact O-N 3.13Å; K190-I193 VanDerWaalsContact O-N 3.1Å; K190-D194 PolarHBondContact O-N 2.94Å
191	S	71.3	Confident	65.2	Low	64 Å²	64	94.1 Å²	94.1	45%	0.448	50%	0.499	S	S	.	.	H	α-helix	trans	-62	-30.4	-179.7	75.7	0	0	0	0	113.5	E187 Q188 L189 I195	E187-S191 PolarHBondContact O-N 2.85Å; E187-S191 VanDerWaalsContact O-N 3.11Å; Q188-S191 PolarHBondContact O-N 2.81Å; Q188-S191 PolarHBondContact O-OG 2.79Å; L189-S191 PolarHBondContact O-N 3.1Å; S191-I195 VanDerWaalsContact O-CD1 3.32Å; S191-I195 WeakPolarHBondContact O-CD1 3.34Å; S191-I195 WeakPolarHBondContact O-CG1 3.28Å
192	L	66.4	Low	62.5	Low	107 Å²	107	96.4 Å²	96.4	56%	0.56	52%	0.52	S	S	*	.	H	α-helix	trans	-75.1	-35.2	175.4	-72.4	165.5	0	0	0	112.6	Q188 L189 K190	Q188-L192 PolarHBondContact O-N 3.15Å; Q188-L192 VanDerWaalsContact O-N 3.16Å; L189-L192 PolarHBondContact O-N 2.66Å; K190-L192 PolarHBondContact O-N 2.93Å
193	I	61	Low	60.1	Low	66 Å²	66	98.3 Å²	98.3	34%	0.338	54%	0.541	S	S	.	.	H	α-helix	trans	-68.9	-43.5	178.1	-67.5	165.2	0	0	0	110.6	L189 K190 I195 H196	L189-I193 HydrophobicContact CG-CD1 4.09Å; L189-I193 WeakPolarHBondContact O-CG1 3.21Å; L189-I193 PolarHBondContact O-N 2.93Å; L189-I193 VanDerWaalsContact O-N 3.14Å; K190-I193 PolarHBondContact O-N 3.13Å; K190-I193 VanDerWaalsContact O-N 3.1Å; I193-I195 PolarHBondContact O-N 3.26Å; I193-H196 PolarHBondContact O-N 2.83Å
194	D	58	Low	57.4	Low	117 Å²	117	103.1 Å²	103.1	63%	0.626	57%	0.568	S	S	*	*	H	α-helix	trans	-64.9	-24.9	-179.4	-71.7	-29	0	0	0	113	K190 H196	K190-D194 PolarHBondContact O-N 2.94Å; D194-H196 VanDerWaalsContact C-N 3.32Å
195	I	56.9	Low	54.9	Low	132 Å²	132	110.1 Å²	110.1	68%	0.677	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-19.3	174.6	-67	167.4	0	0	0	112.2	S191 I193	S191-I195 VanDerWaalsContact O-CD1 3.32Å; S191-I195 WeakPolarHBondContact O-CD1 3.34Å; S191-I195 WeakPolarHBondContact O-CG1 3.28Å; I193-I195 PolarHBondContact O-N 3.26Å
196	H	45	Very low	52.3	Low	150 Å²	150	113.4 Å²	113.4	69%	0.694	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.4	15.1	-170.4	-89	76.6	0	0	0	115.3	I193 D194 P198	I193-H196 PolarHBondContact O-N 2.83Å; D194-H196 VanDerWaalsContact C-N 3.32Å; H196-P198 WeakPolarHBondContact O-CD 3.38Å; H196-P198 VanDerWaalsContact O-N 3.15Å
197	Q	36.8	Very low	49.9	Very low	153 Å²	153	118.6 Å²	118.6	72%	0.715	65%	0.648	S	S	*	*			trans	-62.9	113.2	169.5	-77.1	-164	-1	0	0	110.9
198	P	38.5	Very low	47.8	Very low	118 Å²	118	123.9 Å²	123.9	77%	0.766	67%	0.67	S	S	*	*			trans	-80.1	125.5	171.6	-2.8	23.7	0	0	0	107.6	H196 A200	H196-P198 WeakPolarHBondContact O-CD 3.38Å; H196-P198 VanDerWaalsContact O-N 3.15Å; P198-A200 PolarHBondContact O-N 3.48Å
199	T	33.4	Very low	45.5	Very low	136 Å²	136	123.3 Å²	123.3	83%	0.834	68%	0.684	S	S	*	*			trans	-51.3	111.8	173.7	-52.2	0	0	0	0	110	M201	T199-M201 PolarHBondContact O-N 2.98Å
200	A	36	Very low	43.7	Very low	94 Å²	94	126.3 Å²	126.3	78%	0.777	71%	0.71	S	S	*	*			trans	-66.7	102.2	-174.9	0	0	0	0	0	110.8	P198 T202	P198-A200 PolarHBondContact O-N 3.48Å; A200-T202 PolarHBondContact O-N 3.3Å
201	M	31.8	Very low	41.8	Very low	176 Å²	176	132.7 Å²	132.7	87%	0.867	73%	0.731	S	S	*	*			trans	-68.7	125.5	172.7	-75.6	-167.2	70.9	0	0	110.7	T199 V203	T199-M201 PolarHBondContact O-N 2.98Å; M201-V203 PolarHBondContact O-N 2.92Å
202	T	32.6	Very low	40	Very low	133 Å²	133	135.7 Å²	135.7	82%	0.816	75%	0.749	S	S	*	*			trans	-67.3	108.5	178.7	-22	0	0	0	0	110.7	A200 I204	A200-T202 PolarHBondContact O-N 3.3Å; T202-I204 PolarHBondContact O-N 3.5Å
203	V	35.6	Very low	38.6	Very low	129 Å²	129	138.7 Å²	138.7	78%	0.782	76%	0.764	S	S	*	*			trans	-89.6	103.7	170.4	179.5	0	0	0	0	109.2	M201 Q205	M201-V203 PolarHBondContact O-N 2.92Å; V203-Q205 PolarHBondContact O-N 2.87Å
204	I	34.3	Very low	37.2	Very low	148 Å²	148	141.5 Å²	141.5	76%	0.759	78%	0.78	S	S	*	*			trans	-72.7	121.3	171.9	-61.7	168	0	0	0	108.4	T202	T202-I204 PolarHBondContact O-N 3.5Å
205	Q	33.8	Very low	36.2	Very low	179 Å²	179	141.8 Å²	141.8	84%	0.836	79%	0.791	S	S	*	*			trans	-104.5	124.2	162.1	-84.1	-167.3	-14.7	0	0	110.3	V203	V203-Q205 PolarHBondContact O-N 2.87Å
206	P	30.8	Very low	35	Very low	104 Å²	104	143.6 Å²	143.6	68%	0.675	80%	0.796	S	S	*	*			trans	-92	144.5	177	34.6	-31.8	0	0	0	111.5
207	T	32.1	Very low	34.6	Very low	126 Å²	126	144.9 Å²	144.9	77%	0.773	80%	0.802	S	S	*	*				-179.1	150.5	118	23.5	0	0	0	0	114.9
208	K	37.3	Very low	34.5	Very low	201 Å²	201	143.9 Å²	143.9	87%	0.874	80%	0.801	S	S	*	*			trans	78.7	111.5	154.6	-72.8	162.8	-175.9	178.5	0	118.4
209	A	32.2	Very low	34.3	Very low	95 Å²	95	142.5 Å²	142.5	79%	0.785	79%	0.794	S	S	*	*			trans	-76.5	154.6	179.6	0	0	0	0	0	114
210	S	37.7	Very low	34.2	Very low	124 Å²	124	143 Å²	143	87%	0.867	79%	0.791	S	S	*	*			trans	-155.9	110.2	146.5	-82.1	0	0	0	0	111
211	R	36.4	Very low	34.2	Very low	234 Å²	234	145.2 Å²	145.2	88%	0.883	80%	0.795	S	S	*	*			trans	17.7	128.2	161.2	-65.4	177.8	174.4	172.3	-2.7	120.6
212	P	33.4	Very low	34.2	Very low	127 Å²	127	142.6 Å²	142.6	83%	0.825	79%	0.789	S	S	*	*			trans	-85.8	149.6	160.7	36	-31.8	0	0	0	111.9
213	I	37.5	Very low	34.3	Very low	171 Å²	171	145.6 Å²	145.6	88%	0.877	79%	0.794	S	S	*	*			trans	-125.5	132	159.1	-69.8	-178.5	0	0	0	108.5
214	N	31.6	Very low	33.9	Very low	125 Å²	125	144.3 Å²	144.3	67%	0.668	79%	0.79	S	S	*	*			trans	-90.5	148.1	-175.4	-176	21.2	0	0	0	110.6
215	S	35.8	Very low	34	Very low	122 Å²	122	142.7 Å²	142.7	85%	0.853	79%	0.792	S	S	*	*			trans	-175.3	125.1	141.4	-81.9	0	0	0	0	111.8
216	Q	32.5	Very low	33.9	Very low	170 Å²	170	140.8 Å²	140.8	79%	0.794	78%	0.783	S	S	*	*			trans	-89.8	149.7	170.8	-54.4	153.4	-55	0	0	109.5
217	H	35.9	Very low	34	Very low	177 Å²	177	148.2 Å²	148.2	82%	0.819	80%	0.798	S	S	*	*			trans	-174.3	145.7	140.5	-124.2	-53.7	0	0	0	115.5
218	I	35	Very low	34	Very low	133 Å²	133	147.5 Å²	147.5	68%	0.682	79%	0.789	S	S	*	*			trans	61.8	113.1	156.3	-47.7	-174.9	0	0	0	116.3
219	S	33.7	Very low	33.7	Very low	89 Å²	89	144.9 Å²	144.9	62%	0.622	79%	0.785	S	S	*	*			cis	91.9	122.8	32.5	83.6	0	0	0	0	116.4
220	D	32	Very low	33.7	Very low	146 Å²	146	145.7 Å²	145.7	78%	0.781	79%	0.785	S	S	*	*			trans	59	124	155.4	-49	-32.3	0	0	0	122.1
221	V	36.3	Very low	33.3	Very low	141 Å²	141	151.4 Å²	151.4	86%	0.855	79%	0.787	S	S	*	*				-151.2	127.8	119.9	165.4	0	0	0	0	109.4
222	T	31.3	Very low	33.2	Very low	121 Å²	121	150.7 Å²	150.7	74%	0.742	79%	0.785	S	S	*	*			trans	-88.8	146.4	173.9	-45.1	0	0	0	0	111.6
223	Q	35.4	Very low	33	Very low	196 Å²	196	153.3 Å²	153.3	92%	0.916	79%	0.786	S	S	*	*			trans	-151.6	144.9	153.4	-116.6	169.9	49.7	0	0	112.7
224	S	27.4	Very low	32.7	Very low	101 Å²	101	154.6 Å²	154.6	71%	0.706	79%	0.785	S	S	*	*			trans	-140.4	136	-165.3	147	0	0	0	0	112
225	S	36.7	Very low	32.7	Very low	114 Å²	114	153.3 Å²	153.3	80%	0.797	79%	0.786	S	S	*	*			trans	-165.9	108.6	152.9	42	0	0	0	0	106.9
226	H	31.2	Very low	32.4	Very low	139 Å²	139	154.1 Å²	154.1	64%	0.644	79%	0.789	S	S	*	*				54.7	114.3	65.9	-137.1	-61.2	0	0	0	112.6	N228	H226-N228 PolarHBondContact CE1-OD1 3.37Å; H226-N228 PolarHBondContact ND1-OD1 3.01Å
227	W	32.4	Very low	32.3	Very low	260 Å²	260	150 Å²	150	99%	0.985	78%	0.784	S	S	*	*			trans	-162.9	151.8	140.5	-100.7	24.2	0	0	0	109
228	N	31.8	Very low	32.1	Very low	111 Å²	111	148.8 Å²	148.8	59%	0.594	78%	0.778	S	S	*	*			trans	-104.8	171.1	-152.7	-68.7	-35.5	0	0	0	115.2	H226	H226-N228 PolarHBondContact CE1-OD1 3.37Å; H226-N228 PolarHBondContact ND1-OD1 3.01Å
229	N	32.5	Very low	31.9	Very low	147 Å²	147	150.4 Å²	150.4	79%	0.786	78%	0.78	S	S	*	*			trans	64.5	119.1	149.7	-61.1	-21.5	0	0	0	117.3
230	S	32.3	Very low	31.7	Very low	112 Å²	112	157.9 Å²	157.9	78%	0.783	80%	0.795	S	S	*	*				-171.2	141.8	61.5	-68.7	0	0	0	0	113
231	R	28.3	Very low	31.5	Very low	243 Å²	243	162.2 Å²	162.2	92%	0.917	80%	0.801	S	S	*	*			trans	-77.2	118.8	169.7	177.3	-170.5	-69	-156.9	-1.7	110.6
232	R	33.3	Very low	31.3	Very low	220 Å²	220	160.4 Å²	160.4	83%	0.83	79%	0.794	S	S	*	*			trans	-142.1	134.9	155.9	-73.2	-162.8	-177.4	-162.2	1.6	111.3
233	Q	30.4	Very low	31.3	Very low	182 Å²	182	160.9 Å²	160.9	85%	0.85	80%	0.797	S	S	*	*			trans	-73	139	173.8	-60	145.8	-67.2	0	0	109.7
234	F	31.6	Very low	31.3	Very low	197 Å²	197	158.7 Å²	158.7	86%	0.864	79%	0.792	S	S	*	*			trans	-145.9	142.8	155.7	-86.7	-71.6	0	0	0	111.4
235	S	30.3	Very low	31.6	Very low	98 Å²	98	159 Å²	159	69%	0.685	79%	0.794	S	S	*	*			trans	-81.7	149.2	-171.8	44.7	0	0	0	0	113.5	A237	S235-A237 PolarHBondContact O-N 3.46Å; S235-A237 VanDerWaalsContact O-N 3.07Å
236	P	31.1	Very low	31.7	Very low	140 Å²	140	163.3 Å²	163.3	91%	0.909	79%	0.794	S	S	*	*	S	Bend	trans	-80.8	91.9	-179.6	32	-33.1	0	0	0	112.2
237	A	28.6	Very low	32.2	Very low	83 Å²	83	164.4 Å²	164.4	69%	0.686	80%	0.799	S	S	*	*			trans	-143.5	152.6	157.9	0	0	0	0	0	109.6	S235	S235-A237 PolarHBondContact O-N 3.46Å; S235-A237 VanDerWaalsContact O-N 3.07Å
238	E	32	Very low	32.8	Very low	151 Å²	151	155.4 Å²	155.4	71%	0.706	79%	0.787	S	S	*	*			trans	87.8	100	170.3	-50.4	-138.5	102.1	0	0	120.1
239	K	32.3	Very low	33.8	Very low	168 Å²	168	158 Å²	158	73%	0.73	79%	0.789	S	S	*	*				57.4	95.6	121.2	-64	163.9	-174.4	155.9	0	118.6	R241	K239-R241 PolarHBondContact O-N 3.46Å
240	W	29.3	Very low	34.8	Very low	246 Å²	246	156.6 Å²	156.6	93%	0.932	78%	0.777	S	S	*	*			trans	-61.3	115.5	152.4	-75.8	87.7	0	0	0	111.9
241	R	26.3	Very low	35.9	Very low	237 Å²	237	155.4 Å²	155.4	89%	0.894	77%	0.769	S	S	*	*			trans	-117.5	117.9	150.9	-71	-171.9	-169.6	-106	8.3	108	K239	K239-R241 PolarHBondContact O-N 3.46Å
242	S	33.8	Very low	37.9	Very low	102 Å²	102	149 Å²	149	71%	0.713	75%	0.749	S	S	*	*			trans	-112.6	129.7	164.2	-70.4	0	0	0	0	110.3
243	T	31	Very low	39.8	Very low	132 Å²	132	139.6 Å²	139.6	81%	0.81	72%	0.717	S	S	*	*			trans	-71	141.9	176.5	43.4	0	0	0	0	112
244	N	35	Very low	41.8	Very low	150 Å²	150	135.9 Å²	135.9	80%	0.802	71%	0.709	S	S	*	*			trans	-151.2	131.5	150.9	-105.5	-25.4	0	0	0	111.4
245	S	32.7	Very low	43.4	Very low	107 Å²	107	129.9 Å²	129.9	75%	0.748	68%	0.681	S	S	*	*			trans	-99.2	112.3	-169.9	48.7	0	0	0	0	112.1
246	Y	40	Very low	45.6	Very low	204 Å²	204	125.7 Å²	125.7	80%	0.8	65%	0.651	S	S	*	*			trans	-130	62.9	173.2	-78.7	-83.8	0	0	0	111.6
247	H	41.2	Very low	47.8	Very low	163 Å²	163	127.7 Å²	127.7	76%	0.755	64%	0.641	S	S	*	*			trans	-111	94.7	169.9	-70.8	-71.2	0	0	0	108.8
248	G	45.1	Very low	49.9	Very low	71 Å²	71	133.5 Å²	133.5	73%	0.732	65%	0.645	S	S	*	*	S	Bend	trans	-175	-15.9	-177.8	0	0	0	0	0	121
249	R	52.6	Low	51.6	Low	166 Å²	166	130.4 Å²	130.4	63%	0.626	63%	0.629	S	S	*	*			trans	-135.2	29.2	-176	-70.4	-171.4	-172.3	-112.1	6.1	116.5	S251 E252	R249-S251 PolarHBondContact O-N 3.4Å; R249-E252 VanDerWaalsContact CD-OE2 3.27Å; R249-E252 WeakPolarHBondContact CD-OE2 3.49Å; R249-E252 IonicContact CZ-OE2 3.57Å; R249-E252 IonicContact NE-OE2 3.77Å; R249-E252 IonicContact NH1-OE1 3.53Å; R249-E252 IonicContact NH1-OE2 2.67Å; R249-E252 PolarHBondContact NH1-OE2 3.45Å; R249-E252 PolarHBondContact O-N 3.13Å
250	Q	52.8	Low	53.6	Low	116 Å²	116	124.3 Å²	124.3	54%	0.542	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.2	-26	175.7	-82.5	-176.4	-17.6	0	0	113.8	H268 N269	Q250-H268 HydrophobicContact CG-CB 4.22Å; Q250-H268 PolarHBondContact NE2-O 2.98Å; Q250-N269 PolarHBondContact NE2-OD1 3.49Å
251	S	56.8	Low	55.4	Low	88 Å²	88	121 Å²	121	62%	0.615	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-25.9	-179.1	46.3	0	0	0	0	114.9	R249 R257	R249-S251 PolarHBondContact O-N 3.4Å; S251-R257 PolarHBondContact O-NH2 3.24Å
252	E	68.8	Low	57.1	Low	107 Å²	107	115.1 Å²	115.1	50%	0.5	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.2	-25	-173.4	-68.7	-179.1	159.4	0	0	113.7	R249 P254	R249-E252 VanDerWaalsContact CD-OE2 3.27Å; R249-E252 WeakPolarHBondContact CD-OE2 3.49Å; R249-E252 IonicContact CZ-OE2 3.57Å; R249-E252 IonicContact NE-OE2 3.77Å; R249-E252 IonicContact NH1-OE1 3.53Å; R249-E252 IonicContact NH1-OE2 2.67Å; R249-E252 PolarHBondContact NH1-OE2 3.45Å; R249-E252 PolarHBondContact O-N 3.13Å; E252-P254 VanDerWaalsContact O-CD 3.25Å; E252-P254 WeakPolarHBondContact O-CD 3.31Å
253	C	73.4	Confident	58.8	Low	24 Å²	24	110.2 Å²	110.2	16%	0.162	56%	0.558	C	S	.	*			trans	-70.4	117.8	-175.9	-174	0	0	0	0	111.5	Y255 C256 R257	C253-Y255 PolarHBondContact O-N 3.33Å; C253-C256 HydrophobicContact CB-CB 4.05Å; C253-C256 WeakPolarHBondContact CB-SG 3.38Å; C253-C256 PolarHBondContact O-N 3.03Å; C253-C256 VanDerWaalsContact O-N 3.16Å; C253-C256 PolarHBondContact SG-SG 2.84Å; C253-R257 WeakPolarHBondContact O-CB 3.47Å; C253-R257 PolarHBondContact O-N 3.12Å
254	P	73	Confident	60.5	Low	103 Å²	103	111.4 Å²	111.4	67%	0.669	55%	0.552	S	S	*	*	H	α-helix	trans	-60.8	-34.4	-178.6	-23.6	34.4	0	0	0	112.7	E252 R258	E252-P254 VanDerWaalsContact O-CD 3.25Å; E252-P254 WeakPolarHBondContact O-CD 3.31Å; P254-R258 WeakPolarHBondContact O-CB 3.44Å; P254-R258 PolarHBondContact O-N 3.21Å
255	Y	66	Low	61.8	Low	72 Å²	72	112.4 Å²	112.4	28%	0.282	55%	0.549	S	S	.	.	H	α-helix	trans	-68.8	-47.2	176.7	-174.2	-96.7	0	0	0	111.7	C253 R257 R258 F259 A263 K265 C266	C253-Y255 PolarHBondContact O-N 3.33Å; Y255-R257 VanDerWaalsContact C-N 3.3Å; Y255-R257 PolarHBondContact O-N 3.2Å; Y255-R258 PolarHBondContact O-N 3.21Å; Y255-F259 HydrophobicContact CD1-CD2 4.36Å; Y255-F259 AromaticContact CD2-CD2 3.63Å; Y255-F259 HydrophobicContact CD2-CD2 3.63Å; Y255-F259 AromaticContact CD2-CE2 3.62Å; Y255-F259 HydrophobicContact CD2-CE2 3.62Å; Y255-F259 HydrophobicContact CE1-CD2 4.2Å; Y255-F259 AromaticContact CE2-CD2 3.39Å; Y255-F259 HydrophobicContact CE2-CD2 3.39Å; Y255-F259 AromaticContact CE2-CE2 3.34Å; Y255-F259 HydrophobicContact CE2-CE2 3.34Å; Y255-F259 HydrophobicContact CE2-CG 4.47Å; Y255-F259 HydrophobicContact CE2-CZ 4.37Å; Y255-F259 HydrophobicContact CG-CD2 4.1Å; Y255-F259 AromaticContact CZ-CD2 3.69Å; Y255-F259 WeakPolarHBondContact O-CD2 3.49Å; Y255-F259 PolarHBondContact O-N 2.91Å; Y255-A263 HydrophobicContact CD1-CB 3.75Å; Y255-A263 HydrophobicContact CE1-CB 3.69Å; Y255-K265 HydrophobicContact CE1-CB 3.7Å; Y255-K265 HydrophobicContact CE1-CG 4.38Å; Y255-K265 HydrophobicContact CE2-CD 4.49Å; Y255-K265 WeakPolarHBondContact OH-CG 3.48Å; Y255-C266 HydrophobicContact CD1-CB 3.64Å; Y255-C266 HydrophobicContact CE1-CB 4.42Å; Y255-C266 HydrophobicContact CG-CB 4.47Å
256	C	76.4	Confident	63.9	Low	9 Å²	9	108.5 Å²	108.5	6%	0.061	52%	0.522	C	S	.	.	H	α-helix	trans	-71.5	-24.8	177.8	-27.2	0	0	0	0	112.3	C253 G260 A263 C266 H268	C253-C256 HydrophobicContact CB-CB 4.05Å; C253-C256 WeakPolarHBondContact CB-SG 3.38Å; C253-C256 PolarHBondContact O-N 3.03Å; C253-C256 VanDerWaalsContact O-N 3.16Å; C253-C256 PolarHBondContact SG-SG 2.84Å; C256-G260 WeakPolarHBondContact O-CA 3.3Å; C256-G260 PolarHBondContact O-N 3.17Å; C256-A263 HydrophobicContact CB-CB 3.86Å; C256-C266 WeakPolarHBondContact CB-SG 3.47Å; C256-C266 WeakPolarHBondContact SG-CB 3.38Å; C256-C266 CovalentContact SG-SG 2.07Å; C256-C266 PolarHBondContact SG-SG 3.25Å; C256-H268 PolarHBondContact SG-ND1 2.85Å
257	R	76.1	Confident	65	Low	182 Å²	182	101.9 Å²	101.9	69%	0.687	52%	0.516	S	S	*	.	H	α-helix	trans	-66.4	-39	168.8	-169.5	-179.3	-63.9	169.4	0.7	112.8	S251 C253 Y255	S251-R257 PolarHBondContact O-NH2 3.24Å; C253-R257 WeakPolarHBondContact O-CB 3.47Å; C253-R257 PolarHBondContact O-N 3.12Å; Y255-R257 VanDerWaalsContact C-N 3.3Å; Y255-R257 PolarHBondContact O-N 3.2Å
258	R	72.6	Confident	66.6	Low	205 Å²	205	98.1 Å²	98.1	77%	0.774	50%	0.498	S	S	*	.	H	α-helix	trans	-76.6	-32.1	179.8	-174.1	172.4	-178.8	172.8	1.6	113.9	P254 Y255	P254-R258 WeakPolarHBondContact O-CB 3.44Å; P254-R258 PolarHBondContact O-N 3.21Å; Y255-R258 PolarHBondContact O-N 3.21Å
259	F	69.5	Low	67.7	Low	87 Å²	87	96.4 Å²	96.4	38%	0.382	47%	0.472	S	S	.	.	H	α-helix	trans	-116.7	-2.2	-173.8	-60.1	-74.7	0	0	0	114.3	Y255 K261 N262 A263	Y255-F259 HydrophobicContact CD1-CD2 4.36Å; Y255-F259 AromaticContact CD2-CD2 3.63Å; Y255-F259 HydrophobicContact CD2-CD2 3.63Å; Y255-F259 AromaticContact CD2-CE2 3.62Å; Y255-F259 HydrophobicContact CD2-CE2 3.62Å; Y255-F259 HydrophobicContact CE1-CD2 4.2Å; Y255-F259 AromaticContact CE2-CD2 3.39Å; Y255-F259 HydrophobicContact CE2-CD2 3.39Å; Y255-F259 AromaticContact CE2-CE2 3.34Å; Y255-F259 HydrophobicContact CE2-CE2 3.34Å; Y255-F259 HydrophobicContact CE2-CG 4.47Å; Y255-F259 HydrophobicContact CE2-CZ 4.37Å; Y255-F259 HydrophobicContact CG-CD2 4.1Å; Y255-F259 AromaticContact CZ-CD2 3.69Å; Y255-F259 WeakPolarHBondContact O-CD2 3.49Å; Y255-F259 PolarHBondContact O-N 2.91Å; F259-K261 PolarHBondContact O-N 3.49Å; F259-N262 WeakPolarHBondContact O-CA 3.33Å; F259-N262 VanDerWaalsContact O-CB 3.27Å; F259-N262 WeakPolarHBondContact O-CB 3.4Å; F259-N262 PolarHBondContact O-N 3.5Å; F259-A263 HydrophobicContact CB-CB 3.78Å; F259-A263 PolarHBondContact O-N 2.89Å
260	G	73.1	Confident	67.7	Low	39 Å²	39	99.3 Å²	99.3	40%	0.402	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	53.3	-134.9	178.5	0	0	0	0	0	113.1	C256 N262 A263 N269	C256-G260 WeakPolarHBondContact O-CA 3.3Å; C256-G260 PolarHBondContact O-N 3.17Å; G260-N262 PolarHBondContact O-N 3.36Å; G260-N262 VanDerWaalsContact O-N 3.15Å; G260-A263 WeakPolarHBondContact O-CB 3.18Å; G260-A263 PolarHBondContact O-N 2.89Å; G260-N269 PolarHBondContact O-ND2 2.93Å
261	K	66.6	Low	67.5	Low	177 Å²	177	98.1 Å²	98.1	77%	0.77	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-60.3	-17.1	173	64.1	-177.5	179.3	-178.2	0	114.5	F259 A263	F259-K261 PolarHBondContact O-N 3.49Å; K261-A263 VanDerWaalsContact C-N 3.3Å
262	N	62.9	Low	66.8	Low	113 Å²	113	100 Å²	100	60%	0.604	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-85.9	-2.9	177.3	-55.4	-29.7	0	0	0	112.5	F259 G260 K264	F259-N262 WeakPolarHBondContact O-CA 3.33Å; F259-N262 VanDerWaalsContact O-CB 3.27Å; F259-N262 WeakPolarHBondContact O-CB 3.4Å; F259-N262 PolarHBondContact O-N 3.5Å; G260-N262 PolarHBondContact O-N 3.36Å; G260-N262 VanDerWaalsContact O-N 3.15Å; N262-K264 VanDerWaalsContact C-N 3.31Å; N262-K264 PolarHBondContact O-N 3.21Å
263	A	68.7	Low	65.2	Low	0 Å²	0	102.3 Å²	102.3	0%	0	51%	0.511	C	S	.	.			trans	-73.8	79.7	-179.8	0	0	0	0	0	111.5	Y255 C256 F259 G260 K261 C266 N269	Y255-A263 HydrophobicContact CD1-CB 3.75Å; Y255-A263 HydrophobicContact CE1-CB 3.69Å; C256-A263 HydrophobicContact CB-CB 3.86Å; F259-A263 HydrophobicContact CB-CB 3.78Å; F259-A263 PolarHBondContact O-N 2.89Å; G260-A263 WeakPolarHBondContact O-CB 3.18Å; G260-A263 PolarHBondContact O-N 2.89Å; K261-A263 VanDerWaalsContact C-N 3.3Å; A263-C266 VanDerWaalsContact CB-SG 3.59Å; A263-C266 PolarHBondContact O-SG 3.03Å; A263-C266 VanDerWaalsContact O-SG 3.36Å; A263-N269 WeakPolarHBondContact CB-ND2 3.48Å; A263-N269 PolarHBondContact O-ND2 3.14Å
264	K	67	Low	63.4	Low	157 Å²	157	106.4 Å²	106.4	68%	0.683	54%	0.535	S	S	*	.			trans	-80.3	-24.9	-176.8	-66.3	178.9	-178.4	-175.3	0	113.8	N262	N262-K264 VanDerWaalsContact C-N 3.31Å; N262-K264 PolarHBondContact O-N 3.21Å
265	K	61.5	Low	61.4	Low	170 Å²	170	107.1 Å²	107.1	74%	0.739	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-15.8	-178.5	-56	-176.5	-179.1	-174.3	0	114.8	Y255	Y255-K265 HydrophobicContact CE1-CB 3.7Å; Y255-K265 HydrophobicContact CE1-CG 4.38Å; Y255-K265 HydrophobicContact CE2-CD 4.49Å; Y255-K265 WeakPolarHBondContact OH-CG 3.48Å
266	C	78.1	Confident	60	Low	26 Å²	26	112.5 Å²	112.5	18%	0.176	57%	0.568	C	S	.	*	T	Hydrogen-bonded Turn	trans	-86.5	-3	-178	58.8	0	0	0	0	114.8	Y255 C256 A263 H268	Y255-C266 HydrophobicContact CD1-CB 3.64Å; Y255-C266 HydrophobicContact CE1-CB 4.42Å; Y255-C266 HydrophobicContact CG-CB 4.47Å; C256-C266 WeakPolarHBondContact CB-SG 3.47Å; C256-C266 WeakPolarHBondContact SG-CB 3.38Å; C256-C266 CovalentContact SG-SG 2.07Å; C256-C266 PolarHBondContact SG-SG 3.25Å; A263-C266 VanDerWaalsContact CB-SG 3.59Å; A263-C266 PolarHBondContact O-SG 3.03Å; A263-C266 VanDerWaalsContact O-SG 3.36Å; C266-H268 PolarHBondContact O-N 2.95Å; C266-H268 PolarHBondContact O-ND1 3.35Å
267	G	63.3	Low	58	Low	65 Å²	65	116.9 Å²	116.9	67%	0.67	60%	0.596	S	S	*	*	S	Bend	trans	70	-22.2	-175.6	0	0	0	0	0	115.6	N269	G267-N269 PolarHBondContact O-N 2.75Å
268	H	74.8	Confident	55.8	Low	84 Å²	84	116.7 Å²	116.7	39%	0.389	60%	0.603	S	S	.	*			trans	-72.5	-3.7	-177.2	-55.8	121.8	0	0	0	116	Q250 C256 C266	Q250-H268 HydrophobicContact CG-CB 4.22Å; Q250-H268 PolarHBondContact NE2-O 2.98Å; C256-H268 PolarHBondContact SG-ND1 2.85Å; C266-H268 PolarHBondContact O-N 2.95Å; C266-H268 PolarHBondContact O-ND1 3.35Å
269	N	67.6	Low	53.8	Low	34 Å²	34	111.7 Å²	111.7	18%	0.182	59%	0.59	C	S	.	*	S	Bend	trans	-116.3	122	174	-73	-47.1	0	0	0	108.7	Q250 G260 A263 G267 S271	Q250-N269 PolarHBondContact NE2-OD1 3.49Å; G260-N269 PolarHBondContact O-ND2 2.93Å; A263-N269 WeakPolarHBondContact CB-ND2 3.48Å; A263-N269 PolarHBondContact O-ND2 3.14Å; G267-N269 PolarHBondContact O-N 2.75Å; N269-S271 PolarHBondContact O-N 3.07Å
270	R	52	Low	51.7	Low	228 Å²	228	116 Å²	116	86%	0.86	61%	0.609	S	S	*	*			trans	-60.2	120.5	176.8	-81.6	-172.9	176.6	177	1.4	110.1	V272	R270-V272 PolarHBondContact O-N 3.41Å
271	S	49.5	Very low	49.4	Very low	90 Å²	90	121.1 Å²	121.1	63%	0.629	62%	0.622	S	S	*	*			trans	-71.5	116.3	173.8	49.7	0	0	0	0	110.5	N269 N273	N269-S271 PolarHBondContact O-N 3.07Å; S271-N273 PolarHBondContact O-N 3.21Å
272	V	41.9	Very low	47.5	Very low	129 Å²	129	121.2 Å²	121.2	78%	0.782	63%	0.63	S	S	*	*			trans	-65.5	114.5	159	-179.8	0	0	0	0	106.5	R270 T274	R270-V272 PolarHBondContact O-N 3.41Å; V272-T274 PolarHBondContact O-N 3.48Å; V272-T274 PolarHBondContact O-OG1 2.87Å
273	N	35.8	Very low	45.8	Very low	154 Å²	154	118.7 Å²	118.7	82%	0.824	62%	0.621	S	S	*	*	S	Bend	trans	-57.7	96	-166.3	-81.9	-9.5	0	0	0	112.6	S271	S271-N273 PolarHBondContact O-N 3.21Å
274	T	35.3	Very low	43.9	Very low	110 Å²	110	122.9 Å²	122.9	68%	0.675	65%	0.651	S	S	*	*			trans	-127	88	171.2	33.1	0	0	0	0	106.1	V272 K276	V272-T274 PolarHBondContact O-N 3.48Å; V272-T274 PolarHBondContact O-OG1 2.87Å; T274-K276 PolarHBondContact O-N 2.97Å
275	S	31.7	Very low	42	Very low	119 Å²	119	126.2 Å²	126.2	83%	0.832	66%	0.661	S	S	*	*			trans	-75.3	81.9	-168.4	48.3	0	0	0	0	112.5
276	K	34.8	Very low	40.5	Very low	184 Å²	184	122.5 Å²	122.5	80%	0.8	65%	0.652	S	S	*	*			trans	-121.3	100.3	156	-80.4	-169.9	174.4	-175.7	0	109.6	T274 H278	T274-K276 PolarHBondContact O-N 2.97Å; K276-H278 PolarHBondContact O-N 2.85Å
277	P	34.6	Very low	38.4	Very low	101 Å²	101	127.8 Å²	127.8	66%	0.656	68%	0.679	S	S	*	*			trans	-69.3	121.2	159.5	29.1	-28.5	0	0	0	107.8	I279	P277-I279 VanDerWaalsContact C-N 3.34Å; P277-I279 HydrophobicContact CB-CG1 4.28Å; P277-I279 HydrophobicContact CG-CD1 4.49Å; P277-I279 HydrophobicContact CG-CG1 4.39Å; P277-I279 PolarHBondContact O-N 2.83Å
278	H	30.4	Very low	37	Very low	179 Å²	179	130.6 Å²	130.6	83%	0.829	67%	0.674	S	S	*	*			trans	-69.7	96.3	164.6	-77.8	-87.8	0	0	0	107.9	K276	K276-H278 PolarHBondContact O-N 2.85Å
279	I	29.9	Very low	35.8	Very low	99 Å²	99	129.5 Å²	129.5	51%	0.508	67%	0.673	S	S	.	*			trans	-83.3	128.9	171.9	-59.2	179.6	0	0	0	107.7	P169 P277	P169-I279 HydrophobicContact CB-CD1 4.4Å; P277-I279 VanDerWaalsContact C-N 3.34Å; P277-I279 HydrophobicContact CB-CG1 4.28Å; P277-I279 HydrophobicContact CG-CD1 4.49Å; P277-I279 HydrophobicContact CG-CG1 4.39Å; P277-I279 PolarHBondContact O-N 2.83Å
280	F	26.1	Very low	35.2	Very low	179 Å²	179	134.8 Å²	134.8	79%	0.785	69%	0.69	S	S	*	*			trans	-71.9	136.8	-178.9	-68.8	-94.6	0	0	0	110.5	L282	F280-L282 PolarHBondContact O-N 3.07Å
281	H	24.5	Very low	35.9	Very low	145 Å²	145	125.2 Å²	125.2	67%	0.671	66%	0.656	S	S	*	*			trans	-70.8	111.1	177.3	-155	-101.2	0	0	0	109.2	S283	H281-S283 VanDerWaalsContact ND1-CB 3.29Å; H281-S283 WeakPolarHBondContact ND1-CB 3.37Å; H281-S283 PolarHBondContact ND1-OG 2.88Å; H281-S283 PolarHBondContact O-N 3.41Å
282	L	26.5	Very low	37.2	Very low	180 Å²	180	122.4 Å²	122.4	94%	0.942	63%	0.634	S	S	*	*			trans	-81.1	46.6	175	-119.9	157.4	0	0	0	111.3	F280	F280-L282 PolarHBondContact O-N 3.07Å
283	S	27.7	Very low	39.3	Very low	59 Å²	59	116.2 Å²	116.2	41%	0.413	60%	0.596	S	S	.	*			trans	-87.1	125.2	157	56	0	0	0	0	108.2	H281 Y285	H281-S283 VanDerWaalsContact ND1-CB 3.29Å; H281-S283 WeakPolarHBondContact ND1-CB 3.37Å; H281-S283 PolarHBondContact ND1-OG 2.88Å; H281-S283 PolarHBondContact O-N 3.41Å; S283-Y285 VanDerWaalsContact C-N 3.31Å; S283-Y285 PolarHBondContact O-N 2.87Å
284	S	28.1	Very low	41.9	Very low	89 Å²	89	108.9 Å²	108.9	62%	0.622	56%	0.557	S	S	*	*			trans	-69.5	83.9	177.8	55.9	0	0	0	0	112.2
285	Y	27.5	Very low	44.5	Very low	227 Å²	227	110.2 Å²	110.2	89%	0.89	55%	0.554	S	S	*	*			trans	-87.3	23.2	147	-94	-78.2	0	0	0	111.2	S283	S283-Y285 VanDerWaalsContact C-N 3.31Å; S283-Y285 PolarHBondContact O-N 2.87Å
286	V	30.9	Very low	47.4	Very low	91 Å²	91	104.9 Å²	104.9	55%	0.552	52%	0.517	S	S	*	.	S	Bend	trans	-116.4	114.9	174.9	-169.7	0	0	0	0	106.9	H288	V286-H288 HydrophobicContact CG1-CB 4.11Å; V286-H288 PolarHBondContact O-N 3.43Å
287	N	32.6	Very low	50.1	Low	138 Å²	138	101.3 Å²	101.3	74%	0.738	50%	0.499	S	S	*	.	S	Bend	trans	-70.3	19.5	178.5	-70.7	-29.6	0	0	0	113.7
288	H	35.4	Very low	52.9	Low	123 Å²	123	96.5 Å²	96.5	57%	0.569	47%	0.467	S	S	*	.			trans	-140.4	71.5	-172.2	-51.2	-63.4	0	0	0	109.3	V286 R290	V286-H288 HydrophobicContact CG1-CB 4.11Å; V286-H288 PolarHBondContact O-N 3.43Å; H288-R290 PolarHBondContact O-N 2.55Å
289	V	49.3	Very low	55.5	Low	61 Å²	61	90.7 Å²	90.7	37%	0.37	44%	0.441	S	S	.	.			trans	-78.1	103.2	166.8	179.1	0	0	0	0	107.1	L291	V289-L291 HydrophobicContact CG1-CD2 3.94Å; V289-L291 HydrophobicContact CG1-CG 4.38Å; V289-L291 PolarHBondContact O-N 3.38Å
290	R	55.2	Low	58.1	Low	145 Å²	145	88.5 Å²	88.5	55%	0.547	44%	0.442	S	S	.	.			trans	-74.3	93.6	175.8	-78.6	-176.2	172.6	-179.5	-1.5	110.3	H288 H408 D410	H288-R290 PolarHBondContact O-N 2.55Å; R290-H408 HydrophobicContact CB-CB 4.42Å; R290-H408 HydrophobicContact CG-CB 4.36Å; R290-D410 WeakPolarHBondContact CG-OD1 3.29Å; R290-D410 IonicContact CZ-OD2 3.19Å; R290-D410 IonicContact NE-OD1 2.66Å; R290-D410 PolarHBondContact NE-OD1 3.35Å; R290-D410 IonicContact NE-OD2 3.15Å; R290-D410 IonicContact NH2-OD2 2.83Å; R290-D410 PolarHBondContact NH2-OD2 3.34Å
291	L	65.3	Low	61.1	Low	27 Å²	27	81.4 Å²	81.4	14%	0.141	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	143.9	173.2	-62.9	173.5	0	0	0	109.6	V289 L306 W374 F413	V289-L291 HydrophobicContact CG1-CD2 3.94Å; V289-L291 HydrophobicContact CG1-CG 4.38Å; V289-L291 PolarHBondContact O-N 3.38Å; L291-L306 HydrophobicContact CB-CD1 3.87Å; L291-L306 HydrophobicContact CD2-CD1 4.29Å; L291-L306 HydrophobicContact CG-CD1 4.46Å; L291-W374 HydrophobicContact CD1-CH2 4.38Å; L291-W374 HydrophobicContact CD1-CZ2 3.48Å; L291-W374 VanDerWaalsContact CD1-CZ2 3.48Å; L291-F413 HydrophobicContact CD1-CD2 4.3Å; L291-F413 HydrophobicContact CD1-CE2 4.22Å
292	I	78.1	Confident	64.3	Low	31 Å²	31	79.5 Å²	79.5	16%	0.159	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	108.7	-177.4	-59.5	168.5	0	0	0	107.2	L307 M392 L406	I292-L307 HydrophobicContact CG2-CB 4.14Å; I292-L307 HydrophobicContact CG2-CD1 4.19Å; I292-L307 PolarHBondContact O-N 2.67Å; I292-M392 HydrophobicContact CD1-CE 3.67Å; I292-M392 HydrophobicContact CD1-SD 3.54Å; I292-M392 VanDerWaalsContact CD1-SD 3.54Å; I292-M392 HydrophobicContact CG1-CE 4.16Å; I292-M392 HydrophobicContact CG1-SD 4.35Å; I292-L406 HydrophobicContact CG2-CB 4.25Å; I292-L406 HydrophobicContact CG2-CD1 3.84Å; I292-L406 HydrophobicContact CG2-CD2 3.55Å; I292-L406 HydrophobicContact CG2-CG 4.07Å
293	T	86.4	Confident	67.4	Low	0 Å²	0	71.5 Å²	71.5	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	155.2	-179.5	62.5	0	0	0	0	111.8	E304 I305 L306 W374 H407 T409	T293-E304 VanDerWaalsContact CB-OE1 3.28Å; T293-E304 WeakPolarHBondContact CB-OE1 3.24Å; T293-E304 HydrophobicContact CG2-CG 3.91Å; T293-E304 PolarHBondContact OG1-OE1 3.33Å; T293-I305 CarbonylContact C-O 3.38Å; T293-I305 VanDerWaalsContact CA-O 3.22Å; T293-I305 WeakPolarHBondContact CA-O 3.21Å; T293-L306 HydrophobicContact CG2-CD1 4.42Å; T293-W374 HydrophobicContact CG2-CH2 3.78Å; T293-W374 HydrophobicContact CG2-CZ3 3.73Å; T293-H407 PolarHBondContact N-O 2.93Å; T293-H407 PolarHBondContact O-N 2.96Å; T293-H407 WeakPolarHBondContact OG1-CB 3.26Å; T293-T409 PolarHBondContact OG1-OG1 3.08Å
294	I	89	Confident	70.3	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	154.3	168.8	58.5	172.3	0	0	0	109.6	I305 L307 I357 L378 F399 I404 L406	I294-I305 HydrophobicContact CG1-CB 4.1Å; I294-I305 PolarHBondContact N-O 2.92Å; I294-I305 PolarHBondContact O-N 2.79Å; I294-L307 HydrophobicContact CD1-CD1 4.32Å; I294-L307 HydrophobicContact CD1-CD2 3.77Å; I294-L307 HydrophobicContact CD1-CG 4.23Å; I294-L307 HydrophobicContact CG1-CD1 4.47Å; I294-L307 HydrophobicContact CG1-CD2 4.12Å; I294-L307 HydrophobicContact CG1-CG 4.17Å; I294-L307 HydrophobicContact CG2-CD1 3.82Å; I294-L307 HydrophobicContact CG2-CG 4.31Å; I294-I357 HydrophobicContact CD1-CD1 3.89Å; I294-I357 HydrophobicContact CD1-CG2 3.95Å; I294-L378 HydrophobicContact CD1-CD1 4.21Å; I294-F399 HydrophobicContact CD1-CE2 4.09Å; I294-F399 HydrophobicContact CD1-CZ 4.01Å; I294-I404 HydrophobicContact CB-CG2 4.23Å; I294-I404 HydrophobicContact CG2-CG2 3.87Å; I294-L406 HydrophobicContact CG2-CD2 3.9Å
295	K	90.9	Very high	73.3	Confident	138 Å²	138	68 Å²	68	60%	0.6	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	131.5	172.3	-64.2	-170.7	179.5	-166.8	0	110.2
296	G	91.4	Very high	76.3	Confident	7 Å²	7	57.5 Å²	57.5	7%	0.072	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	-176	170.9	0	0	0	0	0	111.4	D302 I303 T356	G296-D302 WeakPolarHBondContact O-CA 3.4Å; G296-I303 PolarHBondContact N-O 3.18Å; G296-I303 PolarHBondContact O-N 3.27Å; G296-T356 CarbonylContact C-O 3.5Å; G296-T356 WeakPolarHBondContact CA-O 3.42Å
297	R	92.9	Very high	78.9	Confident	108 Å²	108	53.4 Å²	53.4	41%	0.408	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	134.9	-178.7	171.8	-178	-67.7	-165.3	-4.5	110.8	I301 D302 T356	R297-I301 CarbonylContact C-O 3.51Å; R297-I301 WeakPolarHBondContact CA-O 3.24Å; R297-D302 IonicContact CZ-OD1 2.71Å; R297-D302 IonicContact CZ-OD2 3.48Å; R297-D302 IonicContact NE-OD1 3.53Å; R297-D302 PolarHBondContact NE-OD1 3.13Å; R297-D302 VanDerWaalsContact NH2-CG 3.33Å; R297-D302 IonicContact NH2-OD1 3.22Å; R297-D302 PolarHBondContact NH2-OD1 3.29Å; R297-D302 IonicContact NH2-OD2 3.99Å; R297-D302 PolarHBondContact NH2-OD2 3.49Å; R297-T356 PolarHBondContact N-O 2.87Å; R297-T356 PolarHBondContact O-N 3.47Å
298	V	91.9	Very high	81.3	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	120.7	175.1	-179.1	0	0	0	0	108.3	G300 I301 I303 L324 L353 L355 M376	V298-G300 PolarHBondContact O-N 2.95Å; V298-I301 PolarHBondContact N-O 2.71Å; V298-I301 PolarHBondContact O-N 3.34Å; V298-I303 HydrophobicContact CG2-CD1 3.65Å; V298-I303 HydrophobicContact CG2-CG1 4.5Å; V298-L324 HydrophobicContact CB-CD2 4.39Å; V298-L324 HydrophobicContact CG1-CD1 4.1Å; V298-L324 HydrophobicContact CG1-CD2 3.87Å; V298-L353 HydrophobicContact CG1-CB 4.45Å; V298-L353 HydrophobicContact CG1-CD1 4.36Å; V298-L353 HydrophobicContact CG1-CD2 4.17Å; V298-L355 HydrophobicContact CG2-CD1 3.83Å; V298-M376 HydrophobicContact CG2-CE 3.81Å
299	Q	86.3	Confident	83.1	Confident	58 Å²	58	46 Å²	46	27%	0.271	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	46	37.2	-177.6	-55.4	-172.2	5	0	0	115.3	L324 H326	Q299-L324 HydrophobicContact CB-CD2 4.24Å; Q299-H326 PolarHBondContact OE1-CD2 3.15Å
300	G	84.1	Confident	84	Confident	52 Å²	52	43.3 Å²	43.3	54%	0.536	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	93	-14.3	-179.1	0	0	0	0	0	115.4	V298	V298-G300 PolarHBondContact O-N 2.95Å
301	I	89.8	Confident	84.8	Confident	30 Å²	30	36.4 Å²	36.4	15%	0.154	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	117.2	175.1	-51.3	-172.7	0	0	0	109.3	R297 V298 I303 R323 L324	R297-I301 CarbonylContact C-O 3.51Å; R297-I301 WeakPolarHBondContact CA-O 3.24Å; V298-I301 PolarHBondContact N-O 2.71Å; V298-I301 PolarHBondContact O-N 3.34Å; I301-I303 HydrophobicContact CG2-CG2 4.03Å; I301-R323 HydrophobicContact CD1-CB 3.82Å; I301-R323 WeakPolarHBondContact CD1-O 3.3Å; I301-L324 HydrophobicContact CD1-CD2 3.93Å; I301-L324 HydrophobicContact CG1-CD2 4.46Å
302	D	91.4	Very high	85.3	Confident	106 Å²	106	37 Å²	37	57%	0.567	20%	0.199	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	131.8	169.6	-68.3	-32.7	0	0	0	110	G296 R297	G296-D302 WeakPolarHBondContact O-CA 3.4Å; R297-D302 IonicContact CZ-OD1 2.71Å; R297-D302 IonicContact CZ-OD2 3.48Å; R297-D302 IonicContact NE-OD1 3.53Å; R297-D302 PolarHBondContact NE-OD1 3.13Å; R297-D302 VanDerWaalsContact NH2-CG 3.33Å; R297-D302 IonicContact NH2-OD1 3.22Å; R297-D302 PolarHBondContact NH2-OD1 3.29Å; R297-D302 IonicContact NH2-OD2 3.99Å; R297-D302 PolarHBondContact NH2-OD2 3.49Å
303	I	91.4	Very high	85.7	Confident	11 Å²	11	36.3 Å²	36.3	6%	0.056	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	148.9	-175.6	56.2	168.5	0	0	0	111.5	G296 V298 I301 I305 L320 M376	G296-I303 PolarHBondContact N-O 3.18Å; G296-I303 PolarHBondContact O-N 3.27Å; V298-I303 HydrophobicContact CG2-CD1 3.65Å; V298-I303 HydrophobicContact CG2-CG1 4.5Å; I301-I303 HydrophobicContact CG2-CG2 4.03Å; I303-I305 HydrophobicContact CD1-CD1 3.83Å; I303-I305 HydrophobicContact CD1-CG1 3.7Å; I303-I305 HydrophobicContact CG1-CD1 3.96Å; I303-I305 HydrophobicContact CG1-CG1 3.76Å; I303-L320 HydrophobicContact CD1-CD2 4.34Å; I303-L320 HydrophobicContact CG2-CD1 4.09Å; I303-L320 HydrophobicContact CG2-CD2 4.12Å; I303-M376 HydrophobicContact CD1-CB 4.03Å; I303-M376 HydrophobicContact CD1-CE 4.03Å; I303-M376 HydrophobicContact CD1-SD 3.75Å
304	E	89.1	Confident	86	Confident	75 Å²	75	36.3 Å²	36.3	35%	0.35	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	127.8	165.7	-173.6	170.6	-151.5	0	0	109	T293 W374 T409	T293-E304 VanDerWaalsContact CB-OE1 3.28Å; T293-E304 WeakPolarHBondContact CB-OE1 3.24Å; T293-E304 HydrophobicContact CG2-CG 3.91Å; T293-E304 PolarHBondContact OG1-OE1 3.33Å; E304-W374 HydrophobicContact CG-CZ3 4.37Å; E304-T409 PolarHBondContact OE1-OG1 3.38Å
305	I	91.1	Very high	86.1	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	126.9	-168.6	-55.1	173.5	0	0	0	108.8	T293 I294 I303 L355 M376 L378	T293-I305 CarbonylContact C-O 3.38Å; T293-I305 VanDerWaalsContact CA-O 3.22Å; T293-I305 WeakPolarHBondContact CA-O 3.21Å; I294-I305 HydrophobicContact CG1-CB 4.1Å; I294-I305 PolarHBondContact N-O 2.92Å; I294-I305 PolarHBondContact O-N 2.79Å; I303-I305 HydrophobicContact CD1-CD1 3.83Å; I303-I305 HydrophobicContact CD1-CG1 3.7Å; I303-I305 HydrophobicContact CG1-CD1 3.96Å; I303-I305 HydrophobicContact CG1-CG1 3.76Å; I305-L355 HydrophobicContact CD1-CD1 3.51Å; I305-L355 HydrophobicContact CD1-CD2 4.05Å; I305-L355 HydrophobicContact CD1-CG 4.4Å; I305-M376 HydrophobicContact CD1-SD 4.03Å; I305-M376 HydrophobicContact CG1-CB 4.39Å; I305-M376 HydrophobicContact CG1-SD 4.26Å; I305-M376 HydrophobicContact CG2-CB 4.32Å; I305-M376 HydrophobicContact CG2-CG 4.01Å; I305-M376 HydrophobicContact CG2-SD 4.31Å; I305-L378 HydrophobicContact CG2-CB 4.46Å; I305-L378 HydrophobicContact CG2-CD1 3.61Å; I305-L378 HydrophobicContact CG2-CG 3.54Å
306	L	89.1	Confident	86.3	Confident	7 Å²	7	29.7 Å²	29.7	4%	0.037	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	127.7	174.7	-175.8	69	0	0	0	110.5	L291 T293 E308 W374 M376 I377 L378	L291-L306 HydrophobicContact CB-CD1 3.87Å; L291-L306 HydrophobicContact CD2-CD1 4.29Å; L291-L306 HydrophobicContact CG-CD1 4.46Å; T293-L306 HydrophobicContact CG2-CD1 4.42Å; L306-E308 HydrophobicContact CD2-CB 3.98Å; L306-E308 HydrophobicContact CD2-CG 4.43Å; L306-E308 HydrophobicContact CG-CB 4.12Å; L306-W374 HydrophobicContact CB-CD2 3.86Å; L306-W374 HydrophobicContact CB-CE3 3.9Å; L306-W374 HydrophobicContact CB-CG 4.18Å; L306-W374 HydrophobicContact CB-CZ3 4.47Å; L306-W374 HydrophobicContact CD1-CZ2 4.41Å; L306-W374 HydrophobicContact CD2-CD2 4.22Å; L306-W374 HydrophobicContact CD2-CG 4.13Å; L306-W374 HydrophobicContact CG-CD2 4.47Å; L306-M376 PolarHBondContact N-O 3.02Å; L306-M376 VanDerWaalsContact N-O 3.15Å; L306-I377 HydrophobicContact CB-CG1 4.3Å; L306-I377 HydrophobicContact CD2-CD1 4.15Å; L306-I377 HydrophobicContact CD2-CG1 4.24Å; L306-I377 HydrophobicContact CD2-CG2 4.44Å; L306-L378 PolarHBondContact O-N 3.12Å
307	L	85.8	Confident	86.2	Confident	5 Å²	5	31.2 Å²	31.2	3%	0.026	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	98.2	166.1	-64.6	-173.9	0	0	0	109.1	I292 I294 L378 I390 A397 F399 L406	I292-L307 HydrophobicContact CG2-CB 4.14Å; I292-L307 HydrophobicContact CG2-CD1 4.19Å; I292-L307 PolarHBondContact O-N 2.67Å; I294-L307 HydrophobicContact CD1-CD1 4.32Å; I294-L307 HydrophobicContact CD1-CD2 3.77Å; I294-L307 HydrophobicContact CD1-CG 4.23Å; I294-L307 HydrophobicContact CG1-CD1 4.47Å; I294-L307 HydrophobicContact CG1-CD2 4.12Å; I294-L307 HydrophobicContact CG1-CG 4.17Å; I294-L307 HydrophobicContact CG2-CD1 3.82Å; I294-L307 HydrophobicContact CG2-CG 4.31Å; L307-L378 HydrophobicContact CD2-CB 3.98Å; L307-L378 HydrophobicContact CD2-CD1 3.82Å; L307-L378 HydrophobicContact CD2-CG 4.46Å; L307-I390 HydrophobicContact CB-CD1 4.36Å; L307-I390 HydrophobicContact CD1-CD1 4.25Å; L307-A397 HydrophobicContact CD1-CB 4.02Å; L307-F399 HydrophobicContact CD1-CZ 4.23Å; L307-F399 HydrophobicContact CD2-CZ 4.14Å; L307-L406 HydrophobicContact CD1-CD2 3.83Å
308	E	82.7	Confident	86.1	Confident	19 Å²	19	29 Å²	29	9%	0.089	17%	0.17	C	C	.	.			trans	-109.7	95.3	-172.5	-176.4	46.7	-120.3	0	0	111	L306 G310 A311 I377 L378	L306-E308 HydrophobicContact CD2-CB 3.98Å; L306-E308 HydrophobicContact CD2-CG 4.43Å; L306-E308 HydrophobicContact CG-CB 4.12Å; E308-G310 PolarHBondContact O-N 3.4Å; E308-G310 WeakPolarHBondContact OE1-CA 3.3Å; E308-G310 PolarHBondContact OE1-N 3.04Å; E308-A311 HydrophobicContact CB-CB 4.09Å; E308-A311 HydrophobicContact CG-CB 3.79Å; E308-A311 PolarHBondContact O-N 2.91Å; E308-I377 HydrophobicContact CB-CG2 3.48Å; E308-I377 VanDerWaalsContact CB-CG2 3.48Å; E308-I377 HydrophobicContact CG-CG2 4.31Å; E308-L378 PolarHBondContact N-O 2.85Å
309	T	73.3	Confident	85.9	Confident	86 Å²	86	34.5 Å²	34.5	53%	0.528	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-11.9	177.1	57.2	0	0	0	0	113.4	V380 M383 I390	T309-V380 WeakPolarHBondContact O-CG2 3.34Å; T309-M383 HydrophobicContact CG2-CE 3.98Å; T309-M383 HydrophobicContact CG2-SD 4.06Å; T309-I390 HydrophobicContact CG2-CD1 3.95Å
310	G	68.3	Low	86	Confident	5 Å²	5	31.8 Å²	31.8	5%	0.052	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-26.7	169.1	0	0	0	0	0	114.4	R182 E308 G420	R182-G310 VanDerWaalsContact CZ-O 3.3Å; R182-G310 PolarHBondContact NE-O 3.21Å; R182-G310 PolarHBondContact NH2-O 3.43Å; E308-G310 PolarHBondContact O-N 3.4Å; E308-G310 WeakPolarHBondContact OE1-CA 3.3Å; E308-G310 PolarHBondContact OE1-N 3.04Å; G310-G420 CarbonylContact O-C 3.55Å; G310-G420 WeakPolarHBondContact O-CA 3.47Å
311	A	72.6	Confident	86.1	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.161	C	C	.	.			trans	-85	128.5	-175.4	0	0	0	0	0	111.1	E308 I377 G379 V380 V419 I421	E308-A311 HydrophobicContact CB-CB 4.09Å; E308-A311 HydrophobicContact CG-CB 3.79Å; E308-A311 PolarHBondContact O-N 2.91Å; A311-I377 HydrophobicContact CB-CG2 4.32Å; A311-G379 CarbonylContact O-C 3.41Å; A311-G379 VanDerWaalsContact O-CA 3.3Å; A311-G379 WeakPolarHBondContact O-CA 3.49Å; A311-V380 WeakPolarHBondContact O-CG2 3.37Å; A311-V380 PolarHBondContact O-N 3.45Å; A311-V419 WeakPolarHBondContact CB-O 3.21Å; A311-I421 HydrophobicContact CB-CD1 4.5Å
312	S	75.8	Confident	85.8	Confident	38 Å²	38	32 Å²	32	27%	0.266	19%	0.19	S	C	.	.	S	Bend	trans	-81.6	-22	176.2	56.5	0	0	0	0	114.2	D381 I421	S312-D381 WeakPolarHBondContact O-CB 3.22Å; S312-D381 PolarHBondContact O-N 3.37Å; S312-I421 WeakPolarHBondContact CB-O 3.32Å; S312-I421 VanDerWaalsContact OG-CB 3.32Å; S312-I421 WeakPolarHBondContact OG-CB 3.47Å; S312-I421 VanDerWaalsContact OG-CG2 3.24Å; S312-I421 WeakPolarHBondContact OG-CG2 3.45Å; S312-I421 PolarHBondContact OG-O 3.3Å
313	A	85.9	Confident	85.5	Confident	17 Å²	17	33.2 Å²	33.2	14%	0.14	19%	0.186	C	C	.	.	S	Bend	trans	-128.1	149.1	178.9	0	0	0	0	0	111.7	L367 I421	A313-L367 HydrophobicContact CB-CD1 3.94Å; A313-I421 HydrophobicContact CB-CD1 4.22Å
314	S	92.5	Very high	85.2	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.188	C	C	.	.			trans	-82.3	134.5	177.8	-65.3	0	0	0	0	111.2	F366 L367 I377 G379 D381 F382	S314-F366 WeakPolarHBondContact O-CA 3.46Å; S314-L367 PolarHBondContact O-N 3Å; S314-I377 CarbonylContact C-O 3.55Å; S314-I377 VanDerWaalsContact CA-O 3.3Å; S314-I377 WeakPolarHBondContact CA-O 3.36Å; S314-G379 PolarHBondContact OG-N 2.89Å; S314-D381 WeakPolarHBondContact CB-OD1 3.43Å; S314-D381 WeakPolarHBondContact CB-OD2 3.48Å; S314-D381 PolarHBondContact N-OD1 3.47Å; S314-D381 PolarHBondContact N-OD2 3.01Å; S314-D381 PolarHBondContact OG-OD1 3.12Å; S314-D381 PolarHBondContact OG-OD2 3.24Å; S314-F382 WeakPolarHBondContact OG-CB 3.35Å
315	L	92.8	Very high	84.2	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	149.3	-169	-54.4	-176.9	0	0	0	111.7	L337 L345 L367 L372 M376 I377 V419 I421	L315-L337 HydrophobicContact CD2-CD1 3.99Å; L315-L345 HydrophobicContact CD1-CD2 3.79Å; L315-L367 WeakPolarHBondContact CA-O 3.46Å; L315-L367 HydrophobicContact CD2-CB 3.78Å; L315-L367 HydrophobicContact CD2-CD1 4.46Å; L315-L372 HydrophobicContact CB-CD1 4.28Å; L315-L372 HydrophobicContact CB-CD2 3.61Å; L315-L372 HydrophobicContact CD1-CD1 3.59Å; L315-L372 HydrophobicContact CD1-CD2 4.44Å; L315-M376 WeakPolarHBondContact O-CA 3.45Å; L315-I377 HydrophobicContact CB-CB 4.29Å; L315-I377 HydrophobicContact CD1-CD1 4.47Å; L315-I377 PolarHBondContact N-O 3.33Å; L315-I377 PolarHBondContact O-N 2.98Å; L315-V419 HydrophobicContact CD1-CG1 3.67Å; L315-I421 HydrophobicContact CD1-CD1 3.8Å; L315-I421 HydrophobicContact CD2-CD1 3.77Å; L315-I421 HydrophobicContact CG-CD1 3.93Å
316	I	93.3	Very high	82.9	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	140.6	170	-169.3	168.2	0	0	0	110.9	L320 L321 V351 L353 F366 L367 V368 C369 M376	I316-L320 HydrophobicContact CD1-CB 4.5Å; I316-L320 HydrophobicContact CD1-CD2 3.89Å; I316-L320 HydrophobicContact CD1-CG 4.26Å; I316-L320 HydrophobicContact CG1-CB 4.3Å; I316-L320 HydrophobicContact CG1-CD2 4Å; I316-L320 HydrophobicContact CG1-CG 4.48Å; I316-L321 HydrophobicContact CD1-CD2 3.75Å; I316-L321 HydrophobicContact CD1-CG 4.08Å; I316-L321 HydrophobicContact CG1-CG 4.48Å; I316-L321 HydrophobicContact CG2-CD1 4.23Å; I316-L321 HydrophobicContact CG2-CD2 4.49Å; I316-L321 HydrophobicContact CG2-CG 4.28Å; I316-V351 HydrophobicContact CG2-CG1 3.98Å; I316-L353 HydrophobicContact CD1-CD1 3.38Å; I316-F366 HydrophobicContact CB-CB 4.17Å; I316-F366 HydrophobicContact CB-CD1 4.49Å; I316-F366 HydrophobicContact CG2-CB 3.84Å; I316-L367 PolarHBondContact N-O 3.13Å; I316-V368 HydrophobicContact CG2-CB 4.47Å; I316-V368 HydrophobicContact CG2-CG2 3.96Å; I316-C369 PolarHBondContact O-N 2.73Å; I316-M376 HydrophobicContact CD1-CE 3.93Å; I316-M376 HydrophobicContact CG1-CE 4.37Å
317	K	91.2	Very high	81.9	Confident	38 Å²	38	51.6 Å²	51.6	17%	0.165	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	133.3	174.5	-163.6	-179.8	-172.6	-161.2	0	109.9	E319 L320 L321 C369 L372 D375	K317-E319 HydrophobicContact CD-CB 4.21Å; K317-E319 VanDerWaalsContact CE-OE1 3.3Å; K317-E319 WeakPolarHBondContact CE-OE1 3.2Å; K317-E319 WeakPolarHBondContact CE-OE2 3.29Å; K317-E319 HydrophobicContact CG-CB 4.28Å; K317-E319 IonicContact NZ-OE1 3.91Å; K317-E319 PolarHBondContact NZ-OE1 2.86Å; K317-E319 VanDerWaalsContact NZ-OE1 3.15Å; K317-E319 IonicContact NZ-OE2 3.75Å; K317-E319 PolarHBondContact NZ-OE2 3.29Å; K317-E319 PolarHBondContact O-N 3.24Å; K317-L320 PolarHBondContact O-N 3.35Å; K317-L321 PolarHBondContact O-N 2.68Å; K317-C369 WeakPolarHBondContact CA-O 3.28Å; K317-L372 HydrophobicContact CB-CB 4.18Å; K317-L372 HydrophobicContact CB-CD2 4.48Å; K317-L372 WeakPolarHBondContact CD-O 3.5Å; K317-L372 WeakPolarHBondContact CE-O 3.34Å; K317-L372 HydrophobicContact CG-CB 4.18Å; K317-D375 PolarHBondContact N-O 2.85Å
318	N	89.8	Confident	81.3	Confident	62 Å²	62	52.9 Å²	52.9	33%	0.332	28%	0.284	S	S	.	.	H	α-helix	trans	-56.9	-33.6	178.8	-168.6	96.7	0	0	0	112.9	L321 G322 V368 C369 P370	N318-L321 PolarHBondContact O-N 3.36Å; N318-G322 PolarHBondContact O-N 3Å; N318-V368 HydrophobicContact CB-CG1 4Å; N318-V368 WeakPolarHBondContact OD1-CG1 3.49Å; N318-C369 PolarHBondContact N-O 2.88Å; N318-C369 VanDerWaalsContact N-O 3.1Å; N318-P370 HydrophobicContact CB-CB 4.18Å
319	E	87.8	Confident	81	Confident	116 Å²	116	60.5 Å²	60.5	54%	0.542	32%	0.319	S	S	.	.	H	α-helix	trans	-65.2	-34.3	175.7	-69.3	168.9	-147.6	0	0	113.3	K317 L321 G322	K317-E319 HydrophobicContact CD-CB 4.21Å; K317-E319 VanDerWaalsContact CE-OE1 3.3Å; K317-E319 WeakPolarHBondContact CE-OE1 3.2Å; K317-E319 WeakPolarHBondContact CE-OE2 3.29Å; K317-E319 HydrophobicContact CG-CB 4.28Å; K317-E319 IonicContact NZ-OE1 3.91Å; K317-E319 PolarHBondContact NZ-OE1 2.86Å; K317-E319 VanDerWaalsContact NZ-OE1 3.15Å; K317-E319 IonicContact NZ-OE2 3.75Å; K317-E319 PolarHBondContact NZ-OE2 3.29Å; K317-E319 PolarHBondContact O-N 3.24Å; E319-L321 VanDerWaalsContact C-N 3.35Å; E319-G322 PolarHBondContact O-N 2.78Å
320	L	88.2	Confident	81.6	Confident	1 Å²	1	61 Å²	61	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-67.3	-38.5	177.4	179.9	62.3	0	0	0	110.8	I303 I316 K317 G322 R323 D375	I303-L320 HydrophobicContact CD1-CD2 4.34Å; I303-L320 HydrophobicContact CG2-CD1 4.09Å; I303-L320 HydrophobicContact CG2-CD2 4.12Å; I316-L320 HydrophobicContact CD1-CB 4.5Å; I316-L320 HydrophobicContact CD1-CD2 3.89Å; I316-L320 HydrophobicContact CD1-CG 4.26Å; I316-L320 HydrophobicContact CG1-CB 4.3Å; I316-L320 HydrophobicContact CG1-CD2 4Å; I316-L320 HydrophobicContact CG1-CG 4.48Å; K317-L320 PolarHBondContact O-N 3.35Å; L320-G322 VanDerWaalsContact C-N 3.29Å; L320-G322 PolarHBondContact O-N 2.9Å; L320-R323 WeakPolarHBondContact O-CB 3.24Å; L320-R323 PolarHBondContact O-N 3.05Å; L320-R323 VanDerWaalsContact O-N 3.09Å; L320-D375 HydrophobicContact CD2-CB 4.1Å
321	L	86.7	Confident	82.3	Confident	14 Å²	14	65 Å²	65	7%	0.073	34%	0.34	C	S	.	.	H	α-helix	trans	-60.1	-38.7	174.9	-72.2	179.3	0	0	0	112.7	I316 K317 N318 E319 R323 L324 V351 L353 V368	I316-L321 HydrophobicContact CD1-CD2 3.75Å; I316-L321 HydrophobicContact CD1-CG 4.08Å; I316-L321 HydrophobicContact CG1-CG 4.48Å; I316-L321 HydrophobicContact CG2-CD1 4.23Å; I316-L321 HydrophobicContact CG2-CD2 4.49Å; I316-L321 HydrophobicContact CG2-CG 4.28Å; K317-L321 PolarHBondContact O-N 2.68Å; N318-L321 PolarHBondContact O-N 3.36Å; E319-L321 VanDerWaalsContact C-N 3.35Å; L321-R323 PolarHBondContact O-N 3.38Å; L321-R323 VanDerWaalsContact O-N 3.15Å; L321-L324 HydrophobicContact CD2-CD1 3.67Å; L321-L324 WeakPolarHBondContact O-CB 3.27Å; L321-L324 PolarHBondContact O-N 3.15Å; L321-L324 VanDerWaalsContact O-N 3.13Å; L321-V351 HydrophobicContact CD1-CG1 4.33Å; L321-V351 HydrophobicContact CD2-CG1 4.23Å; L321-V351 HydrophobicContact CD2-CG2 4.36Å; L321-L353 HydrophobicContact CD2-CD1 4.14Å; L321-L353 HydrophobicContact CD2-CD2 4.46Å; L321-V368 HydrophobicContact CD1-CB 4.19Å; L321-V368 HydrophobicContact CD1-CG1 3.56Å; L321-V368 HydrophobicContact CD1-CG2 3.52Å
322	G	83.3	Confident	82.9	Confident	73 Å²	73	75.5 Å²	75.5	75%	0.753	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-10.9	176.9	0	0	0	0	0	114.6	N318 E319 L320	N318-G322 PolarHBondContact O-N 3Å; E319-G322 PolarHBondContact O-N 2.78Å; L320-G322 VanDerWaalsContact C-N 3.29Å; L320-G322 PolarHBondContact O-N 2.9Å
323	R	85.4	Confident	82.9	Confident	131 Å²	131	78.7 Å²	78.7	49%	0.494	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-11.7	175.7	-65.7	162.3	57.7	-159.1	-3.3	113	I301 L320 L321 D375	I301-R323 HydrophobicContact CD1-CB 3.82Å; I301-R323 WeakPolarHBondContact CD1-O 3.3Å; L320-R323 WeakPolarHBondContact O-CB 3.24Å; L320-R323 PolarHBondContact O-N 3.05Å; L320-R323 VanDerWaalsContact O-N 3.09Å; L321-R323 PolarHBondContact O-N 3.38Å; L321-R323 VanDerWaalsContact O-N 3.15Å; R323-D375 IonicContact NH1-OD2 3.5Å; R323-D375 PolarHBondContact NH1-OD2 3.28Å
324	L	84.9	Confident	82.5	Confident	17 Å²	17	82.7 Å²	82.7	9%	0.089	41%	0.411	C	S	.	.			trans	-75.1	140.7	-177	-61.6	-176.3	0	0	0	111.2	V298 Q299 I301 L321 H326 V328 L353	V298-L324 HydrophobicContact CB-CD2 4.39Å; V298-L324 HydrophobicContact CG1-CD1 4.1Å; V298-L324 HydrophobicContact CG1-CD2 3.87Å; Q299-L324 HydrophobicContact CB-CD2 4.24Å; I301-L324 HydrophobicContact CD1-CD2 3.93Å; I301-L324 HydrophobicContact CG1-CD2 4.46Å; L321-L324 HydrophobicContact CD2-CD1 3.67Å; L321-L324 WeakPolarHBondContact O-CB 3.27Å; L321-L324 PolarHBondContact O-N 3.15Å; L321-L324 VanDerWaalsContact O-N 3.13Å; L324-H326 VanDerWaalsContact C-N 3.29Å; L324-H326 PolarHBondContact O-N 3.4Å; L324-V328 HydrophobicContact CB-CG2 4.41Å; L324-V328 HydrophobicContact CD1-CG2 3.95Å; L324-L353 HydrophobicContact CD1-CD2 3.8Å
325	N	67.7	Low	82	Confident	130 Å²	130	83.8 Å²	83.8	70%	0.695	42%	0.418	S	S	*	.	S	Bend	trans	-73.1	-15.7	-171.1	-69.3	-41.3	0	0	0	114.6
326	H	64.6	Low	81.4	Confident	132 Å²	132	87.2 Å²	87.2	61%	0.611	44%	0.439	S	S	*	.	S	Bend	trans	-114.7	146.2	-177.3	-62.7	-68.1	0	0	0	111.5	Q299 L324 V328	Q299-H326 PolarHBondContact OE1-CD2 3.15Å; L324-H326 VanDerWaalsContact C-N 3.29Å; L324-H326 PolarHBondContact O-N 3.4Å; H326-V328 VanDerWaalsContact C-N 3.27Å; H326-V328 VanDerWaalsContact O-CG2 3.29Å; H326-V328 WeakPolarHBondContact O-CG2 3.17Å; H326-V328 PolarHBondContact O-N 3.43Å
327	E	66.8	Low	80.6	Confident	199 Å²	199	87.8 Å²	87.8	93%	0.93	44%	0.442	S	S	*	.			trans	-61.8	89.2	165.6	-69.5	-169.8	159.3	0	0	109.8	Q329	E327-Q329 PolarHBondContact O-N 2.87Å
328	V	74.2	Confident	79.8	Confident	32 Å²	32	89.1 Å²	89.1	19%	0.194	45%	0.451	C	S	.	.			trans	-73	121.3	178.9	-156.3	0	0	0	0	108.5	L324 H326 Q330 V351 L353	L324-V328 HydrophobicContact CB-CG2 4.41Å; L324-V328 HydrophobicContact CD1-CG2 3.95Å; H326-V328 VanDerWaalsContact C-N 3.27Å; H326-V328 VanDerWaalsContact O-CG2 3.29Å; H326-V328 WeakPolarHBondContact O-CG2 3.17Å; H326-V328 PolarHBondContact O-N 3.43Å; V328-Q330 PolarHBondContact O-N 3.35Å; V328-V351 HydrophobicContact CB-CG2 3.89Å; V328-V351 HydrophobicContact CG1-CG2 3.28Å; V328-L353 HydrophobicContact CG1-CD2 3.8Å; V328-L353 HydrophobicContact CG2-CD2 4.22Å
329	Q	77	Confident	78.7	Confident	179 Å²	179	86.5 Å²	86.5	84%	0.836	44%	0.437	S	S	*	.			trans	-62.2	108.8	178.9	-69.1	-175.6	-3.7	0	0	110.3	E327	E327-Q329 PolarHBondContact O-N 2.87Å
330	Q	84.3	Confident	77.2	Confident	96 Å²	96	81.9 Å²	81.9	45%	0.449	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	124.2	177	-68.6	-176.9	48.1	0	0	109.9	V328 S349 V351	V328-Q330 PolarHBondContact O-N 3.35Å; Q330-S349 PolarHBondContact OE1-OG 3.09Å; Q330-V351 HydrophobicContact CG-CB 4.36Å; Q330-V351 HydrophobicContact CG-CG2 4.23Å
331	T	84.5	Confident	75.5	Confident	91 Å²	91	85.2 Å²	85.2	56%	0.558	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.7	123.6	167.9	-54.9	0	0	0	0	108.3	Y333 S349 K350	T331-Y333 PolarHBondContact O-N 2.81Å; T331-Y333 VanDerWaalsContact O-N 3.14Å; T331-S349 CarbonylContact O-C 3.59Å; T331-S349 WeakPolarHBondContact O-CA 3.24Å; T331-S349 VanDerWaalsContact O-CB 3.25Å; T331-S349 WeakPolarHBondContact O-CB 3.47Å; T331-K350 PolarHBondContact N-O 2.61Å; T331-K350 PolarHBondContact O-N 3.2Å
332	R	84.7	Confident	73.9	Confident	219 Å²	219	86.8 Å²	86.8	83%	0.826	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.7	117.9	176.9	-167.3	-177.1	-177.9	-177	1.5	109.1
333	Y	76.6	Confident	73.2	Confident	106 Å²	106	86.8 Å²	86.8	42%	0.416	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	72.3	-172.2	-163.4	-91.4	0	0	0	108.6	T331 S335 V347 N348 K350 L367	T331-Y333 PolarHBondContact O-N 2.81Å; T331-Y333 VanDerWaalsContact O-N 3.14Å; Y333-S335 WeakPolarHBondContact CD1-OG 3.36Å; Y333-S335 WeakPolarHBondContact CE1-OG 3.42Å; Y333-S335 PolarHBondContact O-N 2.94Å; Y333-S335 VanDerWaalsContact O-N 3.13Å; Y333-V347 HydrophobicContact CD1-CG1 4.2Å; Y333-N348 CarbonylContact C-O 3.38Å; Y333-N348 PolarHBondContact N-O 3.08Å; Y333-N348 VanDerWaalsContact N-O 3.11Å; Y333-N348 CarbonylContact O-C 3.58Å; Y333-K350 HydrophobicContact CG-CB 4.4Å; Y333-L367 HydrophobicContact CD1-CD2 4.12Å; Y333-L367 HydrophobicContact CE1-CD2 4.21Å
334	P	77.5	Confident	72.7	Confident	101 Å²	101	85.3 Å²	85.3	66%	0.656	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	101.6	-178.5	31.4	-29.9	0	0	0	108.7
335	S	79.9	Confident	72.4	Confident	22 Å²	22	85 Å²	85	15%	0.154	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	161.7	177.2	67.6	0	0	0	0	111.2	Y333 V347	Y333-S335 WeakPolarHBondContact CD1-OG 3.36Å; Y333-S335 WeakPolarHBondContact CE1-OG 3.42Å; Y333-S335 PolarHBondContact O-N 2.94Å; Y333-S335 VanDerWaalsContact O-N 3.13Å; S335-V347 PolarHBondContact N-O 3.4Å; S335-V347 WeakPolarHBondContact O-CB 3.3Å; S335-V347 PolarHBondContact O-N 2.79Å
336	T	80.9	Confident	73.3	Confident	73 Å²	73	84.9 Å²	84.9	45%	0.448	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	125.8	172.1	-56.8	0	0	0	0	107.9	P344	T336-P344 HydrophobicContact CG2-CB 3.48Å; T336-P344 VanDerWaalsContact CG2-CB 3.48Å
337	L	77.1	Confident	74.5	Confident	12 Å²	12	78.7 Å²	78.7	6%	0.063	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	155.3	170.7	-57.5	177.9	0	0	0	108.8	L315 P344 L345 V347 L367 I421	L315-L337 HydrophobicContact CD2-CD1 3.99Å; L337-P344 CarbonylContact O-C 3.56Å; L337-P344 WeakPolarHBondContact O-CA 3.38Å; L337-L345 HydrophobicContact CB-CB 4.4Å; L337-L345 PolarHBondContact N-O 2.92Å; L337-L345 PolarHBondContact O-N 2.85Å; L337-V347 HydrophobicContact CD1-CG2 3.52Å; L337-V347 HydrophobicContact CD2-CG2 4.46Å; L337-V347 HydrophobicContact CG-CG2 3.63Å; L337-L367 HydrophobicContact CD1-CD1 3.85Å; L337-L367 HydrophobicContact CD2-CD1 4.3Å; L337-I421 HydrophobicContact CB-CG1 4.25Å; L337-I421 HydrophobicContact CB-CG2 3.96Å; L337-I421 HydrophobicContact CD1-CD1 3.65Å; L337-I421 HydrophobicContact CD1-CG1 4.03Å; L337-I421 HydrophobicContact CD1-CG2 4.12Å; L337-I421 HydrophobicContact CD2-CG2 3.9Å; L337-I421 HydrophobicContact CG-CG2 4.2Å
338	L	73.3	Confident	75.4	Confident	65 Å²	65	71.6 Å²	71.6	34%	0.34	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125	173.8	-63.4	175.9	0	0	0	110.1	I421 S422	L338-I421 CarbonylContact O-C 3.6Å; L338-I421 WeakPolarHBondContact O-CA 3.12Å; L338-S422 PolarHBondContact O-N 3.29Å
339	T	66.5	Low	76.2	Confident	8 Å²	8	70.3 Å²	70.3	5%	0.049	38%	0.376	C	S	.	.			trans	-68.7	174.6	173.8	67.7	0	0	0	0	111.6	S341 G342 D343 L345 Y418 G420	T339-S341 PolarHBondContact O-N 2.68Å; T339-S341 PolarHBondContact OG1-OG 2.64Å; T339-G342 PolarHBondContact O-N 2.91Å; T339-G342 PolarHBondContact OG1-N 3.03Å; T339-D343 HydrophobicContact CG2-CB 4.31Å; T339-D343 WeakPolarHBondContact CG2-O 3.04Å; T339-D343 PolarHBondContact N-O 3.46Å; T339-D343 WeakPolarHBondContact OG1-CB 3.49Å; T339-D343 PolarHBondContact OG1-N 2.88Å; T339-D343 PolarHBondContact OG1-O 3.45Å; T339-D343 PolarHBondContact OG1-OD2 3.13Å; T339-L345 HydrophobicContact CG2-CB 4.14Å; T339-Y418 WeakPolarHBondContact CB-O 3.24Å; T339-G420 CarbonylContact C-O 3.56Å; T339-G420 VanDerWaalsContact C-O 3.26Å
340	A	56.4	Low	77	Confident	19 Å²	19	65.2 Å²	65.2	16%	0.157	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-22.3	179.5	0	0	0	0	0	113.3	R178 G342 Y418 G420	R178-A340 PolarHBondContact NH1-O 3.02Å; A340-G342 VanDerWaalsContact C-N 3.34Å; A340-Y418 WeakPolarHBondContact CB-O 3.36Å; A340-Y418 PolarHBondContact N-O 2.79Å; A340-G420 PolarHBondContact N-O 3.29Å
341	S	53.6	Low	77.3	Confident	70 Å²	70	60.6 Å²	60.6	49%	0.49	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-8.8	171.2	37.1	0	0	0	0	113.1	T339 D343 S417	T339-S341 PolarHBondContact O-N 2.68Å; T339-S341 PolarHBondContact OG1-OG 2.64Å; S341-D343 WeakPolarHBondContact CB-OD2 3.26Å; S341-D343 PolarHBondContact OG-OD2 3.02Å; S341-S417 WeakPolarHBondContact OG-CB 3.44Å
342	G	53.5	Low	77.7	Confident	47 Å²	47	62.2 Å²	62.2	49%	0.485	33%	0.325	S	S	.	.	S	Bend	trans	88.2	4.9	-176.5	0	0	0	0	0	114.4	T339 A340	T339-G342 PolarHBondContact O-N 2.91Å; T339-G342 PolarHBondContact OG1-N 3.03Å; A340-G342 VanDerWaalsContact C-N 3.34Å
343	D	68.7	Low	78.1	Confident	74 Å²	74	52 Å²	52	40%	0.396	29%	0.287	S	S	.	.			trans	-72.1	142.7	178	-52	-60.5	0	0	0	110.7	T339 S341 L345 S417	T339-D343 HydrophobicContact CG2-CB 4.31Å; T339-D343 WeakPolarHBondContact CG2-O 3.04Å; T339-D343 PolarHBondContact N-O 3.46Å; T339-D343 WeakPolarHBondContact OG1-CB 3.49Å; T339-D343 PolarHBondContact OG1-N 2.88Å; T339-D343 PolarHBondContact OG1-O 3.45Å; T339-D343 PolarHBondContact OG1-OD2 3.13Å; S341-D343 WeakPolarHBondContact CB-OD2 3.26Å; S341-D343 PolarHBondContact OG-OD2 3.02Å; D343-L345 PolarHBondContact O-N 3.45Å; D343-S417 WeakPolarHBondContact OD2-CB 3.46Å
344	P	74.6	Confident	78.9	Confident	99 Å²	99	50.3 Å²	50.3	64%	0.643	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	122.6	175.5	29.2	-33.4	0	0	0	111.5	T336 L337	T336-P344 HydrophobicContact CG2-CB 3.48Å; T336-P344 VanDerWaalsContact CG2-CB 3.48Å; L337-P344 CarbonylContact O-C 3.56Å; L337-P344 WeakPolarHBondContact O-CA 3.38Å
345	L	78.2	Confident	79.6	Confident	11 Å²	11	45.5 Å²	45.5	6%	0.058	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	115.4	169.7	-177	65.2	0	0	0	109.9	L315 L337 T339 D343 C369 T371 L372 V419	L315-L345 HydrophobicContact CD1-CD2 3.79Å; L337-L345 HydrophobicContact CB-CB 4.4Å; L337-L345 PolarHBondContact N-O 2.92Å; L337-L345 PolarHBondContact O-N 2.85Å; T339-L345 HydrophobicContact CG2-CB 4.14Å; D343-L345 PolarHBondContact O-N 3.45Å; L345-C369 HydrophobicContact CD1-CB 4.46Å; L345-T371 WeakPolarHBondContact CD1-OG1 3.42Å; L345-L372 HydrophobicContact CD2-CD1 4.38Å; L345-V419 HydrophobicContact CD2-CG1 3.57Å
346	K	87.4	Confident	80.2	Confident	128 Å²	128	46.5 Å²	46.5	56%	0.557	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	134.3	-178.9	-175.8	-179.7	178.6	-176.4	0	111.6	N348 P370	K346-N348 WeakPolarHBondContact CE-OD1 3.3Å; K346-P370 VanDerWaalsContact O-CD 3.31Å; K346-P370 WeakPolarHBondContact O-CD 3.36Å
347	V	88	Confident	80.7	Confident	1 Å²	1	43 Å²	43	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	135.4	168.2	-178.5	0	0	0	0	108.9	Y333 S335 L337 S349 L367 V368	Y333-V347 HydrophobicContact CD1-CG1 4.2Å; S335-V347 PolarHBondContact N-O 3.4Å; S335-V347 WeakPolarHBondContact O-CB 3.3Å; S335-V347 PolarHBondContact O-N 2.79Å; L337-V347 HydrophobicContact CD1-CG2 3.52Å; L337-V347 HydrophobicContact CD2-CG2 4.46Å; L337-V347 HydrophobicContact CG-CG2 3.63Å; V347-S349 WeakPolarHBondContact CG1-O 3.35Å; V347-L367 HydrophobicContact CG1-CB 3.92Å; V347-L367 HydrophobicContact CG1-CD2 4.32Å; V347-L367 HydrophobicContact CG2-CB 4.25Å; V347-L367 HydrophobicContact CG2-CD1 4.44Å; V347-V368 WeakPolarHBondContact CA-O 3.35Å
348	N	86.5	Confident	81	Confident	50 Å²	50	50.3 Å²	50.3	27%	0.267	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-41	177.9	-67.8	-21.1	0	0	0	112.3	Y333 K346 V368	Y333-N348 CarbonylContact C-O 3.38Å; Y333-N348 PolarHBondContact N-O 3.08Å; Y333-N348 VanDerWaalsContact N-O 3.11Å; Y333-N348 CarbonylContact O-C 3.58Å; K346-N348 WeakPolarHBondContact CE-OD1 3.3Å; N348-V368 PolarHBondContact N-O 2.97Å
349	S	91.5	Very high	81.5	Confident	6 Å²	6	56.8 Å²	56.8	4%	0.042	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	166	-169.4	48.7	0	0	0	0	111.4	Q330 T331 V347 V368	Q330-S349 PolarHBondContact OE1-OG 3.09Å; T331-S349 CarbonylContact O-C 3.59Å; T331-S349 WeakPolarHBondContact O-CA 3.24Å; T331-S349 VanDerWaalsContact O-CB 3.25Å; T331-S349 WeakPolarHBondContact O-CB 3.47Å; V347-S349 WeakPolarHBondContact CG1-O 3.35Å; S349-V368 WeakPolarHBondContact O-CB 3.46Å; S349-V368 WeakPolarHBondContact O-CG2 3.21Å; S349-V368 PolarHBondContact O-N 3.04Å; S349-V368 VanDerWaalsContact OG-CB 3.28Å; S349-V368 WeakPolarHBondContact OG-CB 3.29Å; S349-V368 VanDerWaalsContact OG-CG2 3.25Å; S349-V368 WeakPolarHBondContact OG-CG2 3.28Å
350	K	92.5	Very high	82.5	Confident	71 Å²	71	60.3 Å²	60.3	31%	0.309	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	140.8	165.7	-176.6	172	-178.6	174.7	0	108.9	T331 Y333 F366 L367	T331-K350 PolarHBondContact N-O 2.61Å; T331-K350 PolarHBondContact O-N 3.2Å; Y333-K350 HydrophobicContact CG-CB 4.4Å; K350-F366 WeakPolarHBondContact CA-O 3.21Å; K350-L367 HydrophobicContact CB-CD2 4.05Å; K350-L367 HydrophobicContact CD-CD2 4.21Å; K350-L367 HydrophobicContact CG-CD2 4.09Å
351	V	92.4	Very high	84.1	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	142.4	-176.7	68.1	0	0	0	0	110.1	I316 L321 V328 Q330 L353 G365 F366 V368	I316-V351 HydrophobicContact CG2-CG1 3.98Å; L321-V351 HydrophobicContact CD1-CG1 4.33Å; L321-V351 HydrophobicContact CD2-CG1 4.23Å; L321-V351 HydrophobicContact CD2-CG2 4.36Å; V328-V351 HydrophobicContact CB-CG2 3.89Å; V328-V351 HydrophobicContact CG1-CG2 3.28Å; Q330-V351 HydrophobicContact CG-CB 4.36Å; Q330-V351 HydrophobicContact CG-CG2 4.23Å; V351-L353 HydrophobicContact CG1-CD1 4.03Å; V351-L353 HydrophobicContact CG1-CG 4.2Å; V351-L353 HydrophobicContact CG2-CD2 4.29Å; V351-L353 HydrophobicContact CG2-CG 4.25Å; V351-G365 CarbonylContact O-C 3.55Å; V351-G365 WeakPolarHBondContact O-CA 3.4Å; V351-F366 HydrophobicContact CG1-CB 4Å; V351-F366 PolarHBondContact N-O 3.35Å; V351-F366 PolarHBondContact O-N 3.32Å; V351-V368 HydrophobicContact CB-CG2 4.14Å; V351-V368 HydrophobicContact CG1-CG2 3.73Å
352	W	92.7	Very high	85.9	Confident	125 Å²	125	62.3 Å²	62.3	47%	0.473	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	129.9	172.1	-71.7	93.8	0	0	0	109.4	R363 H364	W352-R363 HydrophobicContact CE3-CG 4.39Å; W352-H364 WeakPolarHBondContact CA-O 3.48Å; W352-H364 VanDerWaalsContact CE3-C 3.44Å
353	L	93.2	Very high	87.8	Confident	3 Å²	3	68 Å²	68	2%	0.016	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	140.2	-176.5	-67	170	0	0	0	111.1	V298 I316 L321 L324 V328 V351 L355 R363 H364 F366 M376	V298-L353 HydrophobicContact CG1-CB 4.45Å; V298-L353 HydrophobicContact CG1-CD1 4.36Å; V298-L353 HydrophobicContact CG1-CD2 4.17Å; I316-L353 HydrophobicContact CD1-CD1 3.38Å; L321-L353 HydrophobicContact CD2-CD1 4.14Å; L321-L353 HydrophobicContact CD2-CD2 4.46Å; L324-L353 HydrophobicContact CD1-CD2 3.8Å; V328-L353 HydrophobicContact CG1-CD2 3.8Å; V328-L353 HydrophobicContact CG2-CD2 4.22Å; V351-L353 HydrophobicContact CG1-CD1 4.03Å; V351-L353 HydrophobicContact CG1-CG 4.2Å; V351-L353 HydrophobicContact CG2-CD2 4.29Å; V351-L353 HydrophobicContact CG2-CG 4.25Å; L353-L355 PolarHBondContact O-N 3.11Å; L353-R363 WeakPolarHBondContact O-CA 3.43Å; L353-H364 PolarHBondContact N-O 3.08Å; L353-H364 PolarHBondContact O-N 3.45Å; L353-F366 HydrophobicContact CB-CD2 3.92Å; L353-F366 HydrophobicContact CB-CE2 3.92Å; L353-F366 HydrophobicContact CD1-CD2 3.93Å; L353-F366 HydrophobicContact CD1-CE2 4.41Å; L353-F366 HydrophobicContact CD1-CG 4.43Å; L353-F366 HydrophobicContact CG-CD2 4.26Å; L353-M376 HydrophobicContact CD1-CE 4.42Å
354	D	92.3	Very high	89	Confident	72 Å²	72	64.7 Å²	64.7	39%	0.385	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	102.2	169.8	-65.7	-23.7	0	0	0	108.9	L361 R363	D354-L361 HydrophobicContact CB-CD1 3.96Å; D354-L361 HydrophobicContact CB-CG 4.32Å; D354-R363 VanDerWaalsContact OD1-CB 3.3Å; D354-R363 WeakPolarHBondContact OD1-CB 3.4Å; D354-R363 WeakPolarHBondContact OD1-CD 3.21Å; D354-R363 VanDerWaalsContact OD1-CG 3.26Å; D354-R363 WeakPolarHBondContact OD1-CG 3.46Å
355	L	93.4	Very high	89.8	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	117.9	177.4	169.3	60	0	0	0	109.6	V298 I305 L353 I357 F362 F366 M376 L378 F382	V298-L355 HydrophobicContact CG2-CD1 3.83Å; I305-L355 HydrophobicContact CD1-CD1 3.51Å; I305-L355 HydrophobicContact CD1-CD2 4.05Å; I305-L355 HydrophobicContact CD1-CG 4.4Å; L353-L355 PolarHBondContact O-N 3.11Å; L355-I357 HydrophobicContact CD1-CG1 4.27Å; L355-I357 HydrophobicContact CD2-CD1 3.96Å; L355-I357 HydrophobicContact CD2-CG1 4.03Å; L355-I357 HydrophobicContact CG-CD1 4.32Å; L355-I357 HydrophobicContact CG-CG1 3.85Å; L355-F362 PolarHBondContact N-O 2.83Å; L355-F362 PolarHBondContact O-N 3.3Å; L355-F366 HydrophobicContact CD2-CZ 4.27Å; L355-M376 HydrophobicContact CD1-SD 4.25Å; L355-M376 HydrophobicContact CD2-SD 4Å; L355-L378 HydrophobicContact CD2-CD1 4.1Å; L355-L378 HydrophobicContact CD2-CD2 3.93Å; L355-F382 HydrophobicContact CD2-CE2 4.13Å; L355-F382 HydrophobicContact CD2-CZ 4.19Å
356	T	92.5	Very high	90.6	Very high	43 Å²	43	59.8 Å²	59.8	26%	0.264	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	122.5	169.9	-55	0	0	0	0	109.8	G296 R297 H360 L361	G296-T356 CarbonylContact C-O 3.5Å; G296-T356 WeakPolarHBondContact CA-O 3.42Å; R297-T356 PolarHBondContact N-O 2.87Å; R297-T356 PolarHBondContact O-N 3.47Å; T356-H360 CarbonylContact C-O 3.55Å; T356-H360 WeakPolarHBondContact CA-O 3.49Å; T356-L361 VanDerWaalsContact OG1-CD1 3.31Å; T356-L361 WeakPolarHBondContact OG1-CD1 3.4Å
357	I	90.2	Very high	90.9	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	118.9	169.3	-46.3	175.2	0	0	0	107.9	I294 L355 R359 H360 F362 L378 F382 I404	I294-I357 HydrophobicContact CD1-CD1 3.89Å; I294-I357 HydrophobicContact CD1-CG2 3.95Å; L355-I357 HydrophobicContact CD1-CG1 4.27Å; L355-I357 HydrophobicContact CD2-CD1 3.96Å; L355-I357 HydrophobicContact CD2-CG1 4.03Å; L355-I357 HydrophobicContact CG-CD1 4.32Å; L355-I357 HydrophobicContact CG-CG1 3.85Å; I357-R359 PolarHBondContact O-N 3.21Å; I357-H360 PolarHBondContact N-O 3.25Å; I357-H360 PolarHBondContact O-N 2.87Å; I357-F362 HydrophobicContact CB-CD2 4.23Å; I357-F362 HydrophobicContact CB-CE2 3.91Å; I357-F362 HydrophobicContact CD1-CD2 3.94Å; I357-F362 HydrophobicContact CD1-CE2 4.02Å; I357-F362 HydrophobicContact CG1-CD2 3.89Å; I357-F362 HydrophobicContact CG1-CE2 4.02Å; I357-L378 HydrophobicContact CD1-CD1 4.27Å; I357-F382 HydrophobicContact CD1-CE1 4.07Å; I357-F382 HydrophobicContact CD1-CZ 3.72Å; I357-I404 HydrophobicContact CB-CD1 4.33Å; I357-I404 HydrophobicContact CG2-CD1 3.52Å; I357-I404 HydrophobicContact CG2-CG1 4.18Å
358	Y	83.9	Confident	91.1	Very high	165 Å²	165	54.5 Å²	54.5	65%	0.647	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.4	-87.5	-172	-169.4	-111.7	0	0	0	113.8
359	R	83.3	Confident	91.2	Very high	200 Å²	200	52.1 Å²	52.1	76%	0.755	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-127.9	2.2	177.7	-67.3	-175.4	-178.7	-163.3	-0.4	113.5	I357	I357-R359 PolarHBondContact O-N 3.21Å
360	H	87.4	Confident	90.9	Very high	82 Å²	82	53.8 Å²	53.8	38%	0.38	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	135.9	-171.6	-62.7	-94.4	0	0	0	110.1	T356 I357 F362 T402	T356-H360 CarbonylContact C-O 3.55Å; T356-H360 WeakPolarHBondContact CA-O 3.49Å; I357-H360 PolarHBondContact N-O 3.25Å; I357-H360 PolarHBondContact O-N 2.87Å; H360-F362 HydrophobicContact CB-CD2 4.45Å; H360-F362 HydrophobicContact CB-CE2 3.56Å; H360-F362 HydrophobicContact CB-CZ 3.79Å; H360-F362 WeakPolarHBondContact O-CD2 3.48Å; H360-T402 WeakPolarHBondContact CD2-CG2 3.44Å; H360-T402 PolarHBondContact CD2-OG1 2.85Å; H360-T402 PolarHBondContact CE1-OG1 2.99Å; H360-T402 PolarHBondContact NE2-OG1 3.04Å
361	L	90.4	Very high	90.5	Very high	112 Å²	112	55.1 Å²	55.1	59%	0.586	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	126.9	-179.9	-163.7	68.9	0	0	0	109.5	D354 T356	D354-L361 HydrophobicContact CB-CD1 3.96Å; D354-L361 HydrophobicContact CB-CG 4.32Å; T356-L361 VanDerWaalsContact OG1-CD1 3.31Å; T356-L361 WeakPolarHBondContact OG1-CD1 3.4Å
362	F	91.9	Very high	90	Very high	20 Å²	20	55.3 Å²	55.3	9%	0.088	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	114.3	178.8	-59.2	-87.5	0	0	0	108.3	L355 I357 H360 F382 H386 F399	L355-F362 PolarHBondContact N-O 2.83Å; L355-F362 PolarHBondContact O-N 3.3Å; I357-F362 HydrophobicContact CB-CD2 4.23Å; I357-F362 HydrophobicContact CB-CE2 3.91Å; I357-F362 HydrophobicContact CD1-CD2 3.94Å; I357-F362 HydrophobicContact CD1-CE2 4.02Å; I357-F362 HydrophobicContact CG1-CD2 3.89Å; I357-F362 HydrophobicContact CG1-CE2 4.02Å; H360-F362 HydrophobicContact CB-CD2 4.45Å; H360-F362 HydrophobicContact CB-CE2 3.56Å; H360-F362 HydrophobicContact CB-CZ 3.79Å; H360-F362 WeakPolarHBondContact O-CD2 3.48Å; F362-F382 HydrophobicContact CB-CE2 3.78Å; F362-F382 HydrophobicContact CB-CZ 3.95Å; F362-F382 HydrophobicContact CD1-CZ 4.18Å; F362-F382 HydrophobicContact CD2-CZ 4.35Å; F362-F382 HydrophobicContact CG-CE2 4.24Å; F362-F382 AromaticContact CG-CZ 3.91Å; F362-F382 HydrophobicContact CG-CZ 3.91Å; F362-H386 HydrophobicContact CD1-CB 4.18Å; F362-H386 AromaticContact CD1-CD2 3.55Å; F362-H386 AromaticContact CD1-CG 3.6Å; F362-H386 AromaticContact CD1-ND1 3.93Å; F362-H386 AromaticContact CD1-NE2 3.81Å; F362-H386 HydrophobicContact CE1-CB 4.1Å; F362-F399 HydrophobicContact CE1-CB 4.23Å; F362-F399 HydrophobicContact CZ-CB 3.91Å
363	R	92.4	Very high	89.4	Confident	165 Å²	165	53 Å²	53	62%	0.623	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	106.9	175.4	-179.4	168	176.4	146.5	-2.9	109	W352 L353 D354	W352-R363 HydrophobicContact CE3-CG 4.39Å; L353-R363 WeakPolarHBondContact O-CA 3.43Å; D354-R363 VanDerWaalsContact OD1-CB 3.3Å; D354-R363 WeakPolarHBondContact OD1-CB 3.4Å; D354-R363 WeakPolarHBondContact OD1-CD 3.21Å; D354-R363 VanDerWaalsContact OD1-CG 3.26Å; D354-R363 WeakPolarHBondContact OD1-CG 3.46Å
364	H	94	Very high	88.9	Confident	5 Å²	5	54.2 Å²	54.2	2%	0.023	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	155.8	-174.8	-164.2	65	0	0	0	112.9	W352 L353 F366 D381 F382 E385	W352-H364 WeakPolarHBondContact CA-O 3.48Å; W352-H364 VanDerWaalsContact CE3-C 3.44Å; L353-H364 PolarHBondContact N-O 3.08Å; L353-H364 PolarHBondContact O-N 3.45Å; H364-F366 HydrophobicContact CB-CD2 4.42Å; H364-F366 HydrophobicContact CB-CE2 3.72Å; H364-F366 HydrophobicContact CB-CZ 4.06Å; H364-F366 WeakPolarHBondContact O-CD2 3.48Å; H364-D381 IonicContact CE1-OD2 3Å; H364-D381 IonicContact NE2-OD1 4Å; H364-D381 IonicContact NE2-OD2 2.86Å; H364-D381 PolarHBondContact NE2-OD2 3.2Å; H364-F382 HydrophobicContact CB-CD2 3.84Å; H364-F382 HydrophobicContact CB-CE2 4.17Å; H364-F382 AromaticContact CD2-CD2 3.97Å; H364-F382 AromaticContact CG-CD2 3.6Å; H364-F382 AromaticContact ND1-CD2 3.89Å; H364-E385 IonicContact CE1-OE2 3.07Å; H364-E385 IonicContact ND1-OE2 3.39Å; H364-E385 PolarHBondContact ND1-OE2 3.29Å
365	G	92.6	Very high	88.8	Confident	7 Å²	7	53.1 Å²	53.1	7%	0.072	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	111.3	177	0	0	0	0	0	111.9	V351	V351-G365 CarbonylContact O-C 3.55Å; V351-G365 WeakPolarHBondContact O-CA 3.4Å
366	F	94.3	Very high	88.7	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	144.1	-178.9	-63.7	-95.1	0	0	0	112.2	S314 I316 K350 V351 L353 L355 H364 M376 L378	S314-F366 WeakPolarHBondContact O-CA 3.46Å; I316-F366 HydrophobicContact CB-CB 4.17Å; I316-F366 HydrophobicContact CB-CD1 4.49Å; I316-F366 HydrophobicContact CG2-CB 3.84Å; K350-F366 WeakPolarHBondContact CA-O 3.21Å; V351-F366 HydrophobicContact CG1-CB 4Å; V351-F366 PolarHBondContact N-O 3.35Å; V351-F366 PolarHBondContact O-N 3.32Å; L353-F366 HydrophobicContact CB-CD2 3.92Å; L353-F366 HydrophobicContact CB-CE2 3.92Å; L353-F366 HydrophobicContact CD1-CD2 3.93Å; L353-F366 HydrophobicContact CD1-CE2 4.41Å; L353-F366 HydrophobicContact CD1-CG 4.43Å; L353-F366 HydrophobicContact CG-CD2 4.26Å; L355-F366 HydrophobicContact CD2-CZ 4.27Å; H364-F366 HydrophobicContact CB-CD2 4.42Å; H364-F366 HydrophobicContact CB-CE2 3.72Å; H364-F366 HydrophobicContact CB-CZ 4.06Å; H364-F366 WeakPolarHBondContact O-CD2 3.48Å; F366-M376 HydrophobicContact CD1-CE 4.08Å; F366-M376 HydrophobicContact CD1-CG 4.35Å; F366-M376 HydrophobicContact CD1-SD 4.46Å; F366-M376 HydrophobicContact CE1-CE 3.6Å; F366-M376 HydrophobicContact CE1-CG 3.79Å; F366-M376 HydrophobicContact CE1-SD 3.56Å; F366-M376 VanDerWaalsContact CE1-SD 3.56Å; F366-M376 HydrophobicContact CE2-CE 4.19Å; F366-M376 HydrophobicContact CZ-CE 3.67Å; F366-M376 HydrophobicContact CZ-SD 3.75Å; F366-L378 HydrophobicContact CE1-CD2 3.73Å; F366-L378 HydrophobicContact CZ-CD2 3.97Å
367	L	92.9	Very high	88.7	Confident	18 Å²	18	51.1 Å²	51.1	9%	0.094	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	133.8	168.2	-58.8	179.2	0	0	0	110.2	A313 S314 L315 I316 Y333 L337 V347 K350	A313-L367 HydrophobicContact CB-CD1 3.94Å; S314-L367 PolarHBondContact O-N 3Å; L315-L367 WeakPolarHBondContact CA-O 3.46Å; L315-L367 HydrophobicContact CD2-CB 3.78Å; L315-L367 HydrophobicContact CD2-CD1 4.46Å; I316-L367 PolarHBondContact N-O 3.13Å; Y333-L367 HydrophobicContact CD1-CD2 4.12Å; Y333-L367 HydrophobicContact CE1-CD2 4.21Å; L337-L367 HydrophobicContact CD1-CD1 3.85Å; L337-L367 HydrophobicContact CD2-CD1 4.3Å; V347-L367 HydrophobicContact CG1-CB 3.92Å; V347-L367 HydrophobicContact CG1-CD2 4.32Å; V347-L367 HydrophobicContact CG2-CB 4.25Å; V347-L367 HydrophobicContact CG2-CD1 4.44Å; K350-L367 HydrophobicContact CB-CD2 4.05Å; K350-L367 HydrophobicContact CD-CD2 4.21Å; K350-L367 HydrophobicContact CG-CD2 4.09Å
368	V	92.6	Very high	88.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	110.5	-172.9	-174.6	0	0	0	0	110.3	I316 N318 L321 V347 N348 S349 V351	I316-V368 HydrophobicContact CG2-CB 4.47Å; I316-V368 HydrophobicContact CG2-CG2 3.96Å; N318-V368 HydrophobicContact CB-CG1 4Å; N318-V368 WeakPolarHBondContact OD1-CG1 3.49Å; L321-V368 HydrophobicContact CD1-CB 4.19Å; L321-V368 HydrophobicContact CD1-CG1 3.56Å; L321-V368 HydrophobicContact CD1-CG2 3.52Å; V347-V368 WeakPolarHBondContact CA-O 3.35Å; N348-V368 PolarHBondContact N-O 2.97Å; S349-V368 WeakPolarHBondContact O-CB 3.46Å; S349-V368 WeakPolarHBondContact O-CG2 3.21Å; S349-V368 PolarHBondContact O-N 3.04Å; S349-V368 VanDerWaalsContact OG-CB 3.28Å; S349-V368 WeakPolarHBondContact OG-CB 3.29Å; S349-V368 VanDerWaalsContact OG-CG2 3.25Å; S349-V368 WeakPolarHBondContact OG-CG2 3.28Å; V351-V368 HydrophobicContact CB-CG2 4.14Å; V351-V368 HydrophobicContact CG1-CG2 3.73Å
369	C	89.5	Confident	88.9	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	120.3	-177.3	-69	0	0	0	0	110.1	I316 K317 N318 L345 L372	I316-C369 PolarHBondContact O-N 2.73Å; K317-C369 WeakPolarHBondContact CA-O 3.28Å; N318-C369 PolarHBondContact N-O 2.88Å; N318-C369 VanDerWaalsContact N-O 3.1Å; L345-C369 HydrophobicContact CD1-CB 4.46Å; C369-L372 HydrophobicContact CB-CB 3.93Å; C369-L372 HydrophobicContact CB-CD1 4.41Å
370	P	85.5	Confident	88.8	Confident	41 Å²	41	35.8 Å²	35.8	27%	0.266	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-32.5	-179.9	28.5	-32.3	0	0	0	112.8	N318 K346	N318-P370 HydrophobicContact CB-CB 4.18Å; K346-P370 VanDerWaalsContact O-CD 3.31Å; K346-P370 WeakPolarHBondContact O-CD 3.36Å
371	T	82.5	Confident	88.7	Confident	100 Å²	100	32.8 Å²	32.8	61%	0.613	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98	25.9	-177.2	57.4	0	0	0	0	112.9	L345	L345-T371 WeakPolarHBondContact CD1-OG1 3.42Å
372	L	83.8	Confident	88.7	Confident	4 Å²	4	27.5 Å²	27.5	2%	0.021	14%	0.143	C	C	.	.			trans	-76.4	133	-179.4	-162.4	62.9	0	0	0	110.7	L315 K317 L345 C369 W374 I377	L315-L372 HydrophobicContact CB-CD1 4.28Å; L315-L372 HydrophobicContact CB-CD2 3.61Å; L315-L372 HydrophobicContact CD1-CD1 3.59Å; L315-L372 HydrophobicContact CD1-CD2 4.44Å; K317-L372 HydrophobicContact CB-CB 4.18Å; K317-L372 HydrophobicContact CB-CD2 4.48Å; K317-L372 WeakPolarHBondContact CD-O 3.5Å; K317-L372 WeakPolarHBondContact CE-O 3.34Å; K317-L372 HydrophobicContact CG-CB 4.18Å; L345-L372 HydrophobicContact CD2-CD1 4.38Å; C369-L372 HydrophobicContact CB-CB 3.93Å; C369-L372 HydrophobicContact CB-CD1 4.41Å; L372-W374 VanDerWaalsContact CD2-O 3.23Å; L372-W374 WeakPolarHBondContact CD2-O 3.28Å; L372-W374 VanDerWaalsContact CG-O 3.27Å; L372-W374 WeakPolarHBondContact CG-O 3.35Å; L372-I377 HydrophobicContact CD1-CD1 3.85Å; L372-I377 HydrophobicContact CD2-CG1 4.39Å; L372-I377 HydrophobicContact CG-CD1 4.44Å
373	T	78	Confident	88.5	Confident	76 Å²	76	27.4 Å²	27.4	47%	0.466	14%	0.143	S	C	.	.	S	Bend	trans	-80	-21.9	-179.7	48	0	0	0	0	113.6	V416	T373-V416 HydrophobicContact CG2-CG1 3.88Å
374	W	83.4	Confident	88.1	Confident	28 Å²	28	22.1 Å²	22.1	11%	0.106	13%	0.127	C	C	.	.	S	Bend	trans	-106.2	146.2	175	-75.6	81.3	0	0	0	110.6	L291 T293 E304 L306 L372 M376 I377 F413	L291-W374 HydrophobicContact CD1-CH2 4.38Å; L291-W374 HydrophobicContact CD1-CZ2 3.48Å; L291-W374 VanDerWaalsContact CD1-CZ2 3.48Å; T293-W374 HydrophobicContact CG2-CH2 3.78Å; T293-W374 HydrophobicContact CG2-CZ3 3.73Å; E304-W374 HydrophobicContact CG-CZ3 4.37Å; L306-W374 HydrophobicContact CB-CD2 3.86Å; L306-W374 HydrophobicContact CB-CE3 3.9Å; L306-W374 HydrophobicContact CB-CG 4.18Å; L306-W374 HydrophobicContact CB-CZ3 4.47Å; L306-W374 HydrophobicContact CD1-CZ2 4.41Å; L306-W374 HydrophobicContact CD2-CD2 4.22Å; L306-W374 HydrophobicContact CD2-CG 4.13Å; L306-W374 HydrophobicContact CG-CD2 4.47Å; L372-W374 VanDerWaalsContact CD2-O 3.23Å; L372-W374 WeakPolarHBondContact CD2-O 3.28Å; L372-W374 VanDerWaalsContact CG-O 3.27Å; L372-W374 WeakPolarHBondContact CG-O 3.35Å; W374-M376 VanDerWaalsContact C-N 3.31Å; W374-M376 PolarHBondContact O-N 2.87Å; W374-I377 HydrophobicContact CB-CD1 4.19Å; W374-I377 HydrophobicContact CB-CG1 3.75Å; W374-I377 HydrophobicContact CG-CG1 4.34Å; W374-F413 HydrophobicContact CZ2-CE2 4.32Å
375	D	89.5	Confident	87.7	Confident	50 Å²	50	26 Å²	26	27%	0.267	15%	0.145	S	C	.	.	S	Bend	trans	-61.2	-41.2	175.3	-99.2	11.7	0	0	0	111.1	K317 L320 R323	K317-D375 PolarHBondContact N-O 2.85Å; L320-D375 HydrophobicContact CD2-CB 4.1Å; R323-D375 IonicContact NH1-OD2 3.5Å; R323-D375 PolarHBondContact NH1-OD2 3.28Å
376	M	93.2	Very high	87.4	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	140.1	173.7	-177.5	173.7	-79.4	0	0	111.6	V298 I303 I305 L306 L315 I316 L353 L355 F366 W374 L378	V298-M376 HydrophobicContact CG2-CE 3.81Å; I303-M376 HydrophobicContact CD1-CB 4.03Å; I303-M376 HydrophobicContact CD1-CE 4.03Å; I303-M376 HydrophobicContact CD1-SD 3.75Å; I305-M376 HydrophobicContact CD1-SD 4.03Å; I305-M376 HydrophobicContact CG1-CB 4.39Å; I305-M376 HydrophobicContact CG1-SD 4.26Å; I305-M376 HydrophobicContact CG2-CB 4.32Å; I305-M376 HydrophobicContact CG2-CG 4.01Å; I305-M376 HydrophobicContact CG2-SD 4.31Å; L306-M376 PolarHBondContact N-O 3.02Å; L306-M376 VanDerWaalsContact N-O 3.15Å; L315-M376 WeakPolarHBondContact O-CA 3.45Å; I316-M376 HydrophobicContact CD1-CE 3.93Å; I316-M376 HydrophobicContact CG1-CE 4.37Å; L353-M376 HydrophobicContact CD1-CE 4.42Å; L355-M376 HydrophobicContact CD1-SD 4.25Å; L355-M376 HydrophobicContact CD2-SD 4Å; F366-M376 HydrophobicContact CD1-CE 4.08Å; F366-M376 HydrophobicContact CD1-CG 4.35Å; F366-M376 HydrophobicContact CD1-SD 4.46Å; F366-M376 HydrophobicContact CE1-CE 3.6Å; F366-M376 HydrophobicContact CE1-CG 3.79Å; F366-M376 HydrophobicContact CE1-SD 3.56Å; F366-M376 VanDerWaalsContact CE1-SD 3.56Å; F366-M376 HydrophobicContact CE2-CE 4.19Å; F366-M376 HydrophobicContact CZ-CE 3.67Å; F366-M376 HydrophobicContact CZ-SD 3.75Å; W374-M376 VanDerWaalsContact C-N 3.31Å; W374-M376 PolarHBondContact O-N 2.87Å; M376-L378 HydrophobicContact SD-CD2 4.49Å
377	I	91.7	Very high	86.9	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	130	171.8	-56.1	-173.6	0	0	0	108.6	L306 E308 A311 S314 L315 L372 W374 V419	L306-I377 HydrophobicContact CB-CG1 4.3Å; L306-I377 HydrophobicContact CD2-CD1 4.15Å; L306-I377 HydrophobicContact CD2-CG1 4.24Å; L306-I377 HydrophobicContact CD2-CG2 4.44Å; E308-I377 HydrophobicContact CB-CG2 3.48Å; E308-I377 VanDerWaalsContact CB-CG2 3.48Å; E308-I377 HydrophobicContact CG-CG2 4.31Å; A311-I377 HydrophobicContact CB-CG2 4.32Å; S314-I377 CarbonylContact C-O 3.55Å; S314-I377 VanDerWaalsContact CA-O 3.3Å; S314-I377 WeakPolarHBondContact CA-O 3.36Å; L315-I377 HydrophobicContact CB-CB 4.29Å; L315-I377 HydrophobicContact CD1-CD1 4.47Å; L315-I377 PolarHBondContact N-O 3.33Å; L315-I377 PolarHBondContact O-N 2.98Å; L372-I377 HydrophobicContact CD1-CD1 3.85Å; L372-I377 HydrophobicContact CD2-CG1 4.39Å; L372-I377 HydrophobicContact CG-CD1 4.44Å; W374-I377 HydrophobicContact CB-CD1 4.19Å; W374-I377 HydrophobicContact CB-CG1 3.75Å; W374-I377 HydrophobicContact CG-CG1 4.34Å; I377-V419 HydrophobicContact CD1-CB 4.4Å
378	L	91.4	Very high	86.5	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	117.8	168.4	-61.8	172.3	0	0	0	109.2	I294 I305 L306 L307 E308 L355 I357 F366 M376 F382	I294-L378 HydrophobicContact CD1-CD1 4.21Å; I305-L378 HydrophobicContact CG2-CB 4.46Å; I305-L378 HydrophobicContact CG2-CD1 3.61Å; I305-L378 HydrophobicContact CG2-CG 3.54Å; L306-L378 PolarHBondContact O-N 3.12Å; L307-L378 HydrophobicContact CD2-CB 3.98Å; L307-L378 HydrophobicContact CD2-CD1 3.82Å; L307-L378 HydrophobicContact CD2-CG 4.46Å; E308-L378 PolarHBondContact N-O 2.85Å; L355-L378 HydrophobicContact CD2-CD1 4.1Å; L355-L378 HydrophobicContact CD2-CD2 3.93Å; I357-L378 HydrophobicContact CD1-CD1 4.27Å; F366-L378 HydrophobicContact CE1-CD2 3.73Å; F366-L378 HydrophobicContact CZ-CD2 3.97Å; M376-L378 HydrophobicContact SD-CD2 4.49Å; L378-F382 HydrophobicContact CB-CB 4.41Å; L378-F382 HydrophobicContact CB-CD1 4.14Å; L378-F382 HydrophobicContact CB-CG 4.36Å; L378-F382 HydrophobicContact CD1-CD1 3.87Å; L378-F382 HydrophobicContact CD1-CE1 3.68Å; L378-F382 HydrophobicContact CD1-CG 4.43Å; L378-F382 HydrophobicContact CD1-CZ 4.08Å; L378-F382 HydrophobicContact CD2-CB 4.17Å; L378-F382 HydrophobicContact CD2-CD1 4Å; L378-F382 HydrophobicContact CD2-CD2 3.72Å; L378-F382 HydrophobicContact CD2-CE1 4.31Å; L378-F382 HydrophobicContact CD2-CE2 4.02Å; L378-F382 HydrophobicContact CD2-CG 3.71Å; L378-F382 HydrophobicContact CD2-CZ 4.31Å; L378-F382 HydrophobicContact CG-CD1 4.21Å; L378-F382 HydrophobicContact CG-CE1 4.47Å; L378-F382 HydrophobicContact CG-CG 4.37Å
379	G	86.9	Confident	86	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.202	C	C	.	.			trans	-91.8	-175	179	0	0	0	0	0	113.1	A311 S314 D381 F382 M383	A311-G379 CarbonylContact O-C 3.41Å; A311-G379 VanDerWaalsContact O-CA 3.3Å; A311-G379 WeakPolarHBondContact O-CA 3.49Å; S314-G379 PolarHBondContact OG-N 2.89Å; G379-D381 VanDerWaalsContact C-OD1 3.29Å; G379-D381 WeakPolarHBondContact CA-OD1 3.45Å; G379-D381 PolarHBondContact O-N 3.01Å; G379-F382 PolarHBondContact O-N 2.67Å; G379-M383 VanDerWaalsContact O-CE 3.3Å; G379-M383 WeakPolarHBondContact O-CE 3.45Å; G379-M383 WeakPolarHBondContact O-CG 3.23Å; G379-M383 PolarHBondContact O-N 2.98Å; G379-M383 VanDerWaalsContact O-N 3.16Å
380	V	81.4	Confident	85.6	Confident	42 Å²	42	39.5 Å²	39.5	26%	0.255	21%	0.214	S	C	.	.	H	α-helix	trans	-62.6	-27.2	177.8	173.3	0	0	0	0	111.9	T309 A311 M383 L384	T309-V380 WeakPolarHBondContact O-CG2 3.34Å; A311-V380 WeakPolarHBondContact O-CG2 3.37Å; A311-V380 PolarHBondContact O-N 3.45Å; V380-M383 HydrophobicContact CG2-CE 4.3Å; V380-M383 PolarHBondContact O-N 3.2Å; V380-L384 HydrophobicContact CG1-CD1 3.66Å; V380-L384 HydrophobicContact CG1-CG 3.92Å; V380-L384 VanDerWaalsContact O-CB 3.32Å; V380-L384 WeakPolarHBondContact O-CB 3.49Å; V380-L384 WeakPolarHBondContact O-CG 3.04Å; V380-L384 PolarHBondContact O-N 3.23Å
381	D	85.9	Confident	85.4	Confident	20 Å²	20	41.6 Å²	41.6	11%	0.107	22%	0.219	C	C	.	.	H	α-helix	trans	-55.1	-58.2	171.1	61.7	-27.4	0	0	0	112.6	L189 S312 S314 H364 G379 M383 L384 E385	L189-D381 HydrophobicContact CD2-CB 3.89Å; S312-D381 WeakPolarHBondContact O-CB 3.22Å; S312-D381 PolarHBondContact O-N 3.37Å; S314-D381 WeakPolarHBondContact CB-OD1 3.43Å; S314-D381 WeakPolarHBondContact CB-OD2 3.48Å; S314-D381 PolarHBondContact N-OD1 3.47Å; S314-D381 PolarHBondContact N-OD2 3.01Å; S314-D381 PolarHBondContact OG-OD1 3.12Å; S314-D381 PolarHBondContact OG-OD2 3.24Å; H364-D381 IonicContact CE1-OD2 3Å; H364-D381 IonicContact NE2-OD1 4Å; H364-D381 IonicContact NE2-OD2 2.86Å; H364-D381 PolarHBondContact NE2-OD2 3.2Å; G379-D381 VanDerWaalsContact C-OD1 3.29Å; G379-D381 WeakPolarHBondContact CA-OD1 3.45Å; G379-D381 PolarHBondContact O-N 3.01Å; D381-M383 VanDerWaalsContact C-N 3.32Å; D381-M383 PolarHBondContact O-N 3.32Å; D381-L384 PolarHBondContact O-N 2.94Å; D381-E385 WeakPolarHBondContact O-CB 3.4Å; D381-E385 PolarHBondContact O-N 3.06Å
382	F	90.2	Very high	85	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.5	-40.8	178.1	-179.4	-88	0	0	0	111.5	S314 L355 I357 F362 H364 L378 G379 L384 E385 H386 F399	S314-F382 WeakPolarHBondContact OG-CB 3.35Å; L355-F382 HydrophobicContact CD2-CE2 4.13Å; L355-F382 HydrophobicContact CD2-CZ 4.19Å; I357-F382 HydrophobicContact CD1-CE1 4.07Å; I357-F382 HydrophobicContact CD1-CZ 3.72Å; F362-F382 HydrophobicContact CB-CE2 3.78Å; F362-F382 HydrophobicContact CB-CZ 3.95Å; F362-F382 HydrophobicContact CD1-CZ 4.18Å; F362-F382 HydrophobicContact CD2-CZ 4.35Å; F362-F382 HydrophobicContact CG-CE2 4.24Å; F362-F382 AromaticContact CG-CZ 3.91Å; F362-F382 HydrophobicContact CG-CZ 3.91Å; H364-F382 HydrophobicContact CB-CD2 3.84Å; H364-F382 HydrophobicContact CB-CE2 4.17Å; H364-F382 AromaticContact CD2-CD2 3.97Å; H364-F382 AromaticContact CG-CD2 3.6Å; H364-F382 AromaticContact ND1-CD2 3.89Å; L378-F382 HydrophobicContact CB-CB 4.41Å; L378-F382 HydrophobicContact CB-CD1 4.14Å; L378-F382 HydrophobicContact CB-CG 4.36Å; L378-F382 HydrophobicContact CD1-CD1 3.87Å; L378-F382 HydrophobicContact CD1-CE1 3.68Å; L378-F382 HydrophobicContact CD1-CG 4.43Å; L378-F382 HydrophobicContact CD1-CZ 4.08Å; L378-F382 HydrophobicContact CD2-CB 4.17Å; L378-F382 HydrophobicContact CD2-CD1 4Å; L378-F382 HydrophobicContact CD2-CD2 3.72Å; L378-F382 HydrophobicContact CD2-CE1 4.31Å; L378-F382 HydrophobicContact CD2-CE2 4.02Å; L378-F382 HydrophobicContact CD2-CG 3.71Å; L378-F382 HydrophobicContact CD2-CZ 4.31Å; L378-F382 HydrophobicContact CG-CD1 4.21Å; L378-F382 HydrophobicContact CG-CE1 4.47Å; L378-F382 HydrophobicContact CG-CG 4.37Å; G379-F382 PolarHBondContact O-N 2.67Å; F382-L384 PolarHBondContact O-N 3.07Å; F382-E385 PolarHBondContact O-N 2.99Å; F382-H386 AromaticContact CD1-CD2 3.96Å; F382-H386 AromaticContact CD2-CD2 3.42Å; F382-H386 VanDerWaalsContact CD2-CD2 3.42Å; F382-H386 WeakPolarHBondContact CD2-CD2 3.49Å; F382-H386 AromaticContact CD2-NE2 3.6Å; F382-H386 AromaticContact CE1-CD2 3.78Å; F382-H386 AromaticContact CE2-CD2 3.26Å; F382-H386 WeakPolarHBondContact CE2-CD2 3.5Å; F382-H386 AromaticContact CE2-NE2 3.45Å; F382-H386 WeakPolarHBondContact CE2-NE2 3.46Å; F382-H386 AromaticContact CG-CD2 3.79Å; F382-H386 AromaticContact CZ-CD2 3.44Å; F382-H386 VanDerWaalsContact CZ-CD2 3.44Å; F382-H386 WeakPolarHBondContact CZ-CD2 3.41Å; F382-H386 PolarHBondContact O-N 3.07Å; F382-F399 HydrophobicContact CD1-CE1 4.16Å; F382-F399 AromaticContact CE1-CD1 3.9Å; F382-F399 HydrophobicContact CE1-CD1 3.9Å; F382-F399 AromaticContact CE1-CE1 3.63Å; F382-F399 HydrophobicContact CE1-CE1 3.63Å
383	M	87.5	Confident	84.4	Confident	19 Å²	19	47 Å²	47	9%	0.094	24%	0.243	C	C	.	.	H	α-helix	trans	-65.3	-37.5	179.5	-72.8	-174.1	-93.5	0	0	112.5	T309 G379 V380 D381 K387 A388 I390	T309-M383 HydrophobicContact CG2-CE 3.98Å; T309-M383 HydrophobicContact CG2-SD 4.06Å; G379-M383 VanDerWaalsContact O-CE 3.3Å; G379-M383 WeakPolarHBondContact O-CE 3.45Å; G379-M383 WeakPolarHBondContact O-CG 3.23Å; G379-M383 PolarHBondContact O-N 2.98Å; G379-M383 VanDerWaalsContact O-N 3.16Å; V380-M383 HydrophobicContact CG2-CE 4.3Å; V380-M383 PolarHBondContact O-N 3.2Å; D381-M383 VanDerWaalsContact C-N 3.32Å; D381-M383 PolarHBondContact O-N 3.32Å; M383-K387 PolarHBondContact O-N 2.74Å; M383-A388 HydrophobicContact CB-CB 3.82Å; M383-A388 HydrophobicContact CG-CB 3.85Å; M383-A388 WeakPolarHBondContact O-CB 3.48Å; M383-A388 PolarHBondContact O-N 2.94Å; M383-I390 HydrophobicContact SD-CD1 3.9Å
384	L	83.4	Confident	84.5	Confident	54 Å²	54	50.3 Å²	50.3	28%	0.283	25%	0.247	S	C	.	.	H	α-helix	trans	-72.3	-45.9	174.9	-72.3	173.6	0	0	0	111.6	A186 V380 D381 F382 H386 K387	A186-L384 HydrophobicContact CB-CD1 3.73Å; V380-L384 HydrophobicContact CG1-CD1 3.66Å; V380-L384 HydrophobicContact CG1-CG 3.92Å; V380-L384 VanDerWaalsContact O-CB 3.32Å; V380-L384 WeakPolarHBondContact O-CB 3.49Å; V380-L384 WeakPolarHBondContact O-CG 3.04Å; V380-L384 PolarHBondContact O-N 3.23Å; D381-L384 PolarHBondContact O-N 2.94Å; F382-L384 PolarHBondContact O-N 3.07Å; L384-H386 VanDerWaalsContact C-N 3.34Å; L384-H386 PolarHBondContact O-N 3.15Å; L384-K387 PolarHBondContact O-N 2.87Å
385	E	86.7	Confident	84.3	Confident	86 Å²	86	52.2 Å²	52.2	40%	0.402	26%	0.259	S	S	.	.	H	α-helix	trans	-58.7	-43.7	-178.1	-170.7	172	152.5	0	0	112	H364 D381 F382	H364-E385 IonicContact CE1-OE2 3.07Å; H364-E385 IonicContact ND1-OE2 3.39Å; H364-E385 PolarHBondContact ND1-OE2 3.29Å; D381-E385 WeakPolarHBondContact O-CB 3.4Å; D381-E385 PolarHBondContact O-N 3.06Å; F382-E385 PolarHBondContact O-N 2.99Å
386	H	85.9	Confident	84.1	Confident	33 Å²	33	52 Å²	52	15%	0.153	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	16	-178.4	-53.6	-41.4	0	0	0	114.2	F362 F382 L384 A388 G400	F362-H386 HydrophobicContact CD1-CB 4.18Å; F362-H386 AromaticContact CD1-CD2 3.55Å; F362-H386 AromaticContact CD1-CG 3.6Å; F362-H386 AromaticContact CD1-ND1 3.93Å; F362-H386 AromaticContact CD1-NE2 3.81Å; F362-H386 HydrophobicContact CE1-CB 4.1Å; F382-H386 AromaticContact CD1-CD2 3.96Å; F382-H386 AromaticContact CD2-CD2 3.42Å; F382-H386 VanDerWaalsContact CD2-CD2 3.42Å; F382-H386 WeakPolarHBondContact CD2-CD2 3.49Å; F382-H386 AromaticContact CD2-NE2 3.6Å; F382-H386 AromaticContact CE1-CD2 3.78Å; F382-H386 AromaticContact CE2-CD2 3.26Å; F382-H386 WeakPolarHBondContact CE2-CD2 3.5Å; F382-H386 AromaticContact CE2-NE2 3.45Å; F382-H386 WeakPolarHBondContact CE2-NE2 3.46Å; F382-H386 AromaticContact CG-CD2 3.79Å; F382-H386 AromaticContact CZ-CD2 3.44Å; F382-H386 VanDerWaalsContact CZ-CD2 3.44Å; F382-H386 WeakPolarHBondContact CZ-CD2 3.41Å; F382-H386 PolarHBondContact O-N 3.07Å; L384-H386 VanDerWaalsContact C-N 3.34Å; L384-H386 PolarHBondContact O-N 3.15Å; H386-A388 VanDerWaalsContact C-N 3.28Å; H386-A388 PolarHBondContact O-N 3.35Å; H386-G400 PolarHBondContact O-N 2.96Å
387	K	83.7	Confident	83.7	Confident	178 Å²	178	52 Å²	52	77%	0.774	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	46.8	177.1	-59.7	178.4	-178.1	175.2	0	112.5	M383 L384	M383-K387 PolarHBondContact O-N 2.74Å; L384-K387 PolarHBondContact O-N 2.87Å
388	A	83.5	Confident	83.4	Confident	27 Å²	27	56.1 Å²	56.1	22%	0.223	27%	0.274	C	S	.	.			trans	-69	137.1	-176.8	0	0	0	0	0	111.7	M383 H386 K398 F399	M383-A388 HydrophobicContact CB-CB 3.82Å; M383-A388 HydrophobicContact CG-CB 3.85Å; M383-A388 WeakPolarHBondContact O-CB 3.48Å; M383-A388 PolarHBondContact O-N 2.94Å; H386-A388 VanDerWaalsContact C-N 3.28Å; H386-A388 PolarHBondContact O-N 3.35Å; A388-K398 CarbonylContact C-O 3.51Å; A388-K398 WeakPolarHBondContact CA-O 3.19Å; A388-F399 HydrophobicContact CB-CD1 3.55Å; A388-F399 HydrophobicContact CB-CE1 3.5Å; A388-F399 HydrophobicContact CB-CZ 4.45Å
389	G	82	Confident	83.1	Confident	21 Å²	21	56.2 Å²	56.2	22%	0.216	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	123.1	172.5	0	0	0	0	0	110.7	F391 A397 K398	G389-F391 VanDerWaalsContact O-CD2 3.32Å; G389-F391 WeakPolarHBondContact O-CD2 3.44Å; G389-F391 WeakPolarHBondContact O-CE2 3.4Å; G389-A397 CarbonylContact O-C 3.26Å; G389-A397 WeakPolarHBondContact O-CA 3.45Å; G389-K398 PolarHBondContact N-O 2.93Å; G389-K398 PolarHBondContact O-N 3.01Å
390	I	82.5	Confident	82.4	Confident	49 Å²	49	58.3 Å²	58.3	25%	0.251	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	116.4	-179.7	-56.4	179.3	0	0	0	109.1	L307 T309 M383 M392 L406	L307-I390 HydrophobicContact CB-CD1 4.36Å; L307-I390 HydrophobicContact CD1-CD1 4.25Å; T309-I390 HydrophobicContact CG2-CD1 3.95Å; M383-I390 HydrophobicContact SD-CD1 3.9Å; I390-M392 HydrophobicContact CG2-CG 4.34Å; I390-M392 HydrophobicContact CG2-SD 3.79Å; I390-L406 HydrophobicContact CG2-CD1 3.81Å
391	F	80.2	Confident	81.9	Confident	85 Å²	85	65.2 Å²	65.2	37%	0.373	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	88.3	-176	-63.3	-85.2	0	0	0	109.7	G389 D393 R394 L395 E396 K398	G389-F391 VanDerWaalsContact O-CD2 3.32Å; G389-F391 WeakPolarHBondContact O-CD2 3.44Å; G389-F391 WeakPolarHBondContact O-CE2 3.4Å; F391-D393 WeakPolarHBondContact CB-OD1 3.32Å; F391-D393 PolarHBondContact O-N 3.28Å; F391-R394 HydrophobicContact CB-CB 4.25Å; F391-R394 PolarHBondContact O-N 3.44Å; F391-R394 VanDerWaalsContact O-N 3.13Å; F391-L395 PolarHBondContact O-N 3.39Å; F391-E396 WeakPolarHBondContact CA-O 3.49Å; F391-E396 WeakPolarHBondContact CB-O 3.42Å; F391-E396 PolarHBondContact N-O 3.03Å; F391-E396 PolarHBondContact O-N 2.93Å; F391-E396 VanDerWaalsContact O-N 3.13Å; F391-K398 HydrophobicContact CD2-CB 4.38Å; F391-K398 HydrophobicContact CE2-CB 3.82Å; F391-K398 HydrophobicContact CE2-CD 4.46Å
392	M	73.9	Confident	81.4	Confident	101 Å²	101	65 Å²	65	50%	0.498	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-22.2	-176.9	-62.7	-60.9	-73.4	0	0	113.5	I292 I390 R394 L406	I292-M392 HydrophobicContact CD1-CE 3.67Å; I292-M392 HydrophobicContact CD1-SD 3.54Å; I292-M392 VanDerWaalsContact CD1-SD 3.54Å; I292-M392 HydrophobicContact CG1-CE 4.16Å; I292-M392 HydrophobicContact CG1-SD 4.35Å; I390-M392 HydrophobicContact CG2-CG 4.34Å; I390-M392 HydrophobicContact CG2-SD 3.79Å; M392-R394 VanDerWaalsContact C-N 3.31Å; M392-L406 HydrophobicContact SD-CD1 4.1Å
393	D	71.2	Confident	81.1	Confident	116 Å²	116	72.2 Å²	72.2	62%	0.62	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-31.5	172	63.8	-43.8	0	0	0	112.5	F391	F391-D393 WeakPolarHBondContact CB-OD1 3.32Å; F391-D393 PolarHBondContact O-N 3.28Å
394	R	80	Confident	81	Confident	146 Å²	146	72.1 Å²	72.1	55%	0.551	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-12.6	-176.4	-68.3	156.7	-160.9	-112	-0.7	113.5	F391 M392 E396	F391-R394 HydrophobicContact CB-CB 4.25Å; F391-R394 PolarHBondContact O-N 3.44Å; F391-R394 VanDerWaalsContact O-N 3.13Å; M392-R394 VanDerWaalsContact C-N 3.31Å; R394-E396 VanDerWaalsContact C-N 3.29Å; R394-E396 HydrophobicContact CB-CB 4.11Å; R394-E396 HydrophobicContact CB-CG 3.95Å
395	L	80.7	Confident	81	Confident	69 Å²	69	78.9 Å²	78.9	36%	0.361	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	48.6	-164.4	-55.3	-177.9	0	0	0	111.1	F391 R405 L406 H408	F391-L395 PolarHBondContact O-N 3.39Å; L395-R405 CarbonylContact O-C 3.57Å; L395-R405 WeakPolarHBondContact O-CA 3.46Å; L395-L406 HydrophobicContact CB-CB 4.35Å; L395-L406 PolarHBondContact O-N 2.93Å; L395-H408 VanDerWaalsContact CD2-NE2 3.27Å; L395-H408 WeakPolarHBondContact CD2-NE2 3.48Å
396	E	84.9	Confident	80.8	Confident	46 Å²	46	75.4 Å²	75.4	22%	0.215	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	137.3	179.3	-70.5	-178.8	169.3	0	0	111.2	F391 R394 R403 I404	F391-E396 WeakPolarHBondContact CA-O 3.49Å; F391-E396 WeakPolarHBondContact CB-O 3.42Å; F391-E396 PolarHBondContact N-O 3.03Å; F391-E396 PolarHBondContact O-N 2.93Å; F391-E396 VanDerWaalsContact O-N 3.13Å; R394-E396 VanDerWaalsContact C-N 3.29Å; R394-E396 HydrophobicContact CB-CB 4.11Å; R394-E396 HydrophobicContact CB-CG 3.95Å; E396-R403 WeakPolarHBondContact OE2-CD 3.11Å; E396-R403 IonicContact OE2-NH1 3.66Å; E396-I404 CarbonylContact C-O 3.41Å; E396-I404 VanDerWaalsContact CA-O 3.32Å; E396-I404 WeakPolarHBondContact CA-O 3.49Å
397	A	84.4	Confident	80.4	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	131.7	159.1	0	0	0	0	0	109.5	L307 G389 F399 R403 I404 L406	L307-A397 HydrophobicContact CD1-CB 4.02Å; G389-A397 CarbonylContact O-C 3.26Å; G389-A397 WeakPolarHBondContact O-CA 3.45Å; A397-F399 HydrophobicContact CB-CD2 4.24Å; A397-F399 HydrophobicContact CB-CE2 3.47Å; A397-F399 VanDerWaalsContact CB-CE2 3.47Å; A397-F399 HydrophobicContact CB-CZ 3.94Å; A397-R403 WeakPolarHBondContact O-CA 3.38Å; A397-I404 PolarHBondContact N-O 3.44Å; A397-I404 PolarHBondContact O-N 2.8Å; A397-L406 HydrophobicContact CB-CD2 3.64Å
398	K	86.1	Confident	79.5	Confident	87 Å²	87	72 Å²	72	38%	0.378	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	130	172.4	-178.7	-178.4	170.3	-177.5	0	109.1	A388 G389 F391 G400 T402	A388-K398 CarbonylContact C-O 3.51Å; A388-K398 WeakPolarHBondContact CA-O 3.19Å; G389-K398 PolarHBondContact N-O 2.93Å; G389-K398 PolarHBondContact O-N 3.01Å; F391-K398 HydrophobicContact CD2-CB 4.38Å; F391-K398 HydrophobicContact CE2-CB 3.82Å; F391-K398 HydrophobicContact CE2-CD 4.46Å; K398-G400 WeakPolarHBondContact CE-O 3.44Å; K398-G400 WeakPolarHBondContact CG-O 3.36Å; K398-T402 CarbonylContact C-O 3.59Å; K398-T402 WeakPolarHBondContact CA-O 3.5Å
399	F	83.4	Confident	78.1	Confident	2 Å²	2	72.2 Å²	72.2	1%	0.009	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	110.7	172.1	-58.9	-90.9	0	0	0	108.3	I294 L307 F362 F382 A388 A397 E401 T402 I404	I294-F399 HydrophobicContact CD1-CE2 4.09Å; I294-F399 HydrophobicContact CD1-CZ 4.01Å; L307-F399 HydrophobicContact CD1-CZ 4.23Å; L307-F399 HydrophobicContact CD2-CZ 4.14Å; F362-F399 HydrophobicContact CE1-CB 4.23Å; F362-F399 HydrophobicContact CZ-CB 3.91Å; F382-F399 HydrophobicContact CD1-CE1 4.16Å; F382-F399 AromaticContact CE1-CD1 3.9Å; F382-F399 HydrophobicContact CE1-CD1 3.9Å; F382-F399 AromaticContact CE1-CE1 3.63Å; F382-F399 HydrophobicContact CE1-CE1 3.63Å; A388-F399 HydrophobicContact CB-CD1 3.55Å; A388-F399 HydrophobicContact CB-CE1 3.5Å; A388-F399 HydrophobicContact CB-CZ 4.45Å; A397-F399 HydrophobicContact CB-CD2 4.24Å; A397-F399 HydrophobicContact CB-CE2 3.47Å; A397-F399 VanDerWaalsContact CB-CE2 3.47Å; A397-F399 HydrophobicContact CB-CZ 3.94Å; F399-E401 PolarHBondContact O-N 3.02Å; F399-T402 PolarHBondContact N-O 3.1Å; F399-T402 VanDerWaalsContact O-CB 3.24Å; F399-T402 WeakPolarHBondContact O-CB 3.36Å; F399-T402 PolarHBondContact O-N 3.27Å; F399-T402 PolarHBondContact O-OG1 3.42Å; F399-I404 HydrophobicContact CD2-CD1 3.63Å; F399-I404 HydrophobicContact CE2-CD1 4.08Å
400	G	72.4	Confident	76.4	Confident	43 Å²	43	75.5 Å²	75.5	44%	0.443	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	-120.9	-166.9	0	0	0	0	0	111.5	H386 K398	H386-G400 PolarHBondContact O-N 2.96Å; K398-G400 WeakPolarHBondContact CE-O 3.44Å; K398-G400 WeakPolarHBondContact CG-O 3.36Å
401	E	70.8	Confident	74.6	Confident	187 Å²	187	77.4 Å²	77.4	87%	0.874	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-19.8	174.1	-59.9	-168.6	150.7	0	0	113.4	F399	F399-E401 PolarHBondContact O-N 3.02Å
402	T	76.2	Confident	72.3	Confident	15 Å²	15	79 Å²	79	9%	0.092	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	137.1	-176.6	-33.8	0	0	0	0	111.1	H360 K398 F399 I404	H360-T402 WeakPolarHBondContact CD2-CG2 3.44Å; H360-T402 PolarHBondContact CD2-OG1 2.85Å; H360-T402 PolarHBondContact CE1-OG1 2.99Å; H360-T402 PolarHBondContact NE2-OG1 3.04Å; K398-T402 CarbonylContact C-O 3.59Å; K398-T402 WeakPolarHBondContact CA-O 3.5Å; F399-T402 PolarHBondContact N-O 3.1Å; F399-T402 VanDerWaalsContact O-CB 3.24Å; F399-T402 WeakPolarHBondContact O-CB 3.36Å; F399-T402 PolarHBondContact O-N 3.27Å; F399-T402 PolarHBondContact O-OG1 3.42Å; T402-I404 HydrophobicContact CG2-CD1 3.74Å; T402-I404 HydrophobicContact CG2-CG1 4.09Å
403	R	83.5	Confident	70.8	Confident	153 Å²	153	78.8 Å²	78.8	58%	0.577	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.2	131.5	163.9	-58.5	-171.3	-166.5	179.6	5.8	109.9	E396 A397	E396-R403 WeakPolarHBondContact OE2-CD 3.11Å; E396-R403 IonicContact OE2-NH1 3.66Å; A397-R403 WeakPolarHBondContact O-CA 3.38Å
404	I	85.4	Confident	68.6	Low	17 Å²	17	82.7 Å²	82.7	9%	0.087	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	132.6	-177.7	-73.7	134.4	0	0	0	107.5	I294 I357 E396 A397 F399 T402	I294-I404 HydrophobicContact CB-CG2 4.23Å; I294-I404 HydrophobicContact CG2-CG2 3.87Å; I357-I404 HydrophobicContact CB-CD1 4.33Å; I357-I404 HydrophobicContact CG2-CD1 3.52Å; I357-I404 HydrophobicContact CG2-CG1 4.18Å; E396-I404 CarbonylContact C-O 3.41Å; E396-I404 VanDerWaalsContact CA-O 3.32Å; E396-I404 WeakPolarHBondContact CA-O 3.49Å; A397-I404 PolarHBondContact N-O 3.44Å; A397-I404 PolarHBondContact O-N 2.8Å; F399-I404 HydrophobicContact CD2-CD1 3.63Å; F399-I404 HydrophobicContact CE2-CD1 4.08Å; T402-I404 HydrophobicContact CG2-CD1 3.74Å; T402-I404 HydrophobicContact CG2-CG1 4.09Å
405	R	83.9	Confident	66	Low	196 Å²	196	80.8 Å²	80.8	74%	0.74	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69	135.5	173.5	-73.3	-175.6	177.6	175.8	-0.1	110.1	L395	L395-R405 CarbonylContact O-C 3.57Å; L395-R405 WeakPolarHBondContact O-CA 3.46Å
406	L	81.8	Confident	63.6	Low	12 Å²	12	80.4 Å²	80.4	6%	0.063	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-74.2	137	170.3	-59.4	177.9	0	0	0	109	I292 I294 L307 I390 M392 L395 A397	I292-L406 HydrophobicContact CG2-CB 4.25Å; I292-L406 HydrophobicContact CG2-CD1 3.84Å; I292-L406 HydrophobicContact CG2-CD2 3.55Å; I292-L406 HydrophobicContact CG2-CG 4.07Å; I294-L406 HydrophobicContact CG2-CD2 3.9Å; L307-L406 HydrophobicContact CD1-CD2 3.83Å; I390-L406 HydrophobicContact CG2-CD1 3.81Å; M392-L406 HydrophobicContact SD-CD1 4.1Å; L395-L406 HydrophobicContact CB-CB 4.35Å; L395-L406 PolarHBondContact O-N 2.93Å; A397-L406 HydrophobicContact CB-CD2 3.64Å
407	H	77.1	Confident	61	Low	80 Å²	80	80.7 Å²	80.7	37%	0.37	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	148.9	165.4	-64.7	-74.4	0	0	0	109	T293	T293-H407 PolarHBondContact N-O 2.93Å; T293-H407 PolarHBondContact O-N 2.96Å; T293-H407 WeakPolarHBondContact OG1-CB 3.26Å
408	H	64.9	Low	58.5	Low	61 Å²	61	87 Å²	87	28%	0.282	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	117	170.3	-74.2	-46.6	0	0	0	108.3	R290 L395	R290-H408 HydrophobicContact CB-CB 4.42Å; R290-H408 HydrophobicContact CG-CB 4.36Å; L395-H408 VanDerWaalsContact CD2-NE2 3.27Å; L395-H408 WeakPolarHBondContact CD2-NE2 3.48Å
409	T	55.5	Low	56	Low	30 Å²	30	83.6 Å²	83.6	18%	0.184	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	103.7	178.2	-34.7	0	0	0	0	107.5	T293 E304 M411	T293-T409 PolarHBondContact OG1-OG1 3.08Å; E304-T409 PolarHBondContact OE1-OG1 3.38Å; T409-M411 VanDerWaalsContact C-N 3.28Å; T409-M411 HydrophobicContact CG2-CG 3.75Å; T409-M411 HydrophobicContact CG2-SD 4.22Å; T409-M411 PolarHBondContact O-N 3.02Å
410	D	46.3	Very low	53.6	Low	90 Å²	90	83.5 Å²	83.5	48%	0.481	43%	0.428	S	S	.	.			trans	-73	84.7	172.3	-80.4	-32.6	0	0	0	108.2	R290	R290-D410 WeakPolarHBondContact CG-OD1 3.29Å; R290-D410 IonicContact CZ-OD2 3.19Å; R290-D410 IonicContact NE-OD1 2.66Å; R290-D410 PolarHBondContact NE-OD1 3.35Å; R290-D410 IonicContact NE-OD2 3.15Å; R290-D410 IonicContact NH2-OD2 2.83Å; R290-D410 PolarHBondContact NH2-OD2 3.34Å
411	M	43.9	Very low	51.6	Low	90 Å²	90	81.7 Å²	81.7	44%	0.443	41%	0.408	S	S	.	.			trans	-103.6	128.3	172.3	-65.7	-166.8	97.8	0	0	111.3	T409 F413	T409-M411 VanDerWaalsContact C-N 3.28Å; T409-M411 HydrophobicContact CG2-CG 3.75Å; T409-M411 HydrophobicContact CG2-SD 4.22Å; T409-M411 PolarHBondContact O-N 3.02Å; M411-F413 VanDerWaalsContact C-N 3.29Å; M411-F413 HydrophobicContact CB-CD2 3.58Å; M411-F413 HydrophobicContact CB-CE2 3.38Å; M411-F413 HydrophobicContact CB-CZ 4.21Å; M411-F413 HydrophobicContact CE-CZ 4.19Å; M411-F413 HydrophobicContact CG-CE2 4.01Å; M411-F413 PolarHBondContact O-N 3.1Å; M411-F413 HydrophobicContact SD-CE2 3.52Å; M411-F413 VanDerWaalsContact SD-CE2 3.52Å; M411-F413 HydrophobicContact SD-CZ 3.65Å
412	S	32.6	Very low	49.7	Very low	119 Å²	119	74.7 Å²	74.7	83%	0.832	38%	0.379	S	S	*	.			trans	-78	71.2	175.6	42.8	0	0	0	0	111.8
413	F	41.3	Very low	47.5	Very low	95 Å²	95	78.1 Å²	78.1	42%	0.417	40%	0.397	S	S	.	.			trans	-78.9	124.9	175.8	-77.1	-69.1	0	0	0	112.7	L291 W374 M411 A415 V416	L291-F413 HydrophobicContact CD1-CD2 4.3Å; L291-F413 HydrophobicContact CD1-CE2 4.22Å; W374-F413 HydrophobicContact CZ2-CE2 4.32Å; M411-F413 VanDerWaalsContact C-N 3.29Å; M411-F413 HydrophobicContact CB-CD2 3.58Å; M411-F413 HydrophobicContact CB-CE2 3.38Å; M411-F413 HydrophobicContact CB-CZ 4.21Å; M411-F413 HydrophobicContact CE-CZ 4.19Å; M411-F413 HydrophobicContact CG-CE2 4.01Å; M411-F413 PolarHBondContact O-N 3.1Å; M411-F413 HydrophobicContact SD-CE2 3.52Å; M411-F413 VanDerWaalsContact SD-CE2 3.52Å; M411-F413 HydrophobicContact SD-CZ 3.65Å; F413-A415 PolarHBondContact O-N 3.16Å; F413-A415 VanDerWaalsContact O-N 3.13Å; F413-V416 HydrophobicContact CB-CG2 4.19Å; F413-V416 HydrophobicContact CD1-CG2 3.66Å; F413-V416 HydrophobicContact CE1-CG2 4.36Å; F413-V416 HydrophobicContact CG-CG2 4.13Å
414	K	25.8	Very low	44.9	Very low	199 Å²	199	75.5 Å²	75.5	87%	0.865	40%	0.4	S	S	*	.	S	Bend	trans	-64	107.1	154.9	-81.2	-177.1	175.1	178.8	0	108.1	V416	K414-V416 VanDerWaalsContact C-N 3.33Å; K414-V416 PolarHBondContact O-N 3.16Å
415	A	25.3	Very low	42.3	Very low	106 Å²	106	78.9 Å²	78.9	88%	0.876	42%	0.421	S	S	*	.			trans	23.5	63.1	162.7	0	0	0	0	0	115.7	F413	F413-A415 PolarHBondContact O-N 3.16Å; F413-A415 VanDerWaalsContact O-N 3.13Å
416	V	30.7	Very low	39.7	Very low	60 Å²	60	80.6 Å²	80.6	36%	0.364	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-75.1	127.5	170.2	176.3	0	0	0	0	107.4	T373 F413 K414 Y418	T373-V416 HydrophobicContact CG2-CG1 3.88Å; F413-V416 HydrophobicContact CB-CG2 4.19Å; F413-V416 HydrophobicContact CD1-CG2 3.66Å; F413-V416 HydrophobicContact CE1-CG2 4.36Å; F413-V416 HydrophobicContact CG-CG2 4.13Å; K414-V416 VanDerWaalsContact C-N 3.33Å; K414-V416 PolarHBondContact O-N 3.16Å; V416-Y418 PolarHBondContact O-N 3.02Å
417	S	29.3	Very low	37.2	Very low	53 Å²	53	87.1 Å²	87.1	37%	0.371	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-55.6	121.3	178.8	29.9	0	0	0	0	110.7	S341 D343 V419	S341-S417 WeakPolarHBondContact OG-CB 3.44Å; D343-S417 WeakPolarHBondContact OD2-CB 3.46Å; S417-V419 PolarHBondContact O-N 3.44Å; S417-V419 VanDerWaalsContact O-N 3.12Å
418	Y	32.7	Very low	34.8	Very low	131 Å²	131	89.9 Å²	89.9	51%	0.514	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-53	118.8	173.6	-100.6	-93.4	0	0	0	109.1	T339 A340 V416 G420	T339-Y418 WeakPolarHBondContact CB-O 3.24Å; A340-Y418 WeakPolarHBondContact CB-O 3.36Å; A340-Y418 PolarHBondContact N-O 2.79Å; V416-Y418 PolarHBondContact O-N 3.02Å; Y418-G420 PolarHBondContact O-N 3.36Å
419	V	33.8	Very low	33.2	Very low	16 Å²	16	92.2 Å²	92.2	10%	0.097	49%	0.494	C	S	.	.			trans	-79.8	57.3	179.7	-171.8	0	0	0	0	110.3	A311 L315 L345 I377 S417 I421	A311-V419 WeakPolarHBondContact CB-O 3.21Å; L315-V419 HydrophobicContact CD1-CG1 3.67Å; L345-V419 HydrophobicContact CD2-CG1 3.57Å; I377-V419 HydrophobicContact CD1-CB 4.4Å; S417-V419 PolarHBondContact O-N 3.44Å; S417-V419 VanDerWaalsContact O-N 3.12Å; V419-I421 HydrophobicContact CG1-CD1 4.37Å; V419-I421 HydrophobicContact CG1-CG1 4.17Å; V419-I421 PolarHBondContact O-N 2.82Å
420	G	32.6	Very low	31.9	Very low	1 Å²	1	94.2 Å²	94.2	1%	0.01	52%	0.522	C	S	.	.			trans	-85.4	89.2	176.5	0	0	0	0	0	112.1	G310 T339 A340 Y418 S422	G310-G420 CarbonylContact O-C 3.55Å; G310-G420 WeakPolarHBondContact O-CA 3.47Å; T339-G420 CarbonylContact C-O 3.56Å; T339-G420 VanDerWaalsContact C-O 3.26Å; A340-G420 PolarHBondContact N-O 3.29Å; Y418-G420 PolarHBondContact O-N 3.36Å; G420-S422 PolarHBondContact O-N 3.46Å
421	I	30.3	Very low	31.1	Very low	5 Å²	5	96.7 Å²	96.7	3%	0.026	54%	0.535	C	S	.	.			trans	-64.2	122.2	-172.3	-64.3	157.5	0	0	0	112.3	A311 S312 A313 L315 L337 L338 V419	A311-I421 HydrophobicContact CB-CD1 4.5Å; S312-I421 WeakPolarHBondContact CB-O 3.32Å; S312-I421 VanDerWaalsContact OG-CB 3.32Å; S312-I421 WeakPolarHBondContact OG-CB 3.47Å; S312-I421 VanDerWaalsContact OG-CG2 3.24Å; S312-I421 WeakPolarHBondContact OG-CG2 3.45Å; S312-I421 PolarHBondContact OG-O 3.3Å; A313-I421 HydrophobicContact CB-CD1 4.22Å; L315-I421 HydrophobicContact CD1-CD1 3.8Å; L315-I421 HydrophobicContact CD2-CD1 3.77Å; L315-I421 HydrophobicContact CG-CD1 3.93Å; L337-I421 HydrophobicContact CB-CG1 4.25Å; L337-I421 HydrophobicContact CB-CG2 3.96Å; L337-I421 HydrophobicContact CD1-CD1 3.65Å; L337-I421 HydrophobicContact CD1-CG1 4.03Å; L337-I421 HydrophobicContact CD1-CG2 4.12Å; L337-I421 HydrophobicContact CD2-CG2 3.9Å; L337-I421 HydrophobicContact CG-CG2 4.2Å; L338-I421 CarbonylContact O-C 3.6Å; L338-I421 WeakPolarHBondContact O-CA 3.12Å; V419-I421 HydrophobicContact CG1-CD1 4.37Å; V419-I421 HydrophobicContact CG1-CG1 4.17Å; V419-I421 PolarHBondContact O-N 2.82Å
422	S	30.2	Very low	30.4	Very low	39 Å²	39	103.2 Å²	103.2	27%	0.273	55%	0.554	S	S	.	*	B	Isolated β-bridge	trans	-108.8	149.4	166.2	-42.7	0	0	0	0	110.2	L338 G420	L338-S422 PolarHBondContact O-N 3.29Å; G420-S422 PolarHBondContact O-N 3.46Å
423	D	30.4	Very low	30.3	Very low	87 Å²	87	104.9 Å²	104.9	47%	0.465	55%	0.552	S	S	.	*			trans	70.8	116.7	176.9	-59.5	-25.9	0	0	0	118.9	V425	D423-V425 PolarHBondContact O-N 2.85Å
424	P	29.9	Very low	29.8	Very low	99 Å²	99	107.7 Å²	107.7	64%	0.643	57%	0.571	S	S	*	*			trans	-75.5	101.7	148.8	26.2	-17.5	0	0	0	108.6	R426	P424-R426 PolarHBondContact O-N 3.49Å
425	V	30.8	Very low	30.3	Very low	87 Å²	87	103.3 Å²	103.3	53%	0.527	56%	0.561	S	S	.	*			trans	-59.1	117.5	179.9	176	0	0	0	0	110.8	D423 Q427	D423-V425 PolarHBondContact O-N 2.85Å; V425-Q427 PolarHBondContact O-N 3.02Å
426	R	28.8	Very low	30.5	Very low	233 Å²	233	107 Å²	107	88%	0.879	56%	0.56	S	S	*	*			trans	-64.8	124.7	165.9	-82.3	-174.1	173.1	-174.4	-1.7	109.5	P424 V428	P424-R426 PolarHBondContact O-N 3.49Å; R426-V428 PolarHBondContact O-N 3.05Å
427	Q	29.4	Very low	30.5	Very low	148 Å²	148	112.9 Å²	112.9	69%	0.692	58%	0.581	S	S	*	*			trans	-66.3	102.6	178.8	-174.7	175.1	16.6	0	0	111.1	V425 N429	V425-Q427 PolarHBondContact O-N 3.02Å; Q427-N429 VanDerWaalsContact C-N 3.28Å; Q427-N429 HydrophobicContact CG-CB 4.41Å; Q427-N429 WeakPolarHBondContact CG-OD1 3.48Å; Q427-N429 VanDerWaalsContact NE2-CG 3.34Å; Q427-N429 PolarHBondContact NE2-ND2 2.68Å; Q427-N429 VanDerWaalsContact NE2-ND2 3.16Å; Q427-N429 PolarHBondContact NE2-OD1 2.88Å; Q427-N429 PolarHBondContact O-N 3.02Å; Q427-N429 VanDerWaalsContact O-N 3.07Å
428	V	26.9	Very low	30.7	Very low	139 Å²	139	121.7 Å²	121.7	84%	0.842	62%	0.624	S	S	*	*			trans	-78.5	84.7	162.5	-177.2	0	0	0	0	107.6	R426 G430	R426-V428 PolarHBondContact O-N 3.05Å; V428-G430 PolarHBondContact O-N 3.18Å
429	N	30.5	Very low	30.6	Very low	109 Å²	109	121.3 Å²	121.3	58%	0.583	63%	0.629	S	S	*	*			trans	-70.3	82.2	169	-92.1	-13	0	0	0	109.6	Q427 N431	Q427-N429 VanDerWaalsContact C-N 3.28Å; Q427-N429 HydrophobicContact CG-CB 4.41Å; Q427-N429 WeakPolarHBondContact CG-OD1 3.48Å; Q427-N429 VanDerWaalsContact NE2-CG 3.34Å; Q427-N429 PolarHBondContact NE2-ND2 2.68Å; Q427-N429 VanDerWaalsContact NE2-ND2 3.16Å; Q427-N429 PolarHBondContact NE2-OD1 2.88Å; Q427-N429 PolarHBondContact O-N 3.02Å; Q427-N429 VanDerWaalsContact O-N 3.07Å; N429-N431 PolarHBondContact O-N 2.98Å
430	G	27.5	Very low	30.5	Very low	73 Å²	73	126.8 Å²	126.8	75%	0.753	66%	0.657	S	S	*	*			trans	-73	62.4	162	0	0	0	0	0	110.9	V428	V428-G430 PolarHBondContact O-N 3.18Å
431	N	30.2	Very low	30.4	Very low	142 Å²	142	133.8 Å²	133.8	76%	0.759	69%	0.693	S	S	*	*			trans	-122.8	130	172.3	-97.6	-19.1	0	0	0	110.1	N429 I433	N429-N431 PolarHBondContact O-N 2.98Å; N431-I433 PolarHBondContact O-N 3.42Å
432	R	29.4	Very low	30.4	Very low	227 Å²	227	141.4 Å²	141.4	86%	0.857	73%	0.733	S	S	*	*			trans	-45.9	128.6	-175.5	-74	169	162.6	165.3	-9.2	112.4	L434	R432-L434 VanDerWaalsContact C-N 3.33Å; R432-L434 PolarHBondContact O-N 2.89Å; R432-L434 VanDerWaalsContact O-N 3.07Å
433	I	29.6	Very low	30.4	Very low	153 Å²	153	147.8 Å²	147.8	79%	0.785	76%	0.761	S	S	*	*			trans	-65.7	101.1	148.6	-61.8	172.6	0	0	0	105.7	N431 T435	N431-I433 PolarHBondContact O-N 3.42Å; I433-T435 HydrophobicContact CG2-CG2 3.89Å
434	L	31.8	Very low	30.4	Very low	154 Å²	154	151.8 Å²	151.8	81%	0.806	78%	0.781	S	S	*	*			trans	-86.7	99.4	153.2	-77.8	168.7	0	0	0	105.6	R432	R432-L434 VanDerWaalsContact C-N 3.33Å; R432-L434 PolarHBondContact O-N 2.89Å; R432-L434 VanDerWaalsContact O-N 3.07Å
435	T	36.4	Very low	30.4	Very low	108 Å²	108	155.6 Å²	155.6	66%	0.663	79%	0.791	S	S	*	*			trans	-66.8	135.8	161.5	32.4	0	0	0	0	108.5	I433 K437	I433-T435 HydrophobicContact CG2-CG2 3.89Å; T435-K437 PolarHBondContact O-N 3.03Å
436	E	28.9	Very low	30.4	Very low	184 Å²	184	160.8 Å²	160.8	86%	0.86	81%	0.811	S	S	*	*	S	Bend	trans	-59.3	125.9	170.6	-167.4	172.9	-168.9	0	0	109.5
437	K	31.6	Very low	30.5	Very low	183 Å²	183	154.8 Å²	154.8	80%	0.796	81%	0.806	S	S	*	*			trans	77.6	83.1	-172.7	-51	172.1	-177.2	175.8	0	116	T435	T435-K437 PolarHBondContact O-N 3.03Å
438	D	33.8	Very low	30.6	Very low	238 Å²	238	155.5 Å²	155.5	100%	1.273	82%	0.816	S	S	*	*				-174.6	0	108.8	-86.2	-16.7	0	0	0	110.7

Retrieved 438 of 438 residues in 111.6 ms (Link to these results)

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