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ATP-binding cassette sub-family G member 5

ABCG5 and ABCG8 form an obligate heterodimer that mediates Mg(2+)- and ATP-dependent sterol transport across the cell membrane. Plays an essential role in the selective transport of dietary plant sterols and cholesterol in and out of the enterocytes and in the selective sterol excretion by the liver into bile. Required for normal sterol homeostasis. The heterodimer with ABCG8 has ATPase activity.

AlphaFold DB , UniProt , Accession A0A096NRF1, Species PAPAN (Papio anubis, Olive baboon), Gene ABCG5, Length 651 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.5	Very low	28.1	Very low	250 Å²	250	133.4 Å²	133.4	100%	1.232	83%	0.825	S	S	*	*				0	75.8	0	-75.9	170.7	168.1	0	0	105
2	G	31.2	Very low	28.3	Very low	72 Å²	72	132.8 Å²	132.8	74%	0.742	83%	0.83	S	S	*	*				82.5	129.2	79.4	0	0	0	0	0	107.3
3	D	29.5	Very low	28.1	Very low	155 Å²	155	132.9 Å²	132.9	83%	0.829	83%	0.83	S	S	*	*			cis	-177.9	171.8	-6.4	-136.1	-22.4	0	0	0	104.3
4	L	26.7	Very low	27.9	Very low	158 Å²	158	128 Å²	128	83%	0.827	82%	0.817	S	S	*	*			trans	88.6	136.9	165.3	-57.9	149.2	0	0	0	117.6
5	S	27.4	Very low	27.7	Very low	93 Å²	93	130.9 Å²	130.9	65%	0.65	82%	0.823	S	S	*	*			cis	-178.2	136.7	-31.8	39.4	0	0	0	0	105.4
6	F	27.3	Very low	27.4	Very low	202 Å²	202	134.6 Å²	134.6	89%	0.886	83%	0.827	S	S	*	*			trans	-48.8	142.5	166	-93.7	-104.9	0	0	0	112.2
7	L	25.9	Very low	27.4	Very low	161 Å²	161	134.3 Å²	134.3	84%	0.843	82%	0.824	S	S	*	*			trans	-167.3	109.1	148.6	-100.8	159.5	0	0	0	110
8	S	25.9	Very low	27.2	Very low	103 Å²	103	135.6 Å²	135.6	72%	0.72	83%	0.825	S	S	*	*			trans	-75.2	150.8	148.9	33.6	0	0	0	0	109
9	P	31	Very low	27.1	Very low	123 Å²	123	141.4 Å²	141.4	80%	0.799	83%	0.831	S	S	*	*				-143	158.7	110.8	33.7	-17.3	0	0	0	113.7
10	G	24.7	Very low	26.9	Very low	82 Å²	82	137.6 Å²	137.6	85%	0.845	82%	0.822	S	S	*	*			trans	-67.9	164.1	173.8	0	0	0	0	0	113.9
11	G	24.6	Very low	26.7	Very low	68 Å²	68	136.9 Å²	136.9	70%	0.701	82%	0.824	S	S	*	*			trans	171.8	96.2	174	0	0	0	0	0	110.6	T13	G11-T13 PolarHBondContact O-N 3.15Å; G11-T13 VanDerWaalsContact O-N 3.15Å
12	S	30.9	Very low	26.4	Very low	126 Å²	126	134.1 Å²	134.1	88%	0.881	81%	0.808	S	S	*	*			trans	-61.5	103.6	170.7	39.4	0	0	0	0	111	G14	S12-G14 PolarHBondContact O-N 3.43Å
13	T	25.8	Very low	26.1	Very low	135 Å²	135	135.9 Å²	135.9	83%	0.828	81%	0.809	S	S	*	*			trans	-94.8	84.9	166.2	48.8	0	0	0	0	109.5	G11	G11-T13 PolarHBondContact O-N 3.15Å; G11-T13 VanDerWaalsContact O-N 3.15Å
14	G	25.3	Very low	25.9	Very low	64 Å²	64	134.1 Å²	134.1	66%	0.66	81%	0.809	S	S	*	*			trans	-65.4	133.4	157	0	0	0	0	0	109.1	S12 Q16	S12-G14 PolarHBondContact O-N 3.43Å; G14-Q16 PolarHBondContact O-N 3.22Å
15	L	24.5	Very low	25.9	Very low	172 Å²	172	134.8 Å²	134.8	90%	0.901	81%	0.813	S	S	*	*			trans	-58.1	101.6	168.6	-94.2	91.6	0	0	0	109	V17	L15-V17 PolarHBondContact O-N 2.92Å
16	Q	23.4	Very low	25.8	Very low	190 Å²	190	139.6 Å²	139.6	89%	0.888	83%	0.825	S	S	*	*			trans	-74	103.2	163.3	-81.3	-171.9	-14.2	0	0	108.5	G14 N18	G14-Q16 PolarHBondContact O-N 3.22Å; Q16-N18 PolarHBondContact O-N 3.32Å
17	V	28	Very low	25.8	Very low	129 Å²	129	133.8 Å²	133.8	78%	0.782	82%	0.821	S	S	*	*			trans	-67.9	117	162.9	175.5	0	0	0	0	107.7	L15 R19	L15-V17 PolarHBondContact O-N 2.92Å; V17-R19 PolarHBondContact O-N 3.14Å; V17-R19 VanDerWaalsContact O-N 3.15Å
18	N	23.1	Very low	25.7	Very low	157 Å²	157	130.5 Å²	130.5	84%	0.84	82%	0.818	S	S	*	*			trans	-59.2	108.2	-178.6	-151	3.7	0	0	0	110.5	Q16 G20	Q16-N18 PolarHBondContact O-N 3.32Å; N18-G20 PolarHBondContact O-N 3.15Å; N18-G20 VanDerWaalsContact O-N 3.14Å
19	R	24.5	Very low	25.8	Very low	247 Å²	247	131.4 Å²	131.4	93%	0.932	82%	0.821	S	S	*	*			trans	-77.5	91.5	170.8	-85.1	-176.1	175.7	178.8	-0.8	109	V17	V17-R19 PolarHBondContact O-N 3.14Å; V17-R19 VanDerWaalsContact O-N 3.15Å
20	G	23.5	Very low	25.7	Very low	64 Å²	64	130.4 Å²	130.4	66%	0.66	82%	0.823	S	S	*	*			trans	-67.8	132.7	165.3	0	0	0	0	0	111.2	N18 Q22	N18-G20 PolarHBondContact O-N 3.15Å; N18-G20 VanDerWaalsContact O-N 3.14Å; G20-Q22 PolarHBondContact O-N 3.31Å
21	S	24.1	Very low	26.1	Very low	123 Å²	123	132.2 Å²	132.2	86%	0.86	82%	0.818	S	S	*	*			trans	-45	114.1	178.7	49.6	0	0	0	0	114.4
22	Q	26.6	Very low	26.8	Very low	192 Å²	192	133.6 Å²	133.6	90%	0.897	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-83.2	116.3	163.7	-80	-179.2	-19.5	0	0	109.5	G20 S24	G20-Q22 PolarHBondContact O-N 3.31Å; Q22-S24 PolarHBondContact O-N 3.25Å
23	S	25	Very low	27.9	Very low	109 Å²	109	133.3 Å²	133.3	76%	0.762	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-64.6	124.6	159.9	51.9	0	0	0	0	109.4	L25	S23-L25 PolarHBondContact O-N 3.41Å
24	S	24.9	Very low	29.7	Very low	118 Å²	118	132 Å²	132	83%	0.825	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-52	118.6	175.8	44.2	0	0	0	0	113.5	Q22	Q22-S24 PolarHBondContact O-N 3.25Å
25	L	27	Very low	32	Very low	173 Å²	173	133 Å²	133	91%	0.906	79%	0.79	S	S	*	*			trans	-115.9	118.9	154.4	-106.2	143	0	0	0	106.1	S23	S23-L25 PolarHBondContact O-N 3.41Å
26	E	26.8	Very low	34.8	Very low	194 Å²	194	125.6 Å²	125.6	91%	0.907	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-59.7	154.4	-169.6	-74.1	169.2	131.1	0	0	113.6
27	G	25.8	Very low	37.9	Very low	79 Å²	79	116.9 Å²	116.9	81%	0.814	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-73.7	133.8	-161.6	0	0	0	0	0	114.7
28	A	23.7	Very low	40.8	Very low	92 Å²	92	110.7 Å²	110.7	76%	0.76	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-91.2	137.5	149.2	0	0	0	0	0	108	A30	A28-A30 PolarHBondContact O-N 3.49Å
29	P	28.3	Very low	44	Very low	122 Å²	122	103.3 Å²	103.3	79%	0.792	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-62.8	124.5	179.8	25.1	-31.2	0	0	0	109.5	T31	P29-T31 VanDerWaalsContact C-N 3.35Å; P29-T31 PolarHBondContact O-N 3.18Å
30	A	30.3	Very low	47.2	Very low	102 Å²	102	91.6 Å²	91.6	84%	0.843	59%	0.59	S	S	*	*			trans	-63.8	95.5	172.8	0	0	0	0	0	108.8	A28 A32	A28-A30 PolarHBondContact O-N 3.49Å; A30-A32 PolarHBondContact O-N 3.45Å; A30-A32 VanDerWaalsContact O-N 3.09Å
31	T	32.4	Very low	50.5	Low	120 Å²	120	89.6 Å²	89.6	74%	0.736	56%	0.564	S	S	*	*			trans	-53.9	114.9	164.1	39.5	0	0	0	0	107.8	P29 L33	P29-T31 VanDerWaalsContact C-N 3.35Å; P29-T31 PolarHBondContact O-N 3.18Å; T31-L33 PolarHBondContact O-N 3.05Å
32	A	38.6	Very low	53.7	Low	97 Å²	97	87.9 Å²	87.9	80%	0.802	54%	0.542	S	S	*	.			trans	-52.5	110.7	174.2	0	0	0	0	0	108.6	A30 E34	A30-A32 PolarHBondContact O-N 3.45Å; A30-A32 VanDerWaalsContact O-N 3.09Å; A32-E34 PolarHBondContact O-N 3.09Å
33	L	55.2	Low	56.8	Low	120 Å²	120	78.8 Å²	78.8	63%	0.628	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-66.5	126.2	-179.1	-84	120.6	0	0	0	109	T31 N242	T31-L33 PolarHBondContact O-N 3.05Å; L33-N242 HydrophobicContact CB-CB 4.45Å; L33-N242 HydrophobicContact CD2-CB 3.69Å; L33-N242 VanDerWaalsContact CD2-ND2 3.27Å; L33-N242 WeakPolarHBondContact CD2-ND2 3.4Å
34	E	62.9	Low	60	Low	108 Å²	108	74.4 Å²	74.4	51%	0.505	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-62.2	134	-180	-65	-177	166.9	0	0	111	A32 H36 N242 L351	A32-E34 PolarHBondContact O-N 3.09Å; E34-H36 PolarHBondContact O-N 3.22Å; E34-N242 PolarHBondContact O-ND2 2.71Å; E34-L351 HydrophobicContact CB-CD2 4.1Å; E34-L351 HydrophobicContact CG-CD2 4.37Å; E34-L351 WeakPolarHBondContact OE2-CD2 3.33Å
35	P	73.1	Confident	63.1	Low	84 Å²	84	69.3 Å²	69.3	55%	0.545	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-73.1	117.9	179.3	28.6	-32.9	0	0	0	110.2	L351	P35-L351 VanDerWaalsContact O-CD1 3.3Å; P35-L351 WeakPolarHBondContact O-CD1 3.43Å
36	H	84.3	Confident	66.1	Low	17 Å²	17	62 Å²	62	8%	0.079	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-81.5	151.7	166.2	-54.2	-53.1	0	0	0	110.5	E34 E77 S78 N116 I244	E34-H36 PolarHBondContact O-N 3.22Å; H36-E77 CarbonylContact O-C 3.56Å; H36-E77 WeakPolarHBondContact O-CA 3.47Å; H36-S78 PolarHBondContact O-N 3.32Å; H36-N116 VanDerWaalsContact CA-OD1 3.3Å; H36-N116 WeakPolarHBondContact CA-OD1 3.43Å; H36-N116 PolarHBondContact ND1-ND2 3.47Å; H36-I244 HydrophobicContact CB-CD1 4.27Å
37	S	87.7	Confident	68.9	Low	7 Å²	7	53.4 Å²	53.4	5%	0.049	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	144.3	178.8	64.5	0	0	0	0	112.2	V115 N116 T345	S37-V115 WeakPolarHBondContact O-CA 3.46Å; S37-N116 PolarHBondContact N-OD1 3.46Å; S37-N116 PolarHBondContact O-N 3.03Å; S37-N116 PolarHBondContact O-OD1 2.9Å; S37-N116 WeakPolarHBondContact OG-CA 3.38Å; S37-T345 WeakPolarHBondContact OG-CG2 3.32Å
38	L	90.3	Very high	71.5	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	118.6	175.7	174.7	64.8	0	0	0	108.5	Y75 V76 M99 V113 V115 F129 V213 I244 V246	L38-Y75 CarbonylContact O-C 3.58Å; L38-Y75 WeakPolarHBondContact O-CA 3.43Å; L38-V76 PolarHBondContact N-O 3.09Å; L38-V76 PolarHBondContact O-N 3.22Å; L38-M99 HydrophobicContact CD2-CE 3.57Å; L38-M99 HydrophobicContact CG-CE 4.34Å; L38-V113 HydrophobicContact CD1-CG1 4.12Å; L38-V115 HydrophobicContact CD1-CG2 3.87Å; L38-F129 HydrophobicContact CD1-CE1 3.72Å; L38-F129 HydrophobicContact CD1-CZ 3.64Å; L38-F129 HydrophobicContact CD2-CE1 4.07Å; L38-V213 HydrophobicContact CD2-CG1 3.86Å; L38-I244 HydrophobicContact CB-CD1 3.77Å; L38-I244 HydrophobicContact CB-CG2 4.38Å; L38-I244 HydrophobicContact CD2-CG2 4.02Å; L38-V246 HydrophobicContact CD2-CG2 4.21Å
39	G	90.3	Very high	73.6	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.01	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	146.6	177.5	0	0	0	0	0	111.6	L74 Y114	G39-L74 CarbonylContact C-O 3.55Å; G39-L74 WeakPolarHBondContact CA-O 3.36Å; G39-Y114 PolarHBondContact N-O 2.68Å; G39-Y114 PolarHBondContact O-N 3.48Å
40	I	91.8	Very high	75.4	Confident	2 Å²	2	55 Å²	55	1%	0.01	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	136	168.9	-53.1	176.5	0	0	0	107.3	A43 S73 L74 L95 M99 V113 I342	I40-A43 HydrophobicContact CG2-CB 3.41Å; I40-A43 VanDerWaalsContact CG2-CB 3.41Å; I40-S73 CarbonylContact O-C 3.6Å; I40-S73 WeakPolarHBondContact O-CA 3.08Å; I40-L74 HydrophobicContact CB-CD1 4.24Å; I40-L74 HydrophobicContact CB-CG 4.08Å; I40-L74 HydrophobicContact CD1-CD1 3.55Å; I40-L74 HydrophobicContact CD1-CD2 3.86Å; I40-L74 HydrophobicContact CD1-CG 3.67Å; I40-L74 HydrophobicContact CG1-CD1 3.7Å; I40-L74 HydrophobicContact CG1-CG 4.01Å; I40-L74 PolarHBondContact N-O 3.35Å; I40-L74 PolarHBondContact O-N 3.35Å; I40-L95 HydrophobicContact CD1-CD1 4.18Å; I40-M99 HydrophobicContact CD1-CE 3.91Å; I40-M99 HydrophobicContact CD1-CG 3.24Å; I40-M99 HydrophobicContact CD1-SD 3.61Å; I40-M99 HydrophobicContact CG1-CG 4.3Å; I40-V113 HydrophobicContact CG1-CG2 4.44Å; I40-I342 WeakPolarHBondContact O-CD1 3.3Å
41	L	91.8	Very high	76.6	Confident	21 Å²	21	54.1 Å²	54.1	11%	0.11	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	128	177.6	-171.8	64.2	0	0	0	110.9	A43 G111 E112 Y114 L339	L41-A43 PolarHBondContact O-N 2.81Å; L41-G111 WeakPolarHBondContact O-CA 3.47Å; L41-E112 PolarHBondContact N-O 2.98Å; L41-E112 PolarHBondContact O-N 3.31Å; L41-Y114 HydrophobicContact CB-CD2 4.36Å; L41-Y114 HydrophobicContact CB-CE2 3.7Å; L41-Y114 HydrophobicContact CD2-CE2 4.23Å; L41-L339 HydrophobicContact CD1-CD2 3.61Å
42	H	91.6	Very high	77.8	Confident	88 Å²	88	55.7 Å²	55.7	41%	0.407	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	51.6	38.1	172.2	-61.4	-57.4	0	0	0	114.4	S44 D71 V72 S73 G111	H42-S44 PolarHBondContact O-N 3.04Å; H42-D71 WeakPolarHBondContact CA-OD1 3.34Å; H42-D71 WeakPolarHBondContact CB-OD1 3.48Å; H42-D71 IonicContact CE1-OD1 2.67Å; H42-D71 IonicContact CG-OD1 2.72Å; H42-D71 IonicContact ND1-OD1 3.22Å; H42-D71 PolarHBondContact ND1-OD1 3.01Å; H42-D71 IonicContact ND1-OD2 3.4Å; H42-D71 PolarHBondContact ND1-OD2 2.75Å; H42-V72 PolarHBondContact N-O 3.01Å; H42-S73 PolarHBondContact N-OG 2.92Å; H42-G111 WeakPolarHBondContact O-CA 3.33Å
43	A	90.4	Very high	78.7	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.008	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	116.3	-178	0	0	0	0	0	111.4	I40 L41 D71 V72 F109 L110	I40-A43 HydrophobicContact CG2-CB 3.41Å; I40-A43 VanDerWaalsContact CG2-CB 3.41Å; L41-A43 PolarHBondContact O-N 2.81Å; A43-D71 PolarHBondContact O-N 3.15Å; A43-V72 HydrophobicContact CB-CB 4.44Å; A43-V72 WeakPolarHBondContact CB-O 3.44Å; A43-V72 PolarHBondContact N-O 2.89Å; A43-V72 PolarHBondContact O-N 3.18Å; A43-F109 HydrophobicContact CB-CE2 4.01Å; A43-F109 HydrophobicContact CB-CZ 4.15Å; A43-L110 CarbonylContact C-O 3.34Å; A43-L110 VanDerWaalsContact CA-O 3.31Å; A43-L110 WeakPolarHBondContact CA-O 3.25Å
44	S	92.6	Very high	78.8	Confident	17 Å²	17	58.1 Å²	58.1	12%	0.119	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	143.5	173.7	-57.5	0	0	0	0	110.3	H42 L69 D71 F109 L110	H42-S44 PolarHBondContact O-N 3.04Å; S44-L69 WeakPolarHBondContact CA-O 3.46Å; S44-D71 PolarHBondContact OG-N 3.38Å; S44-F109 CarbonylContact O-C 3.53Å; S44-F109 WeakPolarHBondContact O-CA 3.02Å; S44-L110 PolarHBondContact N-O 3.15Å; S44-L110 PolarHBondContact O-N 3.09Å
45	Y	91.6	Very high	78.8	Confident	11 Å²	11	61.1 Å²	61.1	4%	0.043	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	129.6	179.8	-175.4	-114.7	0	0	0	110.4	V47 I68 L69 T94 L103 R104 T108 F109	Y45-V47 HydrophobicContact CD1-CG2 3.99Å; Y45-V47 HydrophobicContact CE1-CG2 3.2Å; Y45-I68 HydrophobicContact CD1-CB 4.3Å; Y45-I68 HydrophobicContact CD1-CD1 4.33Å; Y45-I68 HydrophobicContact CE1-CD1 4.32Å; Y45-I68 PolarHBondContact O-N 2.71Å; Y45-L69 PolarHBondContact N-O 2.87Å; Y45-L69 PolarHBondContact O-N 3.1Å; Y45-T94 HydrophobicContact CD1-CG2 3.62Å; Y45-T94 HydrophobicContact CE1-CG2 4.12Å; Y45-T94 HydrophobicContact CG-CG2 4.46Å; Y45-L103 HydrophobicContact CD1-CD2 3.91Å; Y45-L103 HydrophobicContact CD2-CD1 3.64Å; Y45-L103 HydrophobicContact CD2-CD2 4.19Å; Y45-L103 HydrophobicContact CD2-CG 4.38Å; Y45-L103 HydrophobicContact CE1-CD2 3.76Å; Y45-L103 HydrophobicContact CE2-CB 4.09Å; Y45-L103 HydrophobicContact CE2-CD1 3.9Å; Y45-L103 HydrophobicContact CE2-CD2 4.06Å; Y45-L103 HydrophobicContact CE2-CG 4.24Å; Y45-L103 HydrophobicContact CG-CD1 4.05Å; Y45-L103 HydrophobicContact CG-CD2 4.11Å; Y45-R104 PolarHBondContact OH-O 3.45Å; Y45-T108 WeakPolarHBondContact CA-O 3.16Å; Y45-F109 HydrophobicContact CD2-CB 4.08Å; Y45-F109 HydrophobicContact CD2-CD2 4.48Å
46	S	89.5	Confident	78.2	Confident	20 Å²	20	59 Å²	59	14%	0.14	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	141.5	174.4	59.5	0	0	0	0	110.5	R66 G107 T108	S46-R66 CarbonylContact C-O 3.52Å; S46-R66 VanDerWaalsContact CA-O 3.31Å; S46-R66 WeakPolarHBondContact CA-O 3.38Å; S46-G107 CarbonylContact O-C 3.6Å; S46-G107 WeakPolarHBondContact O-CA 3.28Å; S46-T108 PolarHBondContact N-O 3.31Å; S46-T108 VanDerWaalsContact N-O 3.1Å; S46-T108 PolarHBondContact O-N 3.37Å; S46-T108 PolarHBondContact OG-OG1 3.33Å
47	V	85.6	Confident	77	Confident	12 Å²	12	64 Å²	64	7%	0.073	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	128.9	178.8	-178.3	0	0	0	0	109	Y45 H49 T65 R66 I68	Y45-V47 HydrophobicContact CD1-CG2 3.99Å; Y45-V47 HydrophobicContact CE1-CG2 3.2Å; V47-H49 WeakPolarHBondContact CG1-NE2 3.47Å; V47-T65 WeakPolarHBondContact O-CA 3.45Å; V47-R66 PolarHBondContact N-O 3.2Å; V47-R66 PolarHBondContact O-N 3.2Å; V47-I68 HydrophobicContact CB-CD1 4.14Å; V47-I68 HydrophobicContact CG2-CD1 3.42Å; V47-I68 VanDerWaalsContact CG2-CD1 3.42Å; V47-I68 HydrophobicContact CG2-CG1 4.28Å
48	S	79.2	Confident	75.5	Confident	40 Å²	40	69.9 Å²	69.9	28%	0.28	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	117.2	175.5	-58.1	0	0	0	0	110	W64 T65	S48-W64 WeakPolarHBondContact CA-O 3.45Å; S48-T65 PolarHBondContact OG-OG1 3.01Å
49	H	68.4	Low	73.6	Confident	111 Å²	111	71.1 Å²	71.1	51%	0.514	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	143.5	174.9	-76.1	-84.7	0	0	0	111.1	V47 W64	V47-H49 WeakPolarHBondContact CG1-NE2 3.47Å; H49-W64 PolarHBondContact N-O 3.47Å; H49-W64 PolarHBondContact O-N 3.3Å
50	R	65.2	Low	71.6	Confident	175 Å²	175	74.6 Å²	74.6	66%	0.66	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	128.8	166.4	-68.2	-173.5	-172.3	-168.6	0.2	108.7	R52	R50-R52 VanDerWaalsContact C-N 3.34Å; R50-R52 PolarHBondContact O-N 3.09Å
51	V	56.4	Low	69.7	Low	85 Å²	85	85.9 Å²	85.9	52%	0.515	41%	0.41	S	S	.	.	S	Bend	trans	-77.2	-19.5	-170.2	-177.2	0	0	0	0	112.6	W64	V51-W64 HydrophobicContact CG2-CB 3.85Å
52	R	57.4	Low	67.9	Low	152 Å²	152	91.6 Å²	91.6	57%	0.574	44%	0.436	S	S	*	.	S	Bend	trans	-137.6	160.1	-175.8	-71.2	-166.1	-178.6	-178	1.8	113.8	R50 D56	R50-R52 VanDerWaalsContact C-N 3.34Å; R50-R52 PolarHBondContact O-N 3.09Å; R52-D56 WeakPolarHBondContact CD-OD2 3.32Å; R52-D56 IonicContact CZ-OD2 4Å; R52-D56 IonicContact NH1-OD2 3.03Å; R52-D56 PolarHBondContact NH1-OD2 2.95Å
53	P	58	Low	66.6	Low	60 Å²	60	93.3 Å²	93.3	39%	0.39	44%	0.444	S	S	.	.			trans	-61	156.4	178.6	-18.2	30.5	0	0	0	112.7	W55 D56	P53-W55 HydrophobicContact CB-CD2 3.57Å; P53-W55 VanDerWaalsContact CB-CE2 3.43Å; P53-W55 HydrophobicContact CB-CE3 3.49Å; P53-W55 VanDerWaalsContact CB-CE3 3.49Å; P53-W55 HydrophobicContact CB-CG 4.49Å; P53-W55 HydrophobicContact CB-CH2 3.22Å; P53-W55 HydrophobicContact CB-CZ2 3.27Å; P53-W55 HydrophobicContact CB-CZ3 3.33Å; P53-W55 HydrophobicContact CG-CH2 3.68Å; P53-W55 HydrophobicContact CG-CZ2 3.44Å; P53-W55 VanDerWaalsContact CG-CZ2 3.44Å; P53-W55 HydrophobicContact CG-CZ3 4.29Å; P53-W55 PolarHBondContact O-N 3.07Å; P53-D56 PolarHBondContact O-N 3.41Å
54	W	56.2	Low	65.8	Low	208 Å²	208	100.8 Å²	100.8	79%	0.788	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-9.9	-171.7	62.2	-88.6	0	0	0	115.5
55	W	63	Low	65.2	Low	172 Å²	172	103.7 Å²	103.7	65%	0.652	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-5.8	-178.5	59.5	83.8	0	0	0	114.8	P53 V57	P53-W55 HydrophobicContact CB-CD2 3.57Å; P53-W55 VanDerWaalsContact CB-CE2 3.43Å; P53-W55 HydrophobicContact CB-CE3 3.49Å; P53-W55 VanDerWaalsContact CB-CE3 3.49Å; P53-W55 HydrophobicContact CB-CG 4.49Å; P53-W55 HydrophobicContact CB-CH2 3.22Å; P53-W55 HydrophobicContact CB-CZ2 3.27Å; P53-W55 HydrophobicContact CB-CZ3 3.33Å; P53-W55 HydrophobicContact CG-CH2 3.68Å; P53-W55 HydrophobicContact CG-CZ2 3.44Å; P53-W55 VanDerWaalsContact CG-CZ2 3.44Å; P53-W55 HydrophobicContact CG-CZ3 4.29Å; P53-W55 PolarHBondContact O-N 3.07Å; W55-V57 PolarHBondContact O-N 3.3Å
56	D	60.3	Low	64.9	Low	39 Å²	39	110.1 Å²	110.1	21%	0.209	51%	0.514	C	S	.	.			trans	-89	88.9	173.8	-172	1.5	0	0	0	110.4	R52 P53 T58 S59 C60	R52-D56 WeakPolarHBondContact CD-OD2 3.32Å; R52-D56 IonicContact CZ-OD2 4Å; R52-D56 IonicContact NH1-OD2 3.03Å; R52-D56 PolarHBondContact NH1-OD2 2.95Å; P53-D56 PolarHBondContact O-N 3.41Å; D56-T58 PolarHBondContact O-N 3.11Å; D56-T58 PolarHBondContact OD1-OG1 3.29Å; D56-S59 PolarHBondContact O-N 3.16Å; D56-S59 PolarHBondContact O-OG 3.08Å; D56-S59 PolarHBondContact OD2-OG 3.29Å; D56-C60 PolarHBondContact O-N 3.3Å
57	V	59.5	Low	64.8	Low	121 Å²	121	114 Å²	114	73%	0.733	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-26.3	-173.7	-174.7	0	0	0	0	112.4	W55 S59	W55-V57 PolarHBondContact O-N 3.3Å; V57-S59 PolarHBondContact O-N 3.37Å
58	T	57.1	Low	65.1	Low	132 Å²	132	115.6 Å²	115.6	81%	0.81	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-20.5	-176.5	63.7	0	0	0	0	113.8	D56	D56-T58 PolarHBondContact O-N 3.11Å; D56-T58 PolarHBondContact OD1-OG1 3.29Å
59	S	50.1	Low	65.7	Low	25 Å²	25	113.7 Å²	113.7	18%	0.175	52%	0.524	C	S	.	.	S	Bend	trans	-118.3	9.8	-174.9	60	0	0	0	0	113.6	D56 V57 R61 Q62	D56-S59 PolarHBondContact O-N 3.16Å; D56-S59 PolarHBondContact O-OG 3.08Å; D56-S59 PolarHBondContact OD2-OG 3.29Å; V57-S59 PolarHBondContact O-N 3.37Å; S59-R61 PolarHBondContact O-N 3.33Å; S59-Q62 PolarHBondContact O-N 3.49Å
60	C	47.2	Very low	66.9	Low	75 Å²	75	111 Å²	111	51%	0.507	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-12.1	180	-111.5	0	0	0	0	115.6	D56	D56-C60 PolarHBondContact O-N 3.3Å
61	R	51.6	Low	68.2	Low	239 Å²	239	105.6 Å²	105.6	90%	0.902	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-10.4	-180	-79.4	-175.2	174.6	-173.4	-1.1	115.8	S59 Q63	S59-R61 PolarHBondContact O-N 3.33Å; R61-Q63 PolarHBondContact O-N 3.21Å; R61-Q63 VanDerWaalsContact O-N 3.08Å
62	Q	55	Low	70	Confident	140 Å²	140	101.5 Å²	101.5	65%	0.654	47%	0.47	S	S	*	.			trans	-78.8	100.7	179	-68	-158.6	-6.1	0	0	110.6	S59	S59-Q62 PolarHBondContact O-N 3.49Å
63	Q	64.1	Low	71.7	Confident	124 Å²	124	95 Å²	95	58%	0.579	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.5	126.8	172.2	-72.2	179.8	-24	0	0	109	R61	R61-Q63 PolarHBondContact O-N 3.21Å; R61-Q63 VanDerWaalsContact O-N 3.08Å
64	W	73.8	Confident	73.4	Confident	159 Å²	159	92.1 Å²	92.1	60%	0.602	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.8	117.6	172.4	-161.5	74	0	0	0	108.5	S48 H49 V51 R66	S48-W64 WeakPolarHBondContact CA-O 3.45Å; H49-W64 PolarHBondContact N-O 3.47Å; H49-W64 PolarHBondContact O-N 3.3Å; V51-W64 HydrophobicContact CG2-CB 3.85Å; W64-R66 HydrophobicContact CE3-CB 4.15Å; W64-R66 HydrophobicContact CH2-CB 4.37Å; W64-R66 HydrophobicContact CH2-CG 4.35Å; W64-R66 HydrophobicContact CZ3-CB 3.72Å; W64-R66 HydrophobicContact CZ3-CG 4.04Å
65	T	80.3	Confident	75.2	Confident	78 Å²	78	82.7 Å²	82.7	48%	0.479	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	119.7	179.9	-60	0	0	0	0	109.1	V47 S48	V47-T65 WeakPolarHBondContact O-CA 3.45Å; S48-T65 PolarHBondContact OG-OG1 3.01Å
66	R	84.8	Confident	76.7	Confident	146 Å²	146	74.5 Å²	74.5	55%	0.551	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.6	174.4	-171.8	179.2	-179.9	172	0	109.1	S46 V47 W64	S46-R66 CarbonylContact C-O 3.52Å; S46-R66 VanDerWaalsContact CA-O 3.31Å; S46-R66 WeakPolarHBondContact CA-O 3.38Å; V47-R66 PolarHBondContact N-O 3.2Å; V47-R66 PolarHBondContact O-N 3.2Å; W64-R66 HydrophobicContact CE3-CB 4.15Å; W64-R66 HydrophobicContact CH2-CB 4.37Å; W64-R66 HydrophobicContact CH2-CG 4.35Å; W64-R66 HydrophobicContact CZ3-CB 3.72Å; W64-R66 HydrophobicContact CZ3-CG 4.04Å
67	Q	88.6	Confident	78.2	Confident	102 Å²	102	76 Å²	76	48%	0.477	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	122.2	170.4	-165.7	172.2	-7.3	0	0	109.1	L69 K70	Q67-L69 WeakPolarHBondContact CG-O 3.46Å; Q67-L69 PolarHBondContact NE2-O 3.37Å; Q67-K70 HydrophobicContact CG-CG 4.03Å
68	I	90.3	Very high	79.6	Confident	44 Å²	44	71.1 Å²	71.1	23%	0.226	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	-37.5	-177.2	-56.3	-177.2	0	0	0	111.2	Y45 V47 T94 G269	Y45-I68 HydrophobicContact CD1-CB 4.3Å; Y45-I68 HydrophobicContact CD1-CD1 4.33Å; Y45-I68 HydrophobicContact CE1-CD1 4.32Å; Y45-I68 PolarHBondContact O-N 2.71Å; V47-I68 HydrophobicContact CB-CD1 4.14Å; V47-I68 HydrophobicContact CG2-CD1 3.42Å; V47-I68 VanDerWaalsContact CG2-CD1 3.42Å; V47-I68 HydrophobicContact CG2-CG1 4.28Å; I68-T94 HydrophobicContact CB-CG2 4.49Å; I68-T94 HydrophobicContact CG2-CG2 3.85Å; I68-G269 WeakPolarHBondContact O-CA 3.16Å
69	L	92.6	Very high	81.2	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	140.9	174.7	-65.4	174	0	0	0	110	S44 Y45 Q67 T94 L95 A98 L266	S44-L69 WeakPolarHBondContact CA-O 3.46Å; Y45-L69 PolarHBondContact N-O 2.87Å; Y45-L69 PolarHBondContact O-N 3.1Å; Q67-L69 WeakPolarHBondContact CG-O 3.46Å; Q67-L69 PolarHBondContact NE2-O 3.37Å; L69-T94 HydrophobicContact CD1-CG2 3.97Å; L69-T94 HydrophobicContact CG-CG2 4.15Å; L69-L95 HydrophobicContact CD1-CB 4.25Å; L69-L95 HydrophobicContact CD1-CD1 4.43Å; L69-L95 HydrophobicContact CD2-CB 4.24Å; L69-A98 HydrophobicContact CD1-CB 4.39Å; L69-L266 HydrophobicContact CD2-CD2 4.22Å
70	K	93.6	Very high	83.3	Confident	54 Å²	54	67.1 Å²	67.1	24%	0.235	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	108.2	-178.8	-42.2	-165.3	-155.9	155.9	0	110.3	Q67 V72 G269 E270	Q67-K70 HydrophobicContact CG-CG 4.03Å; K70-V72 PolarHBondContact O-N 2.95Å; K70-G269 PolarHBondContact N-O 3.48Å; K70-E270 HydrophobicContact CB-CG 3.9Å; K70-E270 HydrophobicContact CD-CG 3.89Å; K70-E270 VanDerWaalsContact CD-OE1 3.3Å; K70-E270 WeakPolarHBondContact CD-OE1 3.47Å; K70-E270 WeakPolarHBondContact CE-OE1 3.34Å; K70-E270 HydrophobicContact CG-CG 4.09Å; K70-E270 IonicContact NZ-OE1 2.74Å; K70-E270 PolarHBondContact NZ-OE1 3.22Å
71	D	92.1	Very high	85.6	Confident	62 Å²	62	63.5 Å²	63.5	33%	0.332	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	49.6	48.4	165.6	-158.7	34.5	0	0	0	115.7	H42 A43 S44	H42-D71 WeakPolarHBondContact CA-OD1 3.34Å; H42-D71 WeakPolarHBondContact CB-OD1 3.48Å; H42-D71 IonicContact CE1-OD1 2.67Å; H42-D71 IonicContact CG-OD1 2.72Å; H42-D71 IonicContact ND1-OD1 3.22Å; H42-D71 PolarHBondContact ND1-OD1 3.01Å; H42-D71 IonicContact ND1-OD2 3.4Å; H42-D71 PolarHBondContact ND1-OD2 2.75Å; A43-D71 PolarHBondContact O-N 3.15Å; S44-D71 PolarHBondContact OG-N 3.38Å
72	V	94.1	Very high	87.8	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	129.3	-176.1	180	0	0	0	0	110.6	H42 A43 K70 L74 L95 L271	H42-V72 PolarHBondContact N-O 3.01Å; A43-V72 HydrophobicContact CB-CB 4.44Å; A43-V72 WeakPolarHBondContact CB-O 3.44Å; A43-V72 PolarHBondContact N-O 2.89Å; A43-V72 PolarHBondContact O-N 3.18Å; K70-V72 PolarHBondContact O-N 2.95Å; V72-L74 HydrophobicContact CG1-CD2 4.32Å; V72-L95 HydrophobicContact CB-CD1 4.41Å; V72-L95 HydrophobicContact CG1-CD1 3.96Å; V72-L95 HydrophobicContact CG1-CD2 4.11Å; V72-L271 HydrophobicContact CG1-CB 4.23Å; V72-L271 HydrophobicContact CG1-CD2 4.37Å; V72-L271 HydrophobicContact CG2-CB 4.39Å
73	S	94.1	Very high	89.7	Confident	15 Å²	15	45.5 Å²	45.5	11%	0.105	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	130.6	175.3	-56.3	0	0	0	0	111.3	I40 H42 L271	I40-S73 CarbonylContact O-C 3.6Å; I40-S73 WeakPolarHBondContact O-CA 3.08Å; H42-S73 PolarHBondContact N-OG 2.92Å; S73-L271 WeakPolarHBondContact O-CD2 3.42Å
74	L	93.9	Very high	91.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	158.5	-176.9	59.7	81.6	0	0	0	111.9	G39 I40 V72 M82 L95 M99	G39-L74 CarbonylContact C-O 3.55Å; G39-L74 WeakPolarHBondContact CA-O 3.36Å; I40-L74 HydrophobicContact CB-CD1 4.24Å; I40-L74 HydrophobicContact CB-CG 4.08Å; I40-L74 HydrophobicContact CD1-CD1 3.55Å; I40-L74 HydrophobicContact CD1-CD2 3.86Å; I40-L74 HydrophobicContact CD1-CG 3.67Å; I40-L74 HydrophobicContact CG1-CD1 3.7Å; I40-L74 HydrophobicContact CG1-CG 4.01Å; I40-L74 PolarHBondContact N-O 3.35Å; I40-L74 PolarHBondContact O-N 3.35Å; V72-L74 HydrophobicContact CG1-CD2 4.32Å; L74-M82 HydrophobicContact CB-CE 4.31Å; L74-M82 HydrophobicContact CD1-SD 4.19Å; L74-M82 HydrophobicContact CD2-SD 4.42Å; L74-L95 HydrophobicContact CD2-CD2 3.92Å; L74-M99 HydrophobicContact CD1-CE 4.25Å
75	Y	93.5	Very high	92.2	Very high	10 Å²	10	32.1 Å²	32.1	4%	0.039	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	133.2	-176.1	-178.9	-104	0	0	0	111.7	L38 E77 K262 N341 I342 T345	L38-Y75 CarbonylContact O-C 3.58Å; L38-Y75 WeakPolarHBondContact O-CA 3.43Å; Y75-E77 HydrophobicContact CD1-CG 4.44Å; Y75-E77 HydrophobicContact CE1-CG 3.47Å; Y75-E77 VanDerWaalsContact CE1-CG 3.47Å; Y75-E77 WeakPolarHBondContact CE1-OE1 3.45Å; Y75-E77 WeakPolarHBondContact OH-CG 3.43Å; Y75-E77 PolarHBondContact OH-OE1 2.88Å; Y75-K262 WeakPolarHBondContact O-CD 3.49Å; Y75-K262 WeakPolarHBondContact O-CE 3.19Å; Y75-K262 PolarHBondContact O-NZ 3.24Å; Y75-N341 HydrophobicContact CD1-CB 3.87Å; Y75-N341 HydrophobicContact CE1-CB 3.91Å; Y75-N341 HydrophobicContact CG-CB 4.2Å; Y75-I342 HydrophobicContact CD2-CG1 3.85Å; Y75-I342 HydrophobicContact CG-CG1 4.2Å; Y75-T345 HydrophobicContact CE2-CG2 3.87Å; Y75-T345 WeakPolarHBondContact OH-CG2 3.47Å
76	V	93.5	Very high	92.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	143.5	-179.8	-166.8	0	0	0	0	110.4	L38 Q80 M82 I244	L38-V76 PolarHBondContact N-O 3.09Å; L38-V76 PolarHBondContact O-N 3.22Å; V76-Q80 HydrophobicContact CG1-CB 3.98Å; V76-M82 HydrophobicContact CG1-CB 4.39Å; V76-M82 HydrophobicContact CG2-CB 3.92Å; V76-M82 HydrophobicContact CG2-CE 3.26Å; V76-M82 HydrophobicContact CG2-CG 4.27Å; V76-M82 HydrophobicContact CG2-SD 3.4Å; V76-M82 WeakPolarHBondContact CG2-SD 3.25Å; V76-I244 HydrophobicContact CB-CG2 4.13Å; V76-I244 HydrophobicContact CG1-CG2 3.74Å
77	E	91.6	Very high	92.8	Very high	71 Å²	71	22.9 Å²	22.9	33%	0.332	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	159.2	176	-60.5	-178.3	159.1	0	0	111.8	H36 Y75 Q80	H36-E77 CarbonylContact O-C 3.56Å; H36-E77 WeakPolarHBondContact O-CA 3.47Å; Y75-E77 HydrophobicContact CD1-CG 4.44Å; Y75-E77 HydrophobicContact CE1-CG 3.47Å; Y75-E77 VanDerWaalsContact CE1-CG 3.47Å; Y75-E77 WeakPolarHBondContact CE1-OE1 3.45Å; Y75-E77 WeakPolarHBondContact OH-CG 3.43Å; Y75-E77 PolarHBondContact OH-OE1 2.88Å; E77-Q80 HydrophobicContact CB-CG 4.33Å; E77-Q80 VanDerWaalsContact O-CB 3.23Å; E77-Q80 WeakPolarHBondContact O-CB 3.48Å; E77-Q80 PolarHBondContact O-N 3.25Å
78	S	90.6	Very high	92.6	Very high	17 Å²	17	22.4 Å²	22.4	12%	0.119	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	139.6	175.1	-159	0	0	0	0	111	H36 Q80 N242	H36-S78 PolarHBondContact O-N 3.32Å; S78-Q80 VanDerWaalsContact C-N 3.27Å; S78-N242 WeakPolarHBondContact CB-OD1 3.49Å; S78-N242 VanDerWaalsContact OG-CG 3.29Å; S78-N242 PolarHBondContact OG-O 2.9Å; S78-N242 PolarHBondContact OG-OD1 3.04Å
79	G	90.7	Very high	92.3	Very high	30 Å²	30	23.7 Å²	23.7	31%	0.309	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.3	-20.6	-169.8	0	0	0	0	0	113.2	A239 R243	G79-A239 VanDerWaalsContact CA-O 3.25Å; G79-A239 WeakPolarHBondContact CA-O 3.43Å; G79-R243 PolarHBondContact N-O 3.13Å
80	Q	94	Very high	92.1	Very high	43 Å²	43	23.7 Å²	23.7	20%	0.201	16%	0.156	C	C	.	.			trans	-93	146.8	-177.4	-59.8	178.8	-25	0	0	112.7	V76 E77 S78 V245 D261	V76-Q80 HydrophobicContact CG1-CB 3.98Å; E77-Q80 HydrophobicContact CB-CG 4.33Å; E77-Q80 VanDerWaalsContact O-CB 3.23Å; E77-Q80 WeakPolarHBondContact O-CB 3.48Å; E77-Q80 PolarHBondContact O-N 3.25Å; S78-Q80 VanDerWaalsContact C-N 3.27Å; Q80-V245 PolarHBondContact O-N 3.41Å; Q80-D261 VanDerWaalsContact CA-OD2 3.25Å; Q80-D261 WeakPolarHBondContact CA-OD2 3.44Å; Q80-D261 HydrophobicContact CB-CB 4Å; Q80-D261 HydrophobicContact CG-CB 4.19Å
81	I	95.7	Very high	91.9	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	125.8	167.8	-168.4	169.1	0	0	0	110.4	L235 V236 A239 V245 L247 L259 F260 D261 K262	I81-L235 HydrophobicContact CD1-CB 4.08Å; I81-V236 HydrophobicContact CD1-CG2 3.66Å; I81-V236 HydrophobicContact CG2-CG2 4.3Å; I81-A239 HydrophobicContact CB-CB 4.4Å; I81-V245 WeakPolarHBondContact CA-O 3.45Å; I81-V245 HydrophobicContact CD1-CG1 4.16Å; I81-V245 HydrophobicContact CG1-CB 4.14Å; I81-V245 HydrophobicContact CG1-CG1 3.89Å; I81-L247 HydrophobicContact CD1-CD2 3.54Å; I81-L247 HydrophobicContact CG1-CD2 3.69Å; I81-L259 WeakPolarHBondContact CG2-O 3.42Å; I81-F260 HydrophobicContact CD1-CD1 4.24Å; I81-F260 HydrophobicContact CD1-CE1 4.21Å; I81-F260 HydrophobicContact CG1-CD1 4.17Å; I81-F260 HydrophobicContact CG1-CE1 4.48Å; I81-F260 HydrophobicContact CG2-CD1 4.07Å; I81-D261 WeakPolarHBondContact CG2-OD2 3.1Å; I81-D261 PolarHBondContact N-OD2 3.21Å; I81-D261 PolarHBondContact O-N 3.04Å; I81-K262 PolarHBondContact O-N 3.4Å; I81-K262 VanDerWaalsContact O-N 3.12Å
82	M	96.4	Very high	91.9	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	122.4	176.5	173.9	174.8	-88.3	0	0	110.5	L74 V76 I84 V245 V246 L247 K262	L74-M82 HydrophobicContact CB-CE 4.31Å; L74-M82 HydrophobicContact CD1-SD 4.19Å; L74-M82 HydrophobicContact CD2-SD 4.42Å; V76-M82 HydrophobicContact CG1-CB 4.39Å; V76-M82 HydrophobicContact CG2-CB 3.92Å; V76-M82 HydrophobicContact CG2-CE 3.26Å; V76-M82 HydrophobicContact CG2-CG 4.27Å; V76-M82 HydrophobicContact CG2-SD 3.4Å; V76-M82 WeakPolarHBondContact CG2-SD 3.25Å; M82-I84 HydrophobicContact CG-CG1 4.34Å; M82-I84 HydrophobicContact SD-CG1 4.5Å; M82-V245 PolarHBondContact N-O 3.07Å; M82-V246 HydrophobicContact CB-CG1 4.4Å; M82-V246 HydrophobicContact CB-CG2 4.35Å; M82-V246 HydrophobicContact CG-CG1 4.29Å; M82-V246 WeakPolarHBondContact O-CA 3.09Å; M82-V246 HydrophobicContact SD-CG1 4.31Å; M82-L247 PolarHBondContact O-N 3.23Å; M82-K262 CarbonylContact C-O 3.01Å; M82-K262 WeakPolarHBondContact CA-O 3.44Å; M82-K262 HydrophobicContact CB-CB 4.38Å; M82-K262 HydrophobicContact CE-CB 4.04Å; M82-K262 HydrophobicContact CE-CD 3.96Å; M82-K262 HydrophobicContact CG-CB 4.43Å
83	C	96.2	Very high	91.8	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	122.8	172.9	-174.6	0	0	0	0	110.6	L247 F260 K262 I263 A264	C83-L247 HydrophobicContact CB-CD1 4.09Å; C83-F260 HydrophobicContact CB-CB 4.3Å; C83-F260 HydrophobicContact CB-CD1 3.61Å; C83-F260 HydrophobicContact CB-CD2 3.77Å; C83-F260 HydrophobicContact CB-CE1 3.79Å; C83-F260 HydrophobicContact CB-CE2 3.93Å; C83-F260 HydrophobicContact CB-CG 3.61Å; C83-F260 HydrophobicContact CB-CZ 3.94Å; C83-K262 PolarHBondContact N-O 3.29Å; C83-I263 CarbonylContact O-C 3.6Å; C83-I263 WeakPolarHBondContact O-CA 3.4Å; C83-A264 PolarHBondContact O-N 3.17Å
84	I	96.2	Very high	91.6	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	117.2	173.5	-66	164.8	0	0	0	108.9	M82 K92 L95 L96 V246 L247 T248 I249 A264 L266	M82-I84 HydrophobicContact CG-CG1 4.34Å; M82-I84 HydrophobicContact SD-CG1 4.5Å; I84-K92 HydrophobicContact CG2-CB 4.33Å; I84-K92 HydrophobicContact CG2-CG 4.09Å; I84-L95 HydrophobicContact CD1-CD2 4.06Å; I84-L96 HydrophobicContact CD1-CD1 3.64Å; I84-V246 HydrophobicContact CD1-CG1 3.55Å; I84-V246 HydrophobicContact CG1-CG1 4.33Å; I84-L247 PolarHBondContact N-O 3.26Å; I84-T248 HydrophobicContact CB-CG2 4.1Å; I84-T248 HydrophobicContact CG2-CG2 4.22Å; I84-T248 WeakPolarHBondContact O-CA 3.38Å; I84-I249 PolarHBondContact O-N 2.95Å; I84-A264 CarbonylContact C-O 3.56Å; I84-A264 WeakPolarHBondContact CA-O 3.42Å; I84-A264 HydrophobicContact CG1-CB 4.26Å; I84-L266 HydrophobicContact CG2-CD1 3.77Å
85	L	94.4	Very high	91.6	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.01	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	157.6	179	-62.7	170.8	0	0	0	110.2	I249 P252 I263 A264 I265 L266 F298 M302	L85-I249 HydrophobicContact CD2-CB 4.11Å; L85-P252 HydrophobicContact CD2-CG 3.78Å; L85-I263 HydrophobicContact CD1-CG2 3.65Å; L85-I263 HydrophobicContact CG-CG2 4.43Å; L85-A264 PolarHBondContact N-O 2.92Å; L85-I265 HydrophobicContact CB-CG1 4.45Å; L85-L266 PolarHBondContact O-N 3.22Å; L85-F298 HydrophobicContact CD1-CD1 3.43Å; L85-F298 VanDerWaalsContact CD1-CD1 3.43Å; L85-F298 HydrophobicContact CD1-CE1 3.76Å; L85-M302 HydrophobicContact CB-SD 3.73Å
86	G	91.1	Very high	91.5	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.01	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.9	154.6	177.4	0	0	0	0	0	112.2	S90 K92 L266 M302	G86-S90 WeakPolarHBondContact CA-OG 3.32Å; G86-K92 WeakPolarHBondContact O-CE 3.36Å; G86-K92 PolarHBondContact O-NZ 3.06Å; G86-L266 WeakPolarHBondContact CA-O 3.43Å; G86-M302 VanDerWaalsContact CA-SD 3.59Å; G86-M302 PolarHBondContact N-SD 3.04Å; G86-M302 WeakPolarHBondContact O-CE 3.42Å
87	S	85.3	Confident	91.3	Very high	29 Å²	29	23.2 Å²	23.2	20%	0.203	16%	0.159	C	C	.	.			trans	-63.2	168.5	-179.3	60.1	0	0	0	0	112.7	G89 S90 K92	S87-G89 PolarHBondContact O-N 3.47Å; S87-S90 VanDerWaalsContact O-CB 3.27Å; S87-S90 WeakPolarHBondContact O-CB 3.4Å; S87-S90 PolarHBondContact O-N 2.83Å; S87-S90 VanDerWaalsContact O-N 3.1Å; S87-S90 PolarHBondContact O-OG 2.79Å; S87-K92 PolarHBondContact O-NZ 3.16Å
88	S	85.6	Confident	91.2	Very high	92 Å²	92	20.1 Å²	20.1	64%	0.643	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	127.4	171.9	-63.3	0	0	0	0	110.2	S90 H250	S88-S90 VanDerWaalsContact C-N 3.34Å; S88-H250 PolarHBondContact OG-NE2 2.87Å
89	G	83.4	Confident	91	Very high	71 Å²	71	19.3 Å²	19.3	73%	0.732	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.6	6.8	-177.6	0	0	0	0	0	115.5	S87 G91	S87-G89 PolarHBondContact O-N 3.47Å; G89-G91 PolarHBondContact O-N 3.46Å
90	S	87.6	Confident	90.8	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.007	13%	0.127	C	C	.	.	S	Bend	trans	-72.8	-5.2	179.1	73.3	0	0	0	0	115.6	G86 S87 S88 K92 L266 G269	G86-S90 WeakPolarHBondContact CA-OG 3.32Å; S87-S90 VanDerWaalsContact O-CB 3.27Å; S87-S90 WeakPolarHBondContact O-CB 3.4Å; S87-S90 PolarHBondContact O-N 2.83Å; S87-S90 VanDerWaalsContact O-N 3.1Å; S87-S90 PolarHBondContact O-OG 2.79Å; S88-S90 VanDerWaalsContact C-N 3.34Å; S90-K92 WeakPolarHBondContact OG-CG 3.29Å; S90-L266 WeakPolarHBondContact CB-O 3.34Å; S90-L266 PolarHBondContact OG-O 3.26Å; S90-G269 WeakPolarHBondContact O-CA 3.46Å; S90-G269 PolarHBondContact O-N 3.41Å
91	G	89.9	Confident	90.2	Very high	5 Å²	5	17.3 Å²	17.3	5%	0.052	13%	0.13	C	C	.	.	S	Bend	trans	97.5	6.2	178.8	0	0	0	0	0	115.6	G89 T93 T94 L95	G89-G91 PolarHBondContact O-N 3.46Å; G91-T93 PolarHBondContact O-N 2.95Å; G91-T94 CarbonylContact O-C 3.52Å; G91-T94 WeakPolarHBondContact O-CB 3.14Å; G91-T94 PolarHBondContact O-N 3.3Å; G91-T94 VanDerWaalsContact O-N 3.16Å; G91-L95 PolarHBondContact O-N 2.96Å
92	K	92.4	Very high	89.6	Confident	8 Å²	8	19.5 Å²	19.5	4%	0.035	14%	0.139	C	C	.	.	H	α-helix	trans	-49.5	-60.7	178.9	-58.6	-174.1	-62.7	-69	0	113.6	I84 G86 S87 S90 T94 L95 L96 T248	I84-K92 HydrophobicContact CG2-CB 4.33Å; I84-K92 HydrophobicContact CG2-CG 4.09Å; G86-K92 WeakPolarHBondContact O-CE 3.36Å; G86-K92 PolarHBondContact O-NZ 3.06Å; S87-K92 PolarHBondContact O-NZ 3.16Å; S90-K92 WeakPolarHBondContact OG-CG 3.29Å; K92-T94 VanDerWaalsContact C-N 3.27Å; K92-T94 PolarHBondContact O-N 3.39Å; K92-L95 WeakPolarHBondContact O-CB 3.32Å; K92-L95 PolarHBondContact O-N 3.08Å; K92-L95 VanDerWaalsContact O-N 3.12Å; K92-L96 WeakPolarHBondContact O-CD1 3.09Å; K92-L96 PolarHBondContact O-N 3Å; K92-T248 HydrophobicContact CB-CG2 3.78Å
93	T	91	Very high	88.7	Confident	48 Å²	48	20.4 Å²	20.4	29%	0.294	14%	0.143	S	C	.	.	H	α-helix	trans	-61	-38.2	179.3	-53.4	0	0	0	0	111.2	G91 L95 L96 D97 D217	G91-T93 PolarHBondContact O-N 2.95Å; T93-L95 VanDerWaalsContact C-N 3.33Å; T93-L95 PolarHBondContact O-N 3.39Å; T93-L96 PolarHBondContact O-N 3.24Å; T93-D97 WeakPolarHBondContact O-CB 3.17Å; T93-D97 VanDerWaalsContact O-CG 3.31Å; T93-D97 PolarHBondContact O-N 2.85Å; T93-D217 WeakPolarHBondContact CG2-OD2 3.29Å; T93-D217 PolarHBondContact OG1-OD1 2.82Å
94	T	91.3	Very high	87.5	Confident	30 Å²	30	27.8 Å²	27.8	18%	0.184	17%	0.171	C	C	.	.	H	α-helix	trans	-64.1	-36.8	176.4	-48.9	0	0	0	0	112.4	Y45 I68 L69 G91 K92 A98 L103	Y45-T94 HydrophobicContact CD1-CG2 3.62Å; Y45-T94 HydrophobicContact CE1-CG2 4.12Å; Y45-T94 HydrophobicContact CG-CG2 4.46Å; I68-T94 HydrophobicContact CB-CG2 4.49Å; I68-T94 HydrophobicContact CG2-CG2 3.85Å; L69-T94 HydrophobicContact CD1-CG2 3.97Å; L69-T94 HydrophobicContact CG-CG2 4.15Å; G91-T94 CarbonylContact O-C 3.52Å; G91-T94 WeakPolarHBondContact O-CB 3.14Å; G91-T94 PolarHBondContact O-N 3.3Å; G91-T94 VanDerWaalsContact O-N 3.16Å; K92-T94 VanDerWaalsContact C-N 3.27Å; K92-T94 PolarHBondContact O-N 3.39Å; T94-A98 WeakPolarHBondContact O-CB 3.26Å; T94-A98 PolarHBondContact O-N 2.94Å; T94-L103 HydrophobicContact CG2-CD2 3.75Å
95	L	92.5	Very high	86	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-66.7	-44.3	174.5	177.4	63.3	0	0	0	110.9	I40 L69 V72 L74 I84 G91 K92 T93 D97 A98 M99 L266	I40-L95 HydrophobicContact CD1-CD1 4.18Å; L69-L95 HydrophobicContact CD1-CB 4.25Å; L69-L95 HydrophobicContact CD1-CD1 4.43Å; L69-L95 HydrophobicContact CD2-CB 4.24Å; V72-L95 HydrophobicContact CB-CD1 4.41Å; V72-L95 HydrophobicContact CG1-CD1 3.96Å; V72-L95 HydrophobicContact CG1-CD2 4.11Å; L74-L95 HydrophobicContact CD2-CD2 3.92Å; I84-L95 HydrophobicContact CD1-CD2 4.06Å; G91-L95 PolarHBondContact O-N 2.96Å; K92-L95 WeakPolarHBondContact O-CB 3.32Å; K92-L95 PolarHBondContact O-N 3.08Å; K92-L95 VanDerWaalsContact O-N 3.12Å; T93-L95 VanDerWaalsContact C-N 3.33Å; T93-L95 PolarHBondContact O-N 3.39Å; L95-D97 VanDerWaalsContact C-N 3.35Å; L95-D97 PolarHBondContact O-N 3.19Å; L95-A98 VanDerWaalsContact O-CB 3.3Å; L95-A98 WeakPolarHBondContact O-CB 3.39Å; L95-A98 PolarHBondContact O-N 3.42Å; L95-A98 VanDerWaalsContact O-N 3.16Å; L95-M99 HydrophobicContact CG-SD 4.39Å; L95-M99 VanDerWaalsContact O-CG 3.27Å; L95-M99 WeakPolarHBondContact O-CG 3.16Å; L95-M99 PolarHBondContact O-N 3.25Å; L95-L266 HydrophobicContact CB-CD2 4.27Å; L95-L266 HydrophobicContact CD2-CD1 3.86Å; L95-L266 HydrophobicContact CD2-CD2 3.82Å
96	L	92.8	Very high	84.9	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.9	-39.9	175.1	-93.5	73.2	0	0	0	112.3	I84 K92 T93 A98 M99 S100 Y131 L215 F216 D217 T248	I84-L96 HydrophobicContact CD1-CD1 3.64Å; K92-L96 WeakPolarHBondContact O-CD1 3.09Å; K92-L96 PolarHBondContact O-N 3Å; T93-L96 PolarHBondContact O-N 3.24Å; L96-A98 VanDerWaalsContact C-N 3.28Å; L96-A98 PolarHBondContact O-N 3.12Å; L96-M99 PolarHBondContact O-N 3.18Å; L96-S100 WeakPolarHBondContact O-CB 3.07Å; L96-S100 PolarHBondContact O-N 3.46Å; L96-S100 PolarHBondContact O-OG 3.23Å; L96-Y131 HydrophobicContact CB-CE2 3.95Å; L96-L215 HydrophobicContact CD2-CB 4.41Å; L96-F216 WeakPolarHBondContact CD2-O 2.97Å; L96-D217 HydrophobicContact CD2-CB 4.37Å; L96-T248 HydrophobicContact CD1-CG2 3.21Å; L96-T248 HydrophobicContact CD2-CG2 3.78Å; L96-T248 HydrophobicContact CG-CG2 4.08Å
97	D	89.4	Confident	84.1	Confident	40 Å²	40	37.8 Å²	37.8	21%	0.214	22%	0.221	C	C	.	.	H	α-helix	trans	-64.7	-34.4	173.9	-75.9	-28.9	0	0	0	111.4	T93 L95 S100 G101 R102 L103 Y131	T93-D97 WeakPolarHBondContact O-CB 3.17Å; T93-D97 VanDerWaalsContact O-CG 3.31Å; T93-D97 PolarHBondContact O-N 2.85Å; L95-D97 VanDerWaalsContact C-N 3.35Å; L95-D97 PolarHBondContact O-N 3.19Å; D97-S100 WeakPolarHBondContact CA-OG 3.39Å; D97-S100 PolarHBondContact O-OG 2.8Å; D97-G101 PolarHBondContact O-N 2.97Å; D97-G101 VanDerWaalsContact O-N 3.11Å; D97-R102 HydrophobicContact CB-CB 4.11Å; D97-R102 PolarHBondContact O-N 2.72Å; D97-L103 HydrophobicContact CB-CD2 4.12Å; D97-L103 HydrophobicContact CB-CG 4.5Å; D97-L103 PolarHBondContact O-N 3.18Å; D97-Y131 PolarHBondContact OD1-OH 3.35Å
98	A	87.6	Confident	84.1	Confident	5 Å²	5	40.5 Å²	40.5	4%	0.041	24%	0.237	C	C	.	.	H	α-helix	trans	-65	-47.5	172.9	0	0	0	0	0	111.6	L69 T94 L95 L96 S100 G101 L103 F109	L69-A98 HydrophobicContact CD1-CB 4.39Å; T94-A98 WeakPolarHBondContact O-CB 3.26Å; T94-A98 PolarHBondContact O-N 2.94Å; L95-A98 VanDerWaalsContact O-CB 3.3Å; L95-A98 WeakPolarHBondContact O-CB 3.39Å; L95-A98 PolarHBondContact O-N 3.42Å; L95-A98 VanDerWaalsContact O-N 3.16Å; L96-A98 VanDerWaalsContact C-N 3.28Å; L96-A98 PolarHBondContact O-N 3.12Å; A98-S100 VanDerWaalsContact C-N 3.3Å; A98-S100 PolarHBondContact O-N 3.21Å; A98-G101 PolarHBondContact O-N 2.6Å; A98-L103 VanDerWaalsContact CA-CD1 3.49Å; A98-L103 HydrophobicContact CB-CD1 3.44Å; A98-L103 VanDerWaalsContact CB-CD1 3.44Å; A98-L103 HydrophobicContact CB-CD2 4.34Å; A98-L103 HydrophobicContact CB-CG 3.92Å; A98-F109 HydrophobicContact CB-CD2 4.36Å; A98-F109 HydrophobicContact CB-CE2 3.83Å
99	M	87.1	Confident	84.1	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-59.3	-41.3	177.7	-70.7	174.3	76.6	0	0	112.2	L38 I40 L74 L95 L96 F125 F129 L215 V246	L38-M99 HydrophobicContact CD2-CE 3.57Å; L38-M99 HydrophobicContact CG-CE 4.34Å; I40-M99 HydrophobicContact CD1-CE 3.91Å; I40-M99 HydrophobicContact CD1-CG 3.24Å; I40-M99 HydrophobicContact CD1-SD 3.61Å; I40-M99 HydrophobicContact CG1-CG 4.3Å; L74-M99 HydrophobicContact CD1-CE 4.25Å; L95-M99 HydrophobicContact CG-SD 4.39Å; L95-M99 VanDerWaalsContact O-CG 3.27Å; L95-M99 WeakPolarHBondContact O-CG 3.16Å; L95-M99 PolarHBondContact O-N 3.25Å; L96-M99 PolarHBondContact O-N 3.18Å; M99-F125 WeakPolarHBondContact O-CD1 3.37Å; M99-F125 VanDerWaalsContact O-CE1 3.3Å; M99-F125 WeakPolarHBondContact O-CE1 3.48Å; M99-F129 VanDerWaalsContact O-CD2 3.29Å; M99-F129 WeakPolarHBondContact O-CD2 3.46Å; M99-F129 WeakPolarHBondContact O-CE2 3.38Å; M99-F129 WeakPolarHBondContact O-CZ 3.14Å; M99-L215 HydrophobicContact CB-CD1 4.02Å; M99-L215 HydrophobicContact CE-CD2 4.06Å; M99-V246 HydrophobicContact CE-CG1 4.37Å; M99-V246 HydrophobicContact CE-CG2 4.11Å
100	S	86	Confident	84.3	Confident	4 Å²	4	41.5 Å²	41.5	3%	0.028	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-1.5	-178.3	61	0	0	0	0	114.8	L96 D97 A98 R102	L96-S100 WeakPolarHBondContact O-CB 3.07Å; L96-S100 PolarHBondContact O-N 3.46Å; L96-S100 PolarHBondContact O-OG 3.23Å; D97-S100 WeakPolarHBondContact CA-OG 3.39Å; D97-S100 PolarHBondContact O-OG 2.8Å; A98-S100 VanDerWaalsContact C-N 3.3Å; A98-S100 PolarHBondContact O-N 3.21Å; S100-R102 PolarHBondContact O-N 3.05Å; S100-R102 WeakPolarHBondContact OG-CD 3.3Å; S100-R102 VanDerWaalsContact OG-CG 3.3Å; S100-R102 WeakPolarHBondContact OG-CG 3Å
101	G	83	Confident	84.3	Confident	27 Å²	27	43 Å²	43	28%	0.278	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	18.1	-177.2	0	0	0	0	0	114.2	D97 A98 L103 F125	D97-G101 PolarHBondContact O-N 2.97Å; D97-G101 VanDerWaalsContact O-N 3.11Å; A98-G101 PolarHBondContact O-N 2.6Å; G101-L103 VanDerWaalsContact C-N 3.35Å; G101-F125 VanDerWaalsContact N-CD1 3.26Å
102	R	81.6	Confident	84.2	Confident	46 Å²	46	47.4 Å²	47.4	17%	0.174	25%	0.249	C	C	.	.			trans	-83.9	-6.4	178.1	-70.1	-178.9	175	-155	-9.7	113.9	D97 S100 R104 Y131 Q454 D455	D97-R102 HydrophobicContact CB-CB 4.11Å; D97-R102 PolarHBondContact O-N 2.72Å; S100-R102 PolarHBondContact O-N 3.05Å; S100-R102 WeakPolarHBondContact OG-CD 3.3Å; S100-R102 VanDerWaalsContact OG-CG 3.3Å; S100-R102 WeakPolarHBondContact OG-CG 3Å; R102-R104 PolarHBondContact O-N 2.87Å; R102-Y131 VanDerWaalsContact CZ-CB 3.44Å; R102-Q454 PolarHBondContact NH2-O 3.16Å; R102-D455 IonicContact CZ-OD1 3.57Å; R102-D455 IonicContact NH1-OD1 3.88Å; R102-D455 IonicContact NH2-OD1 3.62Å; R102-D455 PolarHBondContact NH2-OD1 3.32Å
103	L	78.4	Confident	84	Confident	19 Å²	19	47.3 Å²	47.3	10%	0.099	25%	0.25	C	C	.	.			trans	-52.9	134.7	177.5	-74.2	174.5	0	0	0	112.8	Y45 T94 D97 A98 G101 F109	Y45-L103 HydrophobicContact CD1-CD2 3.91Å; Y45-L103 HydrophobicContact CD2-CD1 3.64Å; Y45-L103 HydrophobicContact CD2-CD2 4.19Å; Y45-L103 HydrophobicContact CD2-CG 4.38Å; Y45-L103 HydrophobicContact CE1-CD2 3.76Å; Y45-L103 HydrophobicContact CE2-CB 4.09Å; Y45-L103 HydrophobicContact CE2-CD1 3.9Å; Y45-L103 HydrophobicContact CE2-CD2 4.06Å; Y45-L103 HydrophobicContact CE2-CG 4.24Å; Y45-L103 HydrophobicContact CG-CD1 4.05Å; Y45-L103 HydrophobicContact CG-CD2 4.11Å; T94-L103 HydrophobicContact CG2-CD2 3.75Å; D97-L103 HydrophobicContact CB-CD2 4.12Å; D97-L103 HydrophobicContact CB-CG 4.5Å; D97-L103 PolarHBondContact O-N 3.18Å; A98-L103 VanDerWaalsContact CA-CD1 3.49Å; A98-L103 HydrophobicContact CB-CD1 3.44Å; A98-L103 VanDerWaalsContact CB-CD1 3.44Å; A98-L103 HydrophobicContact CB-CD2 4.34Å; A98-L103 HydrophobicContact CB-CG 3.92Å; G101-L103 VanDerWaalsContact C-N 3.35Å; L103-F109 HydrophobicContact CD1-CB 4.16Å; L103-F109 HydrophobicContact CD1-CD2 3.47Å; L103-F109 VanDerWaalsContact CD1-CD2 3.47Å; L103-F109 HydrophobicContact CD1-CE2 4.14Å; L103-F109 HydrophobicContact CD1-CG 4Å
104	R	70.4	Confident	83.9	Confident	155 Å²	155	45.8 Å²	45.8	59%	0.585	24%	0.238	S	C	*	.			trans	-58.1	136	173.7	-79.1	-167.5	-166.3	-174.1	5	111.2	Y45 R102 T106 G107 R651	Y45-R104 PolarHBondContact OH-O 3.45Å; R102-R104 PolarHBondContact O-N 2.87Å; R104-T106 PolarHBondContact O-N 3.02Å; R104-G107 PolarHBondContact O-N 3.19Å; R104-R651 CarbonylContact C-O 3.58Å; R104-R651 WeakPolarHBondContact CA-O 3.26Å; R104-R651 WeakPolarHBondContact CB-O 3.21Å
105	R	66	Low	83.7	Confident	125 Å²	125	44.8 Å²	44.8	47%	0.472	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-10.4	179.6	-65.8	178	177.8	-176.1	1.2	113	G107 R122 S650 R651	R105-G107 PolarHBondContact O-N 3.02Å; R105-R122 VanDerWaalsContact CG-NH2 3.25Å; R105-S650 PolarHBondContact N-O 2.75Å; R105-R651 HydrophobicContact CB-CG 4.02Å; R105-R651 HydrophobicContact CG-CG 4.49Å; R105-R651 PolarHBondContact N-O 2.99Å
106	T	69.9	Low	83.2	Confident	71 Å²	71	45.1 Å²	45.1	44%	0.436	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-10.2	172.9	52.5	0	0	0	0	113.9	R104 R651	R104-T106 PolarHBondContact O-N 3.02Å; T106-R651 VanDerWaalsContact CG2-O 3.32Å; T106-R651 WeakPolarHBondContact CG2-O 3.39Å; T106-R651 PolarHBondContact N-O 3.41Å; T106-R651 PolarHBondContact OG1-O 3.33Å
107	G	75	Confident	82.4	Confident	16 Å²	16	45.4 Å²	45.4	17%	0.165	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	161.2	178.1	0	0	0	0	0	114	S46 R104 R105	S46-G107 CarbonylContact O-C 3.6Å; S46-G107 WeakPolarHBondContact O-CA 3.28Å; R104-G107 PolarHBondContact O-N 3.19Å; R105-G107 PolarHBondContact O-N 3.02Å
108	T	84.6	Confident	82.1	Confident	86 Å²	86	48.7 Å²	48.7	53%	0.528	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	121	170.7	50.1	0	0	0	0	109.6	Y45 S46	Y45-T108 WeakPolarHBondContact CA-O 3.16Å; S46-T108 PolarHBondContact N-O 3.31Å; S46-T108 VanDerWaalsContact N-O 3.1Å; S46-T108 PolarHBondContact O-N 3.37Å; S46-T108 PolarHBondContact OG-OG1 3.33Å
109	F	86.3	Confident	82	Confident	72 Å²	72	51.9 Å²	51.9	32%	0.316	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	126.6	170.9	178.5	-103.2	0	0	0	109.1	A43 S44 Y45 A98 L103 G111	A43-F109 HydrophobicContact CB-CE2 4.01Å; A43-F109 HydrophobicContact CB-CZ 4.15Å; S44-F109 CarbonylContact O-C 3.53Å; S44-F109 WeakPolarHBondContact O-CA 3.02Å; Y45-F109 HydrophobicContact CD2-CB 4.08Å; Y45-F109 HydrophobicContact CD2-CD2 4.48Å; A98-F109 HydrophobicContact CB-CD2 4.36Å; A98-F109 HydrophobicContact CB-CE2 3.83Å; L103-F109 HydrophobicContact CD1-CB 4.16Å; L103-F109 HydrophobicContact CD1-CD2 3.47Å; L103-F109 VanDerWaalsContact CD1-CD2 3.47Å; L103-F109 HydrophobicContact CD1-CE2 4.14Å; L103-F109 HydrophobicContact CD1-CG 4Å; F109-G111 WeakPolarHBondContact CE1-O 3.23Å
110	L	88.1	Confident	81.7	Confident	113 Å²	113	53.3 Å²	53.3	59%	0.592	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	151.4	173.1	-63.5	166.6	0	0	0	108.1	A43 S44	A43-L110 CarbonylContact C-O 3.34Å; A43-L110 VanDerWaalsContact CA-O 3.31Å; A43-L110 WeakPolarHBondContact CA-O 3.25Å; S44-L110 PolarHBondContact N-O 3.15Å; S44-L110 PolarHBondContact O-N 3.09Å
111	G	86.4	Confident	81.4	Confident	33 Å²	33	61.7 Å²	61.7	34%	0.34	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	100.7	174.6	-176.7	0	0	0	0	0	113.1	L41 H42 F109	L41-G111 WeakPolarHBondContact O-CA 3.47Å; H42-G111 WeakPolarHBondContact O-CA 3.33Å; F109-G111 WeakPolarHBondContact CE1-O 3.23Å
112	E	88.1	Confident	80.9	Confident	97 Å²	97	67.2 Å²	67.2	45%	0.453	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	140.8	-173.3	-64.6	-174.4	167.8	0	0	111.2	L41 Y114 T119	L41-E112 PolarHBondContact N-O 2.98Å; L41-E112 PolarHBondContact O-N 3.31Å; E112-Y114 HydrophobicContact CB-CE2 3.76Å; E112-Y114 PolarHBondContact OE2-OH 2.98Å; E112-T119 HydrophobicContact CB-CG2 4.43Å; E112-T119 WeakPolarHBondContact OE2-CG2 3.44Å
113	V	89.4	Confident	80.5	Confident	6 Å²	6	73.2 Å²	73.2	4%	0.036	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.3	172.7	-177.1	0	0	0	0	108.2	L38 I40 V115 L120 F125 F129	L38-V113 HydrophobicContact CD1-CG1 4.12Å; I40-V113 HydrophobicContact CG1-CG2 4.44Å; V113-V115 HydrophobicContact CG1-CG2 4.46Å; V113-L120 PolarHBondContact O-N 3.26Å; V113-F125 HydrophobicContact CB-CE1 4.16Å; V113-F125 HydrophobicContact CB-CZ 4.14Å; V113-F125 HydrophobicContact CG2-CE1 4.04Å; V113-F125 HydrophobicContact CG2-CZ 4.17Å; V113-F129 HydrophobicContact CG1-CZ 4.16Å
114	Y	87.7	Confident	80.5	Confident	16 Å²	16	74.9 Å²	74.9	6%	0.063	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	130.5	179.4	-59.9	-88.9	0	0	0	109.8	G39 L41 E112 R118 T119 I342 K346	G39-Y114 PolarHBondContact N-O 2.68Å; G39-Y114 PolarHBondContact O-N 3.48Å; L41-Y114 HydrophobicContact CB-CD2 4.36Å; L41-Y114 HydrophobicContact CB-CE2 3.7Å; L41-Y114 HydrophobicContact CD2-CE2 4.23Å; E112-Y114 HydrophobicContact CB-CE2 3.76Å; E112-Y114 PolarHBondContact OE2-OH 2.98Å; Y114-R118 VanDerWaalsContact CA-O 3.32Å; Y114-R118 WeakPolarHBondContact CA-O 3.5Å; Y114-T119 HydrophobicContact CD1-CG2 3.71Å; Y114-T119 HydrophobicContact CE1-CG2 3.2Å; Y114-I342 HydrophobicContact CD2-CG2 4.14Å; Y114-K346 HydrophobicContact CD1-CD 4.26Å; Y114-K346 HydrophobicContact CD1-CG 3.95Å; Y114-K346 HydrophobicContact CE1-CD 3.68Å; Y114-K346 VanDerWaalsContact CE1-CE 3.48Å; Y114-K346 HydrophobicContact CE1-CG 3.88Å; Y114-K346 VanDerWaalsContact CZ-NZ 3.26Å; Y114-K346 WeakPolarHBondContact OH-CE 3.33Å; Y114-K346 PolarHBondContact OH-NZ 3.48Å
115	V	86.5	Confident	80.9	Confident	9 Å²	9	68.4 Å²	68.4	6%	0.055	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	122.1	171.5	-168.5	0	0	0	0	108.2	S37 L38 V113 G117 R118 L120 F129 F356	S37-V115 WeakPolarHBondContact O-CA 3.46Å; L38-V115 HydrophobicContact CD1-CG2 3.87Å; V113-V115 HydrophobicContact CG1-CG2 4.46Å; V115-G117 PolarHBondContact O-N 3.42Å; V115-R118 PolarHBondContact N-O 3.4Å; V115-R118 PolarHBondContact O-N 3.36Å; V115-L120 HydrophobicContact CG2-CD2 4.39Å; V115-F129 HydrophobicContact CG2-CZ 4.09Å; V115-F356 HydrophobicContact CB-CE2 4.47Å; V115-F356 HydrophobicContact CG1-CD2 4.42Å; V115-F356 HydrophobicContact CG1-CE2 3.39Å; V115-F356 HydrophobicContact CG1-CZ 3.79Å
116	N	83.4	Confident	81.2	Confident	6 Å²	6	67.1 Å²	67.1	3%	0.032	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.4	45.4	-170.7	-64.3	-0.8	0	0	0	112.5	H36 S37 R118 L351 V354	H36-N116 VanDerWaalsContact CA-OD1 3.3Å; H36-N116 WeakPolarHBondContact CA-OD1 3.43Å; H36-N116 PolarHBondContact ND1-ND2 3.47Å; S37-N116 PolarHBondContact N-OD1 3.46Å; S37-N116 PolarHBondContact O-N 3.03Å; S37-N116 PolarHBondContact O-OD1 2.9Å; S37-N116 WeakPolarHBondContact OG-CA 3.38Å; N116-R118 VanDerWaalsContact C-N 3.27Å; N116-R118 PolarHBondContact O-N 3.43Å; N116-L351 HydrophobicContact CB-CB 4.35Å; N116-V354 WeakPolarHBondContact ND2-CG2 3.48Å
117	G	76.4	Confident	81.5	Confident	6 Å²	6	66.6 Å²	66.6	6%	0.062	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	-1.6	177.5	0	0	0	0	0	116.4	V115 T345	V115-G117 PolarHBondContact O-N 3.42Å; G117-T345 WeakPolarHBondContact CA-O 3.36Å
118	R	82.9	Confident	81.7	Confident	110 Å²	110	66 Å²	66	42%	0.415	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	137.5	178.2	-61.1	-177.1	-174.3	-138.3	-1.7	111.1	Y114 V115 N116 L120	Y114-R118 VanDerWaalsContact CA-O 3.32Å; Y114-R118 WeakPolarHBondContact CA-O 3.5Å; V115-R118 PolarHBondContact N-O 3.4Å; V115-R118 PolarHBondContact O-N 3.36Å; N116-R118 VanDerWaalsContact C-N 3.27Å; N116-R118 PolarHBondContact O-N 3.43Å; R118-L120 PolarHBondContact O-N 2.88Å
119	T	84.9	Confident	81.8	Confident	72 Å²	72	62.4 Å²	62.4	44%	0.442	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	128.4	171.7	49	0	0	0	0	110.1	E112 Y114	E112-T119 HydrophobicContact CB-CG2 4.43Å; E112-T119 WeakPolarHBondContact OE2-CG2 3.44Å; Y114-T119 HydrophobicContact CD1-CG2 3.71Å; Y114-T119 HydrophobicContact CE1-CG2 3.2Å
120	L	81.4	Confident	81.9	Confident	30 Å²	30	59 Å²	59	16%	0.157	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-80.7	125	-178.8	-160.6	66.1	0	0	0	110.3	V113 V115 R118 Q124 F125 C128 F129	V113-L120 PolarHBondContact O-N 3.26Å; V115-L120 HydrophobicContact CG2-CD2 4.39Å; R118-L120 PolarHBondContact O-N 2.88Å; L120-Q124 HydrophobicContact CD1-CB 3.53Å; L120-Q124 HydrophobicContact CG-CB 4.06Å; L120-F125 HydrophobicContact CB-CD2 4.42Å; L120-F125 HydrophobicContact CB-CE2 3.97Å; L120-F125 HydrophobicContact CB-CZ 4.07Å; L120-F125 HydrophobicContact CD2-CB 4.25Å; L120-F125 HydrophobicContact CD2-CD1 3.59Å; L120-F125 HydrophobicContact CD2-CD2 3.8Å; L120-F125 HydrophobicContact CD2-CE1 3.81Å; L120-F125 HydrophobicContact CD2-CE2 4.02Å; L120-F125 HydrophobicContact CD2-CG 3.61Å; L120-F125 HydrophobicContact CD2-CZ 4.02Å; L120-F125 HydrophobicContact CG-CD2 3.9Å; L120-F125 HydrophobicContact CG-CE2 3.96Å; L120-F125 HydrophobicContact CG-CG 4.21Å; L120-F125 HydrophobicContact CG-CZ 4.31Å; L120-F125 WeakPolarHBondContact O-CE2 3.39Å; L120-C128 HydrophobicContact CD1-CB 4.04Å; L120-C128 HydrophobicContact CD2-CB 3.85Å; L120-F129 HydrophobicContact CD2-CD2 4.16Å; L120-F129 HydrophobicContact CD2-CE2 3.43Å; L120-F129 VanDerWaalsContact CD2-CE2 3.43Å; L120-F129 HydrophobicContact CD2-CZ 4.35Å
121	R	79.6	Confident	82.1	Confident	181 Å²	181	53.8 Å²	53.8	68%	0.683	25%	0.252	S	S	*	.	P	Polyproline II helix	trans	-77.5	150.7	171.5	-63.4	-176	178.7	-178.5	-0.5	109.6	E123 Q124 F125	R121-E123 PolarHBondContact O-N 2.97Å; R121-Q124 HydrophobicContact CB-CG 4.26Å; R121-Q124 VanDerWaalsContact N-OE1 3.14Å; R121-Q124 WeakPolarHBondContact O-CB 3.17Å; R121-Q124 PolarHBondContact O-N 3.36Å; R121-F125 WeakPolarHBondContact O-CD2 3.27Å
122	R	72.8	Confident	82.4	Confident	142 Å²	142	52.3 Å²	52.3	54%	0.536	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-48.2	-39.3	-179.6	-168.3	171.6	-173.9	145.4	11.8	114.1	R105 Q124 F125	R105-R122 VanDerWaalsContact CG-NH2 3.25Å; R122-Q124 VanDerWaalsContact C-N 3.26Å; R122-Q124 PolarHBondContact O-N 2.57Å; R122-F125 VanDerWaalsContact CA-CD2 3.49Å
123	E	72.3	Confident	82.5	Confident	172 Å²	172	49.2 Å²	49.2	80%	0.804	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-69.6	-23.1	-179.3	-62.2	172.4	-175	0	0	113.4	R121	R121-E123 PolarHBondContact O-N 2.97Å
124	Q	77.4	Confident	82.4	Confident	55 Å²	55	53.6 Å²	53.6	26%	0.257	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-93.1	-9.4	-174.8	-61.1	168.2	-20	0	0	112.6	L120 R121 R122 D127 C128	L120-Q124 HydrophobicContact CD1-CB 3.53Å; L120-Q124 HydrophobicContact CG-CB 4.06Å; R121-Q124 HydrophobicContact CB-CG 4.26Å; R121-Q124 VanDerWaalsContact N-OE1 3.14Å; R121-Q124 WeakPolarHBondContact O-CB 3.17Å; R121-Q124 PolarHBondContact O-N 3.36Å; R122-Q124 VanDerWaalsContact C-N 3.26Å; R122-Q124 PolarHBondContact O-N 2.57Å; Q124-D127 PolarHBondContact O-N 2.87Å; Q124-C128 WeakPolarHBondContact O-CB 3.21Å; Q124-C128 PolarHBondContact O-N 3.48Å
125	F	79.8	Confident	82.2	Confident	18 Å²	18	56.2 Å²	56.2	8%	0.079	26%	0.263	C	S	.	.	H	α-helix	trans	-61.2	-47	-178.7	-83.9	-96.4	0	0	0	113	M99 G101 V113 L120 R121 R122 D127 C128 F129	M99-F125 WeakPolarHBondContact O-CD1 3.37Å; M99-F125 VanDerWaalsContact O-CE1 3.3Å; M99-F125 WeakPolarHBondContact O-CE1 3.48Å; G101-F125 VanDerWaalsContact N-CD1 3.26Å; V113-F125 HydrophobicContact CB-CE1 4.16Å; V113-F125 HydrophobicContact CB-CZ 4.14Å; V113-F125 HydrophobicContact CG2-CE1 4.04Å; V113-F125 HydrophobicContact CG2-CZ 4.17Å; L120-F125 HydrophobicContact CB-CD2 4.42Å; L120-F125 HydrophobicContact CB-CE2 3.97Å; L120-F125 HydrophobicContact CB-CZ 4.07Å; L120-F125 HydrophobicContact CD2-CB 4.25Å; L120-F125 HydrophobicContact CD2-CD1 3.59Å; L120-F125 HydrophobicContact CD2-CD2 3.8Å; L120-F125 HydrophobicContact CD2-CE1 3.81Å; L120-F125 HydrophobicContact CD2-CE2 4.02Å; L120-F125 HydrophobicContact CD2-CG 3.61Å; L120-F125 HydrophobicContact CD2-CZ 4.02Å; L120-F125 HydrophobicContact CG-CD2 3.9Å; L120-F125 HydrophobicContact CG-CE2 3.96Å; L120-F125 HydrophobicContact CG-CG 4.21Å; L120-F125 HydrophobicContact CG-CZ 4.31Å; L120-F125 WeakPolarHBondContact O-CE2 3.39Å; R121-F125 WeakPolarHBondContact O-CD2 3.27Å; R122-F125 VanDerWaalsContact CA-CD2 3.49Å; F125-D127 PolarHBondContact O-N 2.95Å; F125-C128 PolarHBondContact O-N 3.42Å; F125-C128 VanDerWaalsContact O-N 3.15Å; F125-F129 HydrophobicContact CD1-CD2 4.26Å; F125-F129 AromaticContact CD1-CE2 3.99Å; F125-F129 HydrophobicContact CD1-CE2 3.99Å; F125-F129 HydrophobicContact CE1-CE2 4.42Å; F125-F129 WeakPolarHBondContact O-CD2 3.36Å; F125-F129 PolarHBondContact O-N 3.44Å; F125-F129 VanDerWaalsContact O-N 3.11Å
126	Q	73.2	Confident	81.9	Confident	99 Å²	99	56.5 Å²	56.5	46%	0.463	27%	0.265	S	S	.	.	H	α-helix	trans	-67.6	-27.2	-178.8	-69.8	-174.3	-10.2	0	0	113.1	K357	Q126-K357 WeakPolarHBondContact O-CD 3Å; Q126-K357 PolarHBondContact O-NZ 3.04Å
127	D	74.8	Confident	82	Confident	59 Å²	59	58.2 Å²	58.2	32%	0.316	28%	0.275	S	S	.	.	H	α-helix	trans	-74.9	-42.3	173.8	-68.4	-9.6	0	0	0	109.5	Q124 F125 F356 K357	Q124-D127 PolarHBondContact O-N 2.87Å; F125-D127 PolarHBondContact O-N 2.95Å; D127-F356 CarbonylContact C-O 3.51Å; D127-F356 VanDerWaalsContact C-O 3.27Å; D127-F356 CarbonylContact O-C 3.43Å; D127-F356 WeakPolarHBondContact O-CB 3.46Å; D127-K357 WeakPolarHBondContact O-CB 3.48Å
128	C	79.2	Confident	82.7	Confident	5 Å²	5	59.3 Å²	59.3	3%	0.034	28%	0.28	C	S	.	.	H	α-helix	trans	-70.2	-39.2	-173.6	-163.7	0	0	0	0	115.3	L120 Q124 F125 F356	L120-C128 HydrophobicContact CD1-CB 4.04Å; L120-C128 HydrophobicContact CD2-CB 3.85Å; Q124-C128 WeakPolarHBondContact O-CB 3.21Å; Q124-C128 PolarHBondContact O-N 3.48Å; F125-C128 PolarHBondContact O-N 3.42Å; F125-C128 VanDerWaalsContact O-N 3.15Å; C128-F356 HydrophobicContact CB-CB 4.47Å; C128-F356 HydrophobicContact CB-CD2 4.23Å; C128-F356 WeakPolarHBondContact SG-CD2 3.28Å
129	F	86.6	Confident	83.2	Confident	9 Å²	9	54.1 Å²	54.1	4%	0.039	26%	0.26	C	S	.	.			trans	-112.4	138.8	-169.7	-63.3	-83	0	0	0	111.7	L38 M99 V113 V115 L120 F125 V213 L215	L38-F129 HydrophobicContact CD1-CE1 3.72Å; L38-F129 HydrophobicContact CD1-CZ 3.64Å; L38-F129 HydrophobicContact CD2-CE1 4.07Å; M99-F129 VanDerWaalsContact O-CD2 3.29Å; M99-F129 WeakPolarHBondContact O-CD2 3.46Å; M99-F129 WeakPolarHBondContact O-CE2 3.38Å; M99-F129 WeakPolarHBondContact O-CZ 3.14Å; V113-F129 HydrophobicContact CG1-CZ 4.16Å; V115-F129 HydrophobicContact CG2-CZ 4.09Å; L120-F129 HydrophobicContact CD2-CD2 4.16Å; L120-F129 HydrophobicContact CD2-CE2 3.43Å; L120-F129 VanDerWaalsContact CD2-CE2 3.43Å; L120-F129 HydrophobicContact CD2-CZ 4.35Å; F125-F129 HydrophobicContact CD1-CD2 4.26Å; F125-F129 AromaticContact CD1-CE2 3.99Å; F125-F129 HydrophobicContact CD1-CE2 3.99Å; F125-F129 HydrophobicContact CE1-CE2 4.42Å; F125-F129 WeakPolarHBondContact O-CD2 3.36Å; F125-F129 PolarHBondContact O-N 3.44Å; F125-F129 VanDerWaalsContact O-N 3.11Å; F129-V213 HydrophobicContact CD1-CB 3.99Å; F129-V213 HydrophobicContact CD1-CG1 3.48Å; F129-V213 VanDerWaalsContact CD1-CG1 3.48Å; F129-V213 HydrophobicContact CE1-CB 4.26Å; F129-V213 HydrophobicContact CE1-CG1 3.53Å; F129-L215 HydrophobicContact CB-CD1 4.07Å; F129-L215 HydrophobicContact CD1-CD1 3.67Å; F129-L215 HydrophobicContact CD1-CD2 4.25Å; F129-L215 HydrophobicContact CD1-CG 4Å; F129-L215 HydrophobicContact CE1-CD1 4.37Å; F129-L215 HydrophobicContact CG-CD1 4.03Å
130	S	89.7	Confident	83.5	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.007	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	139.1	159.3	179.3	0	0	0	0	109.7	Q206 P211 V213 M214 L215	S130-Q206 WeakPolarHBondContact OG-CB 3.46Å; S130-Q206 WeakPolarHBondContact OG-CG 3.4Å; S130-Q206 PolarHBondContact OG-OE1 2.91Å; S130-P211 VanDerWaalsContact CB-CB 3.4Å; S130-P211 VanDerWaalsContact CB-CG 3.48Å; S130-V213 PolarHBondContact N-O 3.46Å; S130-M214 WeakPolarHBondContact O-CA 3.41Å; S130-L215 PolarHBondContact O-N 3.34Å
131	Y	91	Very high	84.1	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.016	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	125.4	-172.9	-161.8	-78.1	0	0	0	110.3	L96 D97 R102 L133 L215 D217	L96-Y131 HydrophobicContact CB-CE2 3.95Å; D97-Y131 PolarHBondContact OD1-OH 3.35Å; R102-Y131 VanDerWaalsContact CZ-CB 3.44Å; Y131-L133 HydrophobicContact CD1-CD2 4.02Å; Y131-L133 HydrophobicContact CD1-CG 3.98Å; Y131-L133 HydrophobicContact CE1-CD2 3.71Å; Y131-L133 HydrophobicContact CE1-CG 4.08Å; Y131-L215 CarbonylContact C-O 3.52Å; Y131-L215 WeakPolarHBondContact CA-O 3.27Å; Y131-L215 HydrophobicContact CD2-CB 3.81Å; Y131-L215 HydrophobicContact CD2-CD1 4Å; Y131-L215 HydrophobicContact CE2-CB 4.2Å; Y131-L215 HydrophobicContact CE2-CD1 4.41Å; Y131-D217 HydrophobicContact CE1-CB 4.01Å
132	V	92.6	Very high	84.8	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	112	171.5	-179.6	0	0	0	0	107.8	I203 Q206 L215 F216 D217	V132-I203 HydrophobicContact CG1-CG1 4.43Å; V132-I203 HydrophobicContact CG2-CG1 4.45Å; V132-Q206 HydrophobicContact CG2-CB 4.34Å; V132-Q206 HydrophobicContact CG2-CG 3.75Å; V132-L215 PolarHBondContact N-O 3.35Å; V132-F216 HydrophobicContact CB-CD1 3.57Å; V132-F216 HydrophobicContact CB-CE1 4.01Å; V132-F216 HydrophobicContact CB-CG 4.33Å; V132-F216 HydrophobicContact CG1-CD1 4.05Å; V132-F216 HydrophobicContact CG2-CD1 3.65Å; V132-F216 HydrophobicContact CG2-CE1 3.51Å; V132-F216 HydrophobicContact CG2-CZ 4.36Å; V132-D217 PolarHBondContact O-N 2.85Å
133	L	90.1	Very high	85.9	Confident	33 Å²	33	35.8 Å²	35.8	17%	0.173	19%	0.187	C	C	.	.			trans	-68.4	161.7	-179.8	-73.2	157.9	0	0	0	111.8	Y131 S135 R199 Q451	Y131-L133 HydrophobicContact CD1-CD2 4.02Å; Y131-L133 HydrophobicContact CD1-CG 3.98Å; Y131-L133 HydrophobicContact CE1-CD2 3.71Å; Y131-L133 HydrophobicContact CE1-CG 4.08Å; L133-S135 VanDerWaalsContact C-N 3.27Å; L133-S135 PolarHBondContact O-N 2.91Å; L133-R199 VanDerWaalsContact O-CZ 3.28Å; L133-R199 PolarHBondContact O-NH1 3.36Å; L133-R199 PolarHBondContact O-NH2 3.26Å; L133-Q451 HydrophobicContact CD1-CB 4.16Å; L133-Q451 HydrophobicContact CD1-CG 3.52Å
134	Q	88.1	Confident	87.1	Confident	97 Å²	97	27.6 Å²	27.6	45%	0.453	15%	0.148	S	C	.	.	S	Bend	trans	-57.9	-37.5	174.5	-173.6	-175.6	23.9	0	0	112.9	R199 D217 E218	Q134-R199 PolarHBondContact O-NH1 2.94Å; Q134-D217 VanDerWaalsContact CA-O 3.3Å; Q134-D217 WeakPolarHBondContact CA-O 3.09Å; Q134-D217 PolarHBondContact N-O 2.82Å; Q134-E218 HydrophobicContact CG-CB 4.03Å; Q134-E218 PolarHBondContact NE2-OE2 3.39Å
135	S	82.8	Confident	88	Confident	72 Å²	72	28 Å²	28	50%	0.503	15%	0.148	S	C	.	.	S	Bend	trans	-106.6	136	179.6	62.7	0	0	0	0	112.9	L133 T137	L133-S135 VanDerWaalsContact C-N 3.27Å; L133-S135 PolarHBondContact O-N 2.91Å; S135-T137 PolarHBondContact O-N 3.49Å
136	D	81.9	Confident	88.7	Confident	15 Å²	15	28.2 Å²	28.2	8%	0.08	15%	0.149	C	C	.	.			trans	-94.3	88.8	177.6	-56.2	-48.6	0	0	0	110.5	L138 R198 R199 S202	D136-L138 PolarHBondContact O-N 3.24Å; D136-R198 HydrophobicContact CB-CG 4.37Å; D136-R199 IonicContact OD1-CZ 3.94Å; D136-R199 IonicContact OD1-NH1 3.25Å; D136-R199 PolarHBondContact OD1-NH1 2.86Å; D136-R199 WeakPolarHBondContact OD2-CA 3.5Å; D136-R199 WeakPolarHBondContact OD2-CD 3.25Å; D136-R199 IonicContact OD2-NH1 3.85Å; D136-R199 PolarHBondContact OD2-NH1 3.41Å; D136-S202 WeakPolarHBondContact OD1-CB 3.36Å; D136-S202 PolarHBondContact OD1-OG 2.75Å
137	T	84.2	Confident	89.8	Confident	42 Å²	42	23.5 Å²	23.5	26%	0.258	13%	0.126	S	C	.	.			trans	-87	98.9	172.7	74.6	0	0	0	0	110.4	S135 Q451	S135-T137 PolarHBondContact O-N 3.49Å; T137-Q451 PolarHBondContact OG1-OE1 2.93Å
138	L	92.2	Very high	90.8	Very high	29 Å²	29	20.7 Å²	20.7	15%	0.152	11%	0.112	C	C	.	.			trans	-115.3	155.1	176	-61.1	176.2	0	0	0	110.2	D136 S140 T147 I185 R198 V201	D136-L138 PolarHBondContact O-N 3.24Å; L138-S140 PolarHBondContact O-N 3.1Å; L138-T147 HydrophobicContact CD2-CG2 4.29Å; L138-I185 HydrophobicContact CB-CD1 4.32Å; L138-I185 HydrophobicContact CB-CG2 4.15Å; L138-I185 HydrophobicContact CD1-CD1 4.29Å; L138-I185 HydrophobicContact CD1-CG2 4.33Å; L138-R198 HydrophobicContact CD1-CG 3.98Å; L138-V201 HydrophobicContact CD1-CB 4.07Å; L138-V201 HydrophobicContact CD1-CG1 3.71Å
139	L	93	Very high	91.5	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	13%	0.126	C	C	.	.			trans	-72.6	115.8	175.4	-64.9	179.4	0	0	0	110.3	S141 L142 R374 N378 V444 V448	L139-S141 PolarHBondContact O-N 3.01Å; L139-L142 HydrophobicContact CB-CD1 3.98Å; L139-L142 HydrophobicContact CB-CG 4.16Å; L139-L142 HydrophobicContact CD1-CD1 3.77Å; L139-L142 PolarHBondContact O-N 3Å; L139-R374 HydrophobicContact CD1-CG 3.97Å; L139-R374 VanDerWaalsContact CD1-NE 3.31Å; L139-N378 HydrophobicContact CD1-CB 4.41Å; L139-V444 HydrophobicContact CD2-CG1 4.43Å; L139-V448 HydrophobicContact CD2-CG2 4.06Å
140	S	91.6	Very high	91.9	Very high	21 Å²	21	24.7 Å²	24.7	15%	0.147	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-29.3	-171.8	53.3	0	0	0	0	114.9	L138 L142 G186	L138-S140 PolarHBondContact O-N 3.1Å; S140-L142 VanDerWaalsContact C-N 3.31Å; S140-L142 PolarHBondContact O-N 2.66Å; S140-G186 WeakPolarHBondContact CA-O 3.21Å; S140-G186 VanDerWaalsContact CB-C 3.44Å; S140-G186 WeakPolarHBondContact CB-O 3.37Å; S140-G186 VanDerWaalsContact O-CA 3.28Å; S140-G186 WeakPolarHBondContact O-CA 3.47Å; S140-G186 PolarHBondContact O-N 3.31Å
141	S	92.9	Very high	92	Very high	13 Å²	13	25 Å²	25	9%	0.091	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	3.7	-174.8	-32.4	0	0	0	0	113.8	L139 N378 R381	L139-S141 PolarHBondContact O-N 3.01Å; S141-N378 WeakPolarHBondContact CB-O 3.34Å; S141-N378 WeakPolarHBondContact CB-OD1 3.46Å; S141-N378 PolarHBondContact N-OD1 3.03Å; S141-N378 PolarHBondContact OG-OD1 2.97Å; S141-N378 VanDerWaalsContact OG-OD1 3.06Å; S141-R381 VanDerWaalsContact O-CD 3.23Å; S141-R381 WeakPolarHBondContact O-CD 3.12Å
142	L	95.1	Very high	92	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.127	C	C	.	.	S	Bend	trans	-101	158	176.6	-60.2	-176.7	0	0	0	110.9	L139 S140 E146 T147 Y150 I185 R374 R377 N378	L139-L142 HydrophobicContact CB-CD1 3.98Å; L139-L142 HydrophobicContact CB-CG 4.16Å; L139-L142 HydrophobicContact CD1-CD1 3.77Å; L139-L142 PolarHBondContact O-N 3Å; S140-L142 VanDerWaalsContact C-N 3.31Å; S140-L142 PolarHBondContact O-N 2.66Å; L142-E146 HydrophobicContact CB-CB 4.45Å; L142-T147 WeakPolarHBondContact CB-OG1 3.45Å; L142-Y150 HydrophobicContact CD1-CD2 4.08Å; L142-Y150 HydrophobicContact CD1-CE2 4.22Å; L142-Y150 HydrophobicContact CD2-CE2 4.49Å; L142-I185 PolarHBondContact O-N 2.7Å; L142-R374 HydrophobicContact CD1-CG 3.83Å; L142-R377 HydrophobicContact CD2-CB 4.29Å; L142-R377 HydrophobicContact CD2-CG 4.08Å; L142-N378 HydrophobicContact CD2-CB 4.21Å; L142-N378 HydrophobicContact CG-CB 4.39Å
143	T	95.9	Very high	91.9	Very high	6 Å²	6	26.6 Å²	26.6	4%	0.037	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-81.5	166.7	170.6	71.3	0	0	0	0	111.2	E146 T147 D182 R183 L184	T143-E146 PolarHBondContact N-OE2 3.06Å; T143-E146 PolarHBondContact O-N 3.38Å; T143-E146 WeakPolarHBondContact OG1-CB 3.48Å; T143-E146 WeakPolarHBondContact OG1-CG 3.45Å; T143-E146 PolarHBondContact OG1-N 2.98Å; T143-E146 VanDerWaalsContact OG1-N 3.15Å; T143-T147 WeakPolarHBondContact O-CB 3.45Å; T143-T147 PolarHBondContact O-N 3.38Å; T143-T147 PolarHBondContact O-OG1 2.67Å; T143-D182 VanDerWaalsContact CG2-O 3.23Å; T143-D182 WeakPolarHBondContact CG2-O 3.31Å; T143-R183 WeakPolarHBondContact CA-O 3.46Å; T143-R183 WeakPolarHBondContact CB-O 3.4Å; T143-L184 HydrophobicContact CG2-CD2 4.26Å
144	V	96.5	Very high	91.9	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-57	-53.6	174.2	175	0	0	0	0	110.8	E146 T147 L148 M172 A181 R183 I185 I193 V201	V144-E146 VanDerWaalsContact C-N 3.31Å; V144-E146 PolarHBondContact O-N 3.4Å; V144-T147 PolarHBondContact O-N 3.15Å; V144-L148 HydrophobicContact CG1-CD1 4.06Å; V144-L148 WeakPolarHBondContact O-CG 3.49Å; V144-L148 PolarHBondContact O-N 3.44Å; V144-M172 HydrophobicContact CG1-SD 4.19Å; V144-A181 PolarHBondContact N-O 2.99Å; V144-R183 PolarHBondContact N-O 2.98Å; V144-I185 HydrophobicContact CG2-CG1 4.1Å; V144-I193 HydrophobicContact CG2-CD1 4.08Å; V144-I193 HydrophobicContact CG2-CG2 4.15Å; V144-V201 HydrophobicContact CB-CG2 4.35Å; V144-V201 HydrophobicContact CG1-CG1 4.34Å; V144-V201 HydrophobicContact CG1-CG2 3.62Å; V144-V201 HydrophobicContact CG2-CG2 3.9Å
145	R	96.3	Very high	91.7	Very high	64 Å²	64	20.9 Å²	20.9	24%	0.242	11%	0.11	C	C	.	.	H	α-helix	trans	-58.4	-41.7	178.9	-178.8	-178.6	-71.4	139	0.6	112.1	R149 V168 E169 M172 A181 D182	R145-R149 WeakPolarHBondContact O-CB 3.47Å; R145-R149 PolarHBondContact O-N 3.18Å; R145-V168 HydrophobicContact CG-CG1 4.41Å; R145-E169 IonicContact CZ-OE1 2.63Å; R145-E169 IonicContact NE-OE1 3.41Å; R145-E169 PolarHBondContact NE-OE1 2.65Å; R145-E169 IonicContact NH2-OE1 3.8Å; R145-E169 PolarHBondContact NH2-OE1 2.79Å; R145-E169 IonicContact NH2-OE2 3.99Å; R145-M172 HydrophobicContact CB-CE 4.33Å; R145-M172 HydrophobicContact CB-SD 4.18Å; R145-M172 HydrophobicContact CG-CE 4.25Å; R145-A181 HydrophobicContact CB-CB 4.44Å; R145-A181 VanDerWaalsContact CB-O 3.26Å; R145-A181 WeakPolarHBondContact CB-O 3.25Å; R145-A181 PolarHBondContact N-O 3.32Å; R145-D182 IonicContact CZ-OD1 2.62Å; R145-D182 IonicContact CZ-OD2 3.2Å; R145-D182 IonicContact NH1-OD1 3.4Å; R145-D182 PolarHBondContact NH1-OD1 3.37Å; R145-D182 IonicContact NH1-OD2 2.63Å; R145-D182 PolarHBondContact NH1-OD2 3.07Å; R145-D182 IonicContact NH2-OD2 2.95Å
146	E	95.7	Very high	91.8	Very high	21 Å²	21	18 Å²	18	10%	0.098	9%	0.089	C	C	.	.	H	α-helix	trans	-65.6	-43.9	179	-75.3	169	-167.9	0	0	112.2	L142 T143 V144 R149 Y150 R377 R381	L142-E146 HydrophobicContact CB-CB 4.45Å; T143-E146 PolarHBondContact N-OE2 3.06Å; T143-E146 PolarHBondContact O-N 3.38Å; T143-E146 WeakPolarHBondContact OG1-CB 3.48Å; T143-E146 WeakPolarHBondContact OG1-CG 3.45Å; T143-E146 PolarHBondContact OG1-N 2.98Å; T143-E146 VanDerWaalsContact OG1-N 3.15Å; V144-E146 VanDerWaalsContact C-N 3.31Å; V144-E146 PolarHBondContact O-N 3.4Å; E146-R149 PolarHBondContact O-N 3.32Å; E146-Y150 HydrophobicContact CB-CD2 4.48Å; E146-Y150 HydrophobicContact CB-CE2 4.31Å; E146-Y150 WeakPolarHBondContact O-CD2 3.39Å; E146-Y150 PolarHBondContact O-N 2.97Å; E146-R377 IonicContact OE1-CZ 3.17Å; E146-R377 IonicContact OE1-NE 2.74Å; E146-R377 PolarHBondContact OE1-NE 3.34Å; E146-R377 VanDerWaalsContact OE1-NE 3.1Å; E146-R377 IonicContact OE1-NH2 3.81Å; E146-R377 PolarHBondContact OE1-NH2 3.09Å; E146-R377 IonicContact OE2-CZ 3.5Å; E146-R377 IonicContact OE2-NE 3.21Å; E146-R377 PolarHBondContact OE2-NE 3.49Å; E146-R377 VanDerWaalsContact OE2-NE 3.09Å; E146-R381 IonicContact OE1-CZ 2.66Å; E146-R381 VanDerWaalsContact OE1-CZ 3.22Å; E146-R381 IonicContact OE1-NH1 3.58Å; E146-R381 PolarHBondContact OE1-NH1 3.01Å; E146-R381 IonicContact OE1-NH2 3.2Å; E146-R381 PolarHBondContact OE1-NH2 3.27Å; E146-R381 IonicContact OE2-CZ 3.93Å; E146-R381 IonicContact OE2-NH1 3.1Å; E146-R381 PolarHBondContact OE2-NH1 3.01Å; E146-R381 IonicContact OE2-NH2 2.65Å
147	T	95.8	Very high	91.4	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.8	-47.8	178.9	-60.8	0	0	0	0	110.5	L138 L142 T143 V144 R149 Y150 T151 I185	L138-T147 HydrophobicContact CD2-CG2 4.29Å; L142-T147 WeakPolarHBondContact CB-OG1 3.45Å; T143-T147 WeakPolarHBondContact O-CB 3.45Å; T143-T147 PolarHBondContact O-N 3.38Å; T143-T147 PolarHBondContact O-OG1 2.67Å; V144-T147 PolarHBondContact O-N 3.15Å; T147-R149 VanDerWaalsContact C-N 3.35Å; T147-R149 PolarHBondContact O-N 2.74Å; T147-Y150 PolarHBondContact O-N 2.77Å; T147-T151 WeakPolarHBondContact O-CG2 3.23Å; T147-T151 PolarHBondContact O-N 3.05Å; T147-T151 PolarHBondContact O-OG1 3.13Å; T147-I185 HydrophobicContact CG2-CD1 4.07Å; T147-I185 WeakPolarHBondContact OG1-CD1 3.32Å
148	L	95.7	Very high	90.5	Very high	1 Å²	1	32 Å²	32	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-64.5	-37.4	176.2	-64.2	178.4	0	0	0	112.8	V144 T151 A152 V168 M172 V201 A204 A205 L208	V144-L148 HydrophobicContact CG1-CD1 4.06Å; V144-L148 WeakPolarHBondContact O-CG 3.49Å; V144-L148 PolarHBondContact O-N 3.44Å; L148-T151 WeakPolarHBondContact CA-OG1 3.27Å; L148-T151 PolarHBondContact O-OG1 3.03Å; L148-A152 WeakPolarHBondContact O-CB 3.32Å; L148-A152 PolarHBondContact O-N 2.83Å; L148-V168 HydrophobicContact CB-CG1 3.74Å; L148-V168 HydrophobicContact CB-CG2 4.22Å; L148-V168 HydrophobicContact CD1-CG1 4.38Å; L148-M172 HydrophobicContact CD1-CG 3.49Å; L148-M172 VanDerWaalsContact CD1-CG 3.49Å; L148-M172 HydrophobicContact CD1-SD 3.96Å; L148-V201 HydrophobicContact CD2-CG1 4.41Å; L148-A204 HydrophobicContact CD1-CB 3.93Å; L148-A204 HydrophobicContact CD2-CB 3.56Å; L148-A204 HydrophobicContact CG-CB 4.4Å; L148-A205 HydrophobicContact CD2-CB 4.2Å; L148-L208 HydrophobicContact CB-CD1 4.26Å; L148-L208 HydrophobicContact CD2-CD1 4.12Å; L148-L208 VanDerWaalsContact O-CD1 3.29Å; L148-L208 WeakPolarHBondContact O-CD1 3.49Å
149	R	94.6	Very high	89.2	Confident	87 Å²	87	32 Å²	32	33%	0.328	14%	0.144	S	C	.	.	H	α-helix	trans	-64.1	-43.6	174.6	-179.2	176.8	178.1	152.6	3.7	111.7	R145 E146 T147 A152 L153	R145-R149 WeakPolarHBondContact O-CB 3.47Å; R145-R149 PolarHBondContact O-N 3.18Å; E146-R149 PolarHBondContact O-N 3.32Å; T147-R149 VanDerWaalsContact C-N 3.35Å; T147-R149 PolarHBondContact O-N 2.74Å; R149-A152 PolarHBondContact O-N 3.44Å; R149-L153 HydrophobicContact CG-CD1 3.97Å; R149-L153 HydrophobicContact CG-CG 4.48Å; R149-L153 WeakPolarHBondContact O-CB 3.33Å; R149-L153 WeakPolarHBondContact O-CG 3.44Å; R149-L153 PolarHBondContact O-N 2.88Å
150	Y	94	Very high	88.4	Confident	11 Å²	11	38.1 Å²	38.1	4%	0.043	18%	0.176	C	C	.	.	H	α-helix	trans	-67.7	-41.9	178.3	-73.2	-55.8	0	0	0	112.1	L142 E146 T147 A152 L153 L154 V370 R373 R374 R377	L142-Y150 HydrophobicContact CD1-CD2 4.08Å; L142-Y150 HydrophobicContact CD1-CE2 4.22Å; L142-Y150 HydrophobicContact CD2-CE2 4.49Å; E146-Y150 HydrophobicContact CB-CD2 4.48Å; E146-Y150 HydrophobicContact CB-CE2 4.31Å; E146-Y150 WeakPolarHBondContact O-CD2 3.39Å; E146-Y150 PolarHBondContact O-N 2.97Å; T147-Y150 PolarHBondContact O-N 2.77Å; Y150-A152 VanDerWaalsContact C-N 3.35Å; Y150-L153 PolarHBondContact O-N 3.29Å; Y150-L154 WeakPolarHBondContact O-CB 3.34Å; Y150-L154 WeakPolarHBondContact O-CG 3.43Å; Y150-L154 PolarHBondContact O-N 3.32Å; Y150-V370 HydrophobicContact CD1-CG1 3.82Å; Y150-R373 HydrophobicContact CE1-CG 4.34Å; Y150-R374 HydrophobicContact CD1-CB 3.95Å; Y150-R374 HydrophobicContact CD1-CG 4.43Å; Y150-R374 HydrophobicContact CD2-CB 3.99Å; Y150-R374 HydrophobicContact CD2-CG 3.67Å; Y150-R374 HydrophobicContact CE1-CB 4.03Å; Y150-R374 HydrophobicContact CE2-CB 4.07Å; Y150-R374 HydrophobicContact CE2-CG 4.02Å; Y150-R374 HydrophobicContact CG-CB 3.94Å; Y150-R374 HydrophobicContact CG-CG 3.9Å; Y150-R377 VanDerWaalsContact OH-CD 3.28Å; Y150-R377 WeakPolarHBondContact OH-CD 3.45Å
151	T	92.5	Very high	87.8	Confident	7 Å²	7	41.2 Å²	41.2	4%	0.043	20%	0.196	C	C	.	.	H	α-helix	trans	-64.3	-40.7	175.4	53.3	0	0	0	0	111.2	T147 L148 L154 A155 A205 L208	T147-T151 WeakPolarHBondContact O-CG2 3.23Å; T147-T151 PolarHBondContact O-N 3.05Å; T147-T151 PolarHBondContact O-OG1 3.13Å; L148-T151 WeakPolarHBondContact CA-OG1 3.27Å; L148-T151 PolarHBondContact O-OG1 3.03Å; T151-L154 PolarHBondContact O-N 3.02Å; T151-A155 VanDerWaalsContact O-CB 3.26Å; T151-A155 WeakPolarHBondContact O-CB 3.5Å; T151-A155 PolarHBondContact O-N 3.26Å; T151-A205 HydrophobicContact CG2-CB 4.39Å; T151-L208 WeakPolarHBondContact OG1-CD1 3.4Å
152	A	90.9	Very high	87.3	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.008	21%	0.21	C	C	.	.	H	α-helix	trans	-60.3	-47.2	174.6	0	0	0	0	0	112.3	L148 R149 Y150 L154 A155 I156 F164 V168 L208	L148-A152 WeakPolarHBondContact O-CB 3.32Å; L148-A152 PolarHBondContact O-N 2.83Å; R149-A152 PolarHBondContact O-N 3.44Å; Y150-A152 VanDerWaalsContact C-N 3.35Å; A152-L154 PolarHBondContact O-N 3.44Å; A152-A155 PolarHBondContact O-N 3.45Å; A152-I156 PolarHBondContact O-N 3.17Å; A152-F164 HydrophobicContact CB-CD1 3.99Å; A152-V168 HydrophobicContact CB-CG2 4.08Å; A152-L208 HydrophobicContact CB-CD1 4.04Å; A152-L208 HydrophobicContact CB-CD2 3.86Å; A152-L208 HydrophobicContact CB-CG 4.49Å
153	L	90.3	Very high	87	Confident	37 Å²	37	46.7 Å²	46.7	19%	0.194	23%	0.229	C	C	.	.	H	α-helix	trans	-65	-26.2	178.1	-75.2	169.8	0	0	0	113.1	R149 Y150 F164 P362 V370	R149-L153 HydrophobicContact CG-CD1 3.97Å; R149-L153 HydrophobicContact CG-CG 4.48Å; R149-L153 WeakPolarHBondContact O-CB 3.33Å; R149-L153 WeakPolarHBondContact O-CG 3.44Å; R149-L153 PolarHBondContact O-N 2.88Å; Y150-L153 PolarHBondContact O-N 3.29Å; L153-F164 HydrophobicContact CD2-CD1 4.16Å; L153-F164 HydrophobicContact CD2-CD2 3.66Å; L153-F164 HydrophobicContact CD2-CE1 4.08Å; L153-F164 HydrophobicContact CD2-CE2 3.61Å; L153-F164 HydrophobicContact CD2-CG 3.95Å; L153-F164 HydrophobicContact CD2-CZ 3.85Å; L153-P362 WeakPolarHBondContact O-CG 3.42Å; L153-V370 HydrophobicContact CB-CG1 4.04Å; L153-V370 HydrophobicContact CB-CG2 4.35Å
154	L	89.6	Confident	86.6	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-85.7	-30	176.3	-71.1	169.2	0	0	0	112.5	Y150 T151 A152 P362 K367 V370 L371 L457 Y458	Y150-L154 WeakPolarHBondContact O-CB 3.34Å; Y150-L154 WeakPolarHBondContact O-CG 3.43Å; Y150-L154 PolarHBondContact O-N 3.32Å; T151-L154 PolarHBondContact O-N 3.02Å; A152-L154 PolarHBondContact O-N 3.44Å; L154-P362 WeakPolarHBondContact O-CD 3.49Å; L154-P362 WeakPolarHBondContact O-CG 3.33Å; L154-K367 HydrophobicContact CD2-CB 4.11Å; L154-K367 HydrophobicContact CD2-CG 4.23Å; L154-V370 HydrophobicContact CD2-CB 3.95Å; L154-V370 HydrophobicContact CD2-CG1 3.89Å; L154-V370 HydrophobicContact CG-CB 4.49Å; L154-V370 HydrophobicContact CG-CG1 3.88Å; L154-L371 HydrophobicContact CD1-CD2 3.82Å; L154-L371 HydrophobicContact CD1-CG 4.42Å; L154-L371 HydrophobicContact CD2-CD2 4.35Å; L154-L371 HydrophobicContact CD2-CG 4.06Å; L154-L457 HydrophobicContact CB-CD2 4.17Å; L154-Y458 HydrophobicContact CD1-CD1 4.16Å; L154-Y458 HydrophobicContact CD1-CE1 4.22Å
155	A	85.1	Confident	86.2	Confident	10 Å²	10	51.3 Å²	51.3	8%	0.083	25%	0.25	C	S	.	.	H	α-helix	trans	-83.5	-38.6	-177.9	0	0	0	0	0	113.2	T151 A152 Q209 L457	T151-A155 VanDerWaalsContact O-CB 3.26Å; T151-A155 WeakPolarHBondContact O-CB 3.5Å; T151-A155 PolarHBondContact O-N 3.26Å; A152-A155 PolarHBondContact O-N 3.45Å; A155-Q209 HydrophobicContact CB-CG 4.18Å; A155-L457 HydrophobicContact CB-CD2 3.85Å
156	I	83.7	Confident	85.9	Confident	12 Å²	12	55.1 Å²	55.1	6%	0.062	27%	0.271	C	S	.	.			trans	-118.4	129.3	-168	-53.4	161.8	0	0	0	110.8	A152 F164 K167 D360	A152-I156 PolarHBondContact O-N 3.17Å; I156-F164 HydrophobicContact CB-CE1 3.95Å; I156-F164 HydrophobicContact CG2-CE1 4.34Å; I156-F164 WeakPolarHBondContact O-CZ 3.27Å; I156-K167 HydrophobicContact CD1-CD 3.88Å; I156-D360 CarbonylContact C-O 3.57Å
157	R	73.4	Confident	85.7	Confident	163 Å²	163	56.4 Å²	56.4	62%	0.615	28%	0.276	S	S	*	.	S	Bend	trans	-85.6	-38.9	-178.9	-179.5	176.5	180	167.3	-0.9	113.8	D360 P362	R157-D360 WeakPolarHBondContact CA-O 3.4Å; R157-D360 HydrophobicContact CB-CB 4.12Å; R157-D360 WeakPolarHBondContact CB-O 3.48Å; R157-D360 PolarHBondContact N-O 3.16Å; R157-P362 HydrophobicContact CB-CB 4.42Å
158	R	65.1	Low	85.7	Confident	187 Å²	187	56.5 Å²	56.5	71%	0.706	28%	0.276	S	S	*	.	S	Bend	trans	-99.9	100.4	-172.1	-67.5	-176.9	177.9	-169.4	1.1	109.7
159	G	65.2	Low	85.6	Confident	30 Å²	30	59.1 Å²	59.1	31%	0.309	29%	0.289	S	S	.	.			trans	-173.5	138.3	174.1	0	0	0	0	0	111.6	F164	G159-F164 WeakPolarHBondContact O-CE2 3.11Å
160	N	77.5	Confident	85.6	Confident	130 Å²	130	57.8 Å²	57.8	70%	0.695	30%	0.296	S	S	*	.			trans	-70.7	154.5	162.7	-74.6	-13.8	0	0	0	109	G162 F163 F164	N160-G162 PolarHBondContact O-N 3.36Å; N160-F163 WeakPolarHBondContact O-CA 3.4Å; N160-F163 WeakPolarHBondContact O-CB 3.2Å; N160-F163 PolarHBondContact O-N 2.87Å; N160-F164 VanDerWaalsContact O-CD2 3.25Å; N160-F164 WeakPolarHBondContact O-CD2 3.35Å; N160-F164 PolarHBondContact O-N 2.89Å
161	P	77.9	Confident	85.5	Confident	85 Å²	85	57.8 Å²	57.8	55%	0.552	30%	0.297	S	S	*	.	H	α-helix	trans	-49	-35.1	174.7	-28.9	35.3	0	0	0	113.7	Q165	P161-Q165 PolarHBondContact O-N 3.45Å
162	G	83.2	Confident	85.7	Confident	38 Å²	38	57.5 Å²	57.5	39%	0.392	30%	0.295	S	S	.	.	H	α-helix	trans	-66.9	-37.3	174.5	0	0	0	0	0	114.2	N160 Q165 Q166	N160-G162 PolarHBondContact O-N 3.36Å; G162-Q165 PolarHBondContact O-N 3.31Å; G162-Q166 WeakPolarHBondContact O-CG 3.44Å; G162-Q166 PolarHBondContact O-N 3.38Å
163	F	87.8	Confident	85.8	Confident	90 Å²	90	60.1 Å²	60.1	40%	0.395	32%	0.317	S	S	.	.	H	α-helix	trans	-63	-44.7	175.4	172	-97.4	0	0	0	111.3	N160 Q165 Q166 K167	N160-F163 WeakPolarHBondContact O-CA 3.4Å; N160-F163 WeakPolarHBondContact O-CB 3.2Å; N160-F163 PolarHBondContact O-N 2.87Å; F163-Q165 VanDerWaalsContact C-N 3.29Å; F163-Q165 PolarHBondContact O-N 3.42Å; F163-Q166 PolarHBondContact O-N 3.19Å; F163-K167 HydrophobicContact CE1-CD 4.48Å; F163-K167 HydrophobicContact CZ-CD 4.48Å; F163-K167 WeakPolarHBondContact O-CB 3.32Å; F163-K167 PolarHBondContact O-N 2.83Å
164	F	87.1	Confident	85.8	Confident	11 Å²	11	60.4 Å²	60.4	5%	0.048	32%	0.317	C	S	.	.	H	α-helix	trans	-60.2	-42.3	176.2	-69.3	-74.9	0	0	0	111.7	A152 L153 I156 G159 N160 K167 V168	A152-F164 HydrophobicContact CB-CD1 3.99Å; L153-F164 HydrophobicContact CD2-CD1 4.16Å; L153-F164 HydrophobicContact CD2-CD2 3.66Å; L153-F164 HydrophobicContact CD2-CE1 4.08Å; L153-F164 HydrophobicContact CD2-CE2 3.61Å; L153-F164 HydrophobicContact CD2-CG 3.95Å; L153-F164 HydrophobicContact CD2-CZ 3.85Å; I156-F164 HydrophobicContact CB-CE1 3.95Å; I156-F164 HydrophobicContact CG2-CE1 4.34Å; I156-F164 WeakPolarHBondContact O-CZ 3.27Å; G159-F164 WeakPolarHBondContact O-CE2 3.11Å; N160-F164 VanDerWaalsContact O-CD2 3.25Å; N160-F164 WeakPolarHBondContact O-CD2 3.35Å; N160-F164 PolarHBondContact O-N 2.89Å; F164-K167 PolarHBondContact O-N 2.78Å; F164-V168 WeakPolarHBondContact O-CB 3.36Å; F164-V168 WeakPolarHBondContact O-CG2 3.34Å; F164-V168 PolarHBondContact O-N 3.03Å
165	Q	88.2	Confident	85.9	Confident	93 Å²	93	60.4 Å²	60.4	44%	0.435	32%	0.317	S	S	.	.	H	α-helix	trans	-65.8	-45.7	179.3	-170.6	165.9	-8.7	0	0	111.4	P161 G162 F163 K167 V168 E169	P161-Q165 PolarHBondContact O-N 3.45Å; G162-Q165 PolarHBondContact O-N 3.31Å; F163-Q165 VanDerWaalsContact C-N 3.29Å; F163-Q165 PolarHBondContact O-N 3.42Å; Q165-K167 VanDerWaalsContact C-N 3.34Å; Q165-K167 PolarHBondContact O-N 2.81Å; Q165-V168 PolarHBondContact O-N 3.44Å; Q165-E169 HydrophobicContact CG-CG 4.48Å; Q165-E169 WeakPolarHBondContact O-CB 3.33Å; Q165-E169 VanDerWaalsContact O-CG 3.31Å; Q165-E169 WeakPolarHBondContact O-CG 3.02Å; Q165-E169 PolarHBondContact O-N 3.38Å
166	Q	91.8	Very high	86.3	Confident	144 Å²	144	63.4 Å²	63.4	67%	0.673	34%	0.338	S	S	*	.	H	α-helix	trans	-59.7	-43.3	175.5	-72.9	173.3	-5	0	0	112.2	G162 F163 E169 A170	G162-Q166 WeakPolarHBondContact O-CG 3.44Å; G162-Q166 PolarHBondContact O-N 3.38Å; F163-Q166 PolarHBondContact O-N 3.19Å; Q166-E169 PolarHBondContact O-N 3.01Å; Q166-A170 WeakPolarHBondContact O-CB 3.42Å; Q166-A170 PolarHBondContact O-N 3.46Å
167	K	91	Very high	86.9	Confident	48 Å²	48	62.9 Å²	62.9	21%	0.209	34%	0.335	C	S	.	.	H	α-helix	trans	-63.9	-42.1	177	-166.7	175	-168.6	-178	0	112	I156 F163 F164 Q165 A170 I171 L208	I156-K167 HydrophobicContact CD1-CD 3.88Å; F163-K167 HydrophobicContact CE1-CD 4.48Å; F163-K167 HydrophobicContact CZ-CD 4.48Å; F163-K167 WeakPolarHBondContact O-CB 3.32Å; F163-K167 PolarHBondContact O-N 2.83Å; F164-K167 PolarHBondContact O-N 2.78Å; Q165-K167 VanDerWaalsContact C-N 3.34Å; Q165-K167 PolarHBondContact O-N 2.81Å; K167-A170 PolarHBondContact O-N 3.19Å; K167-I171 HydrophobicContact CG-CD1 4.48Å; K167-I171 WeakPolarHBondContact O-CG1 3.37Å; K167-I171 PolarHBondContact O-N 2.95Å; K167-I171 VanDerWaalsContact O-N 3.13Å; K167-L208 WeakPolarHBondContact CE-O 3.48Å; K167-L208 HydrophobicContact CG-CD2 4.39Å; K167-L208 PolarHBondContact NZ-O 2.9Å
168	V	94.5	Very high	87.9	Confident	2 Å²	2	58 Å²	58	1%	0.012	33%	0.326	C	S	.	.	H	α-helix	trans	-65.3	-43.8	177	169.1	0	0	0	0	111.1	R145 L148 A152 F164 Q165 I171 M172 L208	R145-V168 HydrophobicContact CG-CG1 4.41Å; L148-V168 HydrophobicContact CB-CG1 3.74Å; L148-V168 HydrophobicContact CB-CG2 4.22Å; L148-V168 HydrophobicContact CD1-CG1 4.38Å; A152-V168 HydrophobicContact CB-CG2 4.08Å; F164-V168 WeakPolarHBondContact O-CB 3.36Å; F164-V168 WeakPolarHBondContact O-CG2 3.34Å; F164-V168 PolarHBondContact O-N 3.03Å; Q165-V168 PolarHBondContact O-N 3.44Å; V168-I171 PolarHBondContact O-N 3.34Å; V168-M172 HydrophobicContact CG1-CE 3.8Å; V168-M172 HydrophobicContact CG1-CG 4.41Å; V168-M172 HydrophobicContact CG1-SD 4.11Å; V168-M172 WeakPolarHBondContact O-CB 3.34Å; V168-M172 VanDerWaalsContact O-CG 3.31Å; V168-M172 WeakPolarHBondContact O-CG 3.41Å; V168-M172 PolarHBondContact O-N 3.04Å; V168-L208 HydrophobicContact CG2-CD2 3.99Å
169	E	94.9	Very high	89.3	Confident	56 Å²	56	55.3 Å²	55.3	26%	0.262	32%	0.321	S	S	.	.	H	α-helix	trans	-63.6	-40.3	175.9	-68.2	-60.1	153.9	0	0	112.1	R145 Q165 Q166 I171 M172 A173	R145-E169 IonicContact CZ-OE1 2.63Å; R145-E169 IonicContact NE-OE1 3.41Å; R145-E169 PolarHBondContact NE-OE1 2.65Å; R145-E169 IonicContact NH2-OE1 3.8Å; R145-E169 PolarHBondContact NH2-OE1 2.79Å; R145-E169 IonicContact NH2-OE2 3.99Å; Q165-E169 HydrophobicContact CG-CG 4.48Å; Q165-E169 WeakPolarHBondContact O-CB 3.33Å; Q165-E169 VanDerWaalsContact O-CG 3.31Å; Q165-E169 WeakPolarHBondContact O-CG 3.02Å; Q165-E169 PolarHBondContact O-N 3.38Å; Q166-E169 PolarHBondContact O-N 3.01Å; E169-I171 PolarHBondContact O-N 3.38Å; E169-M172 HydrophobicContact CG-CE 4.29Å; E169-M172 PolarHBondContact O-N 2.91Å; E169-M172 VanDerWaalsContact OE1-CE 3.25Å; E169-M172 WeakPolarHBondContact OE1-CE 3.36Å; E169-M172 WeakPolarHBondContact OE2-CE 3.29Å; E169-A173 WeakPolarHBondContact O-CB 3.36Å; E169-A173 PolarHBondContact O-N 3.29Å
170	A	93.2	Very high	90.8	Very high	59 Å²	59	54.1 Å²	54.1	49%	0.488	31%	0.308	S	S	.	.	H	α-helix	trans	-60.3	-44.9	176.4	0	0	0	0	0	112.1	Q166 K167 A173 E174	Q166-A170 WeakPolarHBondContact O-CB 3.42Å; Q166-A170 PolarHBondContact O-N 3.46Å; K167-A170 PolarHBondContact O-N 3.19Å; A170-A173 PolarHBondContact O-N 3.47Å; A170-E174 WeakPolarHBondContact O-CB 3.32Å; A170-E174 PolarHBondContact O-N 2.79Å
171	I	93.6	Very high	91.6	Very high	11 Å²	11	48 Å²	48	6%	0.056	28%	0.275	C	S	.	.	H	α-helix	trans	-71	-38.2	178.4	-66.9	176.3	0	0	0	111.5	K167 V168 E169 A173 E174 L175 A204 L207 L208	K167-I171 HydrophobicContact CG-CD1 4.48Å; K167-I171 WeakPolarHBondContact O-CG1 3.37Å; K167-I171 PolarHBondContact O-N 2.95Å; K167-I171 VanDerWaalsContact O-N 3.13Å; V168-I171 PolarHBondContact O-N 3.34Å; E169-I171 PolarHBondContact O-N 3.38Å; I171-A173 VanDerWaalsContact C-N 3.31Å; I171-A173 PolarHBondContact O-N 3.16Å; I171-E174 PolarHBondContact O-N 2.92Å; I171-L175 HydrophobicContact CG2-CD1 4.03Å; I171-L175 HydrophobicContact CG2-CG 4.45Å; I171-L175 WeakPolarHBondContact O-CB 3.1Å; I171-L175 WeakPolarHBondContact O-CG 3.34Å; I171-L175 PolarHBondContact O-N 3.25Å; I171-A204 HydrophobicContact CG2-CB 3.85Å; I171-L207 HydrophobicContact CD1-CB 4.2Å; I171-L207 HydrophobicContact CG2-CB 4.23Å; I171-L208 HydrophobicContact CD1-CB 4.25Å; I171-L208 HydrophobicContact CD1-CD2 3.49Å; I171-L208 VanDerWaalsContact CD1-CD2 3.49Å; I171-L208 HydrophobicContact CD1-CG 3.72Å
172	M	95.2	Very high	92.5	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64	-38.4	174.9	-73.7	-172.6	-52	0	0	111.5	V144 R145 L148 V168 E169 S176 L177 A181	V144-M172 HydrophobicContact CG1-SD 4.19Å; R145-M172 HydrophobicContact CB-CE 4.33Å; R145-M172 HydrophobicContact CB-SD 4.18Å; R145-M172 HydrophobicContact CG-CE 4.25Å; L148-M172 HydrophobicContact CD1-CG 3.49Å; L148-M172 VanDerWaalsContact CD1-CG 3.49Å; L148-M172 HydrophobicContact CD1-SD 3.96Å; V168-M172 HydrophobicContact CG1-CE 3.8Å; V168-M172 HydrophobicContact CG1-CG 4.41Å; V168-M172 HydrophobicContact CG1-SD 4.11Å; V168-M172 WeakPolarHBondContact O-CB 3.34Å; V168-M172 VanDerWaalsContact O-CG 3.31Å; V168-M172 WeakPolarHBondContact O-CG 3.41Å; V168-M172 PolarHBondContact O-N 3.04Å; E169-M172 HydrophobicContact CG-CE 4.29Å; E169-M172 PolarHBondContact O-N 2.91Å; E169-M172 VanDerWaalsContact OE1-CE 3.25Å; E169-M172 WeakPolarHBondContact OE1-CE 3.36Å; E169-M172 WeakPolarHBondContact OE2-CE 3.29Å; M172-S176 PolarHBondContact O-N 3.43Å; M172-S176 VanDerWaalsContact O-N 3.17Å; M172-L177 HydrophobicContact CB-CB 4.28Å; M172-L177 HydrophobicContact CG-CB 4.42Å; M172-L177 PolarHBondContact O-N 3.19Å; M172-A181 HydrophobicContact CE-CB 3.97Å; M172-A181 HydrophobicContact SD-CB 3.8Å
173	A	93.7	Very high	93	Very high	57 Å²	57	53.9 Å²	53.9	47%	0.471	28%	0.282	S	S	.	.	H	α-helix	trans	-66.8	-44.8	174.3	0	0	0	0	0	111.5	E169 A170 I171 L175 S176 S178	E169-A173 WeakPolarHBondContact O-CB 3.36Å; E169-A173 PolarHBondContact O-N 3.29Å; A170-A173 PolarHBondContact O-N 3.47Å; I171-A173 VanDerWaalsContact C-N 3.31Å; I171-A173 PolarHBondContact O-N 3.16Å; A173-L175 VanDerWaalsContact C-N 3.27Å; A173-L175 PolarHBondContact O-N 3.16Å; A173-S176 PolarHBondContact O-N 3.05Å; A173-S176 VanDerWaalsContact O-N 3.13Å; A173-S178 WeakPolarHBondContact CA-OG 3.5Å
174	E	90.7	Very high	93.3	Very high	42 Å²	42	53.8 Å²	53.8	20%	0.196	29%	0.286	C	S	.	.	H	α-helix	trans	-57.6	-39.3	177	179.5	170.2	-163.2	0	0	112.4	A170 I171 R241	A170-E174 WeakPolarHBondContact O-CB 3.32Å; A170-E174 PolarHBondContact O-N 2.79Å; I171-E174 PolarHBondContact O-N 2.92Å; E174-R241 WeakPolarHBondContact OE1-CD 3.33Å; E174-R241 IonicContact OE1-CZ 3.87Å; E174-R241 VanDerWaalsContact OE1-CZ 3.29Å; E174-R241 IonicContact OE1-NE 2.75Å; E174-R241 PolarHBondContact OE1-NE 2.74Å; E174-R241 IonicContact OE1-NH1 3.54Å; E174-R241 PolarHBondContact OE1-NH1 3.13Å; E174-R241 IonicContact OE2-NH1 3.29Å
175	L	92.3	Very high	93.7	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	8.5	-179.4	-62.7	-178.6	0	0	0	114.2	I171 A173 L177 R200 A204 L207 L234	I171-L175 HydrophobicContact CG2-CD1 4.03Å; I171-L175 HydrophobicContact CG2-CG 4.45Å; I171-L175 WeakPolarHBondContact O-CB 3.1Å; I171-L175 WeakPolarHBondContact O-CG 3.34Å; I171-L175 PolarHBondContact O-N 3.25Å; A173-L175 VanDerWaalsContact C-N 3.27Å; A173-L175 PolarHBondContact O-N 3.16Å; L175-L177 VanDerWaalsContact C-N 3.33Å; L175-L177 HydrophobicContact CB-CD1 3.98Å; L175-L177 HydrophobicContact CB-CG 4.16Å; L175-L177 HydrophobicContact CD1-CD1 4.37Å; L175-L177 PolarHBondContact O-N 3.01Å; L175-R200 WeakPolarHBondContact CD1-O 3.48Å; L175-R200 WeakPolarHBondContact O-CD 3.31Å; L175-A204 HydrophobicContact CD1-CB 3.28Å; L175-L207 HydrophobicContact CD1-CD1 3.95Å; L175-L207 HydrophobicContact CD2-CD1 3.86Å; L175-L207 HydrophobicContact CG-CD1 4.14Å; L175-L234 HydrophobicContact CD2-CD1 3.63Å; L175-L234 HydrophobicContact CD2-CD2 3.73Å; L175-L234 HydrophobicContact CD2-CG 3.97Å
176	S	92.9	Very high	93.8	Very high	73 Å²	73	49.4 Å²	49.4	51%	0.51	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	49.4	-177.2	-59	0	0	0	0	112.8	M172 A173 H179	M172-S176 PolarHBondContact O-N 3.43Å; M172-S176 VanDerWaalsContact O-N 3.17Å; A173-S176 PolarHBondContact O-N 3.05Å; A173-S176 VanDerWaalsContact O-N 3.13Å; S176-H179 PolarHBondContact O-CE1 3.1Å; S176-H179 VanDerWaalsContact O-CE1 3.26Å; S176-H179 PolarHBondContact O-ND1 3.28Å
177	L	95.3	Very high	93.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.251	C	S	.	.			trans	-111.8	-2.3	178.9	-73	173.2	0	0	0	113.2	M172 L175 H179 V180 A181 E197 R200 V201 A204	M172-L177 HydrophobicContact CB-CB 4.28Å; M172-L177 HydrophobicContact CG-CB 4.42Å; M172-L177 PolarHBondContact O-N 3.19Å; L175-L177 VanDerWaalsContact C-N 3.33Å; L175-L177 HydrophobicContact CB-CD1 3.98Å; L175-L177 HydrophobicContact CB-CG 4.16Å; L175-L177 HydrophobicContact CD1-CD1 4.37Å; L175-L177 PolarHBondContact O-N 3.01Å; L177-H179 PolarHBondContact O-N 3.35Å; L177-V180 HydrophobicContact CB-CG2 4.48Å; L177-V180 HydrophobicContact CD2-CG2 3.94Å; L177-V180 CarbonylContact O-C 3.43Å; L177-V180 WeakPolarHBondContact O-CG2 3.37Å; L177-V180 PolarHBondContact O-N 3.41Å; L177-A181 PolarHBondContact O-N 3.33Å; L177-E197 HydrophobicContact CD2-CB 4.22Å; L177-E197 HydrophobicContact CD2-CG 4.41Å; L177-R200 HydrophobicContact CD1-CB 3.95Å; L177-R200 HydrophobicContact CD2-CB 3.97Å; L177-R200 HydrophobicContact CG-CB 4.13Å; L177-V201 HydrophobicContact CD1-CG2 3.82Å; L177-V201 HydrophobicContact CD2-CG2 4.13Å; L177-A204 HydrophobicContact CD1-CB 4.27Å
178	S	94.8	Very high	92.3	Very high	61 Å²	61	53.8 Å²	53.8	43%	0.427	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-58.9	-33	-175.9	-56.2	0	0	0	0	113.3	A173 V180 A181	A173-S178 WeakPolarHBondContact CA-OG 3.5Å; S178-V180 VanDerWaalsContact C-N 3.27Å; S178-V180 PolarHBondContact O-N 3.28Å; S178-A181 WeakPolarHBondContact O-CB 3.3Å; S178-A181 PolarHBondContact O-N 2.93Å
179	H	95.1	Very high	91.1	Very high	130 Å²	130	60.4 Å²	60.4	60%	0.602	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-69.6	-21.5	178.6	67.3	-65.2	0	0	0	113.6	S176 L177 E197	S176-H179 PolarHBondContact O-CE1 3.1Å; S176-H179 VanDerWaalsContact O-CE1 3.26Å; S176-H179 PolarHBondContact O-ND1 3.28Å; L177-H179 PolarHBondContact O-N 3.35Å; H179-E197 IonicContact CD2-OE1 3.86Å; H179-E197 IonicContact CE1-OE1 3.56Å; H179-E197 IonicContact NE2-OE1 2.79Å; H179-E197 PolarHBondContact NE2-OE1 2.81Å
180	V	95.8	Very high	90	Very high	6 Å²	6	63.5 Å²	63.5	4%	0.036	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-112.7	11	178.5	-74.2	0	0	0	0	113.5	L177 S178 D182 R183 I193 E197	L177-V180 HydrophobicContact CB-CG2 4.48Å; L177-V180 HydrophobicContact CD2-CG2 3.94Å; L177-V180 CarbonylContact O-C 3.43Å; L177-V180 WeakPolarHBondContact O-CG2 3.37Å; L177-V180 PolarHBondContact O-N 3.41Å; S178-V180 VanDerWaalsContact C-N 3.27Å; S178-V180 PolarHBondContact O-N 3.28Å; V180-D182 VanDerWaalsContact C-N 3.28Å; V180-D182 PolarHBondContact O-N 3.34Å; V180-D182 VanDerWaalsContact O-N 3.15Å; V180-R183 HydrophobicContact CB-CB 4.38Å; V180-R183 PolarHBondContact O-N 2.93Å; V180-I193 HydrophobicContact CB-CG2 4.26Å; V180-E197 WeakPolarHBondContact CG1-OE1 3.31Å; V180-E197 HydrophobicContact CG2-CG 4.47Å
181	A	95.2	Very high	89.3	Confident	2 Å²	2	62.8 Å²	62.8	2%	0.017	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-40.5	-173.4	0	0	0	0	0	113.8	V144 R145 M172 L177 S178	V144-A181 PolarHBondContact N-O 2.99Å; R145-A181 HydrophobicContact CB-CB 4.44Å; R145-A181 VanDerWaalsContact CB-O 3.26Å; R145-A181 WeakPolarHBondContact CB-O 3.25Å; R145-A181 PolarHBondContact N-O 3.32Å; M172-A181 HydrophobicContact CE-CB 3.97Å; M172-A181 HydrophobicContact SD-CB 3.8Å; L177-A181 PolarHBondContact O-N 3.33Å; S178-A181 WeakPolarHBondContact O-CB 3.3Å; S178-A181 PolarHBondContact O-N 2.93Å
182	D	95.8	Very high	89.1	Confident	103 Å²	103	63.4 Å²	63.4	55%	0.551	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	4.3	-179	-67.8	-48.3	0	0	0	114.7	T143 R145 V180	T143-D182 VanDerWaalsContact CG2-O 3.23Å; T143-D182 WeakPolarHBondContact CG2-O 3.31Å; R145-D182 IonicContact CZ-OD1 2.62Å; R145-D182 IonicContact CZ-OD2 3.2Å; R145-D182 IonicContact NH1-OD1 3.4Å; R145-D182 PolarHBondContact NH1-OD1 3.37Å; R145-D182 IonicContact NH1-OD2 2.63Å; R145-D182 PolarHBondContact NH1-OD2 3.07Å; R145-D182 IonicContact NH2-OD2 2.95Å; V180-D182 VanDerWaalsContact C-N 3.28Å; V180-D182 PolarHBondContact O-N 3.34Å; V180-D182 VanDerWaalsContact O-N 3.15Å
183	R	94.8	Very high	89	Confident	143 Å²	143	64.3 Å²	64.3	54%	0.54	35%	0.347	S	S	.	.	S	Bend	trans	-79.4	145.3	176.1	-164.9	171.3	176.1	169.8	-1.8	110	T143 V144 V180 I185 G192 I193	T143-R183 WeakPolarHBondContact CA-O 3.46Å; T143-R183 WeakPolarHBondContact CB-O 3.4Å; V144-R183 PolarHBondContact N-O 2.98Å; V180-R183 HydrophobicContact CB-CB 4.38Å; V180-R183 PolarHBondContact O-N 2.93Å; R183-I185 PolarHBondContact O-N 2.97Å; R183-G192 PolarHBondContact NE-O 3.08Å; R183-G192 PolarHBondContact NH2-O 3.26Å; R183-G192 VanDerWaalsContact NH2-O 3.17Å; R183-I193 HydrophobicContact CB-CG2 4.28Å; R183-I193 HydrophobicContact CG-CG2 4.34Å
184	L	94.3	Very high	88.9	Confident	88 Å²	88	64.4 Å²	64.4	46%	0.461	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-62.4	133	172.2	-64.6	174.9	0	0	0	109.6	T143 G186 I193	T143-L184 HydrophobicContact CG2-CD2 4.26Å; L184-G186 PolarHBondContact O-N 3.21Å; L184-I193 PolarHBondContact O-N 2.83Å
185	I	94.6	Very high	88.8	Confident	4 Å²	4	65.9 Å²	65.9	2%	0.021	36%	0.357	C	S	.	.			trans	-59.3	-44.9	175.2	-67.4	172.9	0	0	0	109.2	L138 L142 V144 T147 R183 G192 I193 R198	L138-I185 HydrophobicContact CB-CD1 4.32Å; L138-I185 HydrophobicContact CB-CG2 4.15Å; L138-I185 HydrophobicContact CD1-CD1 4.29Å; L138-I185 HydrophobicContact CD1-CG2 4.33Å; L142-I185 PolarHBondContact O-N 2.7Å; V144-I185 HydrophobicContact CG2-CG1 4.1Å; T147-I185 HydrophobicContact CG2-CD1 4.07Å; T147-I185 WeakPolarHBondContact OG1-CD1 3.32Å; R183-I185 PolarHBondContact O-N 2.97Å; I185-G192 WeakPolarHBondContact O-CA 3.45Å; I185-I193 HydrophobicContact CB-CD1 4.38Å; I185-I193 HydrophobicContact CG1-CD1 4.27Å; I185-I193 HydrophobicContact CG2-CD1 4.1Å; I185-I193 HydrophobicContact CG2-CG1 4.43Å; I185-I193 WeakPolarHBondContact O-CG1 3.25Å; I185-I193 PolarHBondContact O-N 3.28Å; I185-I193 VanDerWaalsContact O-N 3.16Å; I185-R198 HydrophobicContact CG2-CG 4.43Å
186	G	89.8	Confident	88.7	Confident	7 Å²	7	66 Å²	66	7%	0.072	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	70.9	-171	175.8	0	0	0	0	0	113.8	S140 L184 G191	S140-G186 WeakPolarHBondContact CA-O 3.21Å; S140-G186 VanDerWaalsContact CB-C 3.44Å; S140-G186 WeakPolarHBondContact CB-O 3.37Å; S140-G186 VanDerWaalsContact O-CA 3.28Å; S140-G186 WeakPolarHBondContact O-CA 3.47Å; S140-G186 PolarHBondContact O-N 3.31Å; L184-G186 PolarHBondContact O-N 3.21Å; G186-G191 WeakPolarHBondContact CA-O 3.44Å
187	N	81.8	Confident	88.7	Confident	62 Å²	62	63.8 Å²	63.8	33%	0.332	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	179.3	170	65.7	10.8	0	0	0	108.5	N189 L190 G191	N187-N189 PolarHBondContact O-N 3.41Å; N187-N189 VanDerWaalsContact O-N 3.14Å; N187-N189 PolarHBondContact OD1-N 3.03Å; N187-N189 VanDerWaalsContact OD1-N 3.13Å; N187-L190 PolarHBondContact O-N 3.41Å; N187-L190 WeakPolarHBondContact OD1-CB 3.39Å; N187-L190 VanDerWaalsContact OD1-CG 3.25Å; N187-L190 WeakPolarHBondContact OD1-CG 3.3Å; N187-L190 PolarHBondContact OD1-N 3.33Å; N187-G191 PolarHBondContact O-N 2.69Å
188	Y	69.6	Low	88.5	Confident	222 Å²	222	67.9 Å²	67.9	87%	0.871	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-30.8	-179.5	-173	-98.7	0	0	0	113.1
189	N	71.1	Confident	88.4	Confident	141 Å²	141	65.3 Å²	65.3	75%	0.754	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-32.1	-174.2	-63.5	-8.1	0	0	0	114.2	N187	N187-N189 PolarHBondContact O-N 3.41Å; N187-N189 VanDerWaalsContact O-N 3.14Å; N187-N189 PolarHBondContact OD1-N 3.03Å; N187-N189 VanDerWaalsContact OD1-N 3.13Å
190	L	69.8	Low	88.4	Confident	122 Å²	122	60.8 Å²	60.8	64%	0.639	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-3.9	-174.9	-64.8	165.8	0	0	0	112.3	N187	N187-L190 PolarHBondContact O-N 3.41Å; N187-L190 WeakPolarHBondContact OD1-CB 3.39Å; N187-L190 VanDerWaalsContact OD1-CG 3.25Å; N187-L190 WeakPolarHBondContact OD1-CG 3.3Å; N187-L190 PolarHBondContact OD1-N 3.33Å
191	G	79.6	Confident	88.4	Confident	43 Å²	43	60.5 Å²	60.5	44%	0.443	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	68.7	169.1	-166.5	0	0	0	0	0	111.5	G186 N187	G186-G191 WeakPolarHBondContact CA-O 3.44Å; N187-G191 PolarHBondContact O-N 2.69Å
192	G	89.4	Confident	88.3	Confident	24 Å²	24	60.7 Å²	60.7	25%	0.247	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.9	-149.6	-175.1	0	0	0	0	0	113.7	R183 I185	R183-G192 PolarHBondContact NE-O 3.08Å; R183-G192 PolarHBondContact NH2-O 3.26Å; R183-G192 VanDerWaalsContact NH2-O 3.17Å; I185-G192 WeakPolarHBondContact O-CA 3.45Å
193	I	93.2	Very high	88.2	Confident	20 Å²	20	55.8 Å²	55.8	10%	0.103	29%	0.286	C	S	.	.	S	Bend	trans	-75.7	161.4	168.6	64.9	-178.7	0	0	0	110.5	V144 V180 R183 L184 I185 E197 R198 V201	V144-I193 HydrophobicContact CG2-CD1 4.08Å; V144-I193 HydrophobicContact CG2-CG2 4.15Å; V180-I193 HydrophobicContact CB-CG2 4.26Å; R183-I193 HydrophobicContact CB-CG2 4.28Å; R183-I193 HydrophobicContact CG-CG2 4.34Å; L184-I193 PolarHBondContact O-N 2.83Å; I185-I193 HydrophobicContact CB-CD1 4.38Å; I185-I193 HydrophobicContact CG1-CD1 4.27Å; I185-I193 HydrophobicContact CG2-CD1 4.1Å; I185-I193 HydrophobicContact CG2-CG1 4.43Å; I185-I193 WeakPolarHBondContact O-CG1 3.25Å; I185-I193 PolarHBondContact O-N 3.28Å; I185-I193 VanDerWaalsContact O-N 3.16Å; I193-E197 HydrophobicContact CB-CB 4.16Å; I193-E197 HydrophobicContact CD1-CB 4.37Å; I193-E197 HydrophobicContact CG1-CB 4.46Å; I193-R198 HydrophobicContact CD1-CB 3.91Å; I193-R198 HydrophobicContact CD1-CG 4.32Å; I193-R198 HydrophobicContact CG1-CB 4.1Å; I193-V201 HydrophobicContact CD1-CG2 4.02Å
194	S	91.1	Very high	88.2	Confident	58 Å²	58	49 Å²	49	41%	0.406	26%	0.261	S	S	.	.			trans	-65.4	160.1	175.6	64.9	0	0	0	0	112	G196 E197 R198	S194-G196 VanDerWaalsContact C-N 3.31Å; S194-G196 PolarHBondContact O-N 3.47Å; S194-E197 WeakPolarHBondContact CB-OE2 3.41Å; S194-E197 PolarHBondContact N-OE2 3.44Å; S194-E197 PolarHBondContact O-N 2.87Å; S194-E197 VanDerWaalsContact OG-CB 3.26Å; S194-E197 WeakPolarHBondContact OG-CB 3.42Å; S194-E197 WeakPolarHBondContact OG-CG 3.34Å; S194-E197 PolarHBondContact OG-N 3.35Å; S194-E197 PolarHBondContact OG-OE2 3.29Å; S194-R198 WeakPolarHBondContact O-CB 3.26Å; S194-R198 PolarHBondContact O-N 3.5Å
195	T	88.4	Confident	88.1	Confident	74 Å²	74	45.4 Å²	45.4	45%	0.454	24%	0.244	S	C	.	.	H	α-helix	trans	-60.9	-39.9	178	48.7	0	0	0	0	112.1	R198 R199	T195-R198 WeakPolarHBondContact O-CB 3.39Å; T195-R198 PolarHBondContact O-N 3.4Å; T195-R199 PolarHBondContact O-N 3.28Å
196	G	90.1	Very high	87.9	Confident	2 Å²	2	45.6 Å²	45.6	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-63.5	-46.7	173.7	0	0	0	0	0	113.6	S194 R198 R199 R200 T227	S194-G196 VanDerWaalsContact C-N 3.31Å; S194-G196 PolarHBondContact O-N 3.47Å; G196-R198 VanDerWaalsContact C-N 3.3Å; G196-R198 PolarHBondContact O-N 2.91Å; G196-R199 WeakPolarHBondContact O-CB 3.48Å; G196-R199 PolarHBondContact O-N 3.43Å; G196-R200 WeakPolarHBondContact O-CG 3.48Å; G196-R200 PolarHBondContact O-N 3.32Å; G196-T227 VanDerWaalsContact CA-CG2 3.43Å
197	E	92.6	Very high	88	Confident	28 Å²	28	45.5 Å²	45.5	13%	0.131	24%	0.242	C	C	.	.	H	α-helix	trans	-61.3	-41.2	174.8	-73.4	163	153.7	0	0	110.9	L177 H179 V180 I193 S194 R199 R200 V201	L177-E197 HydrophobicContact CD2-CB 4.22Å; L177-E197 HydrophobicContact CD2-CG 4.41Å; H179-E197 IonicContact CD2-OE1 3.86Å; H179-E197 IonicContact CE1-OE1 3.56Å; H179-E197 IonicContact NE2-OE1 2.79Å; H179-E197 PolarHBondContact NE2-OE1 2.81Å; V180-E197 WeakPolarHBondContact CG1-OE1 3.31Å; V180-E197 HydrophobicContact CG2-CG 4.47Å; I193-E197 HydrophobicContact CB-CB 4.16Å; I193-E197 HydrophobicContact CD1-CB 4.37Å; I193-E197 HydrophobicContact CG1-CB 4.46Å; S194-E197 WeakPolarHBondContact CB-OE2 3.41Å; S194-E197 PolarHBondContact N-OE2 3.44Å; S194-E197 PolarHBondContact O-N 2.87Å; S194-E197 VanDerWaalsContact OG-CB 3.26Å; S194-E197 WeakPolarHBondContact OG-CB 3.42Å; S194-E197 WeakPolarHBondContact OG-CG 3.34Å; S194-E197 PolarHBondContact OG-N 3.35Å; S194-E197 PolarHBondContact OG-OE2 3.29Å; E197-R199 VanDerWaalsContact C-N 3.29Å; E197-R199 PolarHBondContact O-N 2.93Å; E197-R200 WeakPolarHBondContact O-CB 3.42Å; E197-R200 PolarHBondContact O-N 2.63Å; E197-R200 VanDerWaalsContact O-N 3.13Å; E197-V201 WeakPolarHBondContact O-CG2 3.37Å; E197-V201 PolarHBondContact O-N 2.74Å
198	R	92.9	Very high	88.3	Confident	86 Å²	86	42.6 Å²	42.6	33%	0.325	23%	0.227	S	C	.	.	H	α-helix	trans	-59.4	-40.6	175.5	-166	178.9	69.9	172.1	0.8	112	D136 L138 I185 I193 S194 T195 G196 V201 S202	D136-R198 HydrophobicContact CB-CG 4.37Å; L138-R198 HydrophobicContact CD1-CG 3.98Å; I185-R198 HydrophobicContact CG2-CG 4.43Å; I193-R198 HydrophobicContact CD1-CB 3.91Å; I193-R198 HydrophobicContact CD1-CG 4.32Å; I193-R198 HydrophobicContact CG1-CB 4.1Å; S194-R198 WeakPolarHBondContact O-CB 3.26Å; S194-R198 PolarHBondContact O-N 3.5Å; T195-R198 WeakPolarHBondContact O-CB 3.39Å; T195-R198 PolarHBondContact O-N 3.4Å; G196-R198 VanDerWaalsContact C-N 3.3Å; G196-R198 PolarHBondContact O-N 2.91Å; R198-V201 PolarHBondContact O-N 3.39Å; R198-S202 PolarHBondContact O-N 3.13Å; R198-S202 VanDerWaalsContact O-N 3.11Å
199	R	92.4	Very high	88.9	Confident	6 Å²	6	32.3 Å²	32.3	2%	0.023	19%	0.187	C	C	.	.	H	α-helix	trans	-60.5	-47.4	173.8	-167.6	64	172.3	167.6	-1.1	110.7	L133 Q134 D136 T195 G196 E197 V201 S202 I203 D217 P219 I231	L133-R199 VanDerWaalsContact O-CZ 3.28Å; L133-R199 PolarHBondContact O-NH1 3.36Å; L133-R199 PolarHBondContact O-NH2 3.26Å; Q134-R199 PolarHBondContact O-NH1 2.94Å; D136-R199 IonicContact OD1-CZ 3.94Å; D136-R199 IonicContact OD1-NH1 3.25Å; D136-R199 PolarHBondContact OD1-NH1 2.86Å; D136-R199 WeakPolarHBondContact OD2-CA 3.5Å; D136-R199 WeakPolarHBondContact OD2-CD 3.25Å; D136-R199 IonicContact OD2-NH1 3.85Å; D136-R199 PolarHBondContact OD2-NH1 3.41Å; T195-R199 PolarHBondContact O-N 3.28Å; G196-R199 WeakPolarHBondContact O-CB 3.48Å; G196-R199 PolarHBondContact O-N 3.43Å; E197-R199 VanDerWaalsContact C-N 3.29Å; E197-R199 PolarHBondContact O-N 2.93Å; R199-V201 VanDerWaalsContact C-N 3.3Å; R199-V201 PolarHBondContact O-N 2.95Å; R199-S202 VanDerWaalsContact O-CB 3.27Å; R199-S202 WeakPolarHBondContact O-CB 3.23Å; R199-S202 PolarHBondContact O-N 2.8Å; R199-S202 VanDerWaalsContact O-N 3.11Å; R199-I203 WeakPolarHBondContact O-CG1 3.21Å; R199-I203 PolarHBondContact O-N 2.8Å; R199-I203 VanDerWaalsContact O-N 3.11Å; R199-D217 PolarHBondContact NH2-O 3.5Å; R199-P219 PolarHBondContact NE-O 3.26Å; R199-P219 VanDerWaalsContact NH2-CA 3.26Å; R199-I231 HydrophobicContact CB-CD1 4.38Å; R199-I231 HydrophobicContact CG-CD1 4.4Å
200	R	93.8	Very high	89.6	Confident	36 Å²	36	29.3 Å²	29.3	14%	0.136	17%	0.171	C	C	.	.	H	α-helix	trans	-59.4	-38	175.7	-62.7	-179.5	-157.8	175.6	3.9	112.4	L175 L177 G196 E197 S202 I203 A204 I231 L234	L175-R200 WeakPolarHBondContact CD1-O 3.48Å; L175-R200 WeakPolarHBondContact O-CD 3.31Å; L177-R200 HydrophobicContact CD1-CB 3.95Å; L177-R200 HydrophobicContact CD2-CB 3.97Å; L177-R200 HydrophobicContact CG-CB 4.13Å; G196-R200 WeakPolarHBondContact O-CG 3.48Å; G196-R200 PolarHBondContact O-N 3.32Å; E197-R200 WeakPolarHBondContact O-CB 3.42Å; E197-R200 PolarHBondContact O-N 2.63Å; E197-R200 VanDerWaalsContact O-N 3.13Å; R200-S202 VanDerWaalsContact C-N 3.33Å; R200-S202 PolarHBondContact O-N 2.68Å; R200-I203 PolarHBondContact O-N 2.62Å; R200-A204 WeakPolarHBondContact O-CB 3.35Å; R200-A204 PolarHBondContact O-N 2.8Å; R200-I231 HydrophobicContact CG-CD1 3.51Å; R200-L234 HydrophobicContact CG-CD2 4.04Å
201	V	95.3	Very high	90.4	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.1	-37.5	176	177.3	0	0	0	0	111.9	L138 V144 L148 L177 I193 E197 R198 R199 A204 A205	L138-V201 HydrophobicContact CD1-CB 4.07Å; L138-V201 HydrophobicContact CD1-CG1 3.71Å; V144-V201 HydrophobicContact CB-CG2 4.35Å; V144-V201 HydrophobicContact CG1-CG1 4.34Å; V144-V201 HydrophobicContact CG1-CG2 3.62Å; V144-V201 HydrophobicContact CG2-CG2 3.9Å; L148-V201 HydrophobicContact CD2-CG1 4.41Å; L177-V201 HydrophobicContact CD1-CG2 3.82Å; L177-V201 HydrophobicContact CD2-CG2 4.13Å; I193-V201 HydrophobicContact CD1-CG2 4.02Å; E197-V201 WeakPolarHBondContact O-CG2 3.37Å; E197-V201 PolarHBondContact O-N 2.74Å; R198-V201 PolarHBondContact O-N 3.39Å; R199-V201 VanDerWaalsContact C-N 3.3Å; R199-V201 PolarHBondContact O-N 2.95Å; V201-A204 WeakPolarHBondContact O-CB 3.37Å; V201-A204 PolarHBondContact O-N 3.06Å; V201-A205 PolarHBondContact O-N 2.84Å
202	S	93.8	Very high	90.7	Very high	5 Å²	5	24 Å²	24	4%	0.035	13%	0.131	C	C	.	.	H	α-helix	trans	-62.1	-44	174.1	-166.7	0	0	0	0	111.4	D136 R198 R199 R200 A205 Q206	D136-S202 WeakPolarHBondContact OD1-CB 3.36Å; D136-S202 PolarHBondContact OD1-OG 2.75Å; R198-S202 PolarHBondContact O-N 3.13Å; R198-S202 VanDerWaalsContact O-N 3.11Å; R199-S202 VanDerWaalsContact O-CB 3.27Å; R199-S202 WeakPolarHBondContact O-CB 3.23Å; R199-S202 PolarHBondContact O-N 2.8Å; R199-S202 VanDerWaalsContact O-N 3.11Å; R200-S202 VanDerWaalsContact C-N 3.33Å; R200-S202 PolarHBondContact O-N 2.68Å; S202-A205 PolarHBondContact O-N 3.46Å; S202-Q206 PolarHBondContact O-N 3.02Å
203	I	94.3	Very high	90.7	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-63.7	-42.4	174	-55.7	176	0	0	0	110.8	V132 R199 R200 A205 Q206 L207 M214 F216 L234 L235 L238	V132-I203 HydrophobicContact CG1-CG1 4.43Å; V132-I203 HydrophobicContact CG2-CG1 4.45Å; R199-I203 WeakPolarHBondContact O-CG1 3.21Å; R199-I203 PolarHBondContact O-N 2.8Å; R199-I203 VanDerWaalsContact O-N 3.11Å; R200-I203 PolarHBondContact O-N 2.62Å; I203-A205 VanDerWaalsContact C-N 3.3Å; I203-A205 PolarHBondContact O-N 3.16Å; I203-Q206 WeakPolarHBondContact O-CB 3.39Å; I203-Q206 PolarHBondContact O-N 2.78Å; I203-Q206 VanDerWaalsContact O-N 3.14Å; I203-L207 HydrophobicContact CG2-CD1 4.16Å; I203-L207 HydrophobicContact CG2-CG 4.35Å; I203-L207 WeakPolarHBondContact O-CG 3.35Å; I203-L207 PolarHBondContact O-N 2.78Å; I203-M214 HydrophobicContact CG2-CE 4.42Å; I203-F216 HydrophobicContact CD1-CE1 4.05Å; I203-F216 HydrophobicContact CG1-CE1 3.89Å; I203-F216 HydrophobicContact CG2-CE1 4.02Å; I203-F216 HydrophobicContact CG2-CZ 4.35Å; I203-L234 HydrophobicContact CD1-CD2 4.46Å; I203-L235 HydrophobicContact CD1-CD2 4.28Å; I203-L238 HydrophobicContact CG2-CD1 4.03Å
204	A	94.6	Very high	90.7	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-57.6	-42.1	177.4	0	0	0	0	0	112.2	L148 I171 L175 L177 R200 V201 Q206 L207 L208	L148-A204 HydrophobicContact CD1-CB 3.93Å; L148-A204 HydrophobicContact CD2-CB 3.56Å; L148-A204 HydrophobicContact CG-CB 4.4Å; I171-A204 HydrophobicContact CG2-CB 3.85Å; L175-A204 HydrophobicContact CD1-CB 3.28Å; L177-A204 HydrophobicContact CD1-CB 4.27Å; R200-A204 WeakPolarHBondContact O-CB 3.35Å; R200-A204 PolarHBondContact O-N 2.8Å; V201-A204 WeakPolarHBondContact O-CB 3.37Å; V201-A204 PolarHBondContact O-N 3.06Å; A204-Q206 VanDerWaalsContact C-N 3.25Å; A204-Q206 PolarHBondContact O-N 3.03Å; A204-L207 PolarHBondContact O-N 3.43Å; A204-L208 PolarHBondContact O-N 3.17Å
205	A	92.4	Very high	90.9	Very high	14 Å²	14	19.2 Å²	19.2	12%	0.116	10%	0.095	C	C	.	.	H	α-helix	trans	-61.2	-37.2	179.1	0	0	0	0	0	112	L148 T151 V201 S202 I203	L148-A205 HydrophobicContact CD2-CB 4.2Å; T151-A205 HydrophobicContact CG2-CB 4.39Å; V201-A205 PolarHBondContact O-N 2.84Å; S202-A205 PolarHBondContact O-N 3.46Å; I203-A205 VanDerWaalsContact C-N 3.3Å; I203-A205 PolarHBondContact O-N 3.16Å
206	Q	90.5	Very high	91.2	Very high	8 Å²	8	15.7 Å²	15.7	4%	0.037	7%	0.073	C	C	.	.	H	α-helix	trans	-72.9	-40.2	175.8	-71.7	-43.2	-45.3	0	0	112.7	S130 V132 S202 I203 A204 L208 Q209 P211 M214 D455	S130-Q206 WeakPolarHBondContact OG-CB 3.46Å; S130-Q206 WeakPolarHBondContact OG-CG 3.4Å; S130-Q206 PolarHBondContact OG-OE1 2.91Å; V132-Q206 HydrophobicContact CG2-CB 4.34Å; V132-Q206 HydrophobicContact CG2-CG 3.75Å; S202-Q206 PolarHBondContact O-N 3.02Å; I203-Q206 WeakPolarHBondContact O-CB 3.39Å; I203-Q206 PolarHBondContact O-N 2.78Å; I203-Q206 VanDerWaalsContact O-N 3.14Å; A204-Q206 VanDerWaalsContact C-N 3.25Å; A204-Q206 PolarHBondContact O-N 3.03Å; Q206-L208 PolarHBondContact O-N 3.22Å; Q206-Q209 PolarHBondContact O-N 3.24Å; Q206-P211 WeakPolarHBondContact O-CD 3.5Å; Q206-M214 HydrophobicContact CB-CE 4.19Å; Q206-D455 PolarHBondContact NE2-OD2 3.34Å
207	L	90.9	Very high	91.4	Very high	4 Å²	4	15.9 Å²	15.9	2%	0.021	7%	0.074	C	C	.	.	H	α-helix	trans	-64.2	-22.6	178.4	-72.3	176.7	0	0	0	113.8	I171 L175 I203 A204 Q209 D210 M214 L238	I171-L207 HydrophobicContact CD1-CB 4.2Å; I171-L207 HydrophobicContact CG2-CB 4.23Å; L175-L207 HydrophobicContact CD1-CD1 3.95Å; L175-L207 HydrophobicContact CD2-CD1 3.86Å; L175-L207 HydrophobicContact CG-CD1 4.14Å; I203-L207 HydrophobicContact CG2-CD1 4.16Å; I203-L207 HydrophobicContact CG2-CG 4.35Å; I203-L207 WeakPolarHBondContact O-CG 3.35Å; I203-L207 PolarHBondContact O-N 2.78Å; A204-L207 PolarHBondContact O-N 3.43Å; L207-Q209 PolarHBondContact O-N 3.25Å; L207-Q209 VanDerWaalsContact O-N 3.13Å; L207-D210 WeakPolarHBondContact O-CA 3.45Å; L207-D210 PolarHBondContact O-N 3.36Å; L207-M214 HydrophobicContact CD2-CE 3.63Å; L207-M214 HydrophobicContact CD2-SD 3.5Å; L207-M214 WeakPolarHBondContact CD2-SD 3.44Å; L207-M214 HydrophobicContact CG-CE 4.04Å; L207-L238 HydrophobicContact CD1-CD1 4.2Å; L207-L238 HydrophobicContact CD1-CD2 3.73Å; L207-L238 HydrophobicContact CD2-CD1 4.41Å; L207-L238 HydrophobicContact CD2-CD2 4.03Å
208	L	89	Confident	91.4	Very high	1 Å²	1	15.6 Å²	15.6	1%	0.005	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-26.3	175.7	-76.8	164.1	0	0	0	113.3	L148 T151 A152 K167 V168 I171 A204 Q206 D210	L148-L208 HydrophobicContact CB-CD1 4.26Å; L148-L208 HydrophobicContact CD2-CD1 4.12Å; L148-L208 VanDerWaalsContact O-CD1 3.29Å; L148-L208 WeakPolarHBondContact O-CD1 3.49Å; T151-L208 WeakPolarHBondContact OG1-CD1 3.4Å; A152-L208 HydrophobicContact CB-CD1 4.04Å; A152-L208 HydrophobicContact CB-CD2 3.86Å; A152-L208 HydrophobicContact CB-CG 4.49Å; K167-L208 WeakPolarHBondContact CE-O 3.48Å; K167-L208 HydrophobicContact CG-CD2 4.39Å; K167-L208 PolarHBondContact NZ-O 2.9Å; V168-L208 HydrophobicContact CG2-CD2 3.99Å; I171-L208 HydrophobicContact CD1-CB 4.25Å; I171-L208 HydrophobicContact CD1-CD2 3.49Å; I171-L208 VanDerWaalsContact CD1-CD2 3.49Å; I171-L208 HydrophobicContact CD1-CG 3.72Å; A204-L208 PolarHBondContact O-N 3.17Å; Q206-L208 PolarHBondContact O-N 3.22Å; L208-D210 PolarHBondContact O-N 2.98Å
209	Q	82.7	Confident	91.4	Very high	7 Å²	7	11.5 Å²	11.5	3%	0.033	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-3.9	177.4	-63.6	172.8	0.8	0	0	113.2	A155 Q206 L207 K357	A155-Q209 HydrophobicContact CB-CG 4.18Å; Q206-Q209 PolarHBondContact O-N 3.24Å; L207-Q209 PolarHBondContact O-N 3.25Å; L207-Q209 VanDerWaalsContact O-N 3.13Å; Q209-K357 HydrophobicContact CB-CG 4.19Å; Q209-K357 HydrophobicContact CG-CG 4.45Å; Q209-K357 VanDerWaalsContact OE1-CD 3.22Å
210	D	84.6	Confident	91.4	Very high	77 Å²	77	12.1 Å²	12.1	41%	0.412	6%	0.062	S	C	.	.			trans	48.7	55.9	-172.7	-162.3	17.6	0	0	0	114.2	L207 L208 R243	L207-D210 WeakPolarHBondContact O-CA 3.45Å; L207-D210 PolarHBondContact O-N 3.36Å; L208-D210 PolarHBondContact O-N 2.98Å; D210-R243 IonicContact OD1-CZ 2.74Å; D210-R243 VanDerWaalsContact OD1-CZ 3.29Å; D210-R243 IonicContact OD1-NH1 3.57Å; D210-R243 PolarHBondContact OD1-NH1 3.1Å; D210-R243 IonicContact OD1-NH2 3.55Å; D210-R243 PolarHBondContact OD1-NH2 3.02Å
211	P	86.6	Confident	91.1	Very high	4 Å²	4	12.8 Å²	12.8	3%	0.026	7%	0.07	C	C	.	.			trans	-77.1	133.7	-176.2	32.8	-35.2	0	0	0	111.8	S130 Q206 M214 R243	S130-P211 VanDerWaalsContact CB-CB 3.4Å; S130-P211 VanDerWaalsContact CB-CG 3.48Å; Q206-P211 WeakPolarHBondContact O-CD 3.5Å; P211-M214 HydrophobicContact CB-CG 4.33Å; P211-M214 HydrophobicContact CG-CE 4.18Å; P211-M214 HydrophobicContact CG-CG 3.86Å; P211-M214 HydrophobicContact CG-SD 4.11Å; P211-R243 PolarHBondContact O-NH1 3.27Å
212	K	85.3	Confident	90.6	Very high	51 Å²	51	16.6 Å²	16.6	22%	0.222	11%	0.109	C	C	.	.	S	Bend	trans	-81.8	-21.5	173.7	-61	-62.5	-170.8	-177.2	0	113.3	R243 I244 F356	K212-R243 CarbonylContact O-C 3.54Å; K212-R243 VanDerWaalsContact O-CA 3.32Å; K212-R243 WeakPolarHBondContact O-CA 3.3Å; K212-I244 PolarHBondContact O-N 3.14Å; K212-F356 HydrophobicContact CB-CD1 3.62Å; K212-F356 HydrophobicContact CB-CE1 3.36Å; K212-F356 HydrophobicContact CG-CD1 3.79Å; K212-F356 HydrophobicContact CG-CE1 3.67Å
213	V	90.4	Very high	90.3	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	122	177.6	-168.4	0	0	0	0	109.3	L38 F129 S130 I244 F356	L38-V213 HydrophobicContact CD2-CG1 3.86Å; F129-V213 HydrophobicContact CD1-CB 3.99Å; F129-V213 HydrophobicContact CD1-CG1 3.48Å; F129-V213 VanDerWaalsContact CD1-CG1 3.48Å; F129-V213 HydrophobicContact CE1-CB 4.26Å; F129-V213 HydrophobicContact CE1-CG1 3.53Å; S130-V213 PolarHBondContact N-O 3.46Å; V213-I244 HydrophobicContact CB-CB 4.45Å; V213-I244 HydrophobicContact CG1-CB 4.08Å; V213-I244 HydrophobicContact CG1-CG2 4.03Å; V213-I244 HydrophobicContact CG2-CB 4.28Å; V213-I244 HydrophobicContact CG2-CD1 4.18Å; V213-F356 HydrophobicContact CG2-CE1 4.45Å; V213-F356 HydrophobicContact CG2-CZ 4.48Å
214	M	93.1	Very high	90	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	130	-176.4	-59.5	-170.5	77.8	0	0	110.6	S130 I203 Q206 L207 P211 F216 L238 I244 V246	S130-M214 WeakPolarHBondContact O-CA 3.41Å; I203-M214 HydrophobicContact CG2-CE 4.42Å; Q206-M214 HydrophobicContact CB-CE 4.19Å; L207-M214 HydrophobicContact CD2-CE 3.63Å; L207-M214 HydrophobicContact CD2-SD 3.5Å; L207-M214 WeakPolarHBondContact CD2-SD 3.44Å; L207-M214 HydrophobicContact CG-CE 4.04Å; P211-M214 HydrophobicContact CB-CG 4.33Å; P211-M214 HydrophobicContact CG-CE 4.18Å; P211-M214 HydrophobicContact CG-CG 3.86Å; P211-M214 HydrophobicContact CG-SD 4.11Å; M214-F216 HydrophobicContact CB-CD2 4.31Å; M214-F216 HydrophobicContact CB-CE2 3.41Å; M214-F216 VanDerWaalsContact CB-CE2 3.41Å; M214-F216 HydrophobicContact CB-CZ 3.89Å; M214-F216 HydrophobicContact CE-CE1 4.36Å; M214-F216 HydrophobicContact CE-CE2 4.39Å; M214-F216 HydrophobicContact CE-CZ 3.64Å; M214-F216 HydrophobicContact SD-CE2 4.44Å; M214-F216 HydrophobicContact SD-CZ 4.09Å; M214-L238 HydrophobicContact SD-CD1 4.42Å; M214-I244 PolarHBondContact N-O 2.87Å; M214-V246 PolarHBondContact O-N 3.44Å
215	L	94.8	Very high	89.6	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.3	179.9	-53.1	176.2	0	0	0	108.4	L96 M99 F129 S130 Y131 V132 V246	L96-L215 HydrophobicContact CD2-CB 4.41Å; M99-L215 HydrophobicContact CB-CD1 4.02Å; M99-L215 HydrophobicContact CE-CD2 4.06Å; F129-L215 HydrophobicContact CB-CD1 4.07Å; F129-L215 HydrophobicContact CD1-CD1 3.67Å; F129-L215 HydrophobicContact CD1-CD2 4.25Å; F129-L215 HydrophobicContact CD1-CG 4Å; F129-L215 HydrophobicContact CE1-CD1 4.37Å; F129-L215 HydrophobicContact CG-CD1 4.03Å; S130-L215 PolarHBondContact O-N 3.34Å; Y131-L215 CarbonylContact C-O 3.52Å; Y131-L215 WeakPolarHBondContact CA-O 3.27Å; Y131-L215 HydrophobicContact CD2-CB 3.81Å; Y131-L215 HydrophobicContact CD2-CD1 4Å; Y131-L215 HydrophobicContact CE2-CB 4.2Å; Y131-L215 HydrophobicContact CE2-CD1 4.41Å; V132-L215 PolarHBondContact N-O 3.35Å; L215-V246 CarbonylContact C-O 3.55Å; L215-V246 WeakPolarHBondContact CA-O 3.39Å; L215-V246 HydrophobicContact CD2-CB 3.66Å; L215-V246 HydrophobicContact CD2-CG1 4.42Å; L215-V246 HydrophobicContact CD2-CG2 3.9Å
216	F	95.6	Very high	89.4	Confident	0 Å²	0	30 Å²	30	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	114.8	-177.6	-61.8	-96	0	0	0	110.1	L96 V132 I203 M214 P219 L235 V245 V246 L247 T248	L96-F216 WeakPolarHBondContact CD2-O 2.97Å; V132-F216 HydrophobicContact CB-CD1 3.57Å; V132-F216 HydrophobicContact CB-CE1 4.01Å; V132-F216 HydrophobicContact CB-CG 4.33Å; V132-F216 HydrophobicContact CG1-CD1 4.05Å; V132-F216 HydrophobicContact CG2-CD1 3.65Å; V132-F216 HydrophobicContact CG2-CE1 3.51Å; V132-F216 HydrophobicContact CG2-CZ 4.36Å; I203-F216 HydrophobicContact CD1-CE1 4.05Å; I203-F216 HydrophobicContact CG1-CE1 3.89Å; I203-F216 HydrophobicContact CG2-CE1 4.02Å; I203-F216 HydrophobicContact CG2-CZ 4.35Å; M214-F216 HydrophobicContact CB-CD2 4.31Å; M214-F216 HydrophobicContact CB-CE2 3.41Å; M214-F216 VanDerWaalsContact CB-CE2 3.41Å; M214-F216 HydrophobicContact CB-CZ 3.89Å; M214-F216 HydrophobicContact CE-CE1 4.36Å; M214-F216 HydrophobicContact CE-CE2 4.39Å; M214-F216 HydrophobicContact CE-CZ 3.64Å; M214-F216 HydrophobicContact SD-CE2 4.44Å; M214-F216 HydrophobicContact SD-CZ 4.09Å; F216-P219 HydrophobicContact CB-CB 4.19Å; F216-P219 HydrophobicContact CB-CG 3.87Å; F216-L235 HydrophobicContact CD1-CD2 3.83Å; F216-L235 HydrophobicContact CD2-CD2 4.05Å; F216-L235 HydrophobicContact CE1-CD2 3.37Å; F216-L235 HydrophobicContact CE2-CD2 3.62Å; F216-L235 HydrophobicContact CG-CD1 4.39Å; F216-L235 HydrophobicContact CG-CD2 4.15Å; F216-L235 HydrophobicContact CZ-CD2 3.26Å; F216-V245 HydrophobicContact CD2-CG1 3.88Å; F216-V245 HydrophobicContact CE2-CG1 3.77Å; F216-V246 PolarHBondContact N-O 3.45Å; F216-L247 HydrophobicContact CB-CB 3.94Å; F216-L247 CarbonylContact O-C 3.6Å; F216-L247 VanDerWaalsContact O-CA 3.24Å; F216-L247 WeakPolarHBondContact O-CA 3.41Å; F216-T248 PolarHBondContact O-N 2.98Å
217	D	94.1	Very high	89.3	Confident	7 Å²	7	30.8 Å²	30.8	4%	0.037	19%	0.185	C	C	.	.	S	Bend	trans	-89.4	113.4	176	-163.1	20	0	0	0	109.7	T93 L96 Y131 V132 Q134 R199 T248	T93-D217 WeakPolarHBondContact CG2-OD2 3.29Å; T93-D217 PolarHBondContact OG1-OD1 2.82Å; L96-D217 HydrophobicContact CD2-CB 4.37Å; Y131-D217 HydrophobicContact CE1-CB 4.01Å; V132-D217 PolarHBondContact O-N 2.85Å; Q134-D217 VanDerWaalsContact CA-O 3.3Å; Q134-D217 WeakPolarHBondContact CA-O 3.09Å; Q134-D217 PolarHBondContact N-O 2.82Å; R199-D217 PolarHBondContact NH2-O 3.5Å; D217-T248 WeakPolarHBondContact CA-OG1 3.42Å; D217-T248 PolarHBondContact OD1-OG1 3.41Å
218	E	92.8	Very high	89.3	Confident	21 Å²	21	31.2 Å²	31.2	10%	0.098	19%	0.189	C	C	.	.	S	Bend	trans	47.4	52.4	174.5	-73.9	-168.3	-176.7	0	0	114.7	Q134 T220 T221 T248	Q134-E218 HydrophobicContact CG-CB 4.03Å; Q134-E218 PolarHBondContact NE2-OE2 3.39Å; E218-T220 PolarHBondContact O-N 3.47Å; E218-T220 VanDerWaalsContact O-N 3.16Å; E218-T221 HydrophobicContact CB-CG2 3.68Å; E218-T221 HydrophobicContact CG-CG2 4.21Å; E218-T221 PolarHBondContact O-N 2.84Å; E218-T221 VanDerWaalsContact O-N 3.16Å; E218-T221 PolarHBondContact O-OG1 3.19Å; E218-T221 WeakPolarHBondContact OE2-CG2 3.5Å; E218-T248 VanDerWaalsContact CA-O 3.22Å; E218-T248 WeakPolarHBondContact CA-O 3.36Å; E218-T248 PolarHBondContact N-O 3.4Å; E218-T248 PolarHBondContact N-OG1 2.99Å
219	P	92.9	Very high	89.4	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.006	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-13.7	-170.8	32.1	-37.3	0	0	0	116.2	R199 F216 I231 L235 L247 T248	R199-P219 PolarHBondContact NE-O 3.26Å; R199-P219 VanDerWaalsContact NH2-CA 3.26Å; F216-P219 HydrophobicContact CB-CB 4.19Å; F216-P219 HydrophobicContact CB-CG 3.87Å; P219-I231 HydrophobicContact CB-CG2 4.49Å; P219-L235 HydrophobicContact CB-CD1 4.5Å; P219-L235 HydrophobicContact CG-CD1 4.08Å; P219-L247 HydrophobicContact CG-CB 4.34Å; P219-T248 VanDerWaalsContact CD-O 3.29Å; P219-T248 WeakPolarHBondContact CD-O 3.24Å
220	T	91	Very high	89.8	Confident	19 Å²	19	35.6 Å²	35.6	12%	0.117	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-6.2	177.7	53	0	0	0	0	113.1	E218 L223 A228 V232	E218-T220 PolarHBondContact O-N 3.47Å; E218-T220 VanDerWaalsContact O-N 3.16Å; T220-L223 PolarHBondContact O-N 3.32Å; T220-A228 HydrophobicContact CG2-CB 4.1Å; T220-V232 HydrophobicContact CG2-CG2 3.72Å
221	T	88.4	Confident	90.2	Very high	49 Å²	49	32 Å²	32	30%	0.301	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	138.9	-175.7	58.1	0	0	0	0	112.3	E218 L223	E218-T221 HydrophobicContact CB-CG2 3.68Å; E218-T221 HydrophobicContact CG-CG2 4.21Å; E218-T221 PolarHBondContact O-N 2.84Å; E218-T221 VanDerWaalsContact O-N 3.16Å; E218-T221 PolarHBondContact O-OG1 3.19Å; E218-T221 WeakPolarHBondContact OE2-CG2 3.5Å; T221-L223 PolarHBondContact O-N 3.47Å
222	G	84.5	Confident	90.6	Very high	80 Å²	80	31.8 Å²	31.8	83%	0.825	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.1	12.6	-178	0	0	0	0	0	114.9
223	L	87.8	Confident	90.9	Very high	31 Å²	31	33.1 Å²	33.1	16%	0.162	20%	0.199	C	C	.	.	S	Bend	trans	-103.4	151.6	172.9	-60.1	179.9	0	0	0	110.7	T220 T221 T227 A228 I231	T220-L223 PolarHBondContact O-N 3.32Å; T221-L223 PolarHBondContact O-N 3.47Å; L223-T227 HydrophobicContact CB-CG2 4.46Å; L223-T227 HydrophobicContact CD1-CG2 4.18Å; L223-T227 HydrophobicContact CD2-CG2 4.19Å; L223-A228 HydrophobicContact CB-CB 4.34Å; L223-I231 HydrophobicContact CD1-CG1 3.85Å
224	D	88.1	Confident	91.1	Very high	80 Å²	80	33.9 Å²	33.9	43%	0.428	20%	0.203	S	C	.	.			trans	-69.1	162.3	166.6	67.4	-75.5	0	0	0	110.5	M226 T227 A228	D224-M226 VanDerWaalsContact C-N 3.35Å; D224-M226 PolarHBondContact O-N 3.11Å; D224-M226 PolarHBondContact OD2-N 3.29Å; D224-T227 VanDerWaalsContact CG-OG1 3.23Å; D224-T227 PolarHBondContact O-N 2.92Å; D224-T227 WeakPolarHBondContact OD1-CB 3.44Å; D224-T227 PolarHBondContact OD1-OG1 3.11Å; D224-T227 PolarHBondContact OD2-N 2.81Å; D224-T227 VanDerWaalsContact OD2-N 3.08Å; D224-T227 PolarHBondContact OD2-OG1 3.47Å; D224-A228 WeakPolarHBondContact O-CB 3.19Å; D224-A228 PolarHBondContact O-N 2.81Å
225	C	85.9	Confident	91.2	Very high	61 Å²	61	33.9 Å²	33.9	41%	0.412	20%	0.203	S	C	.	.	H	α-helix	trans	-62.4	-38.6	-170.7	-66.9	0	0	0	0	114.1	N229 R253	C225-N229 PolarHBondContact O-N 2.94Å; C225-R253 VanDerWaalsContact SG-CZ 3.53Å; C225-R253 PolarHBondContact SG-NE 3.1Å; C225-R253 PolarHBondContact SG-NH2 3.11Å
226	M	88.1	Confident	91.2	Very high	130 Å²	130	34.6 Å²	34.6	64%	0.64	21%	0.207	S	C	*	.	H	α-helix	trans	-69	-46.9	179.4	178.6	177	176.9	0	0	110.2	D224 A228 N229 Q230	D224-M226 VanDerWaalsContact C-N 3.35Å; D224-M226 PolarHBondContact O-N 3.11Å; D224-M226 PolarHBondContact OD2-N 3.29Å; M226-A228 VanDerWaalsContact C-N 3.35Å; M226-A228 PolarHBondContact O-N 3.33Å; M226-N229 PolarHBondContact O-N 3.24Å; M226-Q230 WeakPolarHBondContact O-CG 3.16Å; M226-Q230 PolarHBondContact O-N 2.95Å; M226-Q230 VanDerWaalsContact O-N 3.09Å
227	T	89	Confident	91	Very high	23 Å²	23	38.7 Å²	38.7	14%	0.141	23%	0.226	C	C	.	.	H	α-helix	trans	-63.6	-40	177.9	-57.8	0	0	0	0	112	G196 L223 D224 N229 Q230 I231	G196-T227 VanDerWaalsContact CA-CG2 3.43Å; L223-T227 HydrophobicContact CB-CG2 4.46Å; L223-T227 HydrophobicContact CD1-CG2 4.18Å; L223-T227 HydrophobicContact CD2-CG2 4.19Å; D224-T227 VanDerWaalsContact CG-OG1 3.23Å; D224-T227 PolarHBondContact O-N 2.92Å; D224-T227 WeakPolarHBondContact OD1-CB 3.44Å; D224-T227 PolarHBondContact OD1-OG1 3.11Å; D224-T227 PolarHBondContact OD2-N 2.81Å; D224-T227 VanDerWaalsContact OD2-N 3.08Å; D224-T227 PolarHBondContact OD2-OG1 3.47Å; T227-N229 PolarHBondContact O-N 3.26Å; T227-Q230 PolarHBondContact O-N 3.37Å; T227-I231 HydrophobicContact CG2-CG1 4.48Å; T227-I231 WeakPolarHBondContact O-CG1 3.07Å; T227-I231 PolarHBondContact O-N 3.32Å
228	A	90.9	Very high	90.9	Very high	13 Å²	13	38.5 Å²	38.5	11%	0.107	23%	0.225	C	C	.	.	H	α-helix	trans	-58.2	-46.8	176.3	0	0	0	0	0	111.8	T220 L223 D224 M226 Q230 I231 V232	T220-A228 HydrophobicContact CG2-CB 4.1Å; L223-A228 HydrophobicContact CB-CB 4.34Å; D224-A228 WeakPolarHBondContact O-CB 3.19Å; D224-A228 PolarHBondContact O-N 2.81Å; M226-A228 VanDerWaalsContact C-N 3.35Å; M226-A228 PolarHBondContact O-N 3.33Å; A228-Q230 PolarHBondContact O-N 3.11Å; A228-I231 PolarHBondContact O-N 3.44Å; A228-V232 WeakPolarHBondContact O-CG2 3.41Å; A228-V232 PolarHBondContact O-N 3.5Å
229	N	91.7	Very high	91	Very high	28 Å²	28	37.5 Å²	37.5	15%	0.15	22%	0.221	C	C	.	.	H	α-helix	trans	-60.4	-43.8	175.6	-76.1	0.7	0	0	0	111.8	C225 M226 T227 I231 V232 I233 E255 L256	C225-N229 PolarHBondContact O-N 2.94Å; M226-N229 PolarHBondContact O-N 3.24Å; T227-N229 PolarHBondContact O-N 3.26Å; N229-I231 VanDerWaalsContact C-N 3.33Å; N229-I231 PolarHBondContact O-N 2.85Å; N229-V232 PolarHBondContact O-N 2.92Å; N229-I233 WeakPolarHBondContact O-CG1 3.38Å; N229-I233 PolarHBondContact O-N 2.74Å; N229-E255 PolarHBondContact ND2-OE2 3.29Å; N229-L256 WeakPolarHBondContact OD1-CD2 3.15Å
230	Q	91.1	Very high	90.9	Very high	73 Å²	73	46.2 Å²	46.2	34%	0.341	25%	0.254	S	S	.	.	H	α-helix	trans	-61.4	-39.2	176.9	-71	177.9	-1.3	0	0	112.8	M226 T227 A228 L234	M226-Q230 WeakPolarHBondContact O-CG 3.16Å; M226-Q230 PolarHBondContact O-N 2.95Å; M226-Q230 VanDerWaalsContact O-N 3.09Å; T227-Q230 PolarHBondContact O-N 3.37Å; A228-Q230 PolarHBondContact O-N 3.11Å; Q230-L234 WeakPolarHBondContact O-CB 3.37Å; Q230-L234 PolarHBondContact O-N 3.3Å
231	I	92.8	Very high	90.8	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-64.9	-42.5	175.3	-66.8	-63.1	0	0	0	110.6	R199 R200 P219 L223 T227 A228 N229 L234 L235	R199-I231 HydrophobicContact CB-CD1 4.38Å; R199-I231 HydrophobicContact CG-CD1 4.4Å; R200-I231 HydrophobicContact CG-CD1 3.51Å; P219-I231 HydrophobicContact CB-CG2 4.49Å; L223-I231 HydrophobicContact CD1-CG1 3.85Å; T227-I231 HydrophobicContact CG2-CG1 4.48Å; T227-I231 WeakPolarHBondContact O-CG1 3.07Å; T227-I231 PolarHBondContact O-N 3.32Å; A228-I231 PolarHBondContact O-N 3.44Å; N229-I231 VanDerWaalsContact C-N 3.33Å; N229-I231 PolarHBondContact O-N 2.85Å; I231-L234 WeakPolarHBondContact O-CB 3.25Å; I231-L234 PolarHBondContact O-N 3.37Å; I231-L235 HydrophobicContact CG2-CD1 4.4Å; I231-L235 WeakPolarHBondContact O-CG 3.2Å; I231-L235 PolarHBondContact O-N 2.93Å
232	V	94	Very high	90.8	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.2	-42.1	178.3	176.4	0	0	0	0	111.6	T220 A228 N229 L234 L235 V236 L256 L259 F260	T220-V232 HydrophobicContact CG2-CG2 3.72Å; A228-V232 WeakPolarHBondContact O-CG2 3.41Å; A228-V232 PolarHBondContact O-N 3.5Å; N229-V232 PolarHBondContact O-N 2.92Å; V232-L234 VanDerWaalsContact C-N 3.29Å; V232-L234 PolarHBondContact O-N 2.75Å; V232-L235 WeakPolarHBondContact O-CB 3.22Å; V232-L235 PolarHBondContact O-N 3.06Å; V232-L235 VanDerWaalsContact O-N 3.08Å; V232-V236 WeakPolarHBondContact O-CG2 3.3Å; V232-V236 PolarHBondContact O-N 2.98Å; V232-L256 HydrophobicContact CB-CD2 4.09Å; V232-L256 HydrophobicContact CG1-CD2 4.03Å; V232-L256 HydrophobicContact CG2-CD1 4.13Å; V232-L256 HydrophobicContact CG2-CD2 4.44Å; V232-L259 HydrophobicContact CG1-CD1 4.3Å; V232-F260 HydrophobicContact CG1-CE1 4.14Å; V232-F260 HydrophobicContact CG1-CZ 4.22Å
233	I	92.7	Very high	91.1	Very high	79 Å²	79	47.9 Å²	47.9	41%	0.405	23%	0.229	S	C	.	.	H	α-helix	trans	-58	-45.1	175.1	-68.4	164.9	0	0	0	110.7	N229 L235 V236 E237	N229-I233 WeakPolarHBondContact O-CG1 3.38Å; N229-I233 PolarHBondContact O-N 2.74Å; I233-L235 VanDerWaalsContact C-N 3.31Å; I233-L235 PolarHBondContact O-N 2.7Å; I233-V236 WeakPolarHBondContact O-CB 3.43Å; I233-V236 PolarHBondContact O-N 3.29Å; I233-V236 VanDerWaalsContact O-N 3.16Å; I233-E237 WeakPolarHBondContact O-CG 3.25Å; I233-E237 PolarHBondContact O-N 3.14Å
234	L	93.4	Very high	91.4	Very high	16 Å²	16	46.4 Å²	46.4	8%	0.084	22%	0.221	C	C	.	.	H	α-helix	trans	-58.7	-41.9	175.3	178.7	73.3	0	0	0	112	L175 R200 I203 Q230 I231 V232 V236 E237 L238	L175-L234 HydrophobicContact CD2-CD1 3.63Å; L175-L234 HydrophobicContact CD2-CD2 3.73Å; L175-L234 HydrophobicContact CD2-CG 3.97Å; R200-L234 HydrophobicContact CG-CD2 4.04Å; I203-L234 HydrophobicContact CD1-CD2 4.46Å; Q230-L234 WeakPolarHBondContact O-CB 3.37Å; Q230-L234 PolarHBondContact O-N 3.3Å; I231-L234 WeakPolarHBondContact O-CB 3.25Å; I231-L234 PolarHBondContact O-N 3.37Å; V232-L234 VanDerWaalsContact C-N 3.29Å; V232-L234 PolarHBondContact O-N 2.75Å; L234-V236 VanDerWaalsContact C-N 3.35Å; L234-E237 WeakPolarHBondContact O-CB 3.27Å; L234-E237 PolarHBondContact O-N 3.47Å; L234-L238 WeakPolarHBondContact O-CG 3.41Å; L234-L238 PolarHBondContact O-N 3.29Å
235	L	94.9	Very high	91.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.4	-38.1	176.4	-66.9	179.5	0	0	0	112.3	I81 I203 F216 P219 I231 V232 I233 L238 A239 V245 L247	I81-L235 HydrophobicContact CD1-CB 4.08Å; I203-L235 HydrophobicContact CD1-CD2 4.28Å; F216-L235 HydrophobicContact CD1-CD2 3.83Å; F216-L235 HydrophobicContact CD2-CD2 4.05Å; F216-L235 HydrophobicContact CE1-CD2 3.37Å; F216-L235 HydrophobicContact CE2-CD2 3.62Å; F216-L235 HydrophobicContact CG-CD1 4.39Å; F216-L235 HydrophobicContact CG-CD2 4.15Å; F216-L235 HydrophobicContact CZ-CD2 3.26Å; P219-L235 HydrophobicContact CB-CD1 4.5Å; P219-L235 HydrophobicContact CG-CD1 4.08Å; I231-L235 HydrophobicContact CG2-CD1 4.4Å; I231-L235 WeakPolarHBondContact O-CG 3.2Å; I231-L235 PolarHBondContact O-N 2.93Å; V232-L235 WeakPolarHBondContact O-CB 3.22Å; V232-L235 PolarHBondContact O-N 3.06Å; V232-L235 VanDerWaalsContact O-N 3.08Å; I233-L235 VanDerWaalsContact C-N 3.31Å; I233-L235 PolarHBondContact O-N 2.7Å; L235-L238 HydrophobicContact CD2-CD1 4.22Å; L235-L238 PolarHBondContact O-N 3.5Å; L235-A239 PolarHBondContact O-N 2.9Å; L235-V245 HydrophobicContact CB-CG1 4.29Å; L235-L247 HydrophobicContact CD1-CD2 3.85Å
236	V	94.9	Very high	92.3	Very high	16 Å²	16	39.7 Å²	39.7	10%	0.097	18%	0.181	C	C	.	.	H	α-helix	trans	-64.3	-41	173.4	174.6	0	0	0	0	110.8	I81 V232 I233 L234 L238 A239 R240 L259	I81-V236 HydrophobicContact CD1-CG2 3.66Å; I81-V236 HydrophobicContact CG2-CG2 4.3Å; V232-V236 WeakPolarHBondContact O-CG2 3.3Å; V232-V236 PolarHBondContact O-N 2.98Å; I233-V236 WeakPolarHBondContact O-CB 3.43Å; I233-V236 PolarHBondContact O-N 3.29Å; I233-V236 VanDerWaalsContact O-N 3.16Å; L234-V236 VanDerWaalsContact C-N 3.35Å; V236-L238 VanDerWaalsContact C-N 3.33Å; V236-L238 PolarHBondContact O-N 3.3Å; V236-A239 WeakPolarHBondContact O-CB 3.47Å; V236-A239 PolarHBondContact O-N 3.26Å; V236-R240 WeakPolarHBondContact O-CG 3.05Å; V236-R240 PolarHBondContact O-N 2.82Å; V236-L259 HydrophobicContact CG2-CB 4.4Å
237	E	92.9	Very high	92.7	Very high	86 Å²	86	33.5 Å²	33.5	40%	0.402	15%	0.151	S	C	.	.	H	α-helix	trans	-63.3	-38.1	175	-71.5	176.6	-176.6	0	0	112.4	I233 L234 R240 R241	I233-E237 WeakPolarHBondContact O-CG 3.25Å; I233-E237 PolarHBondContact O-N 3.14Å; L234-E237 WeakPolarHBondContact O-CB 3.27Å; L234-E237 PolarHBondContact O-N 3.47Å; E237-R240 PolarHBondContact O-N 2.75Å; E237-R241 WeakPolarHBondContact O-CG 3.13Å; E237-R241 PolarHBondContact O-N 2.83Å
238	L	92.1	Very high	93	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.01	14%	0.144	C	C	.	.	H	α-helix	trans	-63.9	-40.6	172.9	-68.9	176.2	0	0	0	111.8	I203 L207 M214 L234 L235 V236 R241 R243	I203-L238 HydrophobicContact CG2-CD1 4.03Å; L207-L238 HydrophobicContact CD1-CD1 4.2Å; L207-L238 HydrophobicContact CD1-CD2 3.73Å; L207-L238 HydrophobicContact CD2-CD1 4.41Å; L207-L238 HydrophobicContact CD2-CD2 4.03Å; M214-L238 HydrophobicContact SD-CD1 4.42Å; L234-L238 WeakPolarHBondContact O-CG 3.41Å; L234-L238 PolarHBondContact O-N 3.29Å; L235-L238 HydrophobicContact CD2-CD1 4.22Å; L235-L238 PolarHBondContact O-N 3.5Å; V236-L238 VanDerWaalsContact C-N 3.33Å; V236-L238 PolarHBondContact O-N 3.3Å; L238-R241 PolarHBondContact O-N 2.97Å; L238-R243 WeakPolarHBondContact O-CB 3.16Å; L238-R243 WeakPolarHBondContact O-CG 3.36Å
239	A	93	Very high	93	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.008	14%	0.139	C	C	.	.	H	α-helix	trans	-60.6	-49.3	175.3	0	0	0	0	0	110.7	G79 I81 L235 V236 R241 N242 R243 V245	G79-A239 VanDerWaalsContact CA-O 3.25Å; G79-A239 WeakPolarHBondContact CA-O 3.43Å; I81-A239 HydrophobicContact CB-CB 4.4Å; L235-A239 PolarHBondContact O-N 2.9Å; V236-A239 WeakPolarHBondContact O-CB 3.47Å; V236-A239 PolarHBondContact O-N 3.26Å; A239-R241 PolarHBondContact O-N 3Å; A239-N242 PolarHBondContact O-N 2.8Å; A239-R243 WeakPolarHBondContact CA-O 3.41Å; A239-R243 PolarHBondContact O-N 3.26Å; A239-R243 VanDerWaalsContact O-N 3.1Å; A239-V245 HydrophobicContact CB-CB 4.31Å; A239-V245 HydrophobicContact CB-CG2 3.89Å
240	R	91.2	Very high	92.6	Very high	184 Å²	184	33.9 Å²	33.9	69%	0.694	15%	0.148	S	C	*	.	H	α-helix	trans	-54.6	-26.9	176.4	-72.3	178.5	-174.5	156.4	2.5	113.7	V236 E237 N242	V236-R240 WeakPolarHBondContact O-CG 3.05Å; V236-R240 PolarHBondContact O-N 2.82Å; E237-R240 PolarHBondContact O-N 2.75Å; R240-N242 PolarHBondContact O-N 2.86Å
241	R	89.4	Confident	92.1	Very high	142 Å²	142	36.8 Å²	36.8	54%	0.536	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	35.8	173.1	-66.8	179.6	177	-141.1	-2.4	113.1	E174 E237 L238 A239 R243	E174-R241 WeakPolarHBondContact OE1-CD 3.33Å; E174-R241 IonicContact OE1-CZ 3.87Å; E174-R241 VanDerWaalsContact OE1-CZ 3.29Å; E174-R241 IonicContact OE1-NE 2.75Å; E174-R241 PolarHBondContact OE1-NE 2.74Å; E174-R241 IonicContact OE1-NH1 3.54Å; E174-R241 PolarHBondContact OE1-NH1 3.13Å; E174-R241 IonicContact OE2-NH1 3.29Å; E237-R241 WeakPolarHBondContact O-CG 3.13Å; E237-R241 PolarHBondContact O-N 2.83Å; L238-R241 PolarHBondContact O-N 2.97Å; A239-R241 PolarHBondContact O-N 3Å; R241-R243 PolarHBondContact O-N 2.96Å
242	N	89.1	Confident	91.8	Very high	20 Å²	20	37.1 Å²	37.1	11%	0.107	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	51.3	180	-163.1	36.6	0	0	0	112.7	L33 E34 S78 A239 R240	L33-N242 HydrophobicContact CB-CB 4.45Å; L33-N242 HydrophobicContact CD2-CB 3.69Å; L33-N242 VanDerWaalsContact CD2-ND2 3.27Å; L33-N242 WeakPolarHBondContact CD2-ND2 3.4Å; E34-N242 PolarHBondContact O-ND2 2.71Å; S78-N242 WeakPolarHBondContact CB-OD1 3.49Å; S78-N242 VanDerWaalsContact OG-CG 3.29Å; S78-N242 PolarHBondContact OG-O 2.9Å; S78-N242 PolarHBondContact OG-OD1 3.04Å; A239-N242 PolarHBondContact O-N 2.8Å; R240-N242 PolarHBondContact O-N 2.86Å
243	R	90.8	Very high	91.5	Very high	21 Å²	21	42.4 Å²	42.4	8%	0.079	18%	0.183	C	C	.	.			trans	-121.3	152.6	170.1	-55	-175	-169.3	-81	-2.8	109.7	G79 D210 P211 K212 L238 A239 R241	G79-R243 PolarHBondContact N-O 3.13Å; D210-R243 IonicContact OD1-CZ 2.74Å; D210-R243 VanDerWaalsContact OD1-CZ 3.29Å; D210-R243 IonicContact OD1-NH1 3.57Å; D210-R243 PolarHBondContact OD1-NH1 3.1Å; D210-R243 IonicContact OD1-NH2 3.55Å; D210-R243 PolarHBondContact OD1-NH2 3.02Å; P211-R243 PolarHBondContact O-NH1 3.27Å; K212-R243 CarbonylContact O-C 3.54Å; K212-R243 VanDerWaalsContact O-CA 3.32Å; K212-R243 WeakPolarHBondContact O-CA 3.3Å; L238-R243 WeakPolarHBondContact O-CB 3.16Å; L238-R243 WeakPolarHBondContact O-CG 3.36Å; A239-R243 WeakPolarHBondContact CA-O 3.41Å; A239-R243 PolarHBondContact O-N 3.26Å; A239-R243 VanDerWaalsContact O-N 3.1Å; R241-R243 PolarHBondContact O-N 2.96Å
244	I	93.4	Very high	91.4	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	123.7	167.9	-62.9	179.6	0	0	0	107.3	H36 L38 V76 K212 V213 M214 V246	H36-I244 HydrophobicContact CB-CD1 4.27Å; L38-I244 HydrophobicContact CB-CD1 3.77Å; L38-I244 HydrophobicContact CB-CG2 4.38Å; L38-I244 HydrophobicContact CD2-CG2 4.02Å; V76-I244 HydrophobicContact CB-CG2 4.13Å; V76-I244 HydrophobicContact CG1-CG2 3.74Å; K212-I244 PolarHBondContact O-N 3.14Å; V213-I244 HydrophobicContact CB-CB 4.45Å; V213-I244 HydrophobicContact CG1-CB 4.08Å; V213-I244 HydrophobicContact CG1-CG2 4.03Å; V213-I244 HydrophobicContact CG2-CB 4.28Å; V213-I244 HydrophobicContact CG2-CD1 4.18Å; M214-I244 PolarHBondContact N-O 2.87Å; I244-V246 HydrophobicContact CG2-CG2 4.24Å
245	V	96	Very high	91.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	120.8	178.5	176.7	0	0	0	0	109.3	Q80 I81 M82 F216 L235 A239 L247	Q80-V245 PolarHBondContact O-N 3.41Å; I81-V245 WeakPolarHBondContact CA-O 3.45Å; I81-V245 HydrophobicContact CD1-CG1 4.16Å; I81-V245 HydrophobicContact CG1-CB 4.14Å; I81-V245 HydrophobicContact CG1-CG1 3.89Å; M82-V245 PolarHBondContact N-O 3.07Å; F216-V245 HydrophobicContact CD2-CG1 3.88Å; F216-V245 HydrophobicContact CE2-CG1 3.77Å; L235-V245 HydrophobicContact CB-CG1 4.29Å; A239-V245 HydrophobicContact CB-CB 4.31Å; A239-V245 HydrophobicContact CB-CG2 3.89Å; V245-L247 HydrophobicContact CG1-CD2 4.21Å
246	V	96.8	Very high	91	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.8	173.2	-173.8	0	0	0	0	108.2	L38 M82 I84 M99 M214 L215 F216 I244	L38-V246 HydrophobicContact CD2-CG2 4.21Å; M82-V246 HydrophobicContact CB-CG1 4.4Å; M82-V246 HydrophobicContact CB-CG2 4.35Å; M82-V246 HydrophobicContact CG-CG1 4.29Å; M82-V246 WeakPolarHBondContact O-CA 3.09Å; M82-V246 HydrophobicContact SD-CG1 4.31Å; I84-V246 HydrophobicContact CD1-CG1 3.55Å; I84-V246 HydrophobicContact CG1-CG1 4.33Å; M99-V246 HydrophobicContact CE-CG1 4.37Å; M99-V246 HydrophobicContact CE-CG2 4.11Å; M214-V246 PolarHBondContact O-N 3.44Å; L215-V246 CarbonylContact C-O 3.55Å; L215-V246 WeakPolarHBondContact CA-O 3.39Å; L215-V246 HydrophobicContact CD2-CB 3.66Å; L215-V246 HydrophobicContact CD2-CG1 4.42Å; L215-V246 HydrophobicContact CD2-CG2 3.9Å; F216-V246 PolarHBondContact N-O 3.45Å; I244-V246 HydrophobicContact CG2-CG2 4.24Å
247	L	96	Very high	90.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	146.9	-177.1	59.5	94.1	0	0	0	111.8	I81 M82 C83 I84 F216 P219 L235 V245 I249 F260	I81-L247 HydrophobicContact CD1-CD2 3.54Å; I81-L247 HydrophobicContact CG1-CD2 3.69Å; M82-L247 PolarHBondContact O-N 3.23Å; C83-L247 HydrophobicContact CB-CD1 4.09Å; I84-L247 PolarHBondContact N-O 3.26Å; F216-L247 HydrophobicContact CB-CB 3.94Å; F216-L247 CarbonylContact O-C 3.6Å; F216-L247 VanDerWaalsContact O-CA 3.24Å; F216-L247 WeakPolarHBondContact O-CA 3.41Å; P219-L247 HydrophobicContact CG-CB 4.34Å; L235-L247 HydrophobicContact CD1-CD2 3.85Å; V245-L247 HydrophobicContact CG1-CD2 4.21Å; L247-I249 HydrophobicContact CD1-CD1 3.41Å; L247-I249 VanDerWaalsContact CD1-CD1 3.41Å; L247-I249 HydrophobicContact CD1-CG1 3.42Å; L247-I249 VanDerWaalsContact CD1-CG1 3.42Å; L247-F260 HydrophobicContact CD1-CE1 3.97Å; L247-F260 HydrophobicContact CD1-CZ 4.26Å; L247-F260 HydrophobicContact CD2-CE1 4.09Å
248	T	95.1	Very high	90.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	135.9	169.8	52	0	0	0	0	109.9	I84 K92 L96 F216 D217 E218 P219	I84-T248 HydrophobicContact CB-CG2 4.1Å; I84-T248 HydrophobicContact CG2-CG2 4.22Å; I84-T248 WeakPolarHBondContact O-CA 3.38Å; K92-T248 HydrophobicContact CB-CG2 3.78Å; L96-T248 HydrophobicContact CD1-CG2 3.21Å; L96-T248 HydrophobicContact CD2-CG2 3.78Å; L96-T248 HydrophobicContact CG-CG2 4.08Å; F216-T248 PolarHBondContact O-N 2.98Å; D217-T248 WeakPolarHBondContact CA-OG1 3.42Å; D217-T248 PolarHBondContact OD1-OG1 3.41Å; E218-T248 VanDerWaalsContact CA-O 3.22Å; E218-T248 WeakPolarHBondContact CA-O 3.36Å; E218-T248 PolarHBondContact N-O 3.4Å; E218-T248 PolarHBondContact N-OG1 2.99Å; P219-T248 VanDerWaalsContact CD-O 3.29Å; P219-T248 WeakPolarHBondContact CD-O 3.24Å
249	I	91.4	Very high	90.6	Very high	1 Å²	1	54 Å²	54	1%	0.005	24%	0.242	C	C	.	.			trans	-128.6	136.9	171.6	-58.5	176.3	0	0	0	109.1	I84 L85 L247 P252 F260	I84-I249 PolarHBondContact O-N 2.95Å; L85-I249 HydrophobicContact CD2-CB 4.11Å; L247-I249 HydrophobicContact CD1-CD1 3.41Å; L247-I249 VanDerWaalsContact CD1-CD1 3.41Å; L247-I249 HydrophobicContact CD1-CG1 3.42Å; L247-I249 VanDerWaalsContact CD1-CG1 3.42Å; I249-P252 HydrophobicContact CD1-CB 4.24Å; I249-P252 HydrophobicContact CG2-CB 3.88Å; I249-P252 HydrophobicContact CG2-CG 4.22Å; I249-F260 HydrophobicContact CD1-CE2 4.43Å; I249-F260 HydrophobicContact CD1-CZ 3.7Å
250	H	83.1	Confident	90.7	Very high	71 Å²	71	54.1 Å²	54.1	33%	0.329	24%	0.243	S	C	.	.	S	Bend	trans	-82	-38.9	176.8	-173.8	-93.3	0	0	0	112.3	S88	S88-H250 PolarHBondContact OG-NE2 2.87Å
251	Q	82	Confident	90.9	Very high	134 Å²	134	48.7 Å²	48.7	63%	0.626	23%	0.227	S	C	*	.	S	Bend	trans	-156.6	95.2	175.9	-159.5	170.7	9.1	0	0	112.2	D299	Q251-D299 VanDerWaalsContact CG-OD1 3.28Å; Q251-D299 WeakPolarHBondContact CG-OD1 3.24Å; Q251-D299 PolarHBondContact NE2-OD1 2.98Å; Q251-D299 VanDerWaalsContact NE2-OD1 3.09Å
252	P	86.4	Confident	91.2	Very high	6 Å²	6	43.1 Å²	43.1	4%	0.039	21%	0.207	C	C	.	.			trans	-83.6	152.7	179.3	33.3	-35.1	0	0	0	113	L85 I249 L256 N296 F298	L85-P252 HydrophobicContact CD2-CG 3.78Å; I249-P252 HydrophobicContact CD1-CB 4.24Å; I249-P252 HydrophobicContact CG2-CB 3.88Å; I249-P252 HydrophobicContact CG2-CG 4.22Å; P252-L256 HydrophobicContact CB-CD1 4.16Å; P252-N296 PolarHBondContact O-ND2 3.48Å; P252-N296 VanDerWaalsContact O-ND2 3.16Å; P252-F298 HydrophobicContact CB-CD2 4.07Å; P252-F298 HydrophobicContact CB-CE2 4.03Å; P252-F298 HydrophobicContact CB-CG 4.41Å; P252-F298 HydrophobicContact CB-CZ 4.36Å; P252-F298 HydrophobicContact CG-CB 3.72Å; P252-F298 HydrophobicContact CG-CD1 3.72Å; P252-F298 HydrophobicContact CG-CD2 3.56Å; P252-F298 HydrophobicContact CG-CE1 4.02Å; P252-F298 HydrophobicContact CG-CE2 3.87Å; P252-F298 HydrophobicContact CG-CG 3.43Å; P252-F298 VanDerWaalsContact CG-CG 3.43Å; P252-F298 HydrophobicContact CG-CZ 4.05Å
253	R	87.8	Confident	91.5	Very high	111 Å²	111	42.1 Å²	42.1	42%	0.419	20%	0.202	S	C	.	.			trans	-70.7	149.2	168.7	-72.5	-175.2	161.6	-144.6	-8.1	111.6	C225 E255 L256 F298	C225-R253 VanDerWaalsContact SG-CZ 3.53Å; C225-R253 PolarHBondContact SG-NE 3.1Å; C225-R253 PolarHBondContact SG-NH2 3.11Å; R253-E255 PolarHBondContact O-N 3.18Å; R253-L256 WeakPolarHBondContact O-CB 3.47Å; R253-L256 PolarHBondContact O-N 3.39Å; R253-F298 WeakPolarHBondContact O-CE2 3.35Å
254	S	90.1	Very high	91.7	Very high	62 Å²	62	41.1 Å²	41.1	43%	0.434	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-55.8	-33.4	176.2	54.5	0	0	0	0	113.5	L256 F257 N296	S254-L256 PolarHBondContact O-N 3.49Å; S254-L256 VanDerWaalsContact O-N 3.15Å; S254-F257 WeakPolarHBondContact O-CB 3.21Å; S254-F257 PolarHBondContact O-N 3.36Å; S254-N296 WeakPolarHBondContact CA-OD1 3.49Å; S254-N296 WeakPolarHBondContact CB-OD1 3.36Å
255	E	88.2	Confident	91.8	Very high	115 Å²	115	41.2 Å²	41.2	54%	0.537	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-56.9	-29.3	176.6	-64.8	165.3	-171.6	0	0	113.1	N229 R253 F257	N229-E255 PolarHBondContact ND2-OE2 3.29Å; R253-E255 PolarHBondContact O-N 3.18Å; E255-F257 VanDerWaalsContact C-N 3.26Å; E255-F257 PolarHBondContact O-N 3.09Å
256	L	90.5	Very high	91.7	Very high	6 Å²	6	41.3 Å²	41.3	3%	0.031	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-80.3	-9.2	-178.9	-55.5	176.6	0	0	0	112.7	N229 V232 P252 R253 S254 Q258 L259 F260 F298	N229-L256 WeakPolarHBondContact OD1-CD2 3.15Å; V232-L256 HydrophobicContact CB-CD2 4.09Å; V232-L256 HydrophobicContact CG1-CD2 4.03Å; V232-L256 HydrophobicContact CG2-CD1 4.13Å; V232-L256 HydrophobicContact CG2-CD2 4.44Å; P252-L256 HydrophobicContact CB-CD1 4.16Å; R253-L256 WeakPolarHBondContact O-CB 3.47Å; R253-L256 PolarHBondContact O-N 3.39Å; S254-L256 PolarHBondContact O-N 3.49Å; S254-L256 VanDerWaalsContact O-N 3.15Å; L256-Q258 VanDerWaalsContact C-N 3.31Å; L256-Q258 PolarHBondContact O-N 2.88Å; L256-L259 HydrophobicContact CD2-CD1 3.72Å; L256-L259 WeakPolarHBondContact O-CB 3.44Å; L256-L259 PolarHBondContact O-N 3.02Å; L256-F260 HydrophobicContact CB-CE2 4Å; L256-F260 HydrophobicContact CB-CZ 4.35Å; L256-F260 WeakPolarHBondContact O-CD2 3.36Å; L256-F260 WeakPolarHBondContact O-CE2 2.96Å; L256-F298 HydrophobicContact CB-CE2 4.36Å
257	F	90.3	Very high	91.6	Very high	17 Å²	17	41.3 Å²	41.3	8%	0.075	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-57.9	-43.2	-172.4	-170	-107.5	0	0	0	113	S254 E255 L259 I263 P277 M280 L281 P297 F298	S254-F257 WeakPolarHBondContact O-CB 3.21Å; S254-F257 PolarHBondContact O-N 3.36Å; E255-F257 VanDerWaalsContact C-N 3.26Å; E255-F257 PolarHBondContact O-N 3.09Å; F257-L259 VanDerWaalsContact C-N 3.28Å; F257-L259 PolarHBondContact O-N 2.86Å; F257-I263 HydrophobicContact CD2-CD1 4.08Å; F257-I263 HydrophobicContact CE2-CD1 3.78Å; F257-I263 HydrophobicContact CZ-CD1 4.46Å; F257-P277 HydrophobicContact CD1-CB 4.01Å; F257-P277 HydrophobicContact CE1-CB 3.53Å; F257-P277 HydrophobicContact CE2-CB 4.3Å; F257-P277 HydrophobicContact CZ-CB 3.68Å; F257-P277 WeakPolarHBondContact O-CG 3.21Å; F257-M280 HydrophobicContact CE2-CE 3.3Å; F257-M280 HydrophobicContact CZ-CE 3.56Å; F257-L281 HydrophobicContact CE1-CD1 4.06Å; F257-L281 HydrophobicContact CE1-CG 4.31Å; F257-L281 HydrophobicContact CZ-CD1 4.45Å; F257-L281 HydrophobicContact CZ-CD2 4.35Å; F257-L281 HydrophobicContact CZ-CG 4.19Å; F257-P297 HydrophobicContact CD2-CB 4.17Å; F257-P297 HydrophobicContact CE2-CB 3.86Å; F257-P297 HydrophobicContact CZ-CB 4.1Å; F257-F298 HydrophobicContact CB-CD2 4.31Å; F257-F298 HydrophobicContact CB-CE2 3.6Å; F257-F298 HydrophobicContact CB-CZ 3.93Å; F257-F298 AromaticContact CD2-CD1 3.94Å; F257-F298 HydrophobicContact CD2-CD1 3.94Å; F257-F298 HydrophobicContact CD2-CD2 4.02Å; F257-F298 AromaticContact CD2-CE1 3.63Å; F257-F298 HydrophobicContact CD2-CE1 3.63Å; F257-F298 AromaticContact CD2-CE2 3.71Å; F257-F298 HydrophobicContact CD2-CE2 3.71Å; F257-F298 HydrophobicContact CD2-CG 4.16Å; F257-F298 AromaticContact CD2-CZ 3.54Å; F257-F298 HydrophobicContact CD2-CZ 3.54Å; F257-F298 HydrophobicContact CE2-CD1 4.34Å; F257-F298 HydrophobicContact CE2-CE1 4.18Å; F257-F298 HydrophobicContact CE2-CZ 4.49Å; F257-F298 HydrophobicContact CG-CE2 4.18Å; F257-F298 HydrophobicContact CG-CZ 4.22Å
258	Q	88.4	Confident	91.2	Very high	180 Å²	180	45.4 Å²	45.4	84%	0.841	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-82.2	-6.9	-178	-60.1	-178.4	1.1	0	0	113.1	L256	L256-Q258 VanDerWaalsContact C-N 3.31Å; L256-Q258 PolarHBondContact O-N 2.88Å
259	L	92.8	Very high	90.9	Very high	62 Å²	62	45.4 Å²	45.4	33%	0.325	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-85.2	-17.2	-179	-60.1	-177.6	0	0	0	112.9	I81 V232 V236 L256 F257	I81-L259 WeakPolarHBondContact CG2-O 3.42Å; V232-L259 HydrophobicContact CG1-CD1 4.3Å; V236-L259 HydrophobicContact CG2-CB 4.4Å; L256-L259 HydrophobicContact CD2-CD1 3.72Å; L256-L259 WeakPolarHBondContact O-CB 3.44Å; L256-L259 PolarHBondContact O-N 3.02Å; F257-L259 VanDerWaalsContact C-N 3.28Å; F257-L259 PolarHBondContact O-N 2.86Å
260	F	95.1	Very high	91	Very high	4 Å²	4	46.5 Å²	46.5	2%	0.018	22%	0.222	C	C	.	.			trans	-92.4	128.1	-177.2	-60	-58.6	0	0	0	112.3	I81 C83 V232 L247 I249 L256 I263 P277 F298	I81-F260 HydrophobicContact CD1-CD1 4.24Å; I81-F260 HydrophobicContact CD1-CE1 4.21Å; I81-F260 HydrophobicContact CG1-CD1 4.17Å; I81-F260 HydrophobicContact CG1-CE1 4.48Å; I81-F260 HydrophobicContact CG2-CD1 4.07Å; C83-F260 HydrophobicContact CB-CB 4.3Å; C83-F260 HydrophobicContact CB-CD1 3.61Å; C83-F260 HydrophobicContact CB-CD2 3.77Å; C83-F260 HydrophobicContact CB-CE1 3.79Å; C83-F260 HydrophobicContact CB-CE2 3.93Å; C83-F260 HydrophobicContact CB-CG 3.61Å; C83-F260 HydrophobicContact CB-CZ 3.94Å; V232-F260 HydrophobicContact CG1-CE1 4.14Å; V232-F260 HydrophobicContact CG1-CZ 4.22Å; L247-F260 HydrophobicContact CD1-CE1 3.97Å; L247-F260 HydrophobicContact CD1-CZ 4.26Å; L247-F260 HydrophobicContact CD2-CE1 4.09Å; I249-F260 HydrophobicContact CD1-CE2 4.43Å; I249-F260 HydrophobicContact CD1-CZ 3.7Å; L256-F260 HydrophobicContact CB-CE2 4Å; L256-F260 HydrophobicContact CB-CZ 4.35Å; L256-F260 WeakPolarHBondContact O-CD2 3.36Å; L256-F260 WeakPolarHBondContact O-CE2 2.96Å; F260-I263 HydrophobicContact CB-CD1 4.47Å; F260-I263 HydrophobicContact CB-CG1 3.92Å; F260-I263 HydrophobicContact CD2-CG1 4.39Å; F260-P277 VanDerWaalsContact O-CD 3.29Å; F260-P277 WeakPolarHBondContact O-CD 3.4Å; F260-P277 WeakPolarHBondContact O-CG 3.46Å; F260-F298 HydrophobicContact CD2-CE1 4.26Å; F260-F298 AromaticContact CD2-CZ 3.74Å; F260-F298 HydrophobicContact CD2-CZ 3.74Å; F260-F298 HydrophobicContact CE2-CE1 4.34Å; F260-F298 AromaticContact CE2-CZ 3.69Å; F260-F298 HydrophobicContact CE2-CZ 3.69Å
261	D	95.3	Very high	91.6	Very high	70 Å²	70	43.8 Å²	43.8	37%	0.374	21%	0.21	S	C	.	.	S	Bend	trans	-71.2	-38.3	172.9	-59.5	-69.4	0	0	0	111.1	Q80 I81	Q80-D261 VanDerWaalsContact CA-OD2 3.25Å; Q80-D261 WeakPolarHBondContact CA-OD2 3.44Å; Q80-D261 HydrophobicContact CB-CB 4Å; Q80-D261 HydrophobicContact CG-CB 4.19Å; I81-D261 WeakPolarHBondContact CG2-OD2 3.1Å; I81-D261 PolarHBondContact N-OD2 3.21Å; I81-D261 PolarHBondContact O-N 3.04Å
262	K	95.6	Very high	92.2	Very high	25 Å²	25	37.4 Å²	37.4	11%	0.109	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	136.5	176.3	-66.2	-163.7	175.7	-162.6	0	112.1	Y75 I81 M82 C83 G275	Y75-K262 WeakPolarHBondContact O-CD 3.49Å; Y75-K262 WeakPolarHBondContact O-CE 3.19Å; Y75-K262 PolarHBondContact O-NZ 3.24Å; I81-K262 PolarHBondContact O-N 3.4Å; I81-K262 VanDerWaalsContact O-N 3.12Å; M82-K262 CarbonylContact C-O 3.01Å; M82-K262 WeakPolarHBondContact CA-O 3.44Å; M82-K262 HydrophobicContact CB-CB 4.38Å; M82-K262 HydrophobicContact CE-CB 4.04Å; M82-K262 HydrophobicContact CE-CD 3.96Å; M82-K262 HydrophobicContact CG-CB 4.43Å; C83-K262 PolarHBondContact N-O 3.29Å; K262-G275 CarbonylContact C-O 3.56Å; K262-G275 WeakPolarHBondContact CA-O 3.31Å
263	I	96.1	Very high	92.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.3	172.2	-60.4	170	0	0	0	107.7	C83 L85 F257 F260 C274 G275 P277 M280 F298	C83-I263 CarbonylContact O-C 3.6Å; C83-I263 WeakPolarHBondContact O-CA 3.4Å; L85-I263 HydrophobicContact CD1-CG2 3.65Å; L85-I263 HydrophobicContact CG-CG2 4.43Å; F257-I263 HydrophobicContact CD2-CD1 4.08Å; F257-I263 HydrophobicContact CE2-CD1 3.78Å; F257-I263 HydrophobicContact CZ-CD1 4.46Å; F260-I263 HydrophobicContact CB-CD1 4.47Å; F260-I263 HydrophobicContact CB-CG1 3.92Å; F260-I263 HydrophobicContact CD2-CG1 4.39Å; I263-C274 VanDerWaalsContact O-CA 3.32Å; I263-C274 WeakPolarHBondContact O-CA 3.01Å; I263-G275 PolarHBondContact N-O 3.38Å; I263-G275 PolarHBondContact O-N 2.76Å; I263-P277 HydrophobicContact CD1-CB 4.05Å; I263-P277 HydrophobicContact CD1-CG 3.86Å; I263-P277 HydrophobicContact CG1-CG 4.48Å; I263-M280 HydrophobicContact CB-SD 4.44Å; I263-M280 HydrophobicContact CD1-CE 4.4Å; I263-M280 HydrophobicContact CG2-SD 3.94Å; I263-F298 HydrophobicContact CD1-CE1 3.77Å; I263-F298 HydrophobicContact CD1-CZ 4.37Å; I263-F298 HydrophobicContact CG1-CE1 4.49Å
264	A	95.9	Very high	93	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	135.6	173.9	0	0	0	0	0	110	C83 I84 L85 L271 F273 C274	C83-A264 PolarHBondContact O-N 3.17Å; I84-A264 CarbonylContact C-O 3.56Å; I84-A264 WeakPolarHBondContact CA-O 3.42Å; I84-A264 HydrophobicContact CG1-CB 4.26Å; L85-A264 PolarHBondContact N-O 2.92Å; A264-L271 HydrophobicContact CB-CD1 4.21Å; A264-F273 CarbonylContact C-O 3.56Å; A264-F273 WeakPolarHBondContact CA-O 3.39Å; A264-C274 HydrophobicContact CB-CB 4.2Å
265	I	95.5	Very high	93.3	Very high	2 Å²	2	29 Å²	29	1%	0.01	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	125.1	179	-58.6	177.7	0	0	0	109.4	L85 I272 F273 M280 F284 T305	L85-I265 HydrophobicContact CB-CG1 4.45Å; I265-I272 HydrophobicContact CB-CB 4.38Å; I265-I272 HydrophobicContact CG2-CB 4.3Å; I265-I272 PolarHBondContact O-N 3.33Å; I265-F273 PolarHBondContact N-O 3.32Å; I265-M280 HydrophobicContact CD1-SD 3.92Å; I265-F284 HydrophobicContact CD1-CE2 3.95Å; I265-F284 HydrophobicContact CD1-CZ 3.96Å; I265-T305 HydrophobicContact CG2-CG2 4.06Å; I265-T305 WeakPolarHBondContact CG2-OG1 3.43Å
266	L	94.4	Very high	93.6	Very high	1 Å²	1	26 Å²	26	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	134.6	174.9	-90.9	84.2	0	0	0	111.4	L69 I84 L85 G86 S90 L95 E270 L271	L69-L266 HydrophobicContact CD2-CD2 4.22Å; I84-L266 HydrophobicContact CG2-CD1 3.77Å; L85-L266 PolarHBondContact O-N 3.22Å; G86-L266 WeakPolarHBondContact CA-O 3.43Å; S90-L266 WeakPolarHBondContact CB-O 3.34Å; S90-L266 PolarHBondContact OG-O 3.26Å; L95-L266 HydrophobicContact CB-CD2 4.27Å; L95-L266 HydrophobicContact CD2-CD1 3.86Å; L95-L266 HydrophobicContact CD2-CD2 3.82Å; L266-E270 WeakPolarHBondContact CA-O 3.29Å; L266-L271 HydrophobicContact CD1-CD1 3.93Å
267	S	92.6	Very high	93.8	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.007	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	126.4	172.6	-163.3	0	0	0	0	110.1	G269 E270 T305	S267-G269 PolarHBondContact O-N 3.07Å; S267-E270 PolarHBondContact N-O 3.13Å; S267-E270 WeakPolarHBondContact O-CB 3.2Å; S267-E270 PolarHBondContact O-N 2.89Å; S267-T305 VanDerWaalsContact CB-O 3.25Å; S267-T305 WeakPolarHBondContact CB-O 3.44Å; S267-T305 PolarHBondContact OG-O 3.38Å
268	F	88.6	Confident	94	Very high	85 Å²	85	30.2 Å²	30.2	37%	0.373	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.9	35	-179.3	-69.9	-95.4	0	0	0	115.6	E270 V307	F268-E270 VanDerWaalsContact C-N 3.32Å; F268-V307 HydrophobicContact CD2-CB 4.16Å; F268-V307 HydrophobicContact CD2-CG2 3.71Å; F268-V307 HydrophobicContact CE2-CB 3.4Å; F268-V307 VanDerWaalsContact CE2-CB 3.4Å; F268-V307 HydrophobicContact CE2-CG1 4.45Å; F268-V307 HydrophobicContact CE2-CG2 3.49Å; F268-V307 VanDerWaalsContact CE2-CG2 3.49Å; F268-V307 HydrophobicContact CZ-CB 3.93Å; F268-V307 HydrophobicContact CZ-CG2 4.36Å
269	G	89.8	Confident	94.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.2	-4.5	-179.9	0	0	0	0	0	115.9	I68 K70 S90 S267	I68-G269 WeakPolarHBondContact O-CA 3.16Å; K70-G269 PolarHBondContact N-O 3.48Å; S90-G269 WeakPolarHBondContact O-CA 3.46Å; S90-G269 PolarHBondContact O-N 3.41Å; S267-G269 PolarHBondContact O-N 3.07Å
270	E	92.6	Very high	94.4	Very high	25 Å²	25	21.3 Å²	21.3	12%	0.117	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	143.9	177.5	-70.2	170	-174	0	0	110.2	K70 L266 S267 F268 I272	K70-E270 HydrophobicContact CB-CG 3.9Å; K70-E270 HydrophobicContact CD-CG 3.89Å; K70-E270 VanDerWaalsContact CD-OE1 3.3Å; K70-E270 WeakPolarHBondContact CD-OE1 3.47Å; K70-E270 WeakPolarHBondContact CE-OE1 3.34Å; K70-E270 HydrophobicContact CG-CG 4.09Å; K70-E270 IonicContact NZ-OE1 2.74Å; K70-E270 PolarHBondContact NZ-OE1 3.22Å; L266-E270 WeakPolarHBondContact CA-O 3.29Å; S267-E270 PolarHBondContact N-O 3.13Å; S267-E270 WeakPolarHBondContact O-CB 3.2Å; S267-E270 PolarHBondContact O-N 2.89Å; F268-E270 VanDerWaalsContact C-N 3.32Å; E270-I272 HydrophobicContact CB-CD1 4.42Å
271	L	94.8	Very high	94.4	Very high	13 Å²	13	23.9 Å²	23.9	7%	0.068	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	115	174.6	-177.9	69.4	0	0	0	109.3	V72 S73 A264 L266 C274 Y329	V72-L271 HydrophobicContact CG1-CB 4.23Å; V72-L271 HydrophobicContact CG1-CD2 4.37Å; V72-L271 HydrophobicContact CG2-CB 4.39Å; S73-L271 WeakPolarHBondContact O-CD2 3.42Å; A264-L271 HydrophobicContact CB-CD1 4.21Å; L266-L271 HydrophobicContact CD1-CD1 3.93Å; L271-C274 HydrophobicContact CD1-CB 4.42Å; L271-C274 HydrophobicContact CD2-CB 4.3Å; L271-Y329 HydrophobicContact CD2-CE1 4.07Å; L271-Y329 HydrophobicContact CG-CE1 4.29Å
272	I	95.1	Very high	94.4	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-38.5	-176.6	-52	-55.9	0	0	0	111.6	I265 E270 T305 V322 I325 E326 Y329	I265-I272 HydrophobicContact CB-CB 4.38Å; I265-I272 HydrophobicContact CG2-CB 4.3Å; I265-I272 PolarHBondContact O-N 3.33Å; E270-I272 HydrophobicContact CB-CD1 4.42Å; I272-T305 HydrophobicContact CB-CG2 4.48Å; I272-T305 HydrophobicContact CG2-CG2 3.77Å; I272-V322 HydrophobicContact CD1-CG1 3.58Å; I272-V322 HydrophobicContact CG1-CG1 4.42Å; I272-I325 HydrophobicContact CG2-CB 4.39Å; I272-I325 HydrophobicContact CG2-CG2 3.62Å; I272-E326 HydrophobicContact CD1-CB 3.88Å; I272-E326 HydrophobicContact CD1-CG 4.22Å; I272-Y329 WeakPolarHBondContact O-CB 3.44Å
273	F	95.6	Very high	94.4	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	148.1	180	176.7	-96.3	0	0	0	110.1	A264 I265 G275 E279 M280 F283 F284 Y329 I334	A264-F273 CarbonylContact C-O 3.56Å; A264-F273 WeakPolarHBondContact CA-O 3.39Å; I265-F273 PolarHBondContact N-O 3.32Å; F273-G275 VanDerWaalsContact CE1-N 3.31Å; F273-E279 HydrophobicContact CZ-CB 4.26Å; F273-M280 HydrophobicContact CD1-CB 4.12Å; F273-M280 HydrophobicContact CD1-CG 3.68Å; F273-M280 HydrophobicContact CD1-SD 4.08Å; F273-M280 HydrophobicContact CE1-CB 3.41Å; F273-M280 VanDerWaalsContact CE1-CB 3.41Å; F273-M280 HydrophobicContact CE1-CG 3.52Å; F273-M280 HydrophobicContact CE1-SD 4.19Å; F273-M280 HydrophobicContact CE2-CB 4.46Å; F273-M280 HydrophobicContact CG-CG 4.31Å; F273-M280 HydrophobicContact CZ-CB 3.62Å; F273-M280 HydrophobicContact CZ-CG 4.02Å; F273-F283 HydrophobicContact CD2-CB 4.14Å; F273-F283 AromaticContact CD2-CD1 3.45Å; F273-F283 HydrophobicContact CD2-CD1 3.45Å; F273-F283 VanDerWaalsContact CD2-CD1 3.45Å; F273-F283 HydrophobicContact CD2-CE1 4.02Å; F273-F283 AromaticContact CD2-CG 3.8Å; F273-F283 HydrophobicContact CD2-CG 3.8Å; F273-F283 HydrophobicContact CE2-CB 3.74Å; F273-F283 AromaticContact CE2-CD1 3.98Å; F273-F283 HydrophobicContact CE2-CD1 3.98Å; F273-F283 AromaticContact CE2-CG 3.89Å; F273-F283 HydrophobicContact CE2-CG 3.89Å; F273-F283 HydrophobicContact CG-CD1 4.34Å; F273-F284 HydrophobicContact CB-CE2 4.28Å; F273-F284 HydrophobicContact CB-CZ 4.5Å; F273-F284 HydrophobicContact CG-CE2 4.35Å; F273-Y329 HydrophobicContact CB-CD2 4.47Å; F273-Y329 AromaticContact CD2-CD2 3.87Å; F273-Y329 HydrophobicContact CD2-CD2 3.87Å; F273-Y329 AromaticContact CD2-CE2 4Å; F273-Y329 HydrophobicContact CD2-CE2 4Å; F273-I334 HydrophobicContact CE2-CD1 4.06Å
274	C	96.1	Very high	94.3	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	121.2	165.9	-174.1	0	0	0	0	110.1	I263 A264 L271 Y329 I334	I263-C274 VanDerWaalsContact O-CA 3.32Å; I263-C274 WeakPolarHBondContact O-CA 3.01Å; A264-C274 HydrophobicContact CB-CB 4.2Å; L271-C274 HydrophobicContact CD1-CB 4.42Å; L271-C274 HydrophobicContact CD2-CB 4.3Å; C274-Y329 WeakPolarHBondContact CB-OH 3.23Å; C274-Y329 PolarHBondContact N-OH 2.88Å; C274-Y329 PolarHBondContact O-OH 3.17Å; C274-I334 WeakPolarHBondContact O-CG2 3.3Å
275	G	95.3	Very high	94.3	Very high	4 Å²	4	26.8 Å²	26.8	4%	0.041	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.7	-171.5	-177.1	0	0	0	0	0	112.6	K262 I263 F273	K262-G275 CarbonylContact C-O 3.56Å; K262-G275 WeakPolarHBondContact CA-O 3.31Å; I263-G275 PolarHBondContact N-O 3.38Å; I263-G275 PolarHBondContact O-N 2.76Å; F273-G275 VanDerWaalsContact CE1-N 3.31Å
276	T	95.8	Very high	94.2	Very high	50 Å²	50	33.5 Å²	33.5	31%	0.307	18%	0.183	S	C	.	.			trans	-72.3	162.2	174.3	65.3	0	0	0	0	111.6	V278 E279 M280	T276-V278 PolarHBondContact O-N 3.27Å; T276-E279 PolarHBondContact N-OE2 3.11Å; T276-E279 PolarHBondContact O-N 3.11Å; T276-E279 VanDerWaalsContact OG1-CB 3.32Å; T276-E279 WeakPolarHBondContact OG1-CB 3.49Å; T276-E279 WeakPolarHBondContact OG1-CG 3.41Å; T276-E279 PolarHBondContact OG1-N 2.96Å; T276-E279 PolarHBondContact OG1-OE2 2.8Å; T276-M280 PolarHBondContact O-N 3.25Å
277	P	94.3	Very high	94.2	Very high	17 Å²	17	35.1 Å²	35.1	11%	0.11	19%	0.194	C	C	.	.	H	α-helix	trans	-57.9	-36	176.8	-23.9	32.8	0	0	0	113.5	F257 F260 I263 M280 L281	F257-P277 HydrophobicContact CD1-CB 4.01Å; F257-P277 HydrophobicContact CE1-CB 3.53Å; F257-P277 HydrophobicContact CE2-CB 4.3Å; F257-P277 HydrophobicContact CZ-CB 3.68Å; F257-P277 WeakPolarHBondContact O-CG 3.21Å; F260-P277 VanDerWaalsContact O-CD 3.29Å; F260-P277 WeakPolarHBondContact O-CD 3.4Å; F260-P277 WeakPolarHBondContact O-CG 3.46Å; I263-P277 HydrophobicContact CD1-CB 4.05Å; I263-P277 HydrophobicContact CD1-CG 3.86Å; I263-P277 HydrophobicContact CG1-CG 4.48Å; P277-M280 WeakPolarHBondContact O-CB 3.46Å; P277-M280 PolarHBondContact O-N 2.76Å; P277-L281 PolarHBondContact O-N 3.41Å
278	V	94.2	Very high	94.2	Very high	96 Å²	96	37.7 Å²	37.7	58%	0.582	22%	0.221	S	C	*	.	H	α-helix	trans	-70.7	-49.2	177.5	-177.3	0	0	0	0	110.6	T276 M280 L281 D282	T276-V278 PolarHBondContact O-N 3.27Å; V278-M280 PolarHBondContact O-N 3.31Å; V278-M280 VanDerWaalsContact O-N 3.11Å; V278-L281 PolarHBondContact O-N 3.1Å; V278-D282 PolarHBondContact O-N 3Å; V278-D282 VanDerWaalsContact O-N 3.09Å
279	E	95.2	Very high	94.5	Very high	53 Å²	53	37.8 Å²	37.8	25%	0.248	22%	0.219	C	C	.	.	H	α-helix	trans	-57.1	-29.4	175.6	-74.6	169	161.7	0	0	112.1	F273 T276 F283 I334 K337	F273-E279 HydrophobicContact CZ-CB 4.26Å; T276-E279 PolarHBondContact N-OE2 3.11Å; T276-E279 PolarHBondContact O-N 3.11Å; T276-E279 VanDerWaalsContact OG1-CB 3.32Å; T276-E279 WeakPolarHBondContact OG1-CB 3.49Å; T276-E279 WeakPolarHBondContact OG1-CG 3.41Å; T276-E279 PolarHBondContact OG1-N 2.96Å; T276-E279 PolarHBondContact OG1-OE2 2.8Å; E279-F283 WeakPolarHBondContact O-CB 3.11Å; E279-F283 PolarHBondContact O-N 3.39Å; E279-I334 HydrophobicContact CB-CD1 4.27Å; E279-K337 IonicContact OE1-NZ 3.71Å
280	M	94.8	Very high	94.7	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-68.8	-48.3	175.9	-164.9	177.5	68.6	0	0	112	F257 I263 I265 F273 T276 P277 V278 D282 F283 F284 Y301	F257-M280 HydrophobicContact CE2-CE 3.3Å; F257-M280 HydrophobicContact CZ-CE 3.56Å; I263-M280 HydrophobicContact CB-SD 4.44Å; I263-M280 HydrophobicContact CD1-CE 4.4Å; I263-M280 HydrophobicContact CG2-SD 3.94Å; I265-M280 HydrophobicContact CD1-SD 3.92Å; F273-M280 HydrophobicContact CD1-CB 4.12Å; F273-M280 HydrophobicContact CD1-CG 3.68Å; F273-M280 HydrophobicContact CD1-SD 4.08Å; F273-M280 HydrophobicContact CE1-CB 3.41Å; F273-M280 VanDerWaalsContact CE1-CB 3.41Å; F273-M280 HydrophobicContact CE1-CG 3.52Å; F273-M280 HydrophobicContact CE1-SD 4.19Å; F273-M280 HydrophobicContact CE2-CB 4.46Å; F273-M280 HydrophobicContact CG-CG 4.31Å; F273-M280 HydrophobicContact CZ-CB 3.62Å; F273-M280 HydrophobicContact CZ-CG 4.02Å; T276-M280 PolarHBondContact O-N 3.25Å; P277-M280 WeakPolarHBondContact O-CB 3.46Å; P277-M280 PolarHBondContact O-N 2.76Å; V278-M280 PolarHBondContact O-N 3.31Å; V278-M280 VanDerWaalsContact O-N 3.11Å; M280-D282 VanDerWaalsContact C-N 3.28Å; M280-D282 PolarHBondContact O-N 2.87Å; M280-F283 PolarHBondContact O-N 3.15Å; M280-F284 HydrophobicContact CG-CD2 3.67Å; M280-F284 HydrophobicContact CG-CE2 3.67Å; M280-F284 VanDerWaalsContact O-CD2 3.3Å; M280-F284 WeakPolarHBondContact O-CD2 3.4Å; M280-F284 PolarHBondContact O-N 2.65Å; M280-F284 HydrophobicContact SD-CE2 4.32Å; M280-Y301 HydrophobicContact CE-CD2 3.46Å; M280-Y301 VanDerWaalsContact CE-CD2 3.46Å; M280-Y301 HydrophobicContact CE-CE2 3.79Å; M280-Y301 HydrophobicContact SD-CD2 4.27Å
281	L	94.3	Very high	94.7	Very high	58 Å²	58	41.9 Å²	41.9	30%	0.304	25%	0.249	S	C	.	.	H	α-helix	trans	-59.1	-43	178.1	-67	171.8	0	0	0	111	F257 P277 V278 S285 P297 Y301	F257-L281 HydrophobicContact CE1-CD1 4.06Å; F257-L281 HydrophobicContact CE1-CG 4.31Å; F257-L281 HydrophobicContact CZ-CD1 4.45Å; F257-L281 HydrophobicContact CZ-CD2 4.35Å; F257-L281 HydrophobicContact CZ-CG 4.19Å; P277-L281 PolarHBondContact O-N 3.41Å; V278-L281 PolarHBondContact O-N 3.1Å; L281-S285 WeakPolarHBondContact O-CB 3.27Å; L281-S285 PolarHBondContact O-N 3.09Å; L281-S285 VanDerWaalsContact O-N 3.1Å; L281-S285 PolarHBondContact O-OG 2.69Å; L281-P297 HydrophobicContact CD2-CB 4.39Å; L281-Y301 HydrophobicContact CD2-CE2 3.82Å; L281-Y301 WeakPolarHBondContact CD2-OH 3.39Å
282	D	94.9	Very high	94.7	Very high	92 Å²	92	44.5 Å²	44.5	49%	0.492	27%	0.266	S	S	.	.	H	α-helix	trans	-65.3	-50.2	178.3	-63.8	-21.7	0	0	0	111	V278 M280 F284 S285 D286	V278-D282 PolarHBondContact O-N 3Å; V278-D282 VanDerWaalsContact O-N 3.09Å; M280-D282 VanDerWaalsContact C-N 3.28Å; M280-D282 PolarHBondContact O-N 2.87Å; D282-F284 PolarHBondContact O-N 3.3Å; D282-S285 WeakPolarHBondContact O-CB 3.2Å; D282-S285 PolarHBondContact O-N 2.9Å; D282-S285 VanDerWaalsContact O-N 3.15Å; D282-D286 PolarHBondContact O-N 2.96Å
283	F	95.6	Very high	94.2	Very high	11 Å²	11	53.3 Å²	53.3	5%	0.048	31%	0.307	C	S	.	.	H	α-helix	trans	-59.3	-44.6	-179.1	171.7	-99.6	0	0	0	113.2	F273 E279 M280 S285 D286 C287 I325 A328 Y329 I334	F273-F283 HydrophobicContact CD2-CB 4.14Å; F273-F283 AromaticContact CD2-CD1 3.45Å; F273-F283 HydrophobicContact CD2-CD1 3.45Å; F273-F283 VanDerWaalsContact CD2-CD1 3.45Å; F273-F283 HydrophobicContact CD2-CE1 4.02Å; F273-F283 AromaticContact CD2-CG 3.8Å; F273-F283 HydrophobicContact CD2-CG 3.8Å; F273-F283 HydrophobicContact CE2-CB 3.74Å; F273-F283 AromaticContact CE2-CD1 3.98Å; F273-F283 HydrophobicContact CE2-CD1 3.98Å; F273-F283 AromaticContact CE2-CG 3.89Å; F273-F283 HydrophobicContact CE2-CG 3.89Å; F273-F283 HydrophobicContact CG-CD1 4.34Å; E279-F283 WeakPolarHBondContact O-CB 3.11Å; E279-F283 PolarHBondContact O-N 3.39Å; M280-F283 PolarHBondContact O-N 3.15Å; F283-S285 VanDerWaalsContact C-N 3.33Å; F283-D286 PolarHBondContact O-N 3.27Å; F283-C287 VanDerWaalsContact CZ-SG 3.55Å; F283-C287 PolarHBondContact O-N 2.85Å; F283-C287 PolarHBondContact O-SG 3.23Å; F283-I325 HydrophobicContact CE1-CG2 4.02Å; F283-I325 HydrophobicContact CZ-CG2 4.36Å; F283-A328 HydrophobicContact CZ-CB 4.38Å; F283-Y329 HydrophobicContact CE2-CD2 4.39Å; F283-Y329 HydrophobicContact CZ-CD2 4.34Å; F283-Y329 HydrophobicContact CZ-CG 4.45Å; F283-I334 HydrophobicContact CB-CD1 4.14Å; F283-I334 HydrophobicContact CD2-CD1 4.46Å
284	F	95.6	Very high	93.9	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-72.5	-29.7	179	-81.6	-79.1	0	0	0	112.5	I265 F273 M280 D282 C287 G288 Y289 Y301 L304 T305 I325	I265-F284 HydrophobicContact CD1-CE2 3.95Å; I265-F284 HydrophobicContact CD1-CZ 3.96Å; F273-F284 HydrophobicContact CB-CE2 4.28Å; F273-F284 HydrophobicContact CB-CZ 4.5Å; F273-F284 HydrophobicContact CG-CE2 4.35Å; M280-F284 HydrophobicContact CG-CD2 3.67Å; M280-F284 HydrophobicContact CG-CE2 3.67Å; M280-F284 VanDerWaalsContact O-CD2 3.3Å; M280-F284 WeakPolarHBondContact O-CD2 3.4Å; M280-F284 PolarHBondContact O-N 2.65Å; M280-F284 HydrophobicContact SD-CE2 4.32Å; D282-F284 PolarHBondContact O-N 3.3Å; F284-C287 PolarHBondContact O-N 3.01Å; F284-G288 PolarHBondContact O-N 3.46Å; F284-Y289 CarbonylContact O-C 3.27Å; F284-Y289 WeakPolarHBondContact O-CA 3.13Å; F284-Y289 PolarHBondContact O-N 3.45Å; F284-Y301 HydrophobicContact CB-CD1 3.89Å; F284-Y301 HydrophobicContact CB-CE1 3.24Å; F284-Y301 AromaticContact CD1-CD1 3.75Å; F284-Y301 HydrophobicContact CD1-CD1 3.75Å; F284-Y301 AromaticContact CD1-CE1 4Å; F284-Y301 HydrophobicContact CD1-CE1 4Å; F284-Y301 AromaticContact CD2-CD1 3.7Å; F284-Y301 HydrophobicContact CD2-CD1 3.7Å; F284-Y301 HydrophobicContact CD2-CD2 4.4Å; F284-Y301 AromaticContact CD2-CE1 3.81Å; F284-Y301 HydrophobicContact CD2-CE1 3.81Å; F284-Y301 HydrophobicContact CD2-CE2 4.47Å; F284-Y301 HydrophobicContact CD2-CG 4.02Å; F284-Y301 HydrophobicContact CE1-CD1 4.16Å; F284-Y301 HydrophobicContact CE2-CD1 4.14Å; F284-Y301 HydrophobicContact CE2-CG 4.17Å; F284-Y301 AromaticContact CG-CD1 3.5Å; F284-Y301 HydrophobicContact CG-CD1 3.5Å; F284-Y301 AromaticContact CG-CE1 3.42Å; F284-Y301 HydrophobicContact CG-CE1 3.42Å; F284-Y301 VanDerWaalsContact CG-CE1 3.42Å; F284-Y301 HydrophobicContact CG-CG 4.29Å; F284-Y301 HydrophobicContact CZ-CD1 4.35Å; F284-L304 HydrophobicContact CD1-CD2 3.68Å; F284-L304 HydrophobicContact CE1-CD2 3.91Å; F284-T305 HydrophobicContact CE1-CG2 3.88Å; F284-T305 HydrophobicContact CZ-CG2 3.82Å; F284-I325 HydrophobicContact CE1-CG2 3.94Å
285	S	94.8	Very high	93.7	Very high	53 Å²	53	64.5 Å²	64.5	37%	0.371	37%	0.365	S	S	.	.	H	α-helix	trans	-66.3	-41.2	171.2	-59.2	0	0	0	0	111.4	L281 D282 F283 C287 G288	L281-S285 WeakPolarHBondContact O-CB 3.27Å; L281-S285 PolarHBondContact O-N 3.09Å; L281-S285 VanDerWaalsContact O-N 3.1Å; L281-S285 PolarHBondContact O-OG 2.69Å; D282-S285 WeakPolarHBondContact O-CB 3.2Å; D282-S285 PolarHBondContact O-N 2.9Å; D282-S285 VanDerWaalsContact O-N 3.15Å; F283-S285 VanDerWaalsContact C-N 3.33Å; S285-C287 PolarHBondContact O-N 3.36Å; S285-G288 WeakPolarHBondContact O-CA 3.44Å; S285-G288 PolarHBondContact O-N 2.96Å
286	D	94.2	Very high	93.5	Very high	143 Å²	143	65.7 Å²	65.7	77%	0.765	37%	0.37	S	S	*	.	H	α-helix	trans	-62.9	-32	173.1	-71.7	-17.5	0	0	0	112.3	D282 F283 G288	D282-D286 PolarHBondContact O-N 2.96Å; F283-D286 PolarHBondContact O-N 3.27Å; D286-G288 PolarHBondContact O-N 3.16Å
287	C	93	Very high	93.4	Very high	35 Å²	35	64.4 Å²	64.4	24%	0.236	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-2	172.4	-66	0	0	0	0	113.5	F283 F284 S285 Y289	F283-C287 VanDerWaalsContact CZ-SG 3.55Å; F283-C287 PolarHBondContact O-N 2.85Å; F283-C287 PolarHBondContact O-SG 3.23Å; F284-C287 PolarHBondContact O-N 3.01Å; S285-C287 PolarHBondContact O-N 3.36Å; C287-Y289 HydrophobicContact CB-CD2 4.33Å; C287-Y289 WeakPolarHBondContact O-CD2 3.28Å
288	G	93.7	Very high	93.2	Very high	55 Å²	55	63.7 Å²	63.7	57%	0.567	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.2	13.8	179.2	0	0	0	0	0	115.1	F284 S285 D286 P290	F284-G288 PolarHBondContact O-N 3.46Å; S285-G288 WeakPolarHBondContact O-CA 3.44Å; S285-G288 PolarHBondContact O-N 2.96Å; D286-G288 PolarHBondContact O-N 3.16Å; G288-P290 WeakPolarHBondContact O-CD 3.44Å
289	Y	94.4	Very high	93.1	Very high	87 Å²	87	61.4 Å²	61.4	34%	0.341	34%	0.342	S	S	.	.			trans	-124.4	71.2	-178.7	-60.1	-75.7	0	0	0	111.9	F284 C287 L304 I325	F284-Y289 CarbonylContact O-C 3.27Å; F284-Y289 WeakPolarHBondContact O-CA 3.13Å; F284-Y289 PolarHBondContact O-N 3.45Å; C287-Y289 HydrophobicContact CB-CD2 4.33Å; C287-Y289 WeakPolarHBondContact O-CD2 3.28Å; Y289-L304 HydrophobicContact CD1-CD1 3.78Å; Y289-L304 HydrophobicContact CD1-CD2 4.41Å; Y289-L304 HydrophobicContact CD2-CD1 4.28Å; Y289-L304 HydrophobicContact CD2-CD2 4.03Å; Y289-L304 HydrophobicContact CE1-CD1 4.01Å; Y289-L304 HydrophobicContact CG-CD1 3.92Å; Y289-L304 HydrophobicContact CG-CD2 3.76Å; Y289-L304 HydrophobicContact CG-CG 4.49Å; Y289-I325 HydrophobicContact CD2-CD1 4.46Å; Y289-I325 HydrophobicContact CE2-CD1 4.36Å
290	P	94.8	Very high	93	Very high	81 Å²	81	61.6 Å²	61.6	53%	0.526	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-67.3	142.7	175.2	29.5	-34.6	0	0	0	111.2	G288	G288-P290 WeakPolarHBondContact O-CD 3.44Å
291	C	92.4	Very high	93	Very high	31 Å²	31	61.6 Å²	61.6	21%	0.209	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-77.9	130	175.7	-175.4	0	0	0	0	110.5	F300 Y301	C291-F300 HydrophobicContact CB-CD1 3.9Å; C291-F300 HydrophobicContact CB-CE1 4.22Å; C291-Y301 HydrophobicContact CB-CE1 4.48Å; C291-Y301 HydrophobicContact CB-CE2 4.31Å; C291-Y301 WeakPolarHBondContact CB-OH 3.01Å
292	P	93.6	Very high	92.8	Very high	67 Å²	67	60 Å²	60	44%	0.435	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-62.2	149	171.9	-20.6	31.8	0	0	0	112.6	H294 S295 F300	P292-H294 VanDerWaalsContact C-N 3.31Å; P292-H294 PolarHBondContact O-N 2.94Å; P292-S295 PolarHBondContact O-N 3Å; P292-F300 HydrophobicContact CG-CE2 4.47Å
293	E	86.1	Confident	92.6	Very high	186 Å²	186	61 Å²	61	87%	0.869	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-30.9	-174.1	-66.6	-170.8	166.1	0	0	114.8
294	H	88.8	Confident	92.4	Very high	186 Å²	186	61 Å²	61	86%	0.861	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	16.2	-178.8	-60	-42.9	0	0	0	113.5	P292	P292-H294 VanDerWaalsContact C-N 3.31Å; P292-H294 PolarHBondContact O-N 2.94Å
295	S	91.5	Very high	92.2	Very high	49 Å²	49	61.2 Å²	61.2	34%	0.343	34%	0.341	S	S	.	.	S	Bend	trans	-104.9	143.8	177.3	-66.6	0	0	0	0	110.6	P292 P297	P292-S295 PolarHBondContact O-N 3Å; S295-P297 VanDerWaalsContact O-CD 3.25Å; S295-P297 WeakPolarHBondContact O-CD 3.5Å
296	N	92.5	Very high	91.9	Very high	28 Å²	28	60.2 Å²	60.2	15%	0.15	33%	0.334	C	S	.	.			trans	-68.3	117.8	169.7	179.5	5.1	0	0	0	108.6	P252 S254 F298 D299 F300	P252-N296 PolarHBondContact O-ND2 3.48Å; P252-N296 VanDerWaalsContact O-ND2 3.16Å; S254-N296 WeakPolarHBondContact CA-OD1 3.49Å; S254-N296 WeakPolarHBondContact CB-OD1 3.36Å; N296-F298 PolarHBondContact O-N 2.98Å; N296-F298 PolarHBondContact OD1-N 2.7Å; N296-D299 HydrophobicContact CB-CB 4.12Å; N296-D299 WeakPolarHBondContact CB-OD2 3.38Å; N296-D299 VanDerWaalsContact ND2-CG 3.33Å; N296-D299 PolarHBondContact ND2-OD2 2.95Å; N296-D299 PolarHBondContact O-N 2.84Å; N296-F300 WeakPolarHBondContact O-CB 3.41Å; N296-F300 PolarHBondContact O-N 2.76Å
297	P	92.4	Very high	91.6	Very high	24 Å²	24	54.1 Å²	54.1	16%	0.156	30%	0.302	C	S	.	.	H	α-helix	trans	-58	-35.6	-178.4	-25.2	35.1	0	0	0	112.5	F257 L281 S295 Y301	F257-P297 HydrophobicContact CD2-CB 4.17Å; F257-P297 HydrophobicContact CE2-CB 3.86Å; F257-P297 HydrophobicContact CZ-CB 4.1Å; L281-P297 HydrophobicContact CD2-CB 4.39Å; S295-P297 VanDerWaalsContact O-CD 3.25Å; S295-P297 WeakPolarHBondContact O-CD 3.5Å; P297-Y301 HydrophobicContact CB-CD2 4.29Å; P297-Y301 HydrophobicContact CB-CE2 4.1Å; P297-Y301 WeakPolarHBondContact O-CD2 3.22Å; P297-Y301 PolarHBondContact O-N 3.15Å
298	F	90.9	Very high	91.3	Very high	2 Å²	2	55 Å²	55	1%	0.009	30%	0.304	C	S	.	.	H	α-helix	trans	-62.6	-51.1	177.7	-68	-62.9	0	0	0	112.3	L85 P252 R253 L256 F257 F260 I263 N296 M302	L85-F298 HydrophobicContact CD1-CD1 3.43Å; L85-F298 VanDerWaalsContact CD1-CD1 3.43Å; L85-F298 HydrophobicContact CD1-CE1 3.76Å; P252-F298 HydrophobicContact CB-CD2 4.07Å; P252-F298 HydrophobicContact CB-CE2 4.03Å; P252-F298 HydrophobicContact CB-CG 4.41Å; P252-F298 HydrophobicContact CB-CZ 4.36Å; P252-F298 HydrophobicContact CG-CB 3.72Å; P252-F298 HydrophobicContact CG-CD1 3.72Å; P252-F298 HydrophobicContact CG-CD2 3.56Å; P252-F298 HydrophobicContact CG-CE1 4.02Å; P252-F298 HydrophobicContact CG-CE2 3.87Å; P252-F298 HydrophobicContact CG-CG 3.43Å; P252-F298 VanDerWaalsContact CG-CG 3.43Å; P252-F298 HydrophobicContact CG-CZ 4.05Å; R253-F298 WeakPolarHBondContact O-CE2 3.35Å; L256-F298 HydrophobicContact CB-CE2 4.36Å; F257-F298 HydrophobicContact CB-CD2 4.31Å; F257-F298 HydrophobicContact CB-CE2 3.6Å; F257-F298 HydrophobicContact CB-CZ 3.93Å; F257-F298 AromaticContact CD2-CD1 3.94Å; F257-F298 HydrophobicContact CD2-CD1 3.94Å; F257-F298 HydrophobicContact CD2-CD2 4.02Å; F257-F298 AromaticContact CD2-CE1 3.63Å; F257-F298 HydrophobicContact CD2-CE1 3.63Å; F257-F298 AromaticContact CD2-CE2 3.71Å; F257-F298 HydrophobicContact CD2-CE2 3.71Å; F257-F298 HydrophobicContact CD2-CG 4.16Å; F257-F298 AromaticContact CD2-CZ 3.54Å; F257-F298 HydrophobicContact CD2-CZ 3.54Å; F257-F298 HydrophobicContact CE2-CD1 4.34Å; F257-F298 HydrophobicContact CE2-CE1 4.18Å; F257-F298 HydrophobicContact CE2-CZ 4.49Å; F257-F298 HydrophobicContact CG-CE2 4.18Å; F257-F298 HydrophobicContact CG-CZ 4.22Å; F260-F298 HydrophobicContact CD2-CE1 4.26Å; F260-F298 AromaticContact CD2-CZ 3.74Å; F260-F298 HydrophobicContact CD2-CZ 3.74Å; F260-F298 HydrophobicContact CE2-CE1 4.34Å; F260-F298 AromaticContact CE2-CZ 3.69Å; F260-F298 HydrophobicContact CE2-CZ 3.69Å; I263-F298 HydrophobicContact CD1-CE1 3.77Å; I263-F298 HydrophobicContact CD1-CZ 4.37Å; I263-F298 HydrophobicContact CG1-CE1 4.49Å; N296-F298 PolarHBondContact O-N 2.98Å; N296-F298 PolarHBondContact OD1-N 2.7Å; F298-M302 WeakPolarHBondContact O-CB 3.49Å; F298-M302 WeakPolarHBondContact O-CG 3.2Å; F298-M302 PolarHBondContact O-N 3.44Å
299	D	91.5	Very high	90.9	Very high	48 Å²	48	56.9 Å²	56.9	26%	0.257	31%	0.305	S	S	.	.	H	α-helix	trans	-64.5	-44	-179.5	-65.5	-38.2	0	0	0	110.2	Q251 N296 Y301 M302 D303	Q251-D299 VanDerWaalsContact CG-OD1 3.28Å; Q251-D299 WeakPolarHBondContact CG-OD1 3.24Å; Q251-D299 PolarHBondContact NE2-OD1 2.98Å; Q251-D299 VanDerWaalsContact NE2-OD1 3.09Å; N296-D299 HydrophobicContact CB-CB 4.12Å; N296-D299 WeakPolarHBondContact CB-OD2 3.38Å; N296-D299 VanDerWaalsContact ND2-CG 3.33Å; N296-D299 PolarHBondContact ND2-OD2 2.95Å; N296-D299 PolarHBondContact O-N 2.84Å; D299-Y301 PolarHBondContact O-N 2.8Å; D299-M302 PolarHBondContact O-N 2.84Å; D299-D303 WeakPolarHBondContact O-CB 3.3Å; D299-D303 VanDerWaalsContact O-CG 3.31Å; D299-D303 PolarHBondContact O-N 3.06Å
300	F	93.8	Very high	90.7	Very high	56 Å²	56	60 Å²	60	25%	0.246	32%	0.322	C	S	.	.	H	α-helix	trans	-59.8	-50.1	-179.5	-179.3	-101.2	0	0	0	112.8	C291 P292 N296 M302 D303 L304	C291-F300 HydrophobicContact CB-CD1 3.9Å; C291-F300 HydrophobicContact CB-CE1 4.22Å; P292-F300 HydrophobicContact CG-CE2 4.47Å; N296-F300 WeakPolarHBondContact O-CB 3.41Å; N296-F300 PolarHBondContact O-N 2.76Å; F300-M302 VanDerWaalsContact C-N 3.33Å; F300-D303 PolarHBondContact O-N 3.46Å; F300-L304 WeakPolarHBondContact O-CB 3.44Å; F300-L304 PolarHBondContact O-N 3.34Å
301	Y	93.3	Very high	90.5	Very high	2 Å²	2	58 Å²	58	1%	0.008	31%	0.31	C	S	.	.	H	α-helix	trans	-73.1	-27.6	179.4	-63.9	-51.4	0	0	0	112.6	M280 L281 F284 C291 P297 D299 L304 T305	M280-Y301 HydrophobicContact CE-CD2 3.46Å; M280-Y301 VanDerWaalsContact CE-CD2 3.46Å; M280-Y301 HydrophobicContact CE-CE2 3.79Å; M280-Y301 HydrophobicContact SD-CD2 4.27Å; L281-Y301 HydrophobicContact CD2-CE2 3.82Å; L281-Y301 WeakPolarHBondContact CD2-OH 3.39Å; F284-Y301 HydrophobicContact CB-CD1 3.89Å; F284-Y301 HydrophobicContact CB-CE1 3.24Å; F284-Y301 AromaticContact CD1-CD1 3.75Å; F284-Y301 HydrophobicContact CD1-CD1 3.75Å; F284-Y301 AromaticContact CD1-CE1 4Å; F284-Y301 HydrophobicContact CD1-CE1 4Å; F284-Y301 AromaticContact CD2-CD1 3.7Å; F284-Y301 HydrophobicContact CD2-CD1 3.7Å; F284-Y301 HydrophobicContact CD2-CD2 4.4Å; F284-Y301 AromaticContact CD2-CE1 3.81Å; F284-Y301 HydrophobicContact CD2-CE1 3.81Å; F284-Y301 HydrophobicContact CD2-CE2 4.47Å; F284-Y301 HydrophobicContact CD2-CG 4.02Å; F284-Y301 HydrophobicContact CE1-CD1 4.16Å; F284-Y301 HydrophobicContact CE2-CD1 4.14Å; F284-Y301 HydrophobicContact CE2-CG 4.17Å; F284-Y301 AromaticContact CG-CD1 3.5Å; F284-Y301 HydrophobicContact CG-CD1 3.5Å; F284-Y301 AromaticContact CG-CE1 3.42Å; F284-Y301 HydrophobicContact CG-CE1 3.42Å; F284-Y301 VanDerWaalsContact CG-CE1 3.42Å; F284-Y301 HydrophobicContact CG-CG 4.29Å; F284-Y301 HydrophobicContact CZ-CD1 4.35Å; C291-Y301 HydrophobicContact CB-CE1 4.48Å; C291-Y301 HydrophobicContact CB-CE2 4.31Å; C291-Y301 WeakPolarHBondContact CB-OH 3.01Å; P297-Y301 HydrophobicContact CB-CD2 4.29Å; P297-Y301 HydrophobicContact CB-CE2 4.1Å; P297-Y301 WeakPolarHBondContact O-CD2 3.22Å; P297-Y301 PolarHBondContact O-N 3.15Å; D299-Y301 PolarHBondContact O-N 2.8Å; Y301-L304 HydrophobicContact CD1-CD2 4.28Å; Y301-T305 WeakPolarHBondContact O-CB 3.45Å; Y301-T305 VanDerWaalsContact O-CG2 3.23Å; Y301-T305 WeakPolarHBondContact O-CG2 2.93Å; Y301-T305 PolarHBondContact O-N 2.81Å; Y301-T305 PolarHBondContact O-OG1 2.83Å
302	M	91.4	Very high	90.4	Very high	24 Å²	24	64.1 Å²	64.1	12%	0.118	33%	0.333	C	S	.	.	H	α-helix	trans	-65.3	-45.4	171.2	-78.4	-72.7	-64.7	0	0	111.9	L85 G86 F298 D299 F300 L304 T305 S306	L85-M302 HydrophobicContact CB-SD 3.73Å; G86-M302 VanDerWaalsContact CA-SD 3.59Å; G86-M302 PolarHBondContact N-SD 3.04Å; G86-M302 WeakPolarHBondContact O-CE 3.42Å; F298-M302 WeakPolarHBondContact O-CB 3.49Å; F298-M302 WeakPolarHBondContact O-CG 3.2Å; F298-M302 PolarHBondContact O-N 3.44Å; D299-M302 PolarHBondContact O-N 2.84Å; F300-M302 VanDerWaalsContact C-N 3.33Å; M302-L304 VanDerWaalsContact C-N 3.33Å; M302-L304 PolarHBondContact O-N 3.33Å; M302-T305 PolarHBondContact O-N 3.05Å; M302-T305 PolarHBondContact O-OG1 3.06Å; M302-S306 WeakPolarHBondContact O-CB 3.19Å; M302-S306 PolarHBondContact O-N 3.26Å
303	D	90.3	Very high	90.4	Very high	112 Å²	112	67.5 Å²	67.5	60%	0.599	34%	0.343	S	S	*	.	H	α-helix	trans	-62.1	-43.3	176.3	-71.7	-16.3	0	0	0	110.9	D299 F300 T305 S306 R321	D299-D303 WeakPolarHBondContact O-CB 3.3Å; D299-D303 VanDerWaalsContact O-CG 3.31Å; D299-D303 PolarHBondContact O-N 3.06Å; F300-D303 PolarHBondContact O-N 3.46Å; D303-T305 VanDerWaalsContact C-N 3.34Å; D303-T305 PolarHBondContact O-N 3.45Å; D303-S306 PolarHBondContact O-N 3.35Å; D303-S306 PolarHBondContact O-OG 3.49Å; D303-R321 PolarHBondContact O-NH2 3.28Å
304	L	92.4	Very high	90.6	Very high	13 Å²	13	64.6 Å²	64.6	7%	0.068	32%	0.324	C	S	.	.	H	α-helix	trans	-62.5	-39.3	177.8	-175.1	67.2	0	0	0	112.9	F284 Y289 F300 Y301 M302 R321 I325	F284-L304 HydrophobicContact CD1-CD2 3.68Å; F284-L304 HydrophobicContact CE1-CD2 3.91Å; Y289-L304 HydrophobicContact CD1-CD1 3.78Å; Y289-L304 HydrophobicContact CD1-CD2 4.41Å; Y289-L304 HydrophobicContact CD2-CD1 4.28Å; Y289-L304 HydrophobicContact CD2-CD2 4.03Å; Y289-L304 HydrophobicContact CE1-CD1 4.01Å; Y289-L304 HydrophobicContact CG-CD1 3.92Å; Y289-L304 HydrophobicContact CG-CD2 3.76Å; Y289-L304 HydrophobicContact CG-CG 4.49Å; F300-L304 WeakPolarHBondContact O-CB 3.44Å; F300-L304 PolarHBondContact O-N 3.34Å; Y301-L304 HydrophobicContact CD1-CD2 4.28Å; M302-L304 VanDerWaalsContact C-N 3.33Å; M302-L304 PolarHBondContact O-N 3.33Å; L304-R321 PolarHBondContact O-NE 3.48Å; L304-R321 PolarHBondContact O-NH2 2.97Å; L304-I325 HydrophobicContact CD2-CD1 4.18Å; L304-I325 HydrophobicContact CG-CD1 4.07Å
305	T	91.2	Very high	90.7	Very high	3 Å²	3	59.7 Å²	59.7	2%	0.018	30%	0.302	C	S	.	.	H	α-helix	trans	-90.5	-5	-175.9	57.9	0	0	0	0	113.8	I265 S267 I272 F284 Y301 M302 D303 V322	I265-T305 HydrophobicContact CG2-CG2 4.06Å; I265-T305 WeakPolarHBondContact CG2-OG1 3.43Å; S267-T305 VanDerWaalsContact CB-O 3.25Å; S267-T305 WeakPolarHBondContact CB-O 3.44Å; S267-T305 PolarHBondContact OG-O 3.38Å; I272-T305 HydrophobicContact CB-CG2 4.48Å; I272-T305 HydrophobicContact CG2-CG2 3.77Å; F284-T305 HydrophobicContact CE1-CG2 3.88Å; F284-T305 HydrophobicContact CZ-CG2 3.82Å; Y301-T305 WeakPolarHBondContact O-CB 3.45Å; Y301-T305 VanDerWaalsContact O-CG2 3.23Å; Y301-T305 WeakPolarHBondContact O-CG2 2.93Å; Y301-T305 PolarHBondContact O-N 2.81Å; Y301-T305 PolarHBondContact O-OG1 2.83Å; M302-T305 PolarHBondContact O-N 3.05Å; M302-T305 PolarHBondContact O-OG1 3.06Å; D303-T305 VanDerWaalsContact C-N 3.34Å; D303-T305 PolarHBondContact O-N 3.45Å; T305-V322 VanDerWaalsContact O-CG2 3.29Å; T305-V322 WeakPolarHBondContact O-CG2 3.41Å
306	S	88.8	Confident	90.7	Very high	33 Å²	33	61.9 Å²	61.9	23%	0.231	31%	0.309	C	S	.	.	S	Bend	trans	-83.4	147.9	173.2	74.7	0	0	0	0	112.4	M302 D303 R321	M302-S306 WeakPolarHBondContact O-CB 3.19Å; M302-S306 PolarHBondContact O-N 3.26Å; D303-S306 PolarHBondContact O-N 3.35Å; D303-S306 PolarHBondContact O-OG 3.49Å; S306-R321 PolarHBondContact O-NH2 3.27Å
307	V	87.6	Confident	90.7	Very high	15 Å²	15	67 Å²	67	9%	0.091	33%	0.332	C	S	.	.			trans	-99.5	125.4	171.4	-175	0	0	0	0	108	F268 E315 T318 Y319 V322	F268-V307 HydrophobicContact CD2-CB 4.16Å; F268-V307 HydrophobicContact CD2-CG2 3.71Å; F268-V307 HydrophobicContact CE2-CB 3.4Å; F268-V307 VanDerWaalsContact CE2-CB 3.4Å; F268-V307 HydrophobicContact CE2-CG1 4.45Å; F268-V307 HydrophobicContact CE2-CG2 3.49Å; F268-V307 VanDerWaalsContact CE2-CG2 3.49Å; F268-V307 HydrophobicContact CZ-CB 3.93Å; F268-V307 HydrophobicContact CZ-CG2 4.36Å; V307-E315 HydrophobicContact CG1-CG 4.01Å; V307-T318 WeakPolarHBondContact CG1-OG1 3.44Å; V307-Y319 HydrophobicContact CG2-CD2 4.23Å; V307-V322 HydrophobicContact CG2-CB 4.48Å; V307-V322 HydrophobicContact CG2-CG2 4.06Å
308	D	86.2	Confident	90.6	Very high	53 Å²	53	66.6 Å²	66.6	28%	0.283	33%	0.329	S	S	.	.			trans	-88.2	114.4	-179.7	-178.8	3.8	0	0	0	109.9	Q310 R314 E315 T318	D308-Q310 WeakPolarHBondContact OD1-CB 3.32Å; D308-Q310 PolarHBondContact OD1-N 2.9Å; D308-R314 IonicContact OD2-NH1 3.61Å; D308-E315 WeakPolarHBondContact O-CA 3.25Å; D308-E315 WeakPolarHBondContact O-CB 3.26Å; D308-E315 PolarHBondContact O-N 3.01Å; D308-T318 HydrophobicContact CB-CG2 4.22Å; D308-T318 PolarHBondContact N-OG1 2.86Å; D308-T318 VanDerWaalsContact N-OG1 3.08Å
309	T	86.1	Confident	90.7	Very high	94 Å²	94	70.8 Å²	70.8	58%	0.577	35%	0.345	S	S	*	.			trans	-93	11.6	179.5	62.2	0	0	0	0	113.3	E315	T309-E315 HydrophobicContact CG2-CG 4.44Å
310	Q	88.3	Confident	90.8	Very high	153 Å²	153	74.5 Å²	74.5	72%	0.715	36%	0.359	S	S	*	.	S	Bend	trans	-67.7	-36.1	-177.3	-171.3	175.1	35.2	0	0	112.7	D308	D308-Q310 WeakPolarHBondContact OD1-CB 3.32Å; D308-Q310 PolarHBondContact OD1-N 2.9Å
311	S	91.2	Very high	90.7	Very high	39 Å²	39	74.8 Å²	74.8	27%	0.273	36%	0.358	S	S	.	.	S	Bend	trans	-136.1	151.2	171.6	74.6	0	0	0	0	110.8	E313 R314 E315	S311-E313 VanDerWaalsContact C-N 3.27Å; S311-E313 PolarHBondContact O-N 3.39Å; S311-R314 PolarHBondContact O-N 2.89Å; S311-R314 WeakPolarHBondContact OG-CB 3.36Å; S311-R314 VanDerWaalsContact OG-CG 3.31Å; S311-R314 WeakPolarHBondContact OG-CG 3.26Å; S311-R314 PolarHBondContact OG-N 3.25Å; S311-E315 WeakPolarHBondContact O-CB 3.09Å; S311-E315 PolarHBondContact O-N 3.42Å
312	K	91.2	Very high	90.7	Very high	159 Å²	159	75 Å²	75	69%	0.691	36%	0.36	S	S	*	.	H	α-helix	trans	-63.2	-36.2	-178.6	-69.9	-174.8	177.9	179.8	0	111.8	E315 I316	K312-E315 PolarHBondContact O-N 3.12Å; K312-I316 WeakPolarHBondContact O-CD1 3.2Å; K312-I316 VanDerWaalsContact O-CG1 3.24Å; K312-I316 WeakPolarHBondContact O-CG1 3.46Å; K312-I316 PolarHBondContact O-N 3.35Å; K312-I316 VanDerWaalsContact O-N 3.09Å
313	E	92.3	Very high	90.8	Very high	139 Å²	139	78.5 Å²	78.5	65%	0.65	38%	0.376	S	S	*	.	H	α-helix	trans	-65.6	-46	178.2	-61.4	73.7	-156.7	0	0	111	S311 I316 E317	S311-E313 VanDerWaalsContact C-N 3.27Å; S311-E313 PolarHBondContact O-N 3.39Å; E313-I316 PolarHBondContact O-N 3.16Å; E313-E317 WeakPolarHBondContact O-CB 3.32Å; E313-E317 PolarHBondContact O-N 3.49Å
314	R	90.5	Very high	91	Very high	124 Å²	124	79 Å²	79	47%	0.468	38%	0.376	S	S	.	.	H	α-helix	trans	-67.3	-36.9	176.7	-75	-176.8	176.1	-173.6	0.9	112.2	D308 S311 I316 E317 T318	D308-R314 IonicContact OD2-NH1 3.61Å; S311-R314 PolarHBondContact O-N 2.89Å; S311-R314 WeakPolarHBondContact OG-CB 3.36Å; S311-R314 VanDerWaalsContact OG-CG 3.31Å; S311-R314 WeakPolarHBondContact OG-CG 3.26Å; S311-R314 PolarHBondContact OG-N 3.25Å; R314-I316 VanDerWaalsContact C-N 3.35Å; R314-I316 PolarHBondContact O-N 3.46Å; R314-E317 PolarHBondContact O-N 3.19Å; R314-T318 WeakPolarHBondContact O-CB 3.47Å; R314-T318 WeakPolarHBondContact O-CG2 3.22Å; R314-T318 PolarHBondContact O-N 3.23Å; R314-T318 PolarHBondContact O-OG1 2.7Å
315	E	90.9	Very high	91.1	Very high	84 Å²	84	78.6 Å²	78.6	39%	0.393	37%	0.374	S	S	.	.	H	α-helix	trans	-59.5	-48.5	175.7	-173.8	-178.5	-178.5	0	0	110.2	V307 D308 T309 S311 K312 E317 T318 Y319	V307-E315 HydrophobicContact CG1-CG 4.01Å; D308-E315 WeakPolarHBondContact O-CA 3.25Å; D308-E315 WeakPolarHBondContact O-CB 3.26Å; D308-E315 PolarHBondContact O-N 3.01Å; T309-E315 HydrophobicContact CG2-CG 4.44Å; S311-E315 WeakPolarHBondContact O-CB 3.09Å; S311-E315 PolarHBondContact O-N 3.42Å; K312-E315 PolarHBondContact O-N 3.12Å; E315-E317 PolarHBondContact O-N 2.83Å; E315-T318 PolarHBondContact O-OG1 2.86Å; E315-Y319 WeakPolarHBondContact O-CB 3.28Å; E315-Y319 PolarHBondContact O-N 3.45Å
316	I	92.3	Very high	91.3	Very high	95 Å²	95	79.3 Å²	79.3	49%	0.487	38%	0.377	S	S	.	.	H	α-helix	trans	-64.6	-41.8	179.1	-65.9	164.1	0	0	0	111.4	K312 E313 R314 K320	K312-I316 WeakPolarHBondContact O-CD1 3.2Å; K312-I316 VanDerWaalsContact O-CG1 3.24Å; K312-I316 WeakPolarHBondContact O-CG1 3.46Å; K312-I316 PolarHBondContact O-N 3.35Å; K312-I316 VanDerWaalsContact O-N 3.09Å; E313-I316 PolarHBondContact O-N 3.16Å; R314-I316 VanDerWaalsContact C-N 3.35Å; R314-I316 PolarHBondContact O-N 3.46Å; I316-K320 HydrophobicContact CG2-CD 4.35Å; I316-K320 WeakPolarHBondContact O-CB 3.29Å; I316-K320 VanDerWaalsContact O-CG 3.3Å; I316-K320 WeakPolarHBondContact O-CG 3.39Å; I316-K320 PolarHBondContact O-N 2.82Å; I316-K320 VanDerWaalsContact O-N 3.1Å
317	E	91.9	Very high	91.6	Very high	135 Å²	135	79.8 Å²	79.8	63%	0.631	38%	0.381	S	S	*	.	H	α-helix	trans	-65	-52.4	178.9	-175.6	-177.2	-179.6	0	0	111.9	E313 R314 E315 Y319 K320 R321	E313-E317 WeakPolarHBondContact O-CB 3.32Å; E313-E317 PolarHBondContact O-N 3.49Å; R314-E317 PolarHBondContact O-N 3.19Å; E315-E317 PolarHBondContact O-N 2.83Å; E317-Y319 VanDerWaalsContact C-N 3.35Å; E317-Y319 PolarHBondContact O-N 2.85Å; E317-K320 PolarHBondContact O-N 2.63Å; E317-R321 PolarHBondContact O-N 2.88Å
318	T	91.8	Very high	91.9	Very high	15 Å²	15	80.9 Å²	80.9	9%	0.092	39%	0.391	C	S	.	.	H	α-helix	trans	-67	-36.3	-179.2	55.6	0	0	0	0	111.7	V307 D308 R314 E315 R321 V322	V307-T318 WeakPolarHBondContact CG1-OG1 3.44Å; D308-T318 HydrophobicContact CB-CG2 4.22Å; D308-T318 PolarHBondContact N-OG1 2.86Å; D308-T318 VanDerWaalsContact N-OG1 3.08Å; R314-T318 WeakPolarHBondContact O-CB 3.47Å; R314-T318 WeakPolarHBondContact O-CG2 3.22Å; R314-T318 PolarHBondContact O-N 3.23Å; R314-T318 PolarHBondContact O-OG1 2.7Å; E315-T318 PolarHBondContact O-OG1 2.86Å; T318-R321 WeakPolarHBondContact O-CB 3.28Å; T318-R321 PolarHBondContact O-N 2.87Å; T318-V322 WeakPolarHBondContact O-CG2 3.42Å; T318-V322 PolarHBondContact O-N 2.98Å
319	Y	91.3	Very high	92.3	Very high	90 Å²	90	78.6 Å²	78.6	35%	0.353	38%	0.378	S	S	.	.	H	α-helix	trans	-62	-45.6	173.6	-173.1	-89.2	0	0	0	111.9	V307 E315 E317 R321 V322 Q323	V307-Y319 HydrophobicContact CG2-CD2 4.23Å; E315-Y319 WeakPolarHBondContact O-CB 3.28Å; E315-Y319 PolarHBondContact O-N 3.45Å; E317-Y319 VanDerWaalsContact C-N 3.35Å; E317-Y319 PolarHBondContact O-N 2.85Å; Y319-R321 VanDerWaalsContact C-N 3.3Å; Y319-R321 PolarHBondContact O-N 2.92Å; Y319-V322 PolarHBondContact O-N 2.9Å; Y319-Q323 WeakPolarHBondContact O-CB 3.29Å; Y319-Q323 PolarHBondContact O-N 3.45Å
320	K	93.4	Very high	92.7	Very high	126 Å²	126	78.2 Å²	78.2	55%	0.548	37%	0.369	S	S	.	.	H	α-helix	trans	-59.4	-42	174.8	-78.1	173.6	-179	175.9	0	111.6	I316 E317 Q323 M324	I316-K320 HydrophobicContact CG2-CD 4.35Å; I316-K320 WeakPolarHBondContact O-CB 3.29Å; I316-K320 VanDerWaalsContact O-CG 3.3Å; I316-K320 WeakPolarHBondContact O-CG 3.39Å; I316-K320 PolarHBondContact O-N 2.82Å; I316-K320 VanDerWaalsContact O-N 3.1Å; E317-K320 PolarHBondContact O-N 2.63Å; K320-Q323 PolarHBondContact O-N 2.93Å; K320-M324 WeakPolarHBondContact O-CG 3.35Å; K320-M324 PolarHBondContact O-N 3.07Å
321	R	93.6	Very high	93	Very high	62 Å²	62	78.8 Å²	78.8	23%	0.234	37%	0.369	C	S	.	.	H	α-helix	trans	-58.6	-51.6	176	-179.1	-177.1	69.6	-163.6	-1.2	111.5	D303 L304 S306 E317 T318 Y319 Q323 M324 I325	D303-R321 PolarHBondContact O-NH2 3.28Å; L304-R321 PolarHBondContact O-NE 3.48Å; L304-R321 PolarHBondContact O-NH2 2.97Å; S306-R321 PolarHBondContact O-NH2 3.27Å; E317-R321 PolarHBondContact O-N 2.88Å; T318-R321 WeakPolarHBondContact O-CB 3.28Å; T318-R321 PolarHBondContact O-N 2.87Å; Y319-R321 VanDerWaalsContact C-N 3.3Å; Y319-R321 PolarHBondContact O-N 2.92Å; R321-Q323 VanDerWaalsContact C-N 3.31Å; R321-Q323 PolarHBondContact O-N 2.96Å; R321-M324 PolarHBondContact O-N 3.38Å; R321-I325 HydrophobicContact CG-CD1 4.11Å; R321-I325 WeakPolarHBondContact O-CG1 3.33Å; R321-I325 PolarHBondContact O-N 2.72Å; R321-I325 VanDerWaalsContact O-N 3.1Å
322	V	92.8	Very high	93.1	Very high	6 Å²	6	77.8 Å²	77.8	4%	0.036	36%	0.362	C	S	.	.	H	α-helix	trans	-60.2	-42.8	179.6	173.8	0	0	0	0	111	I272 T305 V307 T318 Y319 M324 I325 E326	I272-V322 HydrophobicContact CD1-CG1 3.58Å; I272-V322 HydrophobicContact CG1-CG1 4.42Å; T305-V322 VanDerWaalsContact O-CG2 3.29Å; T305-V322 WeakPolarHBondContact O-CG2 3.41Å; V307-V322 HydrophobicContact CG2-CB 4.48Å; V307-V322 HydrophobicContact CG2-CG2 4.06Å; T318-V322 WeakPolarHBondContact O-CG2 3.42Å; T318-V322 PolarHBondContact O-N 2.98Å; Y319-V322 PolarHBondContact O-N 2.9Å; V322-M324 PolarHBondContact O-N 3.35Å; V322-I325 PolarHBondContact O-N 3.11Å; V322-E326 WeakPolarHBondContact O-CB 3.29Å; V322-E326 PolarHBondContact O-N 3.33Å
323	Q	93.2	Very high	93.2	Very high	99 Å²	99	74.1 Å²	74.1	46%	0.463	36%	0.362	S	S	.	.	H	α-helix	trans	-64.4	-37.2	178	-168.9	175.7	8.3	0	0	112.7	Y319 K320 R321 S327	Y319-Q323 WeakPolarHBondContact O-CB 3.29Å; Y319-Q323 PolarHBondContact O-N 3.45Å; K320-Q323 PolarHBondContact O-N 2.93Å; R321-Q323 VanDerWaalsContact C-N 3.31Å; R321-Q323 PolarHBondContact O-N 2.96Å; Q323-S327 WeakPolarHBondContact O-CB 3.33Å; Q323-S327 PolarHBondContact O-N 2.91Å; Q323-S327 PolarHBondContact O-OG 3.25Å
324	M	94.3	Very high	93.3	Very high	121 Å²	121	69 Å²	69	60%	0.596	34%	0.338	S	S	*	.	H	α-helix	trans	-63.3	-46.8	174.1	-74.7	-173.4	-74.4	0	0	111.3	K320 R321 V322 S327 A328	K320-M324 WeakPolarHBondContact O-CG 3.35Å; K320-M324 PolarHBondContact O-N 3.07Å; R321-M324 PolarHBondContact O-N 3.38Å; V322-M324 PolarHBondContact O-N 3.35Å; M324-S327 PolarHBondContact O-N 3.23Å; M324-S327 PolarHBondContact O-OG 3.49Å; M324-A328 PolarHBondContact O-N 2.52Å
325	I	94.9	Very high	93.4	Very high	5 Å²	5	63.8 Å²	63.8	3%	0.026	32%	0.32	C	S	.	.	H	α-helix	trans	-63.8	-43.7	178.7	-61.9	168.6	0	0	0	111	I272 F283 F284 Y289 L304 R321 V322 S327 A328 Y329	I272-I325 HydrophobicContact CG2-CB 4.39Å; I272-I325 HydrophobicContact CG2-CG2 3.62Å; F283-I325 HydrophobicContact CE1-CG2 4.02Å; F283-I325 HydrophobicContact CZ-CG2 4.36Å; F284-I325 HydrophobicContact CE1-CG2 3.94Å; Y289-I325 HydrophobicContact CD2-CD1 4.46Å; Y289-I325 HydrophobicContact CE2-CD1 4.36Å; L304-I325 HydrophobicContact CD2-CD1 4.18Å; L304-I325 HydrophobicContact CG-CD1 4.07Å; R321-I325 HydrophobicContact CG-CD1 4.11Å; R321-I325 WeakPolarHBondContact O-CG1 3.33Å; R321-I325 PolarHBondContact O-N 2.72Å; R321-I325 VanDerWaalsContact O-N 3.1Å; V322-I325 PolarHBondContact O-N 3.11Å; I325-S327 VanDerWaalsContact C-N 3.33Å; I325-S327 PolarHBondContact O-N 3.15Å; I325-A328 WeakPolarHBondContact O-CB 2.92Å; I325-A328 PolarHBondContact O-N 2.93Å; I325-Y329 PolarHBondContact O-N 3.49Å
326	E	94.4	Very high	93.5	Very high	19 Å²	19	65 Å²	65	9%	0.089	33%	0.326	C	S	.	.	H	α-helix	trans	-57.5	-46.3	176	-178.4	-92	178.2	0	0	111.6	I272 V322 A328 Y329 K330	I272-E326 HydrophobicContact CD1-CB 3.88Å; I272-E326 HydrophobicContact CD1-CG 4.22Å; V322-E326 WeakPolarHBondContact O-CB 3.29Å; V322-E326 PolarHBondContact O-N 3.33Å; E326-A328 VanDerWaalsContact C-N 3.3Å; E326-A328 PolarHBondContact O-N 2.79Å; E326-Y329 PolarHBondContact O-N 3.21Å; E326-K330 PolarHBondContact O-N 3.44Å; E326-K330 VanDerWaalsContact OE1-CD 3.22Å; E326-K330 WeakPolarHBondContact OE1-CD 3.43Å; E326-K330 WeakPolarHBondContact OE1-CE 3.46Å; E326-K330 IonicContact OE1-NZ 3.09Å; E326-K330 PolarHBondContact OE1-NZ 2.71Å
327	S	94.8	Very high	93.5	Very high	43 Å²	43	65.8 Å²	65.8	30%	0.301	33%	0.326	S	S	.	.	H	α-helix	trans	-67.3	-32.7	179.2	78.4	0	0	0	0	112.5	Q323 M324 I325 K331	Q323-S327 WeakPolarHBondContact O-CB 3.33Å; Q323-S327 PolarHBondContact O-N 2.91Å; Q323-S327 PolarHBondContact O-OG 3.25Å; M324-S327 PolarHBondContact O-N 3.23Å; M324-S327 PolarHBondContact O-OG 3.49Å; I325-S327 VanDerWaalsContact C-N 3.33Å; I325-S327 PolarHBondContact O-N 3.15Å; S327-K331 WeakPolarHBondContact O-CG 3.44Å; S327-K331 PolarHBondContact O-N 2.72Å
328	A	95.3	Very high	93.5	Very high	37 Å²	37	59.9 Å²	59.9	31%	0.306	30%	0.299	S	S	.	.	H	α-helix	trans	-67.3	-43.5	174.4	0	0	0	0	0	110.8	F283 M324 I325 E326 K331 S332	F283-A328 HydrophobicContact CZ-CB 4.38Å; M324-A328 PolarHBondContact O-N 2.52Å; I325-A328 WeakPolarHBondContact O-CB 2.92Å; I325-A328 PolarHBondContact O-N 2.93Å; E326-A328 VanDerWaalsContact C-N 3.3Å; E326-A328 PolarHBondContact O-N 2.79Å; A328-K331 PolarHBondContact O-N 2.98Å; A328-S332 PolarHBondContact O-N 3.23Å
329	Y	94.9	Very high	93.4	Very high	5 Å²	5	61 Å²	61	2%	0.02	30%	0.304	C	S	.	.	H	α-helix	trans	-62.3	-46.2	175.6	175.6	-107.1	0	0	0	111.8	L271 I272 F273 C274 F283 I325 E326 K331 S332 I334 C335	L271-Y329 HydrophobicContact CD2-CE1 4.07Å; L271-Y329 HydrophobicContact CG-CE1 4.29Å; I272-Y329 WeakPolarHBondContact O-CB 3.44Å; F273-Y329 HydrophobicContact CB-CD2 4.47Å; F273-Y329 AromaticContact CD2-CD2 3.87Å; F273-Y329 HydrophobicContact CD2-CD2 3.87Å; F273-Y329 AromaticContact CD2-CE2 4Å; F273-Y329 HydrophobicContact CD2-CE2 4Å; C274-Y329 WeakPolarHBondContact CB-OH 3.23Å; C274-Y329 PolarHBondContact N-OH 2.88Å; C274-Y329 PolarHBondContact O-OH 3.17Å; F283-Y329 HydrophobicContact CE2-CD2 4.39Å; F283-Y329 HydrophobicContact CZ-CD2 4.34Å; F283-Y329 HydrophobicContact CZ-CG 4.45Å; I325-Y329 PolarHBondContact O-N 3.49Å; E326-Y329 PolarHBondContact O-N 3.21Å; Y329-K331 PolarHBondContact O-N 2.98Å; Y329-S332 VanDerWaalsContact O-CB 3.27Å; Y329-S332 WeakPolarHBondContact O-CB 3.09Å; Y329-S332 PolarHBondContact O-N 3.21Å; Y329-S332 PolarHBondContact O-OG 2.63Å; Y329-I334 HydrophobicContact CE2-CG2 4.33Å; Y329-C335 HydrophobicContact CD1-CB 4.45Å; Y329-C335 HydrophobicContact CE1-CB 4.07Å; Y329-C335 HydrophobicContact CE2-CB 4.24Å; Y329-C335 WeakPolarHBondContact O-CB 3.22Å
330	K	93.1	Very high	93.4	Very high	87 Å²	87	60.8 Å²	60.8	38%	0.378	31%	0.307	S	S	.	.	H	α-helix	trans	-58.9	-30.5	178.4	-80.5	-174.4	169.7	167.6	0	113.8	E326	E326-K330 PolarHBondContact O-N 3.44Å; E326-K330 VanDerWaalsContact OE1-CD 3.22Å; E326-K330 WeakPolarHBondContact OE1-CD 3.43Å; E326-K330 WeakPolarHBondContact OE1-CE 3.46Å; E326-K330 IonicContact OE1-NZ 3.09Å; E326-K330 PolarHBondContact OE1-NZ 2.71Å
331	K	94.3	Very high	93.2	Very high	164 Å²	164	56.5 Å²	56.5	71%	0.713	29%	0.289	S	S	*	.	H	α-helix	trans	-88	-11.5	175.9	-67.4	173	-175.7	173	0	113.6	S327 A328 Y329	S327-K331 WeakPolarHBondContact O-CG 3.44Å; S327-K331 PolarHBondContact O-N 2.72Å; A328-K331 PolarHBondContact O-N 2.98Å; Y329-K331 PolarHBondContact O-N 2.98Å
332	S	94.4	Very high	92.9	Very high	19 Å²	19	53.5 Å²	53.5	13%	0.133	28%	0.278	C	S	.	.	S	Bend	trans	-70.1	153	-175.5	75.7	0	0	0	0	112.2	A328 Y329 I334 C335 H336	A328-S332 PolarHBondContact O-N 3.23Å; Y329-S332 VanDerWaalsContact O-CB 3.27Å; Y329-S332 WeakPolarHBondContact O-CB 3.09Å; Y329-S332 PolarHBondContact O-N 3.21Å; Y329-S332 PolarHBondContact O-OG 2.63Å; S332-I334 PolarHBondContact O-N 3.37Å; S332-C335 PolarHBondContact O-N 2.97Å; S332-C335 PolarHBondContact OG-N 2.96Å; S332-H336 PolarHBondContact O-CD2 3.18Å; S332-H336 VanDerWaalsContact O-CD2 3.32Å; S332-H336 PolarHBondContact O-N 3.06Å
333	A	93.8	Very high	92.6	Very high	82 Å²	82	58 Å²	58	68%	0.678	30%	0.299	S	S	*	.	H	α-helix	trans	-61	-28.3	173.1	0	0	0	0	0	112.5	H336 K337	A333-H336 PolarHBondContact O-N 3.33Å; A333-K337 VanDerWaalsContact O-CB 3.27Å; A333-K337 WeakPolarHBondContact O-CB 3.34Å; A333-K337 PolarHBondContact O-N 2.97Å
334	I	93.3	Very high	92.3	Very high	31 Å²	31	59.3 Å²	59.3	16%	0.159	30%	0.3	C	S	.	.	H	α-helix	trans	-64.6	-46.9	179.5	-54.7	168.6	0	0	0	110.2	F273 C274 E279 F283 Y329 S332 K337 T338	F273-I334 HydrophobicContact CE2-CD1 4.06Å; C274-I334 WeakPolarHBondContact O-CG2 3.3Å; E279-I334 HydrophobicContact CB-CD1 4.27Å; F283-I334 HydrophobicContact CB-CD1 4.14Å; F283-I334 HydrophobicContact CD2-CD1 4.46Å; Y329-I334 HydrophobicContact CE2-CG2 4.33Å; S332-I334 PolarHBondContact O-N 3.37Å; I334-K337 PolarHBondContact O-N 3.44Å; I334-T338 PolarHBondContact O-N 3.39Å; I334-T338 PolarHBondContact O-OG1 3.26Å
335	C	92.4	Very high	91.5	Very high	14 Å²	14	54.3 Å²	54.3	10%	0.095	28%	0.276	C	S	.	.	H	α-helix	trans	-62.3	-47.5	176.9	-177.3	0	0	0	0	111.1	Y329 S332 K337 T338 L339	Y329-C335 HydrophobicContact CD1-CB 4.45Å; Y329-C335 HydrophobicContact CE1-CB 4.07Å; Y329-C335 HydrophobicContact CE2-CB 4.24Å; Y329-C335 WeakPolarHBondContact O-CB 3.22Å; S332-C335 PolarHBondContact O-N 2.97Å; S332-C335 PolarHBondContact OG-N 2.96Å; C335-K337 PolarHBondContact O-N 3.23Å; C335-T338 WeakPolarHBondContact O-CB 3.26Å; C335-T338 PolarHBondContact O-N 2.93Å; C335-T338 VanDerWaalsContact O-N 3.11Å; C335-L339 WeakPolarHBondContact O-CG 3.16Å; C335-L339 PolarHBondContact O-N 2.93Å
336	H	93.4	Very high	90.7	Very high	111 Å²	111	56.5 Å²	56.5	51%	0.514	29%	0.285	S	S	.	.	H	α-helix	trans	-60.5	-43.7	177.7	-75.5	-60.7	0	0	0	112.8	S332 A333 T338 L339 E340	S332-H336 PolarHBondContact O-CD2 3.18Å; S332-H336 VanDerWaalsContact O-CD2 3.32Å; S332-H336 PolarHBondContact O-N 3.06Å; A333-H336 PolarHBondContact O-N 3.33Å; H336-T338 VanDerWaalsContact C-N 3.28Å; H336-T338 PolarHBondContact O-N 2.61Å; H336-L339 PolarHBondContact O-N 3.29Å; H336-E340 WeakPolarHBondContact O-CB 3.37Å; H336-E340 PolarHBondContact O-N 2.81Å
337	K	93.4	Very high	89.7	Confident	111 Å²	111	63.2 Å²	63.2	48%	0.483	32%	0.316	S	S	.	.	H	α-helix	trans	-59.2	-39	174.1	-179.8	-176.7	175.4	-171.2	0	111.8	E279 A333 I334 C335 N341	E279-K337 IonicContact OE1-NZ 3.71Å; A333-K337 VanDerWaalsContact O-CB 3.27Å; A333-K337 WeakPolarHBondContact O-CB 3.34Å; A333-K337 PolarHBondContact O-N 2.97Å; I334-K337 PolarHBondContact O-N 3.44Å; C335-K337 PolarHBondContact O-N 3.23Å; K337-N341 WeakPolarHBondContact O-CB 3.44Å; K337-N341 PolarHBondContact O-N 3.32Å; K337-N341 PolarHBondContact O-ND2 2.84Å
338	T	90.1	Very high	88.4	Confident	11 Å²	11	66 Å²	66	7%	0.067	33%	0.327	C	S	.	.	H	α-helix	trans	-68.1	-43.6	178.8	-50.3	0	0	0	0	111.4	I334 C335 H336 N341 I342	I334-T338 PolarHBondContact O-N 3.39Å; I334-T338 PolarHBondContact O-OG1 3.26Å; C335-T338 WeakPolarHBondContact O-CB 3.26Å; C335-T338 PolarHBondContact O-N 2.93Å; C335-T338 VanDerWaalsContact O-N 3.11Å; H336-T338 VanDerWaalsContact C-N 3.28Å; H336-T338 PolarHBondContact O-N 2.61Å; T338-N341 PolarHBondContact O-N 3.46Å; T338-I342 WeakPolarHBondContact O-CG1 3.49Å; T338-I342 PolarHBondContact O-N 3.05Å
339	L	90.9	Very high	86.8	Confident	39 Å²	39	71.2 Å²	71.2	20%	0.204	34%	0.343	C	S	.	.	H	α-helix	trans	-63.4	-44.1	174.3	-69.9	171.6	0	0	0	111.8	L41 C335 H336 N341 I342 E343	L41-L339 HydrophobicContact CD1-CD2 3.61Å; C335-L339 WeakPolarHBondContact O-CG 3.16Å; C335-L339 PolarHBondContact O-N 2.93Å; H336-L339 PolarHBondContact O-N 3.29Å; L339-N341 VanDerWaalsContact C-N 3.31Å; L339-N341 PolarHBondContact O-N 2.91Å; L339-I342 WeakPolarHBondContact O-CB 3.41Å; L339-I342 PolarHBondContact O-N 3.41Å; L339-I342 VanDerWaalsContact O-N 3.15Å; L339-E343 PolarHBondContact O-N 2.66Å
340	E	91.5	Very high	84.7	Confident	85 Å²	85	76.5 Å²	76.5	40%	0.397	38%	0.376	S	S	.	.	H	α-helix	trans	-61.2	-39.8	177.5	-165.2	-170	172.6	0	0	111.3	H336 I342 E343 R344	H336-E340 WeakPolarHBondContact O-CB 3.37Å; H336-E340 PolarHBondContact O-N 2.81Å; E340-I342 PolarHBondContact O-N 2.82Å; E340-E343 PolarHBondContact O-N 3.49Å; E340-R344 HydrophobicContact CG-CG 4.49Å; E340-R344 WeakPolarHBondContact O-CB 3.35Å; E340-R344 VanDerWaalsContact O-CG 3.25Å; E340-R344 WeakPolarHBondContact O-CG 3.31Å; E340-R344 PolarHBondContact O-N 3.08Å; E340-R344 IonicContact OE1-CZ 2.8Å; E340-R344 VanDerWaalsContact OE1-CZ 3.25Å; E340-R344 IonicContact OE1-NE 2.8Å; E340-R344 PolarHBondContact OE1-NE 3.21Å; E340-R344 VanDerWaalsContact OE1-NE 3.17Å; E340-R344 IonicContact OE1-NH2 3.41Å; E340-R344 PolarHBondContact OE1-NH2 3.43Å; E340-R344 IonicContact OE2-CZ 3.29Å; E340-R344 IonicContact OE2-NH2 2.67Å; E340-R344 PolarHBondContact OE2-NH2 2.9Å
341	N	89.5	Confident	82.9	Confident	35 Å²	35	74 Å²	74	19%	0.187	37%	0.366	C	S	.	.	H	α-helix	trans	-62.9	-40.7	175.3	-73.6	-17.2	0	0	0	112.4	Y75 K337 T338 L339 R344 T345	Y75-N341 HydrophobicContact CD1-CB 3.87Å; Y75-N341 HydrophobicContact CE1-CB 3.91Å; Y75-N341 HydrophobicContact CG-CB 4.2Å; K337-N341 WeakPolarHBondContact O-CB 3.44Å; K337-N341 PolarHBondContact O-N 3.32Å; K337-N341 PolarHBondContact O-ND2 2.84Å; T338-N341 PolarHBondContact O-N 3.46Å; L339-N341 VanDerWaalsContact C-N 3.31Å; L339-N341 PolarHBondContact O-N 2.91Å; N341-R344 PolarHBondContact O-N 3.16Å; N341-T345 PolarHBondContact O-N 2.89Å; N341-T345 PolarHBondContact O-OG1 3.24Å; N341-T345 VanDerWaalsContact O-OG1 3.06Å
342	I	86.7	Confident	80.9	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-60.6	-48.2	174.3	-63	162.4	0	0	0	109.4	I40 Y75 Y114 T338 L339 E340 T345 K346	I40-I342 WeakPolarHBondContact O-CD1 3.3Å; Y75-I342 HydrophobicContact CD2-CG1 3.85Å; Y75-I342 HydrophobicContact CG-CG1 4.2Å; Y114-I342 HydrophobicContact CD2-CG2 4.14Å; T338-I342 WeakPolarHBondContact O-CG1 3.49Å; T338-I342 PolarHBondContact O-N 3.05Å; L339-I342 WeakPolarHBondContact O-CB 3.41Å; L339-I342 PolarHBondContact O-N 3.41Å; L339-I342 VanDerWaalsContact O-N 3.15Å; E340-I342 PolarHBondContact O-N 2.82Å; I342-T345 PolarHBondContact O-N 3.07Å; I342-T345 PolarHBondContact O-OG1 3.4Å; I342-K346 WeakPolarHBondContact O-CG 3.09Å; I342-K346 PolarHBondContact O-N 3.04Å; I342-K346 VanDerWaalsContact O-N 3.17Å
343	E	86.9	Confident	78.9	Confident	100 Å²	100	73.7 Å²	73.7	47%	0.467	37%	0.373	S	S	.	.	H	α-helix	trans	-61.1	-46	178	-70.3	-178.8	175.8	0	0	112.5	L339 E340 T345 K346 H347	L339-E343 PolarHBondContact O-N 2.66Å; E340-E343 PolarHBondContact O-N 3.49Å; E343-T345 VanDerWaalsContact C-N 3.29Å; E343-T345 PolarHBondContact O-N 2.86Å; E343-K346 WeakPolarHBondContact O-CA 3.44Å; E343-K346 VanDerWaalsContact O-CB 3.31Å; E343-K346 WeakPolarHBondContact O-CB 3.3Å; E343-K346 PolarHBondContact O-N 2.96Å; E343-H347 PolarHBondContact O-CD2 2.79Å; E343-H347 PolarHBondContact O-N 3.17Å
344	R	85.6	Confident	77	Confident	127 Å²	127	71.2 Å²	71.2	48%	0.479	35%	0.35	S	S	.	.	H	α-helix	trans	-54.4	-45	174.8	-75.3	172.7	-176.8	-179.1	-0.5	111.4	E340 N341 K346 H347 L348	E340-R344 HydrophobicContact CG-CG 4.49Å; E340-R344 WeakPolarHBondContact O-CB 3.35Å; E340-R344 VanDerWaalsContact O-CG 3.25Å; E340-R344 WeakPolarHBondContact O-CG 3.31Å; E340-R344 PolarHBondContact O-N 3.08Å; E340-R344 IonicContact OE1-CZ 2.8Å; E340-R344 VanDerWaalsContact OE1-CZ 3.25Å; E340-R344 IonicContact OE1-NE 2.8Å; E340-R344 PolarHBondContact OE1-NE 3.21Å; E340-R344 VanDerWaalsContact OE1-NE 3.17Å; E340-R344 IonicContact OE1-NH2 3.41Å; E340-R344 PolarHBondContact OE1-NH2 3.43Å; E340-R344 IonicContact OE2-CZ 3.29Å; E340-R344 IonicContact OE2-NH2 2.67Å; E340-R344 PolarHBondContact OE2-NH2 2.9Å; N341-R344 PolarHBondContact O-N 3.16Å; R344-K346 VanDerWaalsContact C-N 3.31Å; R344-K346 PolarHBondContact O-N 3.03Å; R344-H347 PolarHBondContact O-N 3.49Å; R344-H347 VanDerWaalsContact O-N 3.11Å; R344-L348 PolarHBondContact O-N 2.73Å
345	T	78.5	Confident	75	Confident	15 Å²	15	74.6 Å²	74.6	9%	0.092	37%	0.374	C	S	.	.	H	α-helix	trans	-64.7	-30.2	175.9	40.9	0	0	0	0	113.9	S37 Y75 G117 N341 I342 E343 H347 L348	S37-T345 WeakPolarHBondContact OG-CG2 3.32Å; Y75-T345 HydrophobicContact CE2-CG2 3.87Å; Y75-T345 WeakPolarHBondContact OH-CG2 3.47Å; G117-T345 WeakPolarHBondContact CA-O 3.36Å; N341-T345 PolarHBondContact O-N 2.89Å; N341-T345 PolarHBondContact O-OG1 3.24Å; N341-T345 VanDerWaalsContact O-OG1 3.06Å; I342-T345 PolarHBondContact O-N 3.07Å; I342-T345 PolarHBondContact O-OG1 3.4Å; E343-T345 VanDerWaalsContact C-N 3.29Å; E343-T345 PolarHBondContact O-N 2.86Å; T345-H347 VanDerWaalsContact C-N 3.26Å; T345-H347 PolarHBondContact O-N 3.18Å; T345-L348 PolarHBondContact O-N 3.1Å
346	K	78.4	Confident	73.3	Confident	52 Å²	52	74.6 Å²	74.6	23%	0.226	37%	0.372	C	S	.	.	H	α-helix	trans	-64.6	-32.4	172.8	-59.9	-175.7	-162.3	-172.7	0	112.4	Y114 I342 E343 R344 K349	Y114-K346 HydrophobicContact CD1-CD 4.26Å; Y114-K346 HydrophobicContact CD1-CG 3.95Å; Y114-K346 HydrophobicContact CE1-CD 3.68Å; Y114-K346 VanDerWaalsContact CE1-CE 3.48Å; Y114-K346 HydrophobicContact CE1-CG 3.88Å; Y114-K346 VanDerWaalsContact CZ-NZ 3.26Å; Y114-K346 WeakPolarHBondContact OH-CE 3.33Å; Y114-K346 PolarHBondContact OH-NZ 3.48Å; I342-K346 WeakPolarHBondContact O-CG 3.09Å; I342-K346 PolarHBondContact O-N 3.04Å; I342-K346 VanDerWaalsContact O-N 3.17Å; E343-K346 WeakPolarHBondContact O-CA 3.44Å; E343-K346 VanDerWaalsContact O-CB 3.31Å; E343-K346 WeakPolarHBondContact O-CB 3.3Å; E343-K346 PolarHBondContact O-N 2.96Å; R344-K346 VanDerWaalsContact C-N 3.31Å; R344-K346 PolarHBondContact O-N 3.03Å; K346-K349 WeakPolarHBondContact O-CG 3.09Å
347	H	72.6	Confident	71.6	Confident	159 Å²	159	70.6 Å²	70.6	74%	0.736	35%	0.354	S	S	*	.	H	α-helix	trans	-79.1	-33.6	178.7	-68.2	-68.3	0	0	0	112.3	E343 R344 T345 K349	E343-H347 PolarHBondContact O-CD2 2.79Å; E343-H347 PolarHBondContact O-N 3.17Å; R344-H347 PolarHBondContact O-N 3.49Å; R344-H347 VanDerWaalsContact O-N 3.11Å; T345-H347 VanDerWaalsContact C-N 3.26Å; T345-H347 PolarHBondContact O-N 3.18Å; H347-K349 PolarHBondContact O-N 2.85Å
348	L	66.6	Low	69.8	Low	101 Å²	101	68 Å²	68	53%	0.529	35%	0.347	S	S	.	.			trans	-75.6	56.3	174.6	-88.2	144.8	0	0	0	113	R344 T345 T350	R344-L348 PolarHBondContact O-N 2.73Å; T345-L348 PolarHBondContact O-N 3.1Å; L348-T350 PolarHBondContact O-N 2.97Å
349	K	62.8	Low	68.2	Low	148 Å²	148	74.2 Å²	74.2	64%	0.643	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	12.1	175.3	-68.6	-175.8	-179.4	173.3	0	114.7	K346 H347	K346-K349 WeakPolarHBondContact O-CG 3.09Å; H347-K349 PolarHBondContact O-N 2.85Å
350	T	50.3	Low	66.8	Low	116 Å²	116	75.6 Å²	75.6	71%	0.712	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-22.3	-172.1	46.7	0	0	0	0	113.6	L348	L348-T350 PolarHBondContact O-N 2.97Å
351	L	55.4	Low	65.6	Low	33 Å²	33	74 Å²	74	17%	0.173	38%	0.379	C	S	.	.	S	Bend	trans	-79.8	136.4	178.2	-69.1	167.4	0	0	0	111.4	E34 P35 N116	E34-L351 HydrophobicContact CB-CD2 4.1Å; E34-L351 HydrophobicContact CG-CD2 4.37Å; E34-L351 WeakPolarHBondContact OE2-CD2 3.33Å; P35-L351 VanDerWaalsContact O-CD1 3.3Å; P35-L351 WeakPolarHBondContact O-CD1 3.43Å; N116-L351 HydrophobicContact CB-CB 4.35Å
352	P	52.9	Low	65.1	Low	83 Å²	83	72.9 Å²	72.9	54%	0.539	37%	0.374	S	S	.	.			trans	-58.7	147.2	175.9	23.2	-31.1	0	0	0	110.6	V354	P352-V354 PolarHBondContact O-N 3.01Å
353	M	51.5	Low	65	Low	94 Å²	94	74.8 Å²	74.8	46%	0.463	39%	0.393	S	S	.	.			trans	-60	103.1	172.2	-177.2	175	114.3	0	0	107.1	P355	M353-P355 VanDerWaalsContact O-CD 3.26Å; M353-P355 WeakPolarHBondContact O-CD 3.36Å; M353-P355 VanDerWaalsContact O-N 3.12Å
354	V	53.7	Low	65	Low	30 Å²	30	73.7 Å²	73.7	18%	0.182	39%	0.393	C	S	.	.			trans	-63.7	125.3	-172.7	-166.2	0	0	0	0	107.4	N116 P352 F356	N116-V354 WeakPolarHBondContact ND2-CG2 3.48Å; P352-V354 PolarHBondContact O-N 3.01Å; V354-F356 HydrophobicContact CB-CD1 3.66Å; V354-F356 HydrophobicContact CB-CD2 3.62Å; V354-F356 HydrophobicContact CB-CE1 3.33Å; V354-F356 HydrophobicContact CB-CE2 3.33Å; V354-F356 HydrophobicContact CB-CG 3.82Å; V354-F356 HydrophobicContact CB-CZ 3.2Å; V354-F356 HydrophobicContact CG1-CD1 3.34Å; V354-F356 HydrophobicContact CG1-CD2 4.22Å; V354-F356 HydrophobicContact CG1-CE1 3.22Å; V354-F356 HydrophobicContact CG1-CE2 4.16Å; V354-F356 HydrophobicContact CG1-CG 3.88Å; V354-F356 HydrophobicContact CG1-CZ 3.71Å; V354-F356 HydrophobicContact CG2-CD1 4.45Å; V354-F356 HydrophobicContact CG2-CD2 4.42Å; V354-F356 HydrophobicContact CG2-CE1 3.62Å; V354-F356 HydrophobicContact CG2-CE2 3.64Å; V354-F356 HydrophobicContact CG2-CZ 3.2Å; V354-F356 VanDerWaalsContact O-CD2 3.32Å; V354-F356 WeakPolarHBondContact O-CD2 3.29Å; V354-F356 PolarHBondContact O-N 3.23Å
355	P	52.8	Low	65.2	Low	102 Å²	102	76.4 Å²	76.4	66%	0.662	41%	0.409	S	S	*	.			trans	-74	76.5	167.9	31.4	-30.4	0	0	0	106.4	M353 K357	M353-P355 VanDerWaalsContact O-CD 3.26Å; M353-P355 WeakPolarHBondContact O-CD 3.36Å; M353-P355 VanDerWaalsContact O-N 3.12Å; P355-K357 PolarHBondContact O-N 3.37Å
356	F	56.4	Low	65.6	Low	15 Å²	15	79 Å²	79	7%	0.066	43%	0.427	C	S	.	.			trans	-68.8	127.9	171.9	-62.4	-62.2	0	0	0	106.8	V115 D127 C128 K212 V213 V354	V115-F356 HydrophobicContact CB-CE2 4.47Å; V115-F356 HydrophobicContact CG1-CD2 4.42Å; V115-F356 HydrophobicContact CG1-CE2 3.39Å; V115-F356 HydrophobicContact CG1-CZ 3.79Å; D127-F356 CarbonylContact C-O 3.51Å; D127-F356 VanDerWaalsContact C-O 3.27Å; D127-F356 CarbonylContact O-C 3.43Å; D127-F356 WeakPolarHBondContact O-CB 3.46Å; C128-F356 HydrophobicContact CB-CB 4.47Å; C128-F356 HydrophobicContact CB-CD2 4.23Å; C128-F356 WeakPolarHBondContact SG-CD2 3.28Å; K212-F356 HydrophobicContact CB-CD1 3.62Å; K212-F356 HydrophobicContact CB-CE1 3.36Å; K212-F356 HydrophobicContact CG-CD1 3.79Å; K212-F356 HydrophobicContact CG-CE1 3.67Å; V213-F356 HydrophobicContact CG2-CE1 4.45Å; V213-F356 HydrophobicContact CG2-CZ 4.48Å; V354-F356 HydrophobicContact CB-CD1 3.66Å; V354-F356 HydrophobicContact CB-CD2 3.62Å; V354-F356 HydrophobicContact CB-CE1 3.33Å; V354-F356 HydrophobicContact CB-CE2 3.33Å; V354-F356 HydrophobicContact CB-CG 3.82Å; V354-F356 HydrophobicContact CB-CZ 3.2Å; V354-F356 HydrophobicContact CG1-CD1 3.34Å; V354-F356 HydrophobicContact CG1-CD2 4.22Å; V354-F356 HydrophobicContact CG1-CE1 3.22Å; V354-F356 HydrophobicContact CG1-CE2 4.16Å; V354-F356 HydrophobicContact CG1-CG 3.88Å; V354-F356 HydrophobicContact CG1-CZ 3.71Å; V354-F356 HydrophobicContact CG2-CD1 4.45Å; V354-F356 HydrophobicContact CG2-CD2 4.42Å; V354-F356 HydrophobicContact CG2-CE1 3.62Å; V354-F356 HydrophobicContact CG2-CE2 3.64Å; V354-F356 HydrophobicContact CG2-CZ 3.2Å; V354-F356 VanDerWaalsContact O-CD2 3.32Å; V354-F356 WeakPolarHBondContact O-CD2 3.29Å; V354-F356 PolarHBondContact O-N 3.23Å
357	K	57.2	Low	66.3	Low	27 Å²	27	77.3 Å²	77.3	12%	0.117	42%	0.42	C	S	.	.	S	Bend	trans	69.2	124.3	-174.5	-159.9	157.1	169.1	159.1	0	114.5	Q126 D127 Q209 P355 K359 D455	Q126-K357 WeakPolarHBondContact O-CD 3Å; Q126-K357 PolarHBondContact O-NZ 3.04Å; D127-K357 WeakPolarHBondContact O-CB 3.48Å; Q209-K357 HydrophobicContact CB-CG 4.19Å; Q209-K357 HydrophobicContact CG-CG 4.45Å; Q209-K357 VanDerWaalsContact OE1-CD 3.22Å; P355-K357 PolarHBondContact O-N 3.37Å; K357-K359 PolarHBondContact O-N 3.35Å; K357-D455 VanDerWaalsContact CE-O 3.29Å; K357-D455 WeakPolarHBondContact CE-O 3.46Å; K357-D455 PolarHBondContact NZ-O 3.44Å
358	T	55	Low	67.3	Low	57 Å²	57	71 Å²	71	35%	0.35	39%	0.392	S	S	.	.			trans	-56.9	108.6	-178.7	48.4	0	0	0	0	110.8	D360	T358-D360 PolarHBondContact O-N 2.9Å; T358-D360 VanDerWaalsContact O-N 3.1Å
359	K	57.3	Low	68.6	Low	140 Å²	140	68.1 Å²	68.1	61%	0.609	39%	0.387	S	S	*	.	S	Bend	trans	-64	-10.4	173.5	-69.2	-173.7	176.2	-176.9	0	113.7	K357 S361	K357-K359 PolarHBondContact O-N 3.35Å; K359-S361 PolarHBondContact O-N 2.9Å
360	D	60.9	Low	70.1	Confident	68 Å²	68	62.1 Å²	62.1	36%	0.364	36%	0.362	S	S	.	.			trans	-73.5	59.2	173.8	-71.7	-20.9	0	0	0	111	I156 R157 T358	I156-D360 CarbonylContact C-O 3.57Å; R157-D360 WeakPolarHBondContact CA-O 3.4Å; R157-D360 HydrophobicContact CB-CB 4.12Å; R157-D360 WeakPolarHBondContact CB-O 3.48Å; R157-D360 PolarHBondContact N-O 3.16Å; T358-D360 PolarHBondContact O-N 2.9Å; T358-D360 VanDerWaalsContact O-N 3.1Å
361	S	66.5	Low	72.3	Confident	53 Å²	53	56.6 Å²	56.6	37%	0.371	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-77.6	142.1	170.6	84.1	0	0	0	0	110.1	K359 K367	K359-S361 PolarHBondContact O-N 2.9Å; S361-K367 PolarHBondContact OG-NZ 3.31Å
362	P	78.6	Confident	74.2	Confident	10 Å²	10	57.4 Å²	57.4	7%	0.065	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-65.3	158.6	-177.8	22.5	-30.6	0	0	0	112.1	L153 L154 R157 K367	L153-P362 WeakPolarHBondContact O-CG 3.42Å; L154-P362 WeakPolarHBondContact O-CD 3.49Å; L154-P362 WeakPolarHBondContact O-CG 3.33Å; R157-P362 HydrophobicContact CB-CB 4.42Å; P362-K367 HydrophobicContact CB-CG 4.4Å; P362-K367 HydrophobicContact CG-CD 4.46Å; P362-K367 HydrophobicContact CG-CG 3.79Å; P362-K367 WeakPolarHBondContact O-CE 3.47Å
363	G	84.1	Confident	76.3	Confident	40 Å²	40	60.4 Å²	60.4	41%	0.412	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-59.9	153.2	178.1	0	0	0	0	0	112.7	F365 S366 K367	G363-F365 VanDerWaalsContact C-N 3.3Å; G363-F365 PolarHBondContact O-N 2.88Å; G363-S366 WeakPolarHBondContact O-CB 3.2Å; G363-S366 PolarHBondContact O-N 3.34Å; G363-K367 PolarHBondContact O-N 2.99Å
364	V	88.1	Confident	78.4	Confident	78 Å²	78	56 Å²	56	47%	0.473	31%	0.311	S	S	.	.	H	α-helix	trans	-53.2	-43.6	-175.4	177.4	0	0	0	0	112.6	K367 L368 W461	V364-K367 PolarHBondContact O-N 3.4Å; V364-L368 PolarHBondContact O-N 2.95Å; V364-W461 HydrophobicContact CG1-CH2 3.74Å; V364-W461 HydrophobicContact CG1-CZ2 4.1Å
365	F	88.7	Confident	80.4	Confident	183 Å²	183	54.6 Å²	54.6	80%	0.803	30%	0.303	S	S	*	.	H	α-helix	trans	-66.7	-39	178.7	-64.8	-73	0	0	0	112.9	G363 L368 G369	G363-F365 VanDerWaalsContact C-N 3.3Å; G363-F365 PolarHBondContact O-N 2.88Å; F365-L368 PolarHBondContact O-N 3.48Å; F365-G369 PolarHBondContact O-N 3.2Å
366	S	88.7	Confident	82.4	Confident	69 Å²	69	52 Å²	52	48%	0.483	29%	0.285	S	S	.	.	H	α-helix	trans	-65.6	-42.4	175.3	-171.3	0	0	0	0	110.8	G363 L368 G369 V370	G363-S366 WeakPolarHBondContact O-CB 3.2Å; G363-S366 PolarHBondContact O-N 3.34Å; S366-L368 VanDerWaalsContact C-N 3.35Å; S366-L368 PolarHBondContact O-N 3.4Å; S366-G369 PolarHBondContact O-N 2.83Å; S366-V370 WeakPolarHBondContact O-CG2 3.42Å; S366-V370 PolarHBondContact O-N 3.03Å
367	K	91.8	Very high	84.2	Confident	18 Å²	18	55.3 Å²	55.3	8%	0.078	30%	0.297	C	S	.	.	H	α-helix	trans	-58.2	-47.2	174.4	-71.6	-174.1	179.6	-173.2	0	111.2	L154 S361 P362 G363 V364 G369 V370 L371 L457	L154-K367 HydrophobicContact CD2-CB 4.11Å; L154-K367 HydrophobicContact CD2-CG 4.23Å; S361-K367 PolarHBondContact OG-NZ 3.31Å; P362-K367 HydrophobicContact CB-CG 4.4Å; P362-K367 HydrophobicContact CG-CD 4.46Å; P362-K367 HydrophobicContact CG-CG 3.79Å; P362-K367 WeakPolarHBondContact O-CE 3.47Å; G363-K367 PolarHBondContact O-N 2.99Å; V364-K367 PolarHBondContact O-N 3.4Å; K367-G369 PolarHBondContact O-N 2.89Å; K367-V370 PolarHBondContact O-N 2.88Å; K367-L371 WeakPolarHBondContact O-CB 3.38Å; K367-L371 WeakPolarHBondContact O-CG 3.39Å; K367-L371 PolarHBondContact O-N 3.39Å; K367-L457 WeakPolarHBondContact CE-O 3.4Å; K367-L457 PolarHBondContact NZ-O 2.95Å
368	L	94	Very high	86	Confident	25 Å²	25	54.6 Å²	54.6	13%	0.131	30%	0.295	C	S	.	.	H	α-helix	trans	-61.4	-42.7	178.1	-175.5	66.3	0	0	0	112.1	V364 F365 S366 L371 L372 Q462 L465 A466 L469	V364-L368 PolarHBondContact O-N 2.95Å; F365-L368 PolarHBondContact O-N 3.48Å; S366-L368 VanDerWaalsContact C-N 3.35Å; S366-L368 PolarHBondContact O-N 3.4Å; L368-L371 PolarHBondContact O-N 2.84Å; L368-L372 VanDerWaalsContact O-CB 3.31Å; L368-L372 WeakPolarHBondContact O-CB 3.2Å; L368-L372 PolarHBondContact O-N 3.33Å; L368-Q462 WeakPolarHBondContact CD1-O 3.47Å; L368-L465 HydrophobicContact CD1-CB 3.95Å; L368-L465 HydrophobicContact CD1-CD2 4.03Å; L368-L465 HydrophobicContact CD1-CG 3.98Å; L368-L465 HydrophobicContact CD2-CD2 3.58Å; L368-L465 HydrophobicContact CD2-CG 4.14Å; L368-L465 HydrophobicContact CG-CD2 4.48Å; L368-A466 HydrophobicContact CD1-CB 4.15Å; L368-L469 HydrophobicContact CD2-CD1 4.07Å; L368-L469 HydrophobicContact CG-CD1 4.43Å
369	G	94.3	Very high	87.7	Confident	41 Å²	41	52 Å²	52	42%	0.423	28%	0.278	S	S	.	.	H	α-helix	trans	-63.2	-40.8	176.9	0	0	0	0	0	113.2	F365 S366 K367 R373	F365-G369 PolarHBondContact O-N 3.2Å; S366-G369 PolarHBondContact O-N 2.83Å; K367-G369 PolarHBondContact O-N 2.89Å; G369-R373 PolarHBondContact O-N 3.41Å
370	V	94.1	Very high	89.4	Confident	22 Å²	22	49.1 Å²	49.1	13%	0.133	27%	0.273	C	S	.	.	H	α-helix	trans	-66.6	-43.5	175.4	175.9	0	0	0	0	111	Y150 L153 L154 S366 K367 R373 R374	Y150-V370 HydrophobicContact CD1-CG1 3.82Å; L153-V370 HydrophobicContact CB-CG1 4.04Å; L153-V370 HydrophobicContact CB-CG2 4.35Å; L154-V370 HydrophobicContact CD2-CB 3.95Å; L154-V370 HydrophobicContact CD2-CG1 3.89Å; L154-V370 HydrophobicContact CG-CB 4.49Å; L154-V370 HydrophobicContact CG-CG1 3.88Å; S366-V370 WeakPolarHBondContact O-CG2 3.42Å; S366-V370 PolarHBondContact O-N 3.03Å; K367-V370 PolarHBondContact O-N 2.88Å; V370-R373 PolarHBondContact O-N 3.5Å; V370-R374 WeakPolarHBondContact O-CB 3.18Å; V370-R374 PolarHBondContact O-N 3.33Å
371	L	95.8	Very high	91	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62	-45.1	175.5	-74.2	172.8	0	0	0	111.8	L154 K367 L368 R373 R374 V375 Y458 Q462 M463 A466	L154-L371 HydrophobicContact CD1-CD2 3.82Å; L154-L371 HydrophobicContact CD1-CG 4.42Å; L154-L371 HydrophobicContact CD2-CD2 4.35Å; L154-L371 HydrophobicContact CD2-CG 4.06Å; K367-L371 WeakPolarHBondContact O-CB 3.38Å; K367-L371 WeakPolarHBondContact O-CG 3.39Å; K367-L371 PolarHBondContact O-N 3.39Å; L368-L371 PolarHBondContact O-N 2.84Å; L371-R373 VanDerWaalsContact C-N 3.34Å; L371-R373 PolarHBondContact O-N 3.39Å; L371-R374 WeakPolarHBondContact O-CB 3.39Å; L371-R374 PolarHBondContact O-N 3.37Å; L371-V375 WeakPolarHBondContact O-CB 3.31Å; L371-V375 VanDerWaalsContact O-CG2 3.31Å; L371-V375 WeakPolarHBondContact O-CG2 3.48Å; L371-V375 PolarHBondContact O-N 3.23Å; L371-Y458 HydrophobicContact CD1-CD1 4.18Å; L371-Y458 HydrophobicContact CD1-CD2 4.23Å; L371-Y458 HydrophobicContact CD1-CG 4.01Å; L371-Y458 HydrophobicContact CD2-CD1 3.93Å; L371-Y458 HydrophobicContact CD2-CE1 3.63Å; L371-Q462 HydrophobicContact CD1-CB 3.82Å; L371-M463 HydrophobicContact CD2-CE 3.98Å; L371-A466 HydrophobicContact CB-CB 3.83Å
372	L	96.3	Very high	92.1	Very high	50 Å²	50	50.3 Å²	50.3	26%	0.262	27%	0.268	S	S	.	.	H	α-helix	trans	-56.9	-49.9	176.3	179.7	58.4	0	0	0	110.4	L368 R374 V375 T376 A466 L469 H470	L368-L372 VanDerWaalsContact O-CB 3.31Å; L368-L372 WeakPolarHBondContact O-CB 3.2Å; L368-L372 PolarHBondContact O-N 3.33Å; L372-R374 VanDerWaalsContact C-N 3.34Å; L372-R374 PolarHBondContact O-N 3.19Å; L372-V375 PolarHBondContact O-N 3Å; L372-T376 WeakPolarHBondContact O-CB 3.1Å; L372-T376 PolarHBondContact O-N 2.84Å; L372-T376 PolarHBondContact O-OG1 3.12Å; L372-A466 WeakPolarHBondContact CD1-O 3.24Å; L372-L469 HydrophobicContact CD1-CB 3.86Å; L372-L469 HydrophobicContact CD2-CB 4.29Å; L372-H470 HydrophobicContact CD1-CB 3.72Å
373	R	95.9	Very high	92.6	Very high	147 Å²	147	58.2 Å²	58.2	56%	0.555	30%	0.301	S	S	*	.	H	α-helix	trans	-59.9	-42.6	176.8	-171.9	-178.8	-178.8	179.9	2.7	112.5	Y150 G369 V370 L371 R377	Y150-R373 HydrophobicContact CE1-CG 4.34Å; G369-R373 PolarHBondContact O-N 3.41Å; V370-R373 PolarHBondContact O-N 3.5Å; L371-R373 VanDerWaalsContact C-N 3.34Å; L371-R373 PolarHBondContact O-N 3.39Å; R373-R377 VanDerWaalsContact O-CB 3.29Å; R373-R377 WeakPolarHBondContact O-CB 3.39Å; R373-R377 PolarHBondContact O-N 2.83Å
374	R	96.1	Very high	92.9	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-61.8	-48.7	178.1	-178.6	-177.6	-178.9	-167.5	-5.4	111.1	L139 L142 Y150 V370 L371 L372 R377 N378 E452	L139-R374 HydrophobicContact CD1-CG 3.97Å; L139-R374 VanDerWaalsContact CD1-NE 3.31Å; L142-R374 HydrophobicContact CD1-CG 3.83Å; Y150-R374 HydrophobicContact CD1-CB 3.95Å; Y150-R374 HydrophobicContact CD1-CG 4.43Å; Y150-R374 HydrophobicContact CD2-CB 3.99Å; Y150-R374 HydrophobicContact CD2-CG 3.67Å; Y150-R374 HydrophobicContact CE1-CB 4.03Å; Y150-R374 HydrophobicContact CE2-CB 4.07Å; Y150-R374 HydrophobicContact CE2-CG 4.02Å; Y150-R374 HydrophobicContact CG-CB 3.94Å; Y150-R374 HydrophobicContact CG-CG 3.9Å; V370-R374 WeakPolarHBondContact O-CB 3.18Å; V370-R374 PolarHBondContact O-N 3.33Å; L371-R374 WeakPolarHBondContact O-CB 3.39Å; L371-R374 PolarHBondContact O-N 3.37Å; L372-R374 VanDerWaalsContact C-N 3.34Å; L372-R374 PolarHBondContact O-N 3.19Å; R374-R377 PolarHBondContact O-N 3.26Å; R374-N378 WeakPolarHBondContact O-CB 3.39Å; R374-N378 PolarHBondContact O-N 3.38Å; R374-E452 IonicContact CZ-OE1 2.69Å; R374-E452 VanDerWaalsContact CZ-OE1 3.3Å; R374-E452 IonicContact CZ-OE2 3.22Å; R374-E452 VanDerWaalsContact NH1-CD 3.28Å; R374-E452 IonicContact NH1-OE1 2.7Å; R374-E452 PolarHBondContact NH1-OE1 3.19Å; R374-E452 IonicContact NH1-OE2 3.77Å; R374-E452 PolarHBondContact NH1-OE2 3.16Å; R374-E452 IonicContact NH2-OE1 3.52Å; R374-E452 PolarHBondContact NH2-OE1 3.11Å; R374-E452 IonicContact NH2-OE2 3Å
375	V	95.4	Very high	92.9	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.012	30%	0.298	C	S	.	.	H	α-helix	trans	-68.3	-45.3	-178.4	177.3	0	0	0	0	111.2	L371 L372 R377 N378 L379 L445 M463 H470	L371-V375 WeakPolarHBondContact O-CB 3.31Å; L371-V375 VanDerWaalsContact O-CG2 3.31Å; L371-V375 WeakPolarHBondContact O-CG2 3.48Å; L371-V375 PolarHBondContact O-N 3.23Å; L372-V375 PolarHBondContact O-N 3Å; V375-R377 VanDerWaalsContact C-N 3.32Å; V375-R377 PolarHBondContact O-N 3.39Å; V375-N378 PolarHBondContact O-N 2.83Å; V375-L379 PolarHBondContact O-N 3.01Å; V375-L445 HydrophobicContact CB-CD2 4.4Å; V375-L445 HydrophobicContact CG1-CD2 3.56Å; V375-L445 HydrophobicContact CG2-CD2 3.88Å; V375-M463 HydrophobicContact CG2-CE 4.46Å; V375-M463 HydrophobicContact CG2-SD 3.65Å; V375-H470 WeakPolarHBondContact CG1-CD2 3.5Å; V375-H470 VanDerWaalsContact CG1-NE2 3.32Å; V375-H470 WeakPolarHBondContact CG1-NE2 3.49Å
376	T	94.8	Very high	93.2	Very high	46 Å²	46	51.9 Å²	51.9	28%	0.282	27%	0.267	S	S	.	.	H	α-helix	trans	-59.1	-43.7	175.7	-57.2	0	0	0	0	111.1	L372 N378 L379 V380	L372-T376 WeakPolarHBondContact O-CB 3.1Å; L372-T376 PolarHBondContact O-N 2.84Å; L372-T376 PolarHBondContact O-OG1 3.12Å; T376-N378 PolarHBondContact O-N 3.39Å; T376-L379 PolarHBondContact O-N 2.84Å; T376-V380 HydrophobicContact CG2-CG2 4.13Å; T376-V380 WeakPolarHBondContact O-CB 3.49Å; T376-V380 VanDerWaalsContact O-CG2 3.24Å; T376-V380 WeakPolarHBondContact O-CG2 3.32Å; T376-V380 PolarHBondContact O-N 3.49Å
377	R	95.3	Very high	93.4	Very high	86 Å²	86	53.4 Å²	53.4	33%	0.325	27%	0.268	S	S	.	.	H	α-helix	trans	-63.9	-41.1	177.2	-169.7	176.9	-173.1	119.5	-2.1	112.3	L142 E146 Y150 R373 R374 V375 R381	L142-R377 HydrophobicContact CD2-CB 4.29Å; L142-R377 HydrophobicContact CD2-CG 4.08Å; E146-R377 IonicContact OE1-CZ 3.17Å; E146-R377 IonicContact OE1-NE 2.74Å; E146-R377 PolarHBondContact OE1-NE 3.34Å; E146-R377 VanDerWaalsContact OE1-NE 3.1Å; E146-R377 IonicContact OE1-NH2 3.81Å; E146-R377 PolarHBondContact OE1-NH2 3.09Å; E146-R377 IonicContact OE2-CZ 3.5Å; E146-R377 IonicContact OE2-NE 3.21Å; E146-R377 PolarHBondContact OE2-NE 3.49Å; E146-R377 VanDerWaalsContact OE2-NE 3.09Å; Y150-R377 VanDerWaalsContact OH-CD 3.28Å; Y150-R377 WeakPolarHBondContact OH-CD 3.45Å; R373-R377 VanDerWaalsContact O-CB 3.29Å; R373-R377 WeakPolarHBondContact O-CB 3.39Å; R373-R377 PolarHBondContact O-N 2.83Å; R374-R377 PolarHBondContact O-N 3.26Å; V375-R377 VanDerWaalsContact C-N 3.32Å; V375-R377 PolarHBondContact O-N 3.39Å; R377-R381 PolarHBondContact O-N 3.25Å
378	N	93.9	Very high	93.3	Very high	11 Å²	11	57.4 Å²	57.4	6%	0.059	29%	0.288	C	S	.	.	H	α-helix	trans	-61.7	-44.1	176	-179.6	55	0	0	0	111.5	L139 S141 L142 R374 V375 T376 N382	L139-N378 HydrophobicContact CD1-CB 4.41Å; S141-N378 WeakPolarHBondContact CB-O 3.34Å; S141-N378 WeakPolarHBondContact CB-OD1 3.46Å; S141-N378 PolarHBondContact N-OD1 3.03Å; S141-N378 PolarHBondContact OG-OD1 2.97Å; S141-N378 VanDerWaalsContact OG-OD1 3.06Å; L142-N378 HydrophobicContact CD2-CB 4.21Å; L142-N378 HydrophobicContact CG-CB 4.39Å; R374-N378 WeakPolarHBondContact O-CB 3.39Å; R374-N378 PolarHBondContact O-N 3.38Å; V375-N378 PolarHBondContact O-N 2.83Å; T376-N378 PolarHBondContact O-N 3.39Å; N378-N382 PolarHBondContact O-N 2.92Å
379	L	92.2	Very high	93.2	Very high	2 Å²	2	56.4 Å²	56.4	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-67.7	-49.8	178.4	-178	58.1	0	0	0	111.8	V375 T376 R381 N382 A385 V386 L441 F474	V375-L379 PolarHBondContact O-N 3.01Å; T376-L379 PolarHBondContact O-N 2.84Å; L379-R381 PolarHBondContact O-N 3.31Å; L379-N382 CarbonylContact O-C 3.56Å; L379-N382 WeakPolarHBondContact O-CA 3.25Å; L379-N382 PolarHBondContact O-N 3.39Å; L379-A385 HydrophobicContact CD1-CB 3.9Å; L379-V386 HydrophobicContact CD1-CG2 4.37Å; L379-V386 HydrophobicContact CG-CG2 4.15Å; L379-V386 VanDerWaalsContact O-CG2 3.26Å; L379-V386 WeakPolarHBondContact O-CG2 3.4Å; L379-L441 HydrophobicContact CD1-CD1 4.04Å; L379-L441 HydrophobicContact CD1-CD2 3.59Å; L379-L441 HydrophobicContact CD1-CG 4.5Å; L379-L441 HydrophobicContact CD2-CD2 4.15Å; L379-L441 HydrophobicContact CG-CD2 4.39Å; L379-F474 HydrophobicContact CD2-CD2 4.35Å; L379-F474 HydrophobicContact CD2-CE2 4.14Å; L379-F474 HydrophobicContact CD2-CZ 4.36Å
380	V	93.1	Very high	93.2	Very high	81 Å²	81	56.5 Å²	56.5	49%	0.491	27%	0.273	S	S	.	.	H	α-helix	trans	-60.1	-33.6	-176.4	169.4	0	0	0	0	112.5	T376 F474	T376-V380 HydrophobicContact CG2-CG2 4.13Å; T376-V380 WeakPolarHBondContact O-CB 3.49Å; T376-V380 VanDerWaalsContact O-CG2 3.24Å; T376-V380 WeakPolarHBondContact O-CG2 3.32Å; T376-V380 PolarHBondContact O-N 3.49Å; V380-F474 HydrophobicContact CG2-CZ 3.98Å
381	R	92.5	Very high	93.1	Very high	94 Å²	94	59.3 Å²	59.3	36%	0.355	29%	0.287	S	S	.	.	H	α-helix	trans	-74.6	-25.3	175.6	-78.4	-171.3	169.1	165.5	2.4	113.9	S141 E146 R377 L379 K383	S141-R381 VanDerWaalsContact O-CD 3.23Å; S141-R381 WeakPolarHBondContact O-CD 3.12Å; E146-R381 IonicContact OE1-CZ 2.66Å; E146-R381 VanDerWaalsContact OE1-CZ 3.22Å; E146-R381 IonicContact OE1-NH1 3.58Å; E146-R381 PolarHBondContact OE1-NH1 3.01Å; E146-R381 IonicContact OE1-NH2 3.2Å; E146-R381 PolarHBondContact OE1-NH2 3.27Å; E146-R381 IonicContact OE2-CZ 3.93Å; E146-R381 IonicContact OE2-NH1 3.1Å; E146-R381 PolarHBondContact OE2-NH1 3.01Å; E146-R381 IonicContact OE2-NH2 2.65Å; R377-R381 PolarHBondContact O-N 3.25Å; L379-R381 PolarHBondContact O-N 3.31Å; R381-K383 VanDerWaalsContact C-N 3.31Å; R381-K383 PolarHBondContact O-N 3.5Å
382	N	90.3	Very high	92.9	Very high	51 Å²	51	60.5 Å²	60.5	27%	0.273	29%	0.293	S	S	.	.			trans	-81.1	81.9	171.8	-171.7	-13.4	0	0	0	109.7	N378 L379 L384 A385 V386	N378-N382 PolarHBondContact O-N 2.92Å; L379-N382 CarbonylContact O-C 3.56Å; L379-N382 WeakPolarHBondContact O-CA 3.25Å; L379-N382 PolarHBondContact O-N 3.39Å; N382-L384 PolarHBondContact O-N 3.03Å; N382-L384 PolarHBondContact OD1-N 3.3Å; N382-A385 HydrophobicContact CB-CB 4.02Å; N382-A385 VanDerWaalsContact CG-CB 3.49Å; N382-A385 PolarHBondContact O-N 2.97Å; N382-A385 VanDerWaalsContact O-N 3.08Å; N382-A385 PolarHBondContact OD1-N 2.74Å; N382-V386 PolarHBondContact O-N 3.45Å; N382-V386 VanDerWaalsContact O-N 3.07Å
383	K	89.8	Confident	92.7	Very high	177 Å²	177	58.3 Å²	58.3	77%	0.77	28%	0.281	S	S	*	.	H	α-helix	trans	-53.4	-39.8	-178.1	-64.4	-177.2	-178.9	-179.9	0	112.5	R381 V386 M387	R381-K383 VanDerWaalsContact C-N 3.31Å; R381-K383 PolarHBondContact O-N 3.5Å; K383-V386 PolarHBondContact O-N 2.82Å; K383-M387 VanDerWaalsContact O-CB 3.29Å; K383-M387 WeakPolarHBondContact O-CB 3.2Å; K383-M387 PolarHBondContact O-N 3.12Å
384	L	89	Confident	92.6	Very high	116 Å²	116	52.2 Å²	52.2	61%	0.607	26%	0.26	S	S	*	.	H	α-helix	trans	-62.5	-47.1	178.8	-177.4	67.2	0	0	0	111	N382 V386 M387 M388	N382-L384 PolarHBondContact O-N 3.03Å; N382-L384 PolarHBondContact OD1-N 3.3Å; L384-V386 PolarHBondContact O-N 3.1Å; L384-M387 HydrophobicContact CD1-CE 4.11Å; L384-M387 PolarHBondContact O-N 2.92Å; L384-M388 HydrophobicContact CD1-CG 4.43Å; L384-M388 WeakPolarHBondContact O-CB 3.01Å; L384-M388 VanDerWaalsContact O-CG 3.28Å; L384-M388 WeakPolarHBondContact O-CG 3.44Å; L384-M388 PolarHBondContact O-N 3.21Å
385	A	89.9	Confident	92.5	Very high	25 Å²	25	56.1 Å²	56.1	21%	0.207	28%	0.283	C	S	.	.	H	α-helix	trans	-63.7	-42.1	178.6	0	0	0	0	0	112.3	L379 N382 R389	L379-A385 HydrophobicContact CD1-CB 3.9Å; N382-A385 HydrophobicContact CB-CB 4.02Å; N382-A385 VanDerWaalsContact CG-CB 3.49Å; N382-A385 PolarHBondContact O-N 2.97Å; N382-A385 VanDerWaalsContact O-N 3.08Å; N382-A385 PolarHBondContact OD1-N 2.74Å; A385-R389 WeakPolarHBondContact O-CB 3.39Å; A385-R389 PolarHBondContact O-N 2.81Å
386	V	93.6	Very high	92.2	Very high	26 Å²	26	58.3 Å²	58.3	16%	0.158	29%	0.294	C	S	.	.	H	α-helix	trans	-64.1	-45.6	176.5	176.3	0	0	0	0	111.2	L379 N382 K383 L384 R389 L390 F474	L379-V386 HydrophobicContact CD1-CG2 4.37Å; L379-V386 HydrophobicContact CG-CG2 4.15Å; L379-V386 VanDerWaalsContact O-CG2 3.26Å; L379-V386 WeakPolarHBondContact O-CG2 3.4Å; N382-V386 PolarHBondContact O-N 3.45Å; N382-V386 VanDerWaalsContact O-N 3.07Å; K383-V386 PolarHBondContact O-N 2.82Å; L384-V386 PolarHBondContact O-N 3.1Å; V386-R389 PolarHBondContact O-N 2.95Å; V386-L390 HydrophobicContact CG1-CD1 3.9Å; V386-L390 HydrophobicContact CG1-CG 4.37Å; V386-L390 WeakPolarHBondContact O-CG 3.16Å; V386-L390 PolarHBondContact O-N 3.44Å; V386-F474 HydrophobicContact CG1-CD1 4.44Å; V386-F474 HydrophobicContact CG1-CE1 4.12Å; V386-F474 HydrophobicContact CG2-CE1 4.43Å
387	M	93	Very high	92	Very high	101 Å²	101	56.1 Å²	56.1	50%	0.498	28%	0.281	S	S	.	.	H	α-helix	trans	-60.2	-49.9	179.1	-175.2	-173	79	0	0	111.2	K383 L384 R389 L390 L391	K383-M387 VanDerWaalsContact O-CB 3.29Å; K383-M387 WeakPolarHBondContact O-CB 3.2Å; K383-M387 PolarHBondContact O-N 3.12Å; L384-M387 HydrophobicContact CD1-CE 4.11Å; L384-M387 PolarHBondContact O-N 2.92Å; M387-R389 VanDerWaalsContact C-N 3.3Å; M387-R389 PolarHBondContact O-N 3.39Å; M387-L390 PolarHBondContact O-N 2.96Å; M387-L391 VanDerWaalsContact O-CB 3.23Å; M387-L391 WeakPolarHBondContact O-CB 3.44Å; M387-L391 PolarHBondContact O-N 3.42Å
388	M	90.2	Very high	91.9	Very high	103 Å²	103	55.8 Å²	55.8	51%	0.507	29%	0.285	S	S	.	.	H	α-helix	trans	-59.1	-43.9	177.8	-70	-60	-69.8	0	0	111.3	L384 L390 L391 Q392	L384-M388 HydrophobicContact CD1-CG 4.43Å; L384-M388 WeakPolarHBondContact O-CB 3.01Å; L384-M388 VanDerWaalsContact O-CG 3.28Å; L384-M388 WeakPolarHBondContact O-CG 3.44Å; L384-M388 PolarHBondContact O-N 3.21Å; M388-L390 PolarHBondContact O-N 3.37Å; M388-L391 PolarHBondContact O-N 3.27Å; M388-Q392 WeakPolarHBondContact O-CB 3.36Å; M388-Q392 WeakPolarHBondContact O-CG 3.42Å; M388-Q392 PolarHBondContact O-N 3.32Å
389	R	92.4	Very high	91.9	Very high	4 Å²	4	60.9 Å²	60.9	2%	0.015	31%	0.307	C	S	.	.	H	α-helix	trans	-62.8	-39.5	-179.1	-173.4	173.5	-178.1	80.2	48	113.4	A385 V386 M387 N437 Y467 F474 S475 E514	A385-R389 WeakPolarHBondContact O-CB 3.39Å; A385-R389 PolarHBondContact O-N 2.81Å; V386-R389 PolarHBondContact O-N 2.95Å; M387-R389 VanDerWaalsContact C-N 3.3Å; M387-R389 PolarHBondContact O-N 3.39Å; R389-N437 PolarHBondContact NH2-ND2 3.42Å; R389-Y467 PolarHBondContact NH1-OH 3Å; R389-F474 HydrophobicContact CG-CB 4.44Å; R389-S475 PolarHBondContact NH2-OG 2.77Å; R389-E514 IonicContact CZ-OE1 2.7Å; R389-E514 IonicContact CZ-OE2 2.63Å; R389-E514 IonicContact NH1-OE1 2.74Å; R389-E514 PolarHBondContact NH1-OE1 3.4Å; R389-E514 IonicContact NH1-OE2 3.9Å; R389-E514 VanDerWaalsContact NH2-CD 3.34Å; R389-E514 IonicContact NH2-OE1 3.3Å; R389-E514 PolarHBondContact NH2-OE1 2.84Å; R389-E514 IonicContact NH2-OE2 3.76Å; R389-E514 PolarHBondContact NH2-OE2 2.85Å
390	L	93.4	Very high	91.8	Very high	42 Å²	42	61.4 Å²	61.4	22%	0.22	31%	0.309	C	S	.	.	H	α-helix	trans	-79.8	-36.1	179.4	-66.9	178.4	0	0	0	112.6	V386 M387 M388 F474 I477 A478	V386-L390 HydrophobicContact CG1-CD1 3.9Å; V386-L390 HydrophobicContact CG1-CG 4.37Å; V386-L390 WeakPolarHBondContact O-CG 3.16Å; V386-L390 PolarHBondContact O-N 3.44Å; M387-L390 PolarHBondContact O-N 2.96Å; M388-L390 PolarHBondContact O-N 3.37Å; L390-F474 HydrophobicContact CD2-CB 4.42Å; L390-F474 HydrophobicContact CD2-CD1 4.29Å; L390-I477 HydrophobicContact CD2-CB 4.18Å; L390-I477 HydrophobicContact CD2-CG2 3.91Å; L390-A478 HydrophobicContact CD2-CB 4.31Å
391	L	92.9	Very high	91.8	Very high	81 Å²	81	59 Å²	59	42%	0.424	29%	0.294	S	S	.	.	H	α-helix	trans	-95.1	-24.6	-169.2	-158.4	67.7	0	0	0	113.9	M387 M388 N393 L394 T395	M387-L391 VanDerWaalsContact O-CB 3.23Å; M387-L391 WeakPolarHBondContact O-CB 3.44Å; M387-L391 PolarHBondContact O-N 3.42Å; M388-L391 PolarHBondContact O-N 3.27Å; L391-N393 VanDerWaalsContact C-N 3.3Å; L391-N393 PolarHBondContact O-N 3.47Å; L391-L394 HydrophobicContact CD1-CB 4.34Å; L391-L394 HydrophobicContact CD1-CD2 3.75Å; L391-L394 CarbonylContact O-C 3.57Å; L391-L394 WeakPolarHBondContact O-CA 3.47Å; L391-L394 WeakPolarHBondContact O-CB 3.23Å; L391-L394 PolarHBondContact O-N 2.99Å; L391-T395 PolarHBondContact O-N 2.96Å; L391-T395 PolarHBondContact O-OG1 3.36Å; L391-T395 VanDerWaalsContact O-OG1 3.1Å
392	Q	91.4	Very high	91.8	Very high	25 Å²	25	61.8 Å²	61.8	12%	0.117	31%	0.309	C	S	.	.	H	α-helix	trans	-57.9	-37.4	-175.1	64.3	179.2	7.3	0	0	114.2	M388 L394 T395 M396 T433 N437	M388-Q392 WeakPolarHBondContact O-CB 3.36Å; M388-Q392 WeakPolarHBondContact O-CG 3.42Å; M388-Q392 PolarHBondContact O-N 3.32Å; Q392-L394 VanDerWaalsContact C-N 3.34Å; Q392-T395 PolarHBondContact O-N 3.46Å; Q392-M396 PolarHBondContact O-N 2.99Å; Q392-M396 VanDerWaalsContact O-N 3.12Å; Q392-T433 HydrophobicContact CG-CG2 4.38Å; Q392-T433 PolarHBondContact NE2-O 2.83Å; Q392-N437 PolarHBondContact NE2-ND2 3.43Å; Q392-N437 PolarHBondContact NE2-OD1 3.37Å; Q392-N437 PolarHBondContact OE1-OD1 2.96Å
393	N	91	Very high	91.8	Very high	4 Å²	4	65.9 Å²	65.9	2%	0.021	32%	0.324	C	S	.	.	H	α-helix	trans	-65.2	-45.3	177.9	-72.8	-0.3	0	0	0	109	L391 T395 M396 G397 T433 F482	L391-N393 VanDerWaalsContact C-N 3.3Å; L391-N393 PolarHBondContact O-N 3.47Å; N393-T395 PolarHBondContact O-N 2.82Å; N393-M396 PolarHBondContact O-N 3.21Å; N393-G397 PolarHBondContact O-N 3.15Å; N393-T433 WeakPolarHBondContact OD1-CB 3.38Å; N393-T433 WeakPolarHBondContact OD1-CG2 3.35Å; N393-T433 PolarHBondContact OD1-OG1 3.3Å; N393-F482 HydrophobicContact CB-CB 3.78Å; N393-F482 HydrophobicContact CB-CD2 4.46Å; N393-F482 HydrophobicContact CB-CG 4.12Å; N393-F482 WeakPolarHBondContact O-CD2 3.38Å
394	L	94.2	Very high	91.6	Very high	20 Å²	20	59.4 Å²	59.4	11%	0.105	30%	0.299	C	S	.	.	H	α-helix	trans	-61.7	-43.2	176.1	-178.5	63.8	0	0	0	111.4	L391 Q392 M396 G397 L398 I481 V485	L391-L394 HydrophobicContact CD1-CB 4.34Å; L391-L394 HydrophobicContact CD1-CD2 3.75Å; L391-L394 CarbonylContact O-C 3.57Å; L391-L394 WeakPolarHBondContact O-CA 3.47Å; L391-L394 WeakPolarHBondContact O-CB 3.23Å; L391-L394 PolarHBondContact O-N 2.99Å; Q392-L394 VanDerWaalsContact C-N 3.34Å; L394-M396 VanDerWaalsContact C-N 3.3Å; L394-M396 PolarHBondContact O-N 3.03Å; L394-G397 CarbonylContact O-C 3.54Å; L394-G397 WeakPolarHBondContact O-CA 3.16Å; L394-G397 PolarHBondContact O-N 3.23Å; L394-L398 HydrophobicContact CD1-CD1 4.43Å; L394-L398 HydrophobicContact CD1-CD2 4.48Å; L394-L398 HydrophobicContact CD1-CG 4.1Å; L394-L398 HydrophobicContact CD2-CD1 4.4Å; L394-L398 HydrophobicContact CG-CD1 3.98Å; L394-L398 HydrophobicContact CG-CG 4.12Å; L394-L398 WeakPolarHBondContact O-CG 3.04Å; L394-L398 PolarHBondContact O-N 3.28Å; L394-I481 HydrophobicContact CB-CG2 4.4Å; L394-I481 HydrophobicContact CD2-CG2 3.98Å; L394-V485 HydrophobicContact CD1-CB 3.61Å; L394-V485 HydrophobicContact CD1-CG1 3.85Å; L394-V485 HydrophobicContact CD1-CG2 3.85Å
395	T	93.3	Very high	91.6	Very high	81 Å²	81	59.5 Å²	59.5	50%	0.497	30%	0.3	S	S	.	.	H	α-helix	trans	-57.3	-43.9	177.7	-55.2	0	0	0	0	111.6	L391 Q392 N393 G397 L398 F399	L391-T395 PolarHBondContact O-N 2.96Å; L391-T395 PolarHBondContact O-OG1 3.36Å; L391-T395 VanDerWaalsContact O-OG1 3.1Å; Q392-T395 PolarHBondContact O-N 3.46Å; N393-T395 PolarHBondContact O-N 2.82Å; T395-G397 VanDerWaalsContact C-N 3.33Å; T395-G397 PolarHBondContact O-N 3.23Å; T395-L398 PolarHBondContact O-N 2.97Å; T395-F399 WeakPolarHBondContact O-CB 3.06Å; T395-F399 PolarHBondContact O-N 3.13Å
396	M	90.4	Very high	91.5	Very high	48 Å²	48	66.5 Å²	66.5	24%	0.236	32%	0.321	C	S	.	.	H	α-helix	trans	-62.6	-41.6	174	-179.2	59.5	-177.2	0	0	111.8	Q392 N393 L394 F399 L400 S429	Q392-M396 PolarHBondContact O-N 2.99Å; Q392-M396 VanDerWaalsContact O-N 3.12Å; N393-M396 PolarHBondContact O-N 3.21Å; L394-M396 VanDerWaalsContact C-N 3.3Å; L394-M396 PolarHBondContact O-N 3.03Å; M396-F399 WeakPolarHBondContact O-CB 3.31Å; M396-F399 PolarHBondContact O-N 2.86Å; M396-F399 HydrophobicContact SD-CD1 4.49Å; M396-L400 HydrophobicContact CE-CD1 3.87Å; M396-L400 HydrophobicContact CE-CD2 4.19Å; M396-L400 HydrophobicContact CE-CG 4.03Å; M396-L400 HydrophobicContact CG-CD1 4.48Å; M396-L400 WeakPolarHBondContact O-CG 3.48Å; M396-L400 PolarHBondContact O-N 3.4Å; M396-S429 VanDerWaalsContact CE-CB 3.44Å
397	G	91.1	Very high	91.2	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-63.6	-42.5	176.6	0	0	0	0	0	114.4	N393 L394 T395 L400 L401 F482 C486	N393-G397 PolarHBondContact O-N 3.15Å; L394-G397 CarbonylContact O-C 3.54Å; L394-G397 WeakPolarHBondContact O-CA 3.16Å; L394-G397 PolarHBondContact O-N 3.23Å; T395-G397 VanDerWaalsContact C-N 3.33Å; T395-G397 PolarHBondContact O-N 3.23Å; G397-L400 PolarHBondContact O-N 3.5Å; G397-L401 VanDerWaalsContact O-CB 3.25Å; G397-L401 WeakPolarHBondContact O-CB 3.17Å; G397-L401 PolarHBondContact O-N 3.32Å; G397-F482 VanDerWaalsContact CA-CE2 3.5Å; G397-C486 VanDerWaalsContact C-SG 3.54Å; G397-C486 WeakPolarHBondContact CA-SG 3.39Å
398	L	93.3	Very high	90.8	Very high	80 Å²	80	65.6 Å²	65.6	42%	0.419	32%	0.315	S	S	.	.	H	α-helix	trans	-66.6	-38.4	175.1	-69.2	175.8	0	0	0	111.4	L394 T395 L401 F402 V485	L394-L398 HydrophobicContact CD1-CD1 4.43Å; L394-L398 HydrophobicContact CD1-CD2 4.48Å; L394-L398 HydrophobicContact CD1-CG 4.1Å; L394-L398 HydrophobicContact CD2-CD1 4.4Å; L394-L398 HydrophobicContact CG-CD1 3.98Å; L394-L398 HydrophobicContact CG-CG 4.12Å; L394-L398 WeakPolarHBondContact O-CG 3.04Å; L394-L398 PolarHBondContact O-N 3.28Å; T395-L398 PolarHBondContact O-N 2.97Å; L398-L401 HydrophobicContact CD2-CD2 4.22Å; L398-L401 PolarHBondContact O-N 3.26Å; L398-F402 WeakPolarHBondContact O-CB 3.49Å; L398-F402 PolarHBondContact O-N 2.91Å; L398-V485 HydrophobicContact CD2-CG1 4.21Å
399	F	93.2	Very high	90.3	Very high	118 Å²	118	64.6 Å²	64.6	52%	0.518	31%	0.311	S	S	.	.	H	α-helix	trans	-59.3	-48.4	173.7	179	-97.7	0	0	0	111	T395 M396 F402 F403	T395-F399 WeakPolarHBondContact O-CB 3.06Å; T395-F399 PolarHBondContact O-N 3.13Å; M396-F399 WeakPolarHBondContact O-CB 3.31Å; M396-F399 PolarHBondContact O-N 2.86Å; M396-F399 HydrophobicContact SD-CD1 4.49Å; F399-F402 PolarHBondContact O-N 3.09Å; F399-F403 HydrophobicContact CD2-CE2 4.07Å; F399-F403 HydrophobicContact CE1-CD2 4.32Å; F399-F403 HydrophobicContact CE1-CE2 4.06Å; F399-F403 HydrophobicContact CE2-CD2 4.45Å; F399-F403 AromaticContact CE2-CE2 3.56Å; F399-F403 HydrophobicContact CE2-CE2 3.56Å; F399-F403 HydrophobicContact CE2-CZ 4.36Å; F399-F403 HydrophobicContact CZ-CD2 4.25Å; F399-F403 AromaticContact CZ-CE2 3.54Å; F399-F403 HydrophobicContact CZ-CE2 3.54Å; F399-F403 HydrophobicContact CZ-CZ 4.34Å; F399-F403 VanDerWaalsContact O-CD2 3.26Å; F399-F403 WeakPolarHBondContact O-CD2 3.36Å
400	L	90.8	Very high	89.6	Confident	12 Å²	12	67.6 Å²	67.6	6%	0.063	33%	0.328	C	S	.	.	H	α-helix	trans	-65.5	-41.2	176.8	-69.3	171.2	0	0	0	112.5	M396 G397 F402 F403 V404 L422 M425 F426	M396-L400 HydrophobicContact CE-CD1 3.87Å; M396-L400 HydrophobicContact CE-CD2 4.19Å; M396-L400 HydrophobicContact CE-CG 4.03Å; M396-L400 HydrophobicContact CG-CD1 4.48Å; M396-L400 WeakPolarHBondContact O-CG 3.48Å; M396-L400 PolarHBondContact O-N 3.4Å; G397-L400 PolarHBondContact O-N 3.5Å; L400-F402 VanDerWaalsContact C-N 3.27Å; L400-F402 PolarHBondContact O-N 2.89Å; L400-F403 PolarHBondContact O-N 3.11Å; L400-V404 PolarHBondContact O-N 3.18Å; L400-L422 HydrophobicContact CB-CD2 4.31Å; L400-M425 HydrophobicContact CD1-CB 3.76Å; L400-M425 HydrophobicContact CD2-CB 3.87Å; L400-M425 HydrophobicContact CD2-CG 3.89Å; L400-M425 HydrophobicContact CG-CB 4.49Å; L400-F426 HydrophobicContact CD1-CD1 3.67Å; L400-F426 HydrophobicContact CD1-CE1 3.42Å; L400-F426 VanDerWaalsContact CD1-CE1 3.42Å; L400-F426 HydrophobicContact CD1-CZ 4.32Å
401	L	91.6	Very high	88.7	Confident	30 Å²	30	66.3 Å²	66.3	16%	0.157	32%	0.322	C	S	.	.	H	α-helix	trans	-60	-37.8	177.3	175.5	65.3	0	0	0	112.1	G397 L398 F403 L405 T489 L490	G397-L401 VanDerWaalsContact O-CB 3.25Å; G397-L401 WeakPolarHBondContact O-CB 3.17Å; G397-L401 PolarHBondContact O-N 3.32Å; L398-L401 HydrophobicContact CD2-CD2 4.22Å; L398-L401 PolarHBondContact O-N 3.26Å; L401-F403 VanDerWaalsContact C-N 3.29Å; L401-F403 PolarHBondContact O-N 3.31Å; L401-L405 WeakPolarHBondContact O-CA 3.45Å; L401-L405 PolarHBondContact O-N 3.08Å; L401-T489 HydrophobicContact CD1-CG2 3.77Å; L401-T489 HydrophobicContact CD2-CG2 3.65Å; L401-T489 HydrophobicContact CG-CG2 4.32Å; L401-L490 HydrophobicContact CD1-CD2 3.66Å; L401-L490 HydrophobicContact CD1-CG 4.09Å
402	F	92.2	Very high	87.5	Confident	154 Å²	154	66.6 Å²	66.6	68%	0.675	32%	0.323	S	S	*	.	H	α-helix	trans	-60.7	-37.3	178.2	177	-99.3	0	0	0	112.5	L398 F399 L400	L398-F402 WeakPolarHBondContact O-CB 3.49Å; L398-F402 PolarHBondContact O-N 2.91Å; F399-F402 PolarHBondContact O-N 3.09Å; L400-F402 VanDerWaalsContact C-N 3.27Å; L400-F402 PolarHBondContact O-N 2.89Å
403	F	90.3	Very high	86.5	Confident	137 Å²	137	69.7 Å²	69.7	60%	0.601	34%	0.34	S	S	*	.	H	α-helix	trans	-85.6	-44	-179.7	-73.2	-79.8	0	0	0	113.5	F399 L400 L401	F399-F403 HydrophobicContact CD2-CE2 4.07Å; F399-F403 HydrophobicContact CE1-CD2 4.32Å; F399-F403 HydrophobicContact CE1-CE2 4.06Å; F399-F403 HydrophobicContact CE2-CD2 4.45Å; F399-F403 AromaticContact CE2-CE2 3.56Å; F399-F403 HydrophobicContact CE2-CE2 3.56Å; F399-F403 HydrophobicContact CE2-CZ 4.36Å; F399-F403 HydrophobicContact CZ-CD2 4.25Å; F399-F403 AromaticContact CZ-CE2 3.54Å; F399-F403 HydrophobicContact CZ-CE2 3.54Å; F399-F403 HydrophobicContact CZ-CZ 4.34Å; F399-F403 VanDerWaalsContact O-CD2 3.26Å; F399-F403 WeakPolarHBondContact O-CD2 3.36Å; L400-F403 PolarHBondContact O-N 3.11Å; L401-F403 VanDerWaalsContact C-N 3.29Å; L401-F403 PolarHBondContact O-N 3.31Å
404	V	87.3	Confident	85.9	Confident	40 Å²	40	70.4 Å²	70.4	24%	0.242	35%	0.349	C	S	.	.	H	α-helix	trans	-84.3	-21.4	-173.1	-178	0	0	0	0	112	L400 V407 D418 L422	L400-V404 PolarHBondContact O-N 3.18Å; V404-V407 HydrophobicContact CG1-CG2 4.4Å; V404-D418 HydrophobicContact CG1-CB 4.12Å; V404-L422 HydrophobicContact CB-CD2 4.09Å; V404-L422 HydrophobicContact CB-CG 4.42Å; V404-L422 HydrophobicContact CG1-CD1 3.77Å; V404-L422 HydrophobicContact CG1-CD2 4.19Å; V404-L422 HydrophobicContact CG1-CG 4Å; V404-L422 HydrophobicContact CG2-CD2 3.85Å; V404-L422 HydrophobicContact CG2-CG 4.2Å
405	L	87.6	Confident	85.4	Confident	119 Å²	119	69.4 Å²	69.4	62%	0.623	34%	0.344	S	S	*	.			trans	51.3	-153.6	-171.9	-62.3	169.9	0	0	0	110.5	L401 L490	L401-L405 WeakPolarHBondContact O-CA 3.45Å; L401-L405 PolarHBondContact O-N 3.08Å; L405-L490 WeakPolarHBondContact O-CD2 3.19Å
406	R	88.1	Confident	85	Confident	172 Å²	172	66.5 Å²	66.5	65%	0.649	33%	0.325	S	S	*	.	S	Bend	trans	-78.1	129.6	177.6	-164.1	176.8	-144.5	177	4.6	110.1	Q408	R406-Q408 PolarHBondContact O-N 3.36Å
407	V	87.8	Confident	84.8	Confident	11 Å²	11	70.6 Å²	70.6	7%	0.067	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-64.8	130.4	179.6	-178.7	0	0	0	0	110	V404 R419 L422 L490	V404-V407 HydrophobicContact CG1-CG2 4.4Å; V407-R419 HydrophobicContact CG1-CG 3.59Å; V407-L422 HydrophobicContact CG2-CD1 3.45Å; V407-L422 VanDerWaalsContact CG2-CD1 3.45Å; V407-L490 WeakPolarHBondContact CB-O 3.4Å; V407-L490 HydrophobicContact CG2-CB 4.45Å; V407-L490 WeakPolarHBondContact CG2-O 3.25Å; V407-L490 PolarHBondContact N-O 3.37Å
408	Q	84.1	Confident	84.8	Confident	96 Å²	96	73.1 Å²	73.1	45%	0.449	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-92.7	162.4	177.7	-59.5	-173.2	6.4	0	0	111.5	R406 N413 A415 R419	R406-Q408 PolarHBondContact O-N 3.36Å; Q408-N413 VanDerWaalsContact OE1-CB 3.3Å; Q408-N413 PolarHBondContact OE1-ND2 3.06Å; Q408-A415 WeakPolarHBondContact O-CA 3.44Å; Q408-A415 WeakPolarHBondContact O-CB 3.31Å; Q408-R419 PolarHBondContact O-NH1 3.44Å
409	N	79.4	Confident	84.7	Confident	82 Å²	82	69.7 Å²	69.7	44%	0.439	34%	0.338	S	S	.	.	S	Bend	trans	-99.8	-6.4	177.3	-66.8	-18.2	0	0	0	113.3	R419 T586	N409-R419 PolarHBondContact OD1-NH2 2.74Å; N409-T586 PolarHBondContact O-N 2.9Å; N409-T586 PolarHBondContact O-OG1 2.9Å
410	N	78.1	Confident	84.6	Confident	68 Å²	68	65.1 Å²	65.1	36%	0.364	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-79.7	119.1	177.8	-69.9	-26.7	0	0	0	110.4	L412 N413 A415 T586	N410-L412 VanDerWaalsContact C-N 3.29Å; N410-L412 PolarHBondContact O-N 3.17Å; N410-N413 HydrophobicContact CB-CB 4.12Å; N410-N413 PolarHBondContact O-N 2.85Å; N410-A415 VanDerWaalsContact O-CB 3.28Å; N410-A415 WeakPolarHBondContact O-CB 3.49Å; N410-A415 PolarHBondContact O-N 3.22Å; N410-T586 CarbonylContact C-O 3.38Å; N410-T586 WeakPolarHBondContact CA-O 3.45Å; N410-T586 PolarHBondContact OD1-OG1 3.19Å
411	V	75.3	Confident	84.7	Confident	15 Å²	15	66.1 Å²	66.1	9%	0.091	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-61	-38.8	-178.1	-175.4	0	0	0	0	111.8	N413 G414 F585 T586 M599	V411-N413 PolarHBondContact O-N 3.34Å; V411-G414 PolarHBondContact O-N 2.92Å; V411-G414 VanDerWaalsContact O-N 3.09Å; V411-F585 HydrophobicContact CG2-CB 3.41Å; V411-F585 VanDerWaalsContact CG2-CB 3.41Å; V411-F585 HydrophobicContact CG2-CG 4.27Å; V411-T586 PolarHBondContact N-O 3.43Å; V411-M599 WeakPolarHBondContact CG1-O 3.32Å
412	L	68	Low	84.8	Confident	87 Å²	87	65 Å²	65	46%	0.455	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-61.4	-23.5	176.4	-79.3	140.4	0	0	0	113.7	N410	N410-L412 VanDerWaalsContact C-N 3.29Å; N410-L412 PolarHBondContact O-N 3.17Å
413	N	69.8	Low	84.8	Confident	89 Å²	89	57.7 Å²	57.7	48%	0.476	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-97.3	13.1	179.5	-63.2	-11	0	0	0	112.4	Q408 N410 V411	Q408-N413 VanDerWaalsContact OE1-CB 3.3Å; Q408-N413 PolarHBondContact OE1-ND2 3.06Å; N410-N413 HydrophobicContact CB-CB 4.12Å; N410-N413 PolarHBondContact O-N 2.85Å; V411-N413 PolarHBondContact O-N 3.34Å
414	G	78.3	Confident	85	Confident	19 Å²	19	53.9 Å²	53.9	20%	0.196	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	91	13.7	176.3	0	0	0	0	0	115.8	V411 I416 Q417 D418	V411-G414 PolarHBondContact O-N 2.92Å; V411-G414 VanDerWaalsContact O-N 3.09Å; G414-I416 VanDerWaalsContact C-N 3.29Å; G414-I416 PolarHBondContact O-N 3.35Å; G414-Q417 PolarHBondContact O-N 2.67Å; G414-D418 WeakPolarHBondContact O-CB 3.46Å; G414-D418 VanDerWaalsContact O-CG 3.3Å; G414-D418 PolarHBondContact O-N 2.64Å
415	A	82.8	Confident	85.3	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-47.6	-41.1	-172.9	0	0	0	0	0	116.3	Q408 N410 R419 F585	Q408-A415 WeakPolarHBondContact O-CA 3.44Å; Q408-A415 WeakPolarHBondContact O-CB 3.31Å; N410-A415 VanDerWaalsContact O-CB 3.28Å; N410-A415 WeakPolarHBondContact O-CB 3.49Å; N410-A415 PolarHBondContact O-N 3.22Å; A415-R419 WeakPolarHBondContact O-CG 3.28Å; A415-R419 PolarHBondContact O-NH1 2.93Å; A415-F585 HydrophobicContact CB-CD1 4.26Å
416	I	85.1	Confident	85.6	Confident	19 Å²	19	50.6 Å²	50.6	10%	0.097	26%	0.257	C	S	.	.	H	α-helix	trans	-81.9	-45.9	179.5	-61	175.6	0	0	0	110.1	G414 D418 R419 V420 F580 F585 F602 F608	G414-I416 VanDerWaalsContact C-N 3.29Å; G414-I416 PolarHBondContact O-N 3.35Å; I416-D418 VanDerWaalsContact C-N 3.35Å; I416-D418 PolarHBondContact O-N 2.72Å; I416-R419 PolarHBondContact O-N 3.17Å; I416-V420 HydrophobicContact CG2-CG2 4.15Å; I416-V420 WeakPolarHBondContact O-CB 3.4Å; I416-V420 VanDerWaalsContact O-CG2 3.23Å; I416-V420 WeakPolarHBondContact O-CG2 3.21Å; I416-V420 PolarHBondContact O-N 3.41Å; I416-F580 HydrophobicContact CG1-CE1 4.33Å; I416-F580 HydrophobicContact CG2-CE1 4.03Å; I416-F580 HydrophobicContact CG2-CZ 4.24Å; I416-F585 HydrophobicContact CD1-CD2 4.08Å; I416-F585 HydrophobicContact CD1-CE2 4.14Å; I416-F585 HydrophobicContact CG1-CD2 4.18Å; I416-F585 HydrophobicContact CG1-CE1 4.44Å; I416-F585 HydrophobicContact CG1-CE2 3.97Å; I416-F585 HydrophobicContact CG1-CG 4.5Å; I416-F585 HydrophobicContact CG1-CZ 4.12Å; I416-F602 HydrophobicContact CD1-CB 3.82Å; I416-F608 HydrophobicContact CG2-CD1 4.18Å; I416-F608 HydrophobicContact CG2-CD2 3.96Å; I416-F608 HydrophobicContact CG2-CE1 3.98Å; I416-F608 HydrophobicContact CG2-CE2 3.77Å; I416-F608 HydrophobicContact CG2-CG 4.18Å; I416-F608 HydrophobicContact CG2-CZ 3.8Å
417	Q	87.6	Confident	85.9	Confident	134 Å²	134	42.4 Å²	42.4	63%	0.626	23%	0.227	S	C	*	.	H	α-helix	trans	-60.9	-41.7	-178.4	-176.2	174.9	-15.3	0	0	112.1	G414 V420 G421	G414-Q417 PolarHBondContact O-N 2.67Å; Q417-V420 PolarHBondContact O-N 2.99Å; Q417-G421 PolarHBondContact O-N 3.07Å
418	D	90.3	Very high	86.1	Confident	54 Å²	54	42.5 Å²	42.5	29%	0.289	23%	0.23	S	C	.	.	H	α-helix	trans	-65	-43.7	178.2	-66.5	-20.8	0	0	0	111.4	V404 G414 I416 G421 L422	V404-D418 HydrophobicContact CG1-CB 4.12Å; G414-D418 WeakPolarHBondContact O-CB 3.46Å; G414-D418 VanDerWaalsContact O-CG 3.3Å; G414-D418 PolarHBondContact O-N 2.64Å; I416-D418 VanDerWaalsContact C-N 3.35Å; I416-D418 PolarHBondContact O-N 2.72Å; D418-G421 PolarHBondContact O-N 3.47Å; D418-L422 WeakPolarHBondContact O-CB 3.39Å; D418-L422 VanDerWaalsContact O-CG 3.25Å; D418-L422 WeakPolarHBondContact O-CG 3.2Å; D418-L422 PolarHBondContact O-N 3.41Å
419	R	90.9	Very high	86.5	Confident	7 Å²	7	38.7 Å²	38.7	3%	0.026	21%	0.214	C	C	.	.	H	α-helix	trans	-62.2	-47.6	175.2	-74	179.2	173.5	86.4	-1.5	111.4	V407 Q408 N409 A415 I416 G421 L422 L423 E579 F580	V407-R419 HydrophobicContact CG1-CG 3.59Å; Q408-R419 PolarHBondContact O-NH1 3.44Å; N409-R419 PolarHBondContact OD1-NH2 2.74Å; A415-R419 WeakPolarHBondContact O-CG 3.28Å; A415-R419 PolarHBondContact O-NH1 2.93Å; I416-R419 PolarHBondContact O-N 3.17Å; R419-G421 VanDerWaalsContact C-N 3.34Å; R419-G421 PolarHBondContact O-N 3.22Å; R419-L422 PolarHBondContact O-N 3.29Å; R419-L423 VanDerWaalsContact O-CG 3.3Å; R419-L423 WeakPolarHBondContact O-CG 3.2Å; R419-L423 PolarHBondContact O-N 3.03Å; R419-E579 IonicContact CZ-OE1 3.96Å; R419-E579 IonicContact NE-OE1 2.94Å; R419-E579 PolarHBondContact NE-OE1 3.37Å; R419-F580 HydrophobicContact CB-CE2 4.19Å; R419-F580 HydrophobicContact CB-CZ 3.75Å
420	V	91.1	Very high	87.2	Confident	22 Å²	22	35.1 Å²	35.1	13%	0.133	20%	0.195	C	C	.	.	H	α-helix	trans	-60.9	-45	178.6	172.1	0	0	0	0	110.6	I416 Q417 L423 Y424 F548 F580 F608	I416-V420 HydrophobicContact CG2-CG2 4.15Å; I416-V420 WeakPolarHBondContact O-CB 3.4Å; I416-V420 VanDerWaalsContact O-CG2 3.23Å; I416-V420 WeakPolarHBondContact O-CG2 3.21Å; I416-V420 PolarHBondContact O-N 3.41Å; Q417-V420 PolarHBondContact O-N 2.99Å; V420-L423 PolarHBondContact O-N 3.21Å; V420-Y424 WeakPolarHBondContact O-CB 3.49Å; V420-Y424 PolarHBondContact O-N 3.31Å; V420-F548 HydrophobicContact CG1-CB 3.63Å; V420-F548 HydrophobicContact CG1-CD1 3.96Å; V420-F548 HydrophobicContact CG1-CD2 4.4Å; V420-F548 HydrophobicContact CG1-CG 3.75Å; V420-F580 HydrophobicContact CG2-CZ 4.22Å; V420-F608 HydrophobicContact CG2-CE1 3.6Å; V420-F608 HydrophobicContact CG2-CZ 3.43Å; V420-F608 VanDerWaalsContact CG2-CZ 3.43Å
421	G	92.3	Very high	88	Confident	34 Å²	34	31.9 Å²	31.9	35%	0.351	18%	0.178	S	C	.	.	H	α-helix	trans	-61.1	-43.1	175.7	0	0	0	0	0	113	Q417 D418 R419 Y424 M425	Q417-G421 PolarHBondContact O-N 3.07Å; D418-G421 PolarHBondContact O-N 3.47Å; R419-G421 VanDerWaalsContact C-N 3.34Å; R419-G421 PolarHBondContact O-N 3.22Å; G421-Y424 PolarHBondContact O-N 2.86Å; G421-M425 WeakPolarHBondContact O-CB 3.04Å; G421-M425 VanDerWaalsContact O-CG 3.28Å; G421-M425 WeakPolarHBondContact O-CG 3.38Å; G421-M425 PolarHBondContact O-N 3.44Å
422	L	93.8	Very high	88.8	Confident	5 Å²	5	35.4 Å²	35.4	3%	0.026	19%	0.19	C	C	.	.	H	α-helix	trans	-61.2	-50.7	174.9	-77.4	168.5	0	0	0	111.8	L400 V404 V407 D418 R419 Y424 M425 F426 L490	L400-L422 HydrophobicContact CB-CD2 4.31Å; V404-L422 HydrophobicContact CB-CD2 4.09Å; V404-L422 HydrophobicContact CB-CG 4.42Å; V404-L422 HydrophobicContact CG1-CD1 3.77Å; V404-L422 HydrophobicContact CG1-CD2 4.19Å; V404-L422 HydrophobicContact CG1-CG 4Å; V404-L422 HydrophobicContact CG2-CD2 3.85Å; V404-L422 HydrophobicContact CG2-CG 4.2Å; V407-L422 HydrophobicContact CG2-CD1 3.45Å; V407-L422 VanDerWaalsContact CG2-CD1 3.45Å; D418-L422 WeakPolarHBondContact O-CB 3.39Å; D418-L422 VanDerWaalsContact O-CG 3.25Å; D418-L422 WeakPolarHBondContact O-CG 3.2Å; D418-L422 PolarHBondContact O-N 3.41Å; R419-L422 PolarHBondContact O-N 3.29Å; L422-Y424 VanDerWaalsContact C-N 3.35Å; L422-Y424 PolarHBondContact O-N 3.32Å; L422-M425 PolarHBondContact O-N 2.76Å; L422-F426 HydrophobicContact CB-CE2 4.2Å; L422-F426 HydrophobicContact CD2-CE2 4.48Å; L422-F426 HydrophobicContact CD2-CZ 4.24Å; L422-F426 WeakPolarHBondContact O-CD2 3.29Å; L422-F426 VanDerWaalsContact O-CG 3.27Å; L422-F426 WeakPolarHBondContact O-CG 3.33Å; L422-F426 PolarHBondContact O-N 2.91Å; L422-L490 HydrophobicContact CD1-CD1 4.25Å; L422-L490 HydrophobicContact CD1-CD2 4.04Å; L422-L490 HydrophobicContact CD2-CD1 4.14Å; L422-L490 HydrophobicContact CD2-CD2 4.08Å
423	L	93.6	Very high	90	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-62	-43.8	179.3	-66	-175.9	0	0	0	111.2	R419 V420 M425 F426 V427 F502 F548 L575 F580	R419-L423 VanDerWaalsContact O-CG 3.3Å; R419-L423 WeakPolarHBondContact O-CG 3.2Å; R419-L423 PolarHBondContact O-N 3.03Å; V420-L423 PolarHBondContact O-N 3.21Å; L423-M425 VanDerWaalsContact C-N 3.35Å; L423-M425 PolarHBondContact O-N 3.1Å; L423-F426 PolarHBondContact O-N 2.94Å; L423-V427 WeakPolarHBondContact O-CG2 3.42Å; L423-V427 PolarHBondContact O-N 3.13Å; L423-F502 HydrophobicContact CD2-CE2 4.35Å; L423-F548 HydrophobicContact CB-CE2 3.87Å; L423-F548 HydrophobicContact CB-CZ 4.07Å; L423-F548 HydrophobicContact CD1-CZ 4.34Å; L423-L575 HydrophobicContact CD1-CB 4.1Å; L423-L575 HydrophobicContact CD2-CB 3.92Å; L423-L575 HydrophobicContact CD2-CD1 4.32Å; L423-L575 HydrophobicContact CD2-CG 4.5Å; L423-L575 HydrophobicContact CG-CB 4.48Å; L423-F580 HydrophobicContact CD1-CE2 4.32Å
424	Y	93.6	Very high	91.1	Very high	56 Å²	56	27.4 Å²	27.4	22%	0.22	15%	0.148	C	C	.	.	H	α-helix	trans	-55.5	-49.1	174.5	-179.4	-88.8	0	0	0	111.6	V420 G421 L422 G428 V542 F548 V549	V420-Y424 WeakPolarHBondContact O-CB 3.49Å; V420-Y424 PolarHBondContact O-N 3.31Å; G421-Y424 PolarHBondContact O-N 2.86Å; L422-Y424 VanDerWaalsContact C-N 3.35Å; L422-Y424 PolarHBondContact O-N 3.32Å; Y424-G428 PolarHBondContact O-N 3.22Å; Y424-V542 HydrophobicContact CD1-CG1 4.37Å; Y424-V542 HydrophobicContact CD2-CG1 3.46Å; Y424-V542 VanDerWaalsContact CD2-CG1 3.46Å; Y424-V542 HydrophobicContact CE1-CG1 4.1Å; Y424-V542 HydrophobicContact CE2-CB 4.5Å; Y424-V542 HydrophobicContact CE2-CG1 3.16Å; Y424-V542 HydrophobicContact CG-CG1 4.06Å; Y424-V542 VanDerWaalsContact CZ-CG1 3.49Å; Y424-F548 HydrophobicContact CD2-CB 4.24Å; Y424-F548 HydrophobicContact CD2-CD2 4.16Å; Y424-V549 HydrophobicContact CD2-CG2 3.99Å; Y424-V549 HydrophobicContact CE2-CG2 3.36Å
425	M	94	Very high	91.8	Very high	90 Å²	90	26.5 Å²	26.5	44%	0.443	14%	0.139	S	C	.	.	H	α-helix	trans	-66.2	-38.3	179.4	-73.6	-65.3	-149.4	0	0	112.3	L400 G421 L422 L423 G428 S429	L400-M425 HydrophobicContact CD1-CB 3.76Å; L400-M425 HydrophobicContact CD2-CB 3.87Å; L400-M425 HydrophobicContact CD2-CG 3.89Å; L400-M425 HydrophobicContact CG-CB 4.49Å; G421-M425 WeakPolarHBondContact O-CB 3.04Å; G421-M425 VanDerWaalsContact O-CG 3.28Å; G421-M425 WeakPolarHBondContact O-CG 3.38Å; G421-M425 PolarHBondContact O-N 3.44Å; L422-M425 PolarHBondContact O-N 2.76Å; L423-M425 VanDerWaalsContact C-N 3.35Å; L423-M425 PolarHBondContact O-N 3.1Å; M425-G428 PolarHBondContact O-N 2.84Å; M425-S429 WeakPolarHBondContact O-CB 2.92Å; M425-S429 PolarHBondContact O-N 3.39Å; M425-S429 PolarHBondContact O-OG 3.41Å
426	F	94.3	Very high	92.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-66	-46.4	176.9	-66.3	-36.1	0	0	0	112.4	L400 L422 L423 G428 S429 T430 F482 L490 F502 L506	L400-F426 HydrophobicContact CD1-CD1 3.67Å; L400-F426 HydrophobicContact CD1-CE1 3.42Å; L400-F426 VanDerWaalsContact CD1-CE1 3.42Å; L400-F426 HydrophobicContact CD1-CZ 4.32Å; L422-F426 HydrophobicContact CB-CE2 4.2Å; L422-F426 HydrophobicContact CD2-CE2 4.48Å; L422-F426 HydrophobicContact CD2-CZ 4.24Å; L422-F426 WeakPolarHBondContact O-CD2 3.29Å; L422-F426 VanDerWaalsContact O-CG 3.27Å; L422-F426 WeakPolarHBondContact O-CG 3.33Å; L422-F426 PolarHBondContact O-N 2.91Å; L423-F426 PolarHBondContact O-N 2.94Å; F426-G428 VanDerWaalsContact C-N 3.26Å; F426-G428 PolarHBondContact O-N 2.9Å; F426-S429 PolarHBondContact O-N 2.85Å; F426-T430 WeakPolarHBondContact O-CB 3.25Å; F426-T430 VanDerWaalsContact O-CG2 3.23Å; F426-T430 WeakPolarHBondContact O-CG2 2.84Å; F426-T430 PolarHBondContact O-N 3.41Å; F426-T430 VanDerWaalsContact O-N 3.07Å; F426-T430 PolarHBondContact O-OG1 3.13Å; F426-F482 HydrophobicContact CD1-CE2 4.2Å; F426-F482 AromaticContact CD1-CZ 3.57Å; F426-F482 HydrophobicContact CD1-CZ 3.57Å; F426-F482 AromaticContact CE1-CE2 3.83Å; F426-F482 HydrophobicContact CE1-CE2 3.83Å; F426-F482 AromaticContact CE1-CZ 3.48Å; F426-F482 HydrophobicContact CE1-CZ 3.48Å; F426-F482 VanDerWaalsContact CE1-CZ 3.48Å; F426-F482 HydrophobicContact CG-CZ 4.26Å; F426-F482 HydrophobicContact CZ-CZ 4.11Å; F426-L490 HydrophobicContact CE2-CD1 4.07Å; F426-L490 HydrophobicContact CZ-CD1 3.71Å; F426-F502 HydrophobicContact CD2-CE2 4.15Å; F426-F502 AromaticContact CD2-CZ 3.95Å; F426-F502 HydrophobicContact CD2-CZ 3.95Å; F426-F502 HydrophobicContact CE2-CE2 4.34Å; F426-F502 AromaticContact CE2-CZ 3.93Å; F426-F502 HydrophobicContact CE2-CZ 3.93Å; F426-L506 HydrophobicContact CB-CD1 4.15Å; F426-L506 HydrophobicContact CB-CD2 3.89Å; F426-L506 HydrophobicContact CG-CD1 4.37Å
427	V	94.4	Very high	92.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-64.5	-33	178.4	-178.7	0	0	0	0	111.4	L423 P431 V542 Q568 C571 L575	L423-V427 WeakPolarHBondContact O-CG2 3.42Å; L423-V427 PolarHBondContact O-N 3.13Å; V427-P431 WeakPolarHBondContact O-CD 3.41Å; V427-P431 WeakPolarHBondContact O-CG 3.17Å; V427-V542 HydrophobicContact CB-CG2 4.27Å; V427-V542 HydrophobicContact CG1-CG2 3.85Å; V427-Q568 HydrophobicContact CG1-CB 4.04Å; V427-Q568 HydrophobicContact CG1-CG 4.01Å; V427-C571 HydrophobicContact CG1-CB 4.25Å; V427-L575 HydrophobicContact CG2-CD1 3.42Å; V427-L575 VanDerWaalsContact CG2-CD1 3.42Å
428	G	91.4	Very high	92.9	Very high	14 Å²	14	22 Å²	22	14%	0.144	12%	0.119	C	C	.	.	H	α-helix	trans	-80.3	-36.7	178.7	0	0	0	0	0	114.9	Y424 M425 F426 P431 V542	Y424-G428 PolarHBondContact O-N 3.22Å; M425-G428 PolarHBondContact O-N 2.84Å; F426-G428 VanDerWaalsContact C-N 3.26Å; F426-G428 PolarHBondContact O-N 2.9Å; G428-P431 WeakPolarHBondContact O-CG 3.22Å; G428-V542 VanDerWaalsContact CA-CG2 3.48Å
429	S	92.1	Very high	93	Very high	16 Å²	16	20 Å²	20	11%	0.112	11%	0.109	C	C	.	.	H	α-helix	trans	-86.6	-33	-174.9	62	0	0	0	0	114	M396 M425 F426 Y432 T433	M396-S429 VanDerWaalsContact CE-CB 3.44Å; M425-S429 WeakPolarHBondContact O-CB 2.92Å; M425-S429 PolarHBondContact O-N 3.39Å; M425-S429 PolarHBondContact O-OG 3.41Å; F426-S429 PolarHBondContact O-N 2.85Å; S429-Y432 WeakPolarHBondContact O-CA 3.37Å; S429-Y432 VanDerWaalsContact O-CB 3.27Å; S429-Y432 WeakPolarHBondContact O-CB 3.24Å; S429-Y432 PolarHBondContact O-N 3.23Å; S429-Y432 VanDerWaalsContact O-N 3.08Å; S429-T433 PolarHBondContact O-N 3.1Å
430	T	93.8	Very high	92.9	Very high	6 Å²	6	25.7 Å²	25.7	4%	0.037	14%	0.14	C	C	.	.	H	α-helix	trans	-58.8	-42.8	178.1	48.2	0	0	0	0	114.8	F426 Y432 T433 G434 L506 P509 H510	F426-T430 WeakPolarHBondContact O-CB 3.25Å; F426-T430 VanDerWaalsContact O-CG2 3.23Å; F426-T430 WeakPolarHBondContact O-CG2 2.84Å; F426-T430 PolarHBondContact O-N 3.41Å; F426-T430 VanDerWaalsContact O-N 3.07Å; F426-T430 PolarHBondContact O-OG1 3.13Å; T430-Y432 VanDerWaalsContact C-N 3.29Å; T430-Y432 PolarHBondContact O-N 2.82Å; T430-T433 PolarHBondContact O-N 2.89Å; T430-T433 PolarHBondContact O-OG1 3.22Å; T430-G434 PolarHBondContact O-N 2.9Å; T430-L506 HydrophobicContact CG2-CB 4.34Å; T430-L506 HydrophobicContact CG2-CD2 4.29Å; T430-P509 WeakPolarHBondContact OG1-CB 3.2Å; T430-H510 WeakPolarHBondContact O-CA 2.9Å; T430-H510 PolarHBondContact O-ND1 2.84Å
431	P	95	Very high	92.8	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-67.8	-30.9	172.6	26.7	-34.8	0	0	0	112.4	V427 G428 G434 M435 P509 G513 F567	V427-P431 WeakPolarHBondContact O-CD 3.41Å; V427-P431 WeakPolarHBondContact O-CG 3.17Å; G428-P431 WeakPolarHBondContact O-CG 3.22Å; P431-G434 PolarHBondContact O-N 3.5Å; P431-M435 PolarHBondContact O-N 2.79Å; P431-P509 VanDerWaalsContact CA-O 3.28Å; P431-P509 WeakPolarHBondContact CA-O 3.28Å; P431-P509 WeakPolarHBondContact CB-O 3.42Å; P431-G513 WeakPolarHBondContact O-CA 3.06Å; P431-F567 HydrophobicContact CB-CE2 4.34Å; P431-F567 HydrophobicContact CB-CZ 4.01Å; P431-F567 HydrophobicContact CG-CE2 4.29Å; P431-F567 HydrophobicContact CG-CZ 4.19Å
432	Y	92.7	Very high	92.9	Very high	89 Å²	89	24.2 Å²	24.2	35%	0.349	12%	0.123	S	C	.	.	H	α-helix	trans	-64.4	-40.7	176.6	-176.3	-92.9	0	0	0	111.7	S429 T430 G434 M435 L436 A535	S429-Y432 WeakPolarHBondContact O-CA 3.37Å; S429-Y432 VanDerWaalsContact O-CB 3.27Å; S429-Y432 WeakPolarHBondContact O-CB 3.24Å; S429-Y432 PolarHBondContact O-N 3.23Å; S429-Y432 VanDerWaalsContact O-N 3.08Å; T430-Y432 VanDerWaalsContact C-N 3.29Å; T430-Y432 PolarHBondContact O-N 2.82Å; Y432-G434 VanDerWaalsContact C-N 3.34Å; Y432-G434 PolarHBondContact O-N 3.35Å; Y432-M435 HydrophobicContact CD1-CE 4.43Å; Y432-M435 HydrophobicContact CD2-CE 3.31Å; Y432-M435 HydrophobicContact CD2-SD 4.42Å; Y432-M435 HydrophobicContact CE1-CE 4.4Å; Y432-M435 HydrophobicContact CE2-CE 3.26Å; Y432-M435 HydrophobicContact CG-CE 3.92Å; Y432-M435 WeakPolarHBondContact O-CB 3.27Å; Y432-M435 PolarHBondContact O-N 3.02Å; Y432-L436 HydrophobicContact CD1-CD1 3.91Å; Y432-L436 HydrophobicContact CD1-CG 4.17Å; Y432-L436 HydrophobicContact CE1-CD1 3.5Å; Y432-L436 VanDerWaalsContact CE1-CD1 3.5Å; Y432-L436 HydrophobicContact CE1-CD2 4.24Å; Y432-L436 HydrophobicContact CE1-CG 3.84Å; Y432-L436 WeakPolarHBondContact O-CG 3.5Å; Y432-L436 PolarHBondContact O-N 3.12Å; Y432-A535 HydrophobicContact CD2-CB 4.01Å; Y432-A535 HydrophobicContact CE2-CB 3.86Å
433	T	92.6	Very high	92.8	Very high	8 Å²	8	25.1 Å²	25.1	5%	0.049	13%	0.129	C	C	.	.	H	α-helix	trans	-67.2	-35.1	174.6	63.4	0	0	0	0	112.3	Q392 N393 S429 T430 M435 L436 N437 H510	Q392-T433 HydrophobicContact CG-CG2 4.38Å; Q392-T433 PolarHBondContact NE2-O 2.83Å; N393-T433 WeakPolarHBondContact OD1-CB 3.38Å; N393-T433 WeakPolarHBondContact OD1-CG2 3.35Å; N393-T433 PolarHBondContact OD1-OG1 3.3Å; S429-T433 PolarHBondContact O-N 3.1Å; T430-T433 PolarHBondContact O-N 2.89Å; T430-T433 PolarHBondContact O-OG1 3.22Å; T433-M435 VanDerWaalsContact C-N 3.35Å; T433-L436 PolarHBondContact O-N 3.12Å; T433-N437 PolarHBondContact O-N 2.77Å; T433-N437 VanDerWaalsContact O-N 3.13Å; T433-H510 PolarHBondContact OG1-CE1 3.46Å; T433-H510 PolarHBondContact OG1-ND1 3.41Å
434	G	93.4	Very high	92.7	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.4	-41.7	171.4	0	0	0	0	0	112.7	T430 P431 Y432 N437 A438 H510 E514	T430-G434 PolarHBondContact O-N 2.9Å; P431-G434 PolarHBondContact O-N 3.5Å; Y432-G434 VanDerWaalsContact C-N 3.34Å; Y432-G434 PolarHBondContact O-N 3.35Å; G434-N437 WeakPolarHBondContact O-CB 3.5Å; G434-N437 PolarHBondContact O-N 2.96Å; G434-A438 PolarHBondContact O-N 3.23Å; G434-H510 WeakPolarHBondContact CA-O 3.37Å; G434-H510 PolarHBondContact N-ND1 2.9Å; G434-E514 WeakPolarHBondContact O-CA 3.48Å; G434-E514 WeakPolarHBondContact O-CB 3.4Å
435	M	94.1	Very high	92.7	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.7	-48.7	173.8	173.5	-157.2	68.9	0	0	112.2	P431 Y432 T433 N437 A438 V439 T517 N531 V534 A535	P431-M435 PolarHBondContact O-N 2.79Å; Y432-M435 HydrophobicContact CD1-CE 4.43Å; Y432-M435 HydrophobicContact CD2-CE 3.31Å; Y432-M435 HydrophobicContact CD2-SD 4.42Å; Y432-M435 HydrophobicContact CE1-CE 4.4Å; Y432-M435 HydrophobicContact CE2-CE 3.26Å; Y432-M435 HydrophobicContact CG-CE 3.92Å; Y432-M435 WeakPolarHBondContact O-CB 3.27Å; Y432-M435 PolarHBondContact O-N 3.02Å; T433-M435 VanDerWaalsContact C-N 3.35Å; M435-N437 PolarHBondContact O-N 3.27Å; M435-A438 PolarHBondContact O-N 3.41Å; M435-A438 VanDerWaalsContact O-N 3.13Å; M435-V439 HydrophobicContact CG-CG2 4.04Å; M435-V439 WeakPolarHBondContact O-CG2 3.38Å; M435-V439 PolarHBondContact O-N 3.36Å; M435-T517 WeakPolarHBondContact CA-OG1 3.3Å; M435-T517 WeakPolarHBondContact CB-OG1 3.17Å; M435-T517 HydrophobicContact CG-CG2 4.24Å; M435-T517 WeakPolarHBondContact CG-OG1 3.24Å; M435-N531 WeakPolarHBondContact CE-OD1 3.28Å; M435-N531 PolarHBondContact SD-OD1 3.47Å; M435-V534 HydrophobicContact CB-CB 4.49Å; M435-V534 HydrophobicContact CB-CG1 3.74Å; M435-V534 HydrophobicContact CG-CB 3.82Å; M435-V534 HydrophobicContact CG-CG1 3.63Å; M435-V534 HydrophobicContact SD-CB 3.56Å; M435-V534 VanDerWaalsContact SD-CB 3.56Å; M435-V534 HydrophobicContact SD-CG1 3.65Å; M435-A535 HydrophobicContact CE-CB 4.41Å; M435-A535 HydrophobicContact SD-CB 4.17Å
436	L	92.1	Very high	92.6	Very high	49 Å²	49	23 Å²	23	26%	0.257	12%	0.124	S	C	.	.	H	α-helix	trans	-56.5	-36.7	178.1	-74.3	-179.7	0	0	0	112.2	Y432 T433 N440	Y432-L436 HydrophobicContact CD1-CD1 3.91Å; Y432-L436 HydrophobicContact CD1-CG 4.17Å; Y432-L436 HydrophobicContact CE1-CD1 3.5Å; Y432-L436 VanDerWaalsContact CE1-CD1 3.5Å; Y432-L436 HydrophobicContact CE1-CD2 4.24Å; Y432-L436 HydrophobicContact CE1-CG 3.84Å; Y432-L436 WeakPolarHBondContact O-CG 3.5Å; Y432-L436 PolarHBondContact O-N 3.12Å; T433-L436 PolarHBondContact O-N 3.12Å; L436-N440 WeakPolarHBondContact O-CB 3.34Å; L436-N440 PolarHBondContact O-N 3.32Å; L436-N440 PolarHBondContact O-ND2 3.33Å
437	N	91.8	Very high	92.4	Very high	10 Å²	10	25 Å²	25	5%	0.053	14%	0.14	C	C	.	.	H	α-helix	trans	-62.2	-53.1	174	-78.9	-23.4	0	0	0	112.5	R389 Q392 T433 G434 M435 L441	R389-N437 PolarHBondContact NH2-ND2 3.42Å; Q392-N437 PolarHBondContact NE2-ND2 3.43Å; Q392-N437 PolarHBondContact NE2-OD1 3.37Å; Q392-N437 PolarHBondContact OE1-OD1 2.96Å; T433-N437 PolarHBondContact O-N 2.77Å; T433-N437 VanDerWaalsContact O-N 3.13Å; G434-N437 WeakPolarHBondContact O-CB 3.5Å; G434-N437 PolarHBondContact O-N 2.96Å; M435-N437 PolarHBondContact O-N 3.27Å; N437-L441 WeakPolarHBondContact O-CB 3.34Å; N437-L441 PolarHBondContact O-N 3.47Å
438	A	92.9	Very high	92.4	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-67.5	-44.3	-176.9	0	0	0	0	0	112.9	G434 M435 N440 L441 F442 Y467 E514 T517 L518	G434-A438 PolarHBondContact O-N 3.23Å; M435-A438 PolarHBondContact O-N 3.41Å; M435-A438 VanDerWaalsContact O-N 3.13Å; A438-N440 VanDerWaalsContact C-N 3.28Å; A438-N440 PolarHBondContact O-N 3.03Å; A438-L441 PolarHBondContact O-N 3.35Å; A438-F442 WeakPolarHBondContact O-CB 3.12Å; A438-F442 PolarHBondContact O-N 2.95Å; A438-Y467 WeakPolarHBondContact CA-OH 3.37Å; A438-E514 HydrophobicContact CB-CG 3.89Å; A438-T517 HydrophobicContact CB-CG2 3.58Å; A438-L518 HydrophobicContact CB-CD2 4.01Å; A438-L518 HydrophobicContact CB-CG 4.34Å
439	V	92.9	Very high	92.4	Very high	12 Å²	12	24.4 Å²	24.4	7%	0.073	13%	0.134	C	C	.	.	H	α-helix	trans	-60.8	-37.4	-178.1	171.5	0	0	0	0	111.7	M435 P443 T517 P527 N531	M435-V439 HydrophobicContact CG-CG2 4.04Å; M435-V439 WeakPolarHBondContact O-CG2 3.38Å; M435-V439 PolarHBondContact O-N 3.36Å; V439-P443 WeakPolarHBondContact O-CD 3.42Å; V439-P443 WeakPolarHBondContact O-CG 3.15Å; V439-T517 HydrophobicContact CG2-CG2 3.43Å; V439-T517 VanDerWaalsContact CG2-CG2 3.43Å; V439-P527 HydrophobicContact CG1-CB 4.04Å; V439-N531 HydrophobicContact CG1-CB 4.34Å; V439-N531 HydrophobicContact CG2-CB 4.24Å
440	N	88.6	Confident	92.2	Very high	126 Å²	126	24.8 Å²	24.8	67%	0.674	14%	0.135	S	C	*	.	H	α-helix	trans	-81	-33.9	-177.3	-72.8	-49.2	0	0	0	113.2	L436 A438	L436-N440 WeakPolarHBondContact O-CB 3.34Å; L436-N440 PolarHBondContact O-N 3.32Å; L436-N440 PolarHBondContact O-ND2 3.33Å; A438-N440 VanDerWaalsContact C-N 3.28Å; A438-N440 PolarHBondContact O-N 3.03Å
441	L	90.1	Very high	91.9	Very high	24 Å²	24	25.5 Å²	25.5	13%	0.126	14%	0.138	C	C	.	.	H	α-helix	trans	-95.5	-43.4	-172.5	-173.7	62.4	0	0	0	113	L379 N437 A438 L445 Y467	L379-L441 HydrophobicContact CD1-CD1 4.04Å; L379-L441 HydrophobicContact CD1-CD2 3.59Å; L379-L441 HydrophobicContact CD1-CG 4.5Å; L379-L441 HydrophobicContact CD2-CD2 4.15Å; L379-L441 HydrophobicContact CG-CD2 4.39Å; N437-L441 WeakPolarHBondContact O-CB 3.34Å; N437-L441 PolarHBondContact O-N 3.47Å; A438-L441 PolarHBondContact O-N 3.35Å; L441-L445 WeakPolarHBondContact O-CD1 2.87Å; L441-Y467 HydrophobicContact CB-CE2 4.42Å; L441-Y467 HydrophobicContact CD2-CE2 3.83Å; L441-Y467 HydrophobicContact CG-CE2 4.15Å
442	F	93.1	Very high	91.7	Very high	1 Å²	1	26 Å²	26	0%	0.004	14%	0.14	C	C	.	.	H	α-helix	trans	-71.2	-31.8	-168	-170	-101.4	0	0	0	115.6	A438 V444 L445 R446 L464 Y467 L518 L521 F642	A438-F442 WeakPolarHBondContact O-CB 3.12Å; A438-F442 PolarHBondContact O-N 2.95Å; F442-V444 VanDerWaalsContact C-N 3.28Å; F442-V444 PolarHBondContact O-N 2.93Å; F442-L445 PolarHBondContact O-N 3.37Å; F442-L445 VanDerWaalsContact O-N 3.12Å; F442-R446 HydrophobicContact CD1-CB 4.02Å; F442-R446 HydrophobicContact CE1-CB 3.71Å; F442-R446 HydrophobicContact CE1-CG 3.98Å; F442-R446 HydrophobicContact CZ-CB 4.31Å; F442-R446 WeakPolarHBondContact O-CB 3.44Å; F442-R446 PolarHBondContact O-N 3.16Å; F442-L464 HydrophobicContact CE2-CD1 4.26Å; F442-L464 HydrophobicContact CZ-CD1 4.05Å; F442-Y467 HydrophobicContact CB-CE2 4.19Å; F442-Y467 HydrophobicContact CD2-CD1 4.41Å; F442-Y467 AromaticContact CD2-CD2 3.58Å; F442-Y467 HydrophobicContact CD2-CD2 3.58Å; F442-Y467 HydrophobicContact CD2-CE2 4.03Å; F442-Y467 AromaticContact CD2-CG 3.78Å; F442-Y467 HydrophobicContact CD2-CG 3.78Å; F442-Y467 HydrophobicContact CE2-CD2 4.32Å; F442-Y467 HydrophobicContact CE2-CG 4.16Å; F442-L518 HydrophobicContact CB-CD2 3.75Å; F442-L518 HydrophobicContact CD1-CD2 3.78Å; F442-L518 HydrophobicContact CD2-CD2 3.44Å; F442-L518 VanDerWaalsContact CD2-CD2 3.44Å; F442-L518 HydrophobicContact CE1-CD2 4.24Å; F442-L518 HydrophobicContact CE2-CD2 3.93Å; F442-L518 HydrophobicContact CG-CD2 3.35Å; F442-L518 HydrophobicContact CZ-CD2 4.3Å; F442-L521 HydrophobicContact CB-CD1 4.08Å; F442-L521 HydrophobicContact CD1-CB 4.08Å; F442-L521 HydrophobicContact CD1-CD1 3.86Å; F442-L521 HydrophobicContact CE1-CB 4.39Å; F442-L521 HydrophobicContact CG-CD1 4.4Å; F442-F642 AromaticContact CE1-CE1 3.91Å; F442-F642 HydrophobicContact CE1-CE1 3.91Å; F442-F642 AromaticContact CE1-CZ 3.48Å; F442-F642 HydrophobicContact CE1-CZ 3.48Å; F442-F642 VanDerWaalsContact CE1-CZ 3.48Å; F442-F642 AromaticContact CZ-CE1 3.69Å; F442-F642 HydrophobicContact CZ-CE1 3.69Å; F442-F642 AromaticContact CZ-CZ 3.52Å; F442-F642 HydrophobicContact CZ-CZ 3.52Å
443	P	92.8	Very high	91.4	Very high	25 Å²	25	22.6 Å²	22.6	16%	0.162	13%	0.129	C	C	.	.	H	α-helix	trans	-56.8	-37.4	-177.9	-29.4	36.7	0	0	0	114.6	V439 R446 A447 L521 P527	V439-P443 WeakPolarHBondContact O-CD 3.42Å; V439-P443 WeakPolarHBondContact O-CG 3.15Å; P443-R446 PolarHBondContact O-N 3.46Å; P443-A447 WeakPolarHBondContact O-CB 3.46Å; P443-A447 PolarHBondContact O-N 2.86Å; P443-L521 HydrophobicContact CG-CD2 4.47Å; P443-P527 HydrophobicContact CB-CG 4.02Å; P443-P527 HydrophobicContact CG-CB 4.03Å; P443-P527 HydrophobicContact CG-CG 3.69Å
444	V	90.9	Very high	91	Very high	76 Å²	76	25.2 Å²	25.2	46%	0.461	14%	0.141	S	C	.	.	H	α-helix	trans	-66.4	-47.6	177	179	0	0	0	0	110.4	L139 F442 R446 A447 V448	L139-V444 HydrophobicContact CD2-CG1 4.43Å; F442-V444 VanDerWaalsContact C-N 3.28Å; F442-V444 PolarHBondContact O-N 2.93Å; V444-R446 VanDerWaalsContact C-N 3.28Å; V444-R446 PolarHBondContact O-N 3.27Å; V444-A447 PolarHBondContact O-N 3.37Å; V444-V448 WeakPolarHBondContact O-CG2 3.43Å; V444-V448 PolarHBondContact O-N 2.93Å
445	L	93.4	Very high	90.4	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-63.2	-37	177.6	-80	72	0	0	0	111.7	V375 L441 F442 S449 M463 Y467	V375-L445 HydrophobicContact CB-CD2 4.4Å; V375-L445 HydrophobicContact CG1-CD2 3.56Å; V375-L445 HydrophobicContact CG2-CD2 3.88Å; L441-L445 WeakPolarHBondContact O-CD1 2.87Å; F442-L445 PolarHBondContact O-N 3.37Å; F442-L445 VanDerWaalsContact O-N 3.12Å; L445-S449 WeakPolarHBondContact O-CB 3.32Å; L445-S449 PolarHBondContact O-N 3.35Å; L445-M463 HydrophobicContact CB-CG 4.41Å; L445-M463 HydrophobicContact CB-SD 4.28Å; L445-M463 HydrophobicContact CD2-SD 4.07Å; L445-M463 HydrophobicContact CG-SD 4.4Å; L445-Y467 HydrophobicContact CD2-CD2 4.05Å
446	R	92.7	Very high	89.8	Confident	26 Å²	26	27.3 Å²	27.3	10%	0.098	16%	0.161	C	C	.	.	H	α-helix	trans	-64.2	-46.3	176.4	-173.2	-171.2	71.1	163.5	-2.7	111.4	F442 P443 V444 S449 D450 L521 I524 Q525 F642	F442-R446 HydrophobicContact CD1-CB 4.02Å; F442-R446 HydrophobicContact CE1-CB 3.71Å; F442-R446 HydrophobicContact CE1-CG 3.98Å; F442-R446 HydrophobicContact CZ-CB 4.31Å; F442-R446 WeakPolarHBondContact O-CB 3.44Å; F442-R446 PolarHBondContact O-N 3.16Å; P443-R446 PolarHBondContact O-N 3.46Å; V444-R446 VanDerWaalsContact C-N 3.28Å; V444-R446 PolarHBondContact O-N 3.27Å; R446-S449 CarbonylContact O-C 3.54Å; R446-S449 WeakPolarHBondContact O-CB 3.44Å; R446-S449 PolarHBondContact O-N 2.9Å; R446-D450 PolarHBondContact O-N 3.26Å; R446-L521 WeakPolarHBondContact CD-O 3.39Å; R446-L521 PolarHBondContact NH1-O 3.4Å; R446-I524 PolarHBondContact NH1-O 2.98Å; R446-I524 VanDerWaalsContact NH1-O 3.12Å; R446-Q525 PolarHBondContact NH1-O 2.94Å; R446-Q525 PolarHBondContact NH2-O 3.27Å; R446-F642 HydrophobicContact CG-CE1 4.33Å
447	A	90.1	Very high	89.5	Confident	40 Å²	40	25.5 Å²	25.5	33%	0.331	15%	0.152	S	C	.	.	H	α-helix	trans	-63.3	-46.2	178.2	0	0	0	0	0	111.6	P443 V444 S449 D450 Q451	P443-A447 WeakPolarHBondContact O-CB 3.46Å; P443-A447 PolarHBondContact O-N 2.86Å; V444-A447 PolarHBondContact O-N 3.37Å; A447-S449 VanDerWaalsContact C-N 3.29Å; A447-S449 PolarHBondContact O-N 3.32Å; A447-D450 PolarHBondContact O-N 3.06Å; A447-D450 VanDerWaalsContact O-N 3.12Å; A447-Q451 PolarHBondContact O-N 3.37Å; A447-Q451 VanDerWaalsContact O-N 3.09Å
448	V	92.8	Very high	89.4	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.006	15%	0.15	C	C	.	.	H	α-helix	trans	-59.9	-41.1	173.8	173	0	0	0	0	110.9	L139 V444 D450 Q451 E452	L139-V448 HydrophobicContact CD2-CG2 4.06Å; V444-V448 WeakPolarHBondContact O-CG2 3.43Å; V444-V448 PolarHBondContact O-N 2.93Å; V448-D450 PolarHBondContact O-N 3.43Å; V448-Q451 PolarHBondContact O-N 3.38Å; V448-E452 HydrophobicContact CG1-CG 4.08Å; V448-E452 WeakPolarHBondContact CG1-OE1 3.42Å; V448-E452 WeakPolarHBondContact O-CB 3.47Å; V448-E452 WeakPolarHBondContact O-CG 3.4Å; V448-E452 PolarHBondContact O-N 2.96Å
449	S	92.4	Very high	89.3	Confident	2 Å²	2	30.1 Å²	30.1	1%	0.014	17%	0.173	C	C	.	.	H	α-helix	trans	-65.9	-34.4	175.1	-176.3	0	0	0	0	113.6	L445 R446 A447 Q451 S453 Y458	L445-S449 WeakPolarHBondContact O-CB 3.32Å; L445-S449 PolarHBondContact O-N 3.35Å; R446-S449 CarbonylContact O-C 3.54Å; R446-S449 WeakPolarHBondContact O-CB 3.44Å; R446-S449 PolarHBondContact O-N 2.9Å; A447-S449 VanDerWaalsContact C-N 3.29Å; A447-S449 PolarHBondContact O-N 3.32Å; S449-Q451 VanDerWaalsContact C-N 3.34Å; S449-S453 WeakPolarHBondContact O-CB 3.32Å; S449-S453 PolarHBondContact O-N 3.24Å; S449-S453 VanDerWaalsContact O-N 3.16Å; S449-Y458 WeakPolarHBondContact CA-OH 3.48Å; S449-Y458 WeakPolarHBondContact OG-CE2 3.37Å
450	D	88.9	Confident	89.2	Confident	24 Å²	24	29.8 Å²	29.8	13%	0.128	17%	0.17	C	C	.	.	H	α-helix	trans	-65.5	-41.7	176.2	-75.4	-40.8	0	0	0	110.1	R446 A447 V448 Q454 K460 R645 I649	R446-D450 PolarHBondContact O-N 3.26Å; A447-D450 PolarHBondContact O-N 3.06Å; A447-D450 VanDerWaalsContact O-N 3.12Å; V448-D450 PolarHBondContact O-N 3.43Å; D450-Q454 WeakPolarHBondContact O-CG 3.39Å; D450-Q454 PolarHBondContact O-N 3.39Å; D450-K460 VanDerWaalsContact OD1-CD 3.22Å; D450-K460 WeakPolarHBondContact OD1-CD 3.49Å; D450-K460 WeakPolarHBondContact OD1-CE 3.28Å; D450-K460 IonicContact OD1-NZ 3.72Å; D450-K460 PolarHBondContact OD1-NZ 2.82Å; D450-R645 IonicContact OD1-CZ 2.71Å; D450-R645 IonicContact OD1-NE 2.98Å; D450-R645 PolarHBondContact OD1-NE 3.04Å; D450-R645 VanDerWaalsContact OD1-NE 3.17Å; D450-R645 IonicContact OD1-NH2 2.72Å; D450-R645 IonicContact OD2-CZ 3.69Å; D450-R645 IonicContact OD2-NE 3.78Å; D450-R645 IonicContact OD2-NH2 3.94Å; D450-R645 PolarHBondContact OD2-NH2 2.96Å; D450-I649 WeakPolarHBondContact OD1-CD1 2.78Å
451	Q	87.3	Confident	89.4	Confident	21 Å²	21	26 Å²	26	10%	0.098	15%	0.147	C	C	.	.	H	α-helix	trans	-70.1	-57.3	176.9	169.7	161.5	12.1	0	0	112.8	L133 T137 A447 V448 S449 S453 Q454 D455	L133-Q451 HydrophobicContact CD1-CB 4.16Å; L133-Q451 HydrophobicContact CD1-CG 3.52Å; T137-Q451 PolarHBondContact OG1-OE1 2.93Å; A447-Q451 PolarHBondContact O-N 3.37Å; A447-Q451 VanDerWaalsContact O-N 3.09Å; V448-Q451 PolarHBondContact O-N 3.38Å; S449-Q451 VanDerWaalsContact C-N 3.34Å; Q451-S453 PolarHBondContact O-N 3.03Å; Q451-Q454 WeakPolarHBondContact O-CB 3.39Å; Q451-Q454 PolarHBondContact O-N 2.98Å; Q451-D455 PolarHBondContact O-N 3.37Å
452	E	89.3	Confident	89.6	Confident	10 Å²	10	25.2 Å²	25.2	5%	0.047	14%	0.142	C	C	.	.	H	α-helix	trans	-64.9	-26.4	-175.3	-70.4	-173.7	-165.9	0	0	112.6	R374 V448 D455 G456 L457 Y458	R374-E452 IonicContact CZ-OE1 2.69Å; R374-E452 VanDerWaalsContact CZ-OE1 3.3Å; R374-E452 IonicContact CZ-OE2 3.22Å; R374-E452 VanDerWaalsContact NH1-CD 3.28Å; R374-E452 IonicContact NH1-OE1 2.7Å; R374-E452 PolarHBondContact NH1-OE1 3.19Å; R374-E452 IonicContact NH1-OE2 3.77Å; R374-E452 PolarHBondContact NH1-OE2 3.16Å; R374-E452 IonicContact NH2-OE1 3.52Å; R374-E452 PolarHBondContact NH2-OE1 3.11Å; R374-E452 IonicContact NH2-OE2 3Å; V448-E452 HydrophobicContact CG1-CG 4.08Å; V448-E452 WeakPolarHBondContact CG1-OE1 3.42Å; V448-E452 WeakPolarHBondContact O-CB 3.47Å; V448-E452 WeakPolarHBondContact O-CG 3.4Å; V448-E452 PolarHBondContact O-N 2.96Å; E452-D455 PolarHBondContact O-N 3.34Å; E452-G456 PolarHBondContact O-N 3.04Å; E452-L457 HydrophobicContact CB-CD1 3.76Å; E452-L457 HydrophobicContact CG-CD1 3.95Å; E452-L457 WeakPolarHBondContact O-CB 3.45Å; E452-L457 PolarHBondContact O-N 3.48Å; E452-Y458 HydrophobicContact CB-CE1 3.91Å; E452-Y458 WeakPolarHBondContact OE2-CE1 3.48Å; E452-Y458 PolarHBondContact OE2-OH 3.5Å
453	S	87.5	Confident	89.7	Confident	18 Å²	18	25.2 Å²	25.2	13%	0.126	14%	0.142	C	C	.	.	H	α-helix	trans	-72.4	-35	174.3	-171.3	0	0	0	0	112.8	S449 Q451 D455 G456 Y458	S449-S453 WeakPolarHBondContact O-CB 3.32Å; S449-S453 PolarHBondContact O-N 3.24Å; S449-S453 VanDerWaalsContact O-N 3.16Å; Q451-S453 PolarHBondContact O-N 3.03Å; S453-D455 PolarHBondContact O-N 2.93Å; S453-G456 PolarHBondContact O-N 2.73Å; S453-Y458 VanDerWaalsContact CA-O 3.25Å; S453-Y458 WeakPolarHBondContact CA-O 2.9Å; S453-Y458 WeakPolarHBondContact CB-O 3.46Å; S453-Y458 PolarHBondContact OG-O 3.24Å
454	Q	82.8	Confident	89.7	Confident	63 Å²	63	24.2 Å²	24.2	29%	0.294	14%	0.136	S	C	.	.	H	α-helix	trans	-66.7	-25.9	171.9	-71.8	175.6	-6.3	0	0	112.5	R102 D450 Q451 G456	R102-Q454 PolarHBondContact NH2-O 3.16Å; D450-Q454 WeakPolarHBondContact O-CG 3.39Å; D450-Q454 PolarHBondContact O-N 3.39Å; Q451-Q454 WeakPolarHBondContact O-CB 3.39Å; Q451-Q454 PolarHBondContact O-N 2.98Å; Q454-G456 PolarHBondContact O-N 2.9Å
455	D	81.5	Confident	89.9	Confident	6 Å²	6	22.2 Å²	22.2	3%	0.032	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-1.6	171.6	-62.1	-19.3	0	0	0	112.8	R102 Q206 K357 Q451 E452 S453 L457	R102-D455 IonicContact CZ-OD1 3.57Å; R102-D455 IonicContact NH1-OD1 3.88Å; R102-D455 IonicContact NH2-OD1 3.62Å; R102-D455 PolarHBondContact NH2-OD1 3.32Å; Q206-D455 PolarHBondContact NE2-OD2 3.34Å; K357-D455 VanDerWaalsContact CE-O 3.29Å; K357-D455 WeakPolarHBondContact CE-O 3.46Å; K357-D455 PolarHBondContact NZ-O 3.44Å; Q451-D455 PolarHBondContact O-N 3.37Å; E452-D455 PolarHBondContact O-N 3.34Å; S453-D455 PolarHBondContact O-N 2.93Å; D455-L457 HydrophobicContact CB-CD1 4.35Å; D455-L457 PolarHBondContact O-N 3.35Å
456	G	81.6	Confident	90	Very high	38 Å²	38	22.1 Å²	22.1	39%	0.392	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	14.4	176.5	0	0	0	0	0	115.3	E452 S453 Q454	E452-G456 PolarHBondContact O-N 3.04Å; S453-G456 PolarHBondContact O-N 2.73Å; Q454-G456 PolarHBondContact O-N 2.9Å
457	L	86.1	Confident	90.2	Very high	10 Å²	10	20.9 Å²	20.9	5%	0.052	12%	0.117	C	C	.	.	S	Bend	trans	-67.6	-49.9	179.3	-74.5	154.8	0	0	0	111.6	L154 A155 K367 E452 D455	L154-L457 HydrophobicContact CB-CD2 4.17Å; A155-L457 HydrophobicContact CB-CD2 3.85Å; K367-L457 WeakPolarHBondContact CE-O 3.4Å; K367-L457 PolarHBondContact NZ-O 2.95Å; E452-L457 HydrophobicContact CB-CD1 3.76Å; E452-L457 HydrophobicContact CG-CD1 3.95Å; E452-L457 WeakPolarHBondContact O-CB 3.45Å; E452-L457 PolarHBondContact O-N 3.48Å; D455-L457 HydrophobicContact CB-CD1 4.35Å; D455-L457 PolarHBondContact O-N 3.35Å
458	Y	90.4	Very high	90.4	Very high	7 Å²	7	19.5 Å²	19.5	3%	0.027	10%	0.104	C	C	.	.			trans	-154.7	165.2	-179.9	57.9	-101.8	0	0	0	111.6	L154 L371 S449 E452 S453 M463	L154-Y458 HydrophobicContact CD1-CD1 4.16Å; L154-Y458 HydrophobicContact CD1-CE1 4.22Å; L371-Y458 HydrophobicContact CD1-CD1 4.18Å; L371-Y458 HydrophobicContact CD1-CD2 4.23Å; L371-Y458 HydrophobicContact CD1-CG 4.01Å; L371-Y458 HydrophobicContact CD2-CD1 3.93Å; L371-Y458 HydrophobicContact CD2-CE1 3.63Å; S449-Y458 WeakPolarHBondContact CA-OH 3.48Å; S449-Y458 WeakPolarHBondContact OG-CE2 3.37Å; E452-Y458 HydrophobicContact CB-CE1 3.91Å; E452-Y458 WeakPolarHBondContact OE2-CE1 3.48Å; E452-Y458 PolarHBondContact OE2-OH 3.5Å; S453-Y458 VanDerWaalsContact CA-O 3.25Å; S453-Y458 WeakPolarHBondContact CA-O 2.9Å; S453-Y458 WeakPolarHBondContact CB-O 3.46Å; S453-Y458 PolarHBondContact OG-O 3.24Å; Y458-M463 HydrophobicContact CE2-CB 4.03Å; Y458-M463 HydrophobicContact CE2-CE 4.28Å; Y458-M463 WeakPolarHBondContact OH-CE 3.43Å
459	Q	90.1	Very high	90.5	Very high	101 Å²	101	22.8 Å²	22.8	47%	0.472	12%	0.122	S	C	.	.			trans	-85.7	146.9	174.9	-67.2	179.8	-13.5	0	0	110.8	W461 Q462	Q459-W461 VanDerWaalsContact C-N 3.26Å; Q459-W461 PolarHBondContact O-N 2.97Å; Q459-W461 VanDerWaalsContact O-N 3.13Å; Q459-Q462 HydrophobicContact CB-CG 4.35Å; Q459-Q462 VanDerWaalsContact O-CB 3.28Å; Q459-Q462 WeakPolarHBondContact O-CB 3.25Å; Q459-Q462 WeakPolarHBondContact O-CG 3.43Å; Q459-Q462 PolarHBondContact O-N 3.1Å
460	K	91.4	Very high	90.5	Very high	5 Å²	5	22.9 Å²	22.9	2%	0.022	12%	0.122	C	C	.	.	H	α-helix	trans	-58.8	-32.8	-171.7	-72.2	178.8	-158.4	-170	0	114.7	D450 Q462 M463 L464 F642 D646	D450-K460 VanDerWaalsContact OD1-CD 3.22Å; D450-K460 WeakPolarHBondContact OD1-CD 3.49Å; D450-K460 WeakPolarHBondContact OD1-CE 3.28Å; D450-K460 IonicContact OD1-NZ 3.72Å; D450-K460 PolarHBondContact OD1-NZ 2.82Å; K460-Q462 PolarHBondContact O-N 3.01Å; K460-M463 PolarHBondContact O-N 3.38Å; K460-L464 PolarHBondContact O-N 3.01Å; K460-F642 HydrophobicContact CB-CB 4.43Å; K460-F642 HydrophobicContact CB-CD1 4.16Å; K460-D646 WeakPolarHBondContact CB-OD1 3.31Å; K460-D646 WeakPolarHBondContact CD-OD1 3.36Å; K460-D646 WeakPolarHBondContact CE-OD1 3.39Å; K460-D646 WeakPolarHBondContact CG-OD1 3.48Å; K460-D646 IonicContact NZ-OD1 3.17Å
461	W	92.8	Very high	90.7	Very high	46 Å²	46	21.8 Å²	21.8	17%	0.174	12%	0.116	C	C	.	.	H	α-helix	trans	-64.1	-24.5	176.5	70.2	-95.2	0	0	0	113	V364 Q459 M463 L464 L465 I639 F642	V364-W461 HydrophobicContact CG1-CH2 3.74Å; V364-W461 HydrophobicContact CG1-CZ2 4.1Å; Q459-W461 VanDerWaalsContact C-N 3.26Å; Q459-W461 PolarHBondContact O-N 2.97Å; Q459-W461 VanDerWaalsContact O-N 3.13Å; W461-M463 VanDerWaalsContact C-N 3.34Å; W461-L464 WeakPolarHBondContact O-CB 3.5Å; W461-L464 PolarHBondContact O-N 3.41Å; W461-L465 HydrophobicContact CE3-CB 4.44Å; W461-L465 HydrophobicContact CE3-CD2 4.37Å; W461-L465 HydrophobicContact CZ3-CD2 3.87Å; W461-L465 WeakPolarHBondContact O-CB 3.37Å; W461-L465 PolarHBondContact O-N 3.44Å; W461-I639 HydrophobicContact CB-CG2 4.05Å; W461-I639 HydrophobicContact CG-CG2 4.29Å; W461-F642 HydrophobicContact CB-CB 4.23Å
462	Q	94.1	Very high	91	Very high	7 Å²	7	23.9 Å²	23.9	3%	0.033	13%	0.127	C	C	.	.	H	α-helix	trans	-68.2	-36.6	178.6	-58.8	-177	-80	0	0	111.1	L368 L371 Q459 K460 A466	L368-Q462 WeakPolarHBondContact CD1-O 3.47Å; L371-Q462 HydrophobicContact CD1-CB 3.82Å; Q459-Q462 HydrophobicContact CB-CG 4.35Å; Q459-Q462 VanDerWaalsContact O-CB 3.28Å; Q459-Q462 WeakPolarHBondContact O-CB 3.25Å; Q459-Q462 WeakPolarHBondContact O-CG 3.43Å; Q459-Q462 PolarHBondContact O-N 3.1Å; K460-Q462 PolarHBondContact O-N 3.01Å; Q462-A466 WeakPolarHBondContact O-CB 3.42Å; Q462-A466 PolarHBondContact O-N 3.39Å
463	M	94	Very high	91.3	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.01	15%	0.147	C	C	.	.	H	α-helix	trans	-67.4	-43	172.5	-180	62	72.8	0	0	111.3	L371 V375 L445 Y458 K460 W461 L465 A466 Y467	L371-M463 HydrophobicContact CD2-CE 3.98Å; V375-M463 HydrophobicContact CG2-CE 4.46Å; V375-M463 HydrophobicContact CG2-SD 3.65Å; L445-M463 HydrophobicContact CB-CG 4.41Å; L445-M463 HydrophobicContact CB-SD 4.28Å; L445-M463 HydrophobicContact CD2-SD 4.07Å; L445-M463 HydrophobicContact CG-SD 4.4Å; Y458-M463 HydrophobicContact CE2-CB 4.03Å; Y458-M463 HydrophobicContact CE2-CE 4.28Å; Y458-M463 WeakPolarHBondContact OH-CE 3.43Å; K460-M463 PolarHBondContact O-N 3.38Å; W461-M463 VanDerWaalsContact C-N 3.34Å; M463-L465 VanDerWaalsContact C-N 3.33Å; M463-L465 PolarHBondContact O-N 2.98Å; M463-A466 PolarHBondContact O-N 3.13Å; M463-Y467 PolarHBondContact O-N 3.32Å
464	L	94.6	Very high	91.6	Very high	4 Å²	4	27.3 Å²	27.3	2%	0.021	15%	0.147	C	C	.	.	H	α-helix	trans	-57.5	-47.6	175.1	177.3	74.3	0	0	0	111	F442 K460 W461 A466 Y467 V468 L518 G638 I639 F642	F442-L464 HydrophobicContact CE2-CD1 4.26Å; F442-L464 HydrophobicContact CZ-CD1 4.05Å; K460-L464 PolarHBondContact O-N 3.01Å; W461-L464 WeakPolarHBondContact O-CB 3.5Å; W461-L464 PolarHBondContact O-N 3.41Å; L464-A466 PolarHBondContact O-N 2.87Å; L464-Y467 WeakPolarHBondContact O-CA 3.47Å; L464-Y467 VanDerWaalsContact O-CB 3.29Å; L464-Y467 WeakPolarHBondContact O-CB 3.45Å; L464-Y467 PolarHBondContact O-N 3.46Å; L464-Y467 VanDerWaalsContact O-N 3.09Å; L464-V468 WeakPolarHBondContact O-CG2 3.18Å; L464-V468 PolarHBondContact O-N 2.76Å; L464-L518 HydrophobicContact CD1-CB 3.82Å; L464-L518 HydrophobicContact CD1-CD1 3.92Å; L464-L518 HydrophobicContact CD1-CG 4.33Å; L464-G638 WeakPolarHBondContact CD2-O 3.04Å; L464-I639 HydrophobicContact CD2-CG1 4.47Å; L464-F642 HydrophobicContact CB-CD1 4.43Å; L464-F642 HydrophobicContact CB-CD2 4.45Å; L464-F642 HydrophobicContact CB-CG 4.31Å; L464-F642 HydrophobicContact CD1-CD2 4.29Å; L464-F642 HydrophobicContact CD1-CE2 3.9Å; L464-F642 HydrophobicContact CD1-CZ 4.23Å; L464-F642 HydrophobicContact CD2-CD2 3.72Å; L464-F642 HydrophobicContact CD2-CE2 4.15Å; L464-F642 HydrophobicContact CD2-CG 4.2Å; L464-F642 HydrophobicContact CG-CD2 4.37Å; L464-F642 HydrophobicContact CG-CE2 4.46Å
465	L	94.8	Very high	92.2	Very high	34 Å²	34	24.3 Å²	24.3	18%	0.178	13%	0.133	C	C	.	.	H	α-helix	trans	-66.5	-39.1	-179.4	-173.5	61.3	0	0	0	111.7	L368 W461 M463 Y467 V468 L469 V635	L368-L465 HydrophobicContact CD1-CB 3.95Å; L368-L465 HydrophobicContact CD1-CD2 4.03Å; L368-L465 HydrophobicContact CD1-CG 3.98Å; L368-L465 HydrophobicContact CD2-CD2 3.58Å; L368-L465 HydrophobicContact CD2-CG 4.14Å; L368-L465 HydrophobicContact CG-CD2 4.48Å; W461-L465 HydrophobicContact CE3-CB 4.44Å; W461-L465 HydrophobicContact CE3-CD2 4.37Å; W461-L465 HydrophobicContact CZ3-CD2 3.87Å; W461-L465 WeakPolarHBondContact O-CB 3.37Å; W461-L465 PolarHBondContact O-N 3.44Å; M463-L465 VanDerWaalsContact C-N 3.33Å; M463-L465 PolarHBondContact O-N 2.98Å; L465-Y467 PolarHBondContact O-N 3.48Å; L465-V468 PolarHBondContact O-N 3.46Å; L465-L469 HydrophobicContact CD1-CG 4.44Å; L465-L469 HydrophobicContact CG-CD1 4.22Å; L465-L469 VanDerWaalsContact O-CG 3.31Å; L465-L469 WeakPolarHBondContact O-CG 3.36Å; L465-L469 PolarHBondContact O-N 2.87Å; L465-V635 HydrophobicContact CD1-CG1 4.47Å
466	A	95.8	Very high	92.9	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-59.1	-38.5	171.2	0	0	0	0	0	111.5	L368 L371 L372 Q462 M463 L464 H470	L368-A466 HydrophobicContact CD1-CB 4.15Å; L371-A466 HydrophobicContact CB-CB 3.83Å; L372-A466 WeakPolarHBondContact CD1-O 3.24Å; Q462-A466 WeakPolarHBondContact O-CB 3.42Å; Q462-A466 PolarHBondContact O-N 3.39Å; M463-A466 PolarHBondContact O-N 3.13Å; L464-A466 PolarHBondContact O-N 2.87Å; A466-H470 PolarHBondContact O-CD2 3.37Å; A466-H470 VanDerWaalsContact O-CD2 3.23Å; A466-H470 PolarHBondContact O-N 3.35Å; A466-H470 VanDerWaalsContact O-N 3.15Å
467	Y	95.4	Very high	93.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.3	-54.7	173	-172.4	-82.7	0	0	0	111.8	R389 A438 L441 F442 L445 M463 L464 L465 L469 H470 V471 E514 L518	R389-Y467 PolarHBondContact NH1-OH 3Å; A438-Y467 WeakPolarHBondContact CA-OH 3.37Å; L441-Y467 HydrophobicContact CB-CE2 4.42Å; L441-Y467 HydrophobicContact CD2-CE2 3.83Å; L441-Y467 HydrophobicContact CG-CE2 4.15Å; F442-Y467 HydrophobicContact CB-CE2 4.19Å; F442-Y467 HydrophobicContact CD2-CD1 4.41Å; F442-Y467 AromaticContact CD2-CD2 3.58Å; F442-Y467 HydrophobicContact CD2-CD2 3.58Å; F442-Y467 HydrophobicContact CD2-CE2 4.03Å; F442-Y467 AromaticContact CD2-CG 3.78Å; F442-Y467 HydrophobicContact CD2-CG 3.78Å; F442-Y467 HydrophobicContact CE2-CD2 4.32Å; F442-Y467 HydrophobicContact CE2-CG 4.16Å; L445-Y467 HydrophobicContact CD2-CD2 4.05Å; M463-Y467 PolarHBondContact O-N 3.32Å; L464-Y467 WeakPolarHBondContact O-CA 3.47Å; L464-Y467 VanDerWaalsContact O-CB 3.29Å; L464-Y467 WeakPolarHBondContact O-CB 3.45Å; L464-Y467 PolarHBondContact O-N 3.46Å; L464-Y467 VanDerWaalsContact O-N 3.09Å; L465-Y467 PolarHBondContact O-N 3.48Å; Y467-L469 VanDerWaalsContact C-N 3.26Å; Y467-L469 PolarHBondContact O-N 3.45Å; Y467-H470 WeakPolarHBondContact CA-CD2 3.47Å; Y467-H470 WeakPolarHBondContact CA-NE2 3.38Å; Y467-H470 AromaticContact CD2-CE1 3.7Å; Y467-H470 AromaticContact CD2-NE2 3.04Å; Y467-H470 WeakPolarHBondContact CD2-NE2 3.12Å; Y467-H470 AromaticContact CE2-CE1 3.73Å; Y467-H470 AromaticContact CE2-NE2 3.54Å; Y467-H470 AromaticContact CG-NE2 3.45Å; Y467-H470 PolarHBondContact O-CD2 3.36Å; Y467-H470 PolarHBondContact O-N 2.63Å; Y467-H470 PolarHBondContact O-NE2 3.42Å; Y467-V471 HydrophobicContact CE1-CB 4.37Å; Y467-V471 HydrophobicContact CE1-CG1 4.48Å; Y467-V471 WeakPolarHBondContact O-CG1 3.33Å; Y467-V471 PolarHBondContact O-N 3.3Å; Y467-E514 HydrophobicContact CE1-CG 4.25Å; Y467-E514 WeakPolarHBondContact CE1-OE1 3.44Å; Y467-E514 PolarHBondContact OH-OE1 3.36Å; Y467-L518 HydrophobicContact CD1-CD1 3.33Å; Y467-L518 HydrophobicContact CD1-CD2 3.81Å; Y467-L518 HydrophobicContact CD1-CG 4.15Å; Y467-L518 HydrophobicContact CE1-CD1 3.64Å; Y467-L518 HydrophobicContact CE1-CD2 3.74Å; Y467-L518 HydrophobicContact CE1-CG 4.12Å; Y467-L518 HydrophobicContact CG-CD1 4.33Å; Y467-L518 HydrophobicContact CG-CD2 4.36Å
468	V	95.1	Very high	94	Very high	10 Å²	10	28.9 Å²	28.9	6%	0.061	15%	0.15	C	C	.	.	H	α-helix	trans	-58.6	-35.1	-178.9	170.5	0	0	0	0	112.5	L464 L465 V471 L472 F515 L518 V635	L464-V468 WeakPolarHBondContact O-CG2 3.18Å; L464-V468 PolarHBondContact O-N 2.76Å; L465-V468 PolarHBondContact O-N 3.46Å; V468-V471 WeakPolarHBondContact O-CG1 3.41Å; V468-L472 WeakPolarHBondContact O-CG 3.47Å; V468-F515 HydrophobicContact CB-CE1 4.07Å; V468-F515 HydrophobicContact CG1-CE1 3.79Å; V468-F515 HydrophobicContact CG1-CZ 3.85Å; V468-F515 HydrophobicContact CG2-CD1 3.99Å; V468-F515 HydrophobicContact CG2-CE1 3.79Å; V468-L518 HydrophobicContact CG2-CD1 4Å; V468-V635 HydrophobicContact CG1-CG1 4.2Å; V468-V635 HydrophobicContact CG1-CG2 3.71Å; V468-V635 HydrophobicContact CG2-CG2 4.26Å
469	L	94.8	Very high	94.2	Very high	71 Å²	71	28.7 Å²	28.7	37%	0.372	15%	0.15	S	C	.	.	H	α-helix	trans	-77	-37.7	179	-68.8	173.9	0	0	0	112.6	L368 L372 L465 Y467 V471	L368-L469 HydrophobicContact CD2-CD1 4.07Å; L368-L469 HydrophobicContact CG-CD1 4.43Å; L372-L469 HydrophobicContact CD1-CB 3.86Å; L372-L469 HydrophobicContact CD2-CB 4.29Å; L465-L469 HydrophobicContact CD1-CG 4.44Å; L465-L469 HydrophobicContact CG-CD1 4.22Å; L465-L469 VanDerWaalsContact O-CG 3.31Å; L465-L469 WeakPolarHBondContact O-CG 3.36Å; L465-L469 PolarHBondContact O-N 2.87Å; Y467-L469 VanDerWaalsContact C-N 3.26Å; Y467-L469 PolarHBondContact O-N 3.45Å; L469-V471 VanDerWaalsContact C-N 3.31Å; L469-V471 PolarHBondContact O-N 2.96Å
470	H	93.1	Very high	94.5	Very high	4 Å²	4	27.9 Å²	27.9	2%	0.019	15%	0.147	C	C	.	.	H	α-helix	trans	-74.3	-22.8	-179.4	80.1	67.7	0	0	0	113.2	L372 V375 A466 Y467 P473 F474	L372-H470 HydrophobicContact CD1-CB 3.72Å; V375-H470 WeakPolarHBondContact CG1-CD2 3.5Å; V375-H470 VanDerWaalsContact CG1-NE2 3.32Å; V375-H470 WeakPolarHBondContact CG1-NE2 3.49Å; A466-H470 PolarHBondContact O-CD2 3.37Å; A466-H470 VanDerWaalsContact O-CD2 3.23Å; A466-H470 PolarHBondContact O-N 3.35Å; A466-H470 VanDerWaalsContact O-N 3.15Å; Y467-H470 WeakPolarHBondContact CA-CD2 3.47Å; Y467-H470 WeakPolarHBondContact CA-NE2 3.38Å; Y467-H470 AromaticContact CD2-CE1 3.7Å; Y467-H470 AromaticContact CD2-NE2 3.04Å; Y467-H470 WeakPolarHBondContact CD2-NE2 3.12Å; Y467-H470 AromaticContact CE2-CE1 3.73Å; Y467-H470 AromaticContact CE2-NE2 3.54Å; Y467-H470 AromaticContact CG-NE2 3.45Å; Y467-H470 PolarHBondContact O-CD2 3.36Å; Y467-H470 PolarHBondContact O-N 2.63Å; Y467-H470 PolarHBondContact O-NE2 3.42Å; H470-P473 WeakPolarHBondContact O-CD 3.31Å; H470-F474 WeakPolarHBondContact O-CD2 3.26Å
471	V	92.6	Very high	94.7	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-75.8	-36	-173.6	57	0	0	0	0	112.2	Y467 V468 L469 F474 S475 E514 F515	Y467-V471 HydrophobicContact CE1-CB 4.37Å; Y467-V471 HydrophobicContact CE1-CG1 4.48Å; Y467-V471 WeakPolarHBondContact O-CG1 3.33Å; Y467-V471 PolarHBondContact O-N 3.3Å; V468-V471 WeakPolarHBondContact O-CG1 3.41Å; L469-V471 VanDerWaalsContact C-N 3.31Å; L469-V471 PolarHBondContact O-N 2.96Å; V471-F474 PolarHBondContact O-N 3.47Å; V471-F474 VanDerWaalsContact O-N 3.11Å; V471-S475 PolarHBondContact O-N 3.48Å; V471-E514 HydrophobicContact CG2-CG 4.35Å; V471-E514 WeakPolarHBondContact CG2-OE1 3.13Å; V471-E514 WeakPolarHBondContact CG2-OE2 3.41Å; V471-F515 HydrophobicContact CG1-CE1 3.7Å; V471-F515 HydrophobicContact CG1-CZ 4.04Å
472	L	93.6	Very high	94.8	Very high	65 Å²	65	28.4 Å²	28.4	34%	0.34	15%	0.152	S	C	.	.	H	α-helix	trans	-51.9	-49	-173.7	-63.7	170	0	0	0	113.3	V468 F474 S475 V476 L511 F515	V468-L472 WeakPolarHBondContact O-CG 3.47Å; L472-F474 PolarHBondContact O-N 3.42Å; L472-S475 PolarHBondContact O-N 2.61Å; L472-V476 WeakPolarHBondContact O-CB 3.24Å; L472-V476 VanDerWaalsContact O-CG2 3.25Å; L472-V476 WeakPolarHBondContact O-CG2 3.42Å; L472-V476 PolarHBondContact O-N 3.29Å; L472-L511 HydrophobicContact CD2-CD1 3.82Å; L472-L511 HydrophobicContact CD2-CD2 3.9Å; L472-F515 HydrophobicContact CD2-CZ 4.14Å
473	P	94.8	Very high	94.9	Very high	71 Å²	71	28.1 Å²	28.1	46%	0.461	15%	0.151	S	C	.	.	H	α-helix	trans	-61.4	-42.8	-179.8	-22.5	34.6	0	0	0	112.9	H470 I477	H470-P473 WeakPolarHBondContact O-CD 3.31Å; P473-I477 WeakPolarHBondContact O-CD1 3.05Å; P473-I477 WeakPolarHBondContact O-CG1 3.31Å; P473-I477 PolarHBondContact O-N 3.49Å
474	F	94.6	Very high	94.9	Very high	30 Å²	30	30.6 Å²	30.6	13%	0.132	17%	0.169	C	C	.	.	H	α-helix	trans	-69.2	-40.2	-179	-66.2	-89.9	0	0	0	111.7	L379 V380 V386 R389 L390 H470 V471 L472 I477 A478	L379-F474 HydrophobicContact CD2-CD2 4.35Å; L379-F474 HydrophobicContact CD2-CE2 4.14Å; L379-F474 HydrophobicContact CD2-CZ 4.36Å; V380-F474 HydrophobicContact CG2-CZ 3.98Å; V386-F474 HydrophobicContact CG1-CD1 4.44Å; V386-F474 HydrophobicContact CG1-CE1 4.12Å; V386-F474 HydrophobicContact CG2-CE1 4.43Å; R389-F474 HydrophobicContact CG-CB 4.44Å; L390-F474 HydrophobicContact CD2-CB 4.42Å; L390-F474 HydrophobicContact CD2-CD1 4.29Å; H470-F474 WeakPolarHBondContact O-CD2 3.26Å; V471-F474 PolarHBondContact O-N 3.47Å; V471-F474 VanDerWaalsContact O-N 3.11Å; L472-F474 PolarHBondContact O-N 3.42Å; F474-I477 PolarHBondContact O-N 3.26Å; F474-A478 VanDerWaalsContact O-CB 3.27Å; F474-A478 WeakPolarHBondContact O-CB 3.37Å; F474-A478 PolarHBondContact O-N 2.94Å
475	S	94.6	Very high	94.9	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-68.7	-38.3	178.5	-74.5	0	0	0	0	112.2	R389 V471 L472 A478 T479 H510	R389-S475 PolarHBondContact NH2-OG 2.77Å; V471-S475 PolarHBondContact O-N 3.48Å; L472-S475 PolarHBondContact O-N 2.61Å; S475-A478 PolarHBondContact O-N 3.44Å; S475-T479 WeakPolarHBondContact O-CB 3.07Å; S475-T479 PolarHBondContact O-N 3.37Å; S475-T479 PolarHBondContact O-OG1 2.66Å; S475-H510 PolarHBondContact OG-CD2 2.83Å; S475-H510 PolarHBondContact OG-NE2 3.33Å; S475-H510 VanDerWaalsContact OG-NE2 3.13Å
476	V	95.9	Very high	94.8	Very high	63 Å²	63	31.2 Å²	31.2	38%	0.382	17%	0.174	S	C	.	.	H	α-helix	trans	-61.3	-48.7	172.4	172	0	0	0	0	110.4	L472 A478 T479 M480 L507	L472-V476 WeakPolarHBondContact O-CB 3.24Å; L472-V476 VanDerWaalsContact O-CG2 3.25Å; L472-V476 WeakPolarHBondContact O-CG2 3.42Å; L472-V476 PolarHBondContact O-N 3.29Å; V476-A478 PolarHBondContact O-N 3.47Å; V476-T479 PolarHBondContact O-N 3.26Å; V476-M480 HydrophobicContact CG1-CG 4.47Å; V476-M480 VanDerWaalsContact O-CG 3.28Å; V476-M480 WeakPolarHBondContact O-CG 3.37Å; V476-M480 PolarHBondContact O-N 3.25Å; V476-L507 HydrophobicContact CG2-CD1 4.1Å; V476-L507 HydrophobicContact CG2-CD2 3.83Å
477	I	96.2	Very high	94.7	Very high	86 Å²	86	31.3 Å²	31.3	44%	0.441	17%	0.174	S	C	.	.	H	α-helix	trans	-61.8	-45.5	178.6	-66.2	165	0	0	0	111	L390 P473 F474 T479 M480 I481	L390-I477 HydrophobicContact CD2-CB 4.18Å; L390-I477 HydrophobicContact CD2-CG2 3.91Å; P473-I477 WeakPolarHBondContact O-CD1 3.05Å; P473-I477 WeakPolarHBondContact O-CG1 3.31Å; P473-I477 PolarHBondContact O-N 3.49Å; F474-I477 PolarHBondContact O-N 3.26Å; I477-T479 PolarHBondContact O-N 2.82Å; I477-M480 PolarHBondContact O-N 3.17Å; I477-I481 HydrophobicContact CG2-CD1 3.7Å; I477-I481 HydrophobicContact CG2-CG1 4.3Å; I477-I481 VanDerWaalsContact O-CG1 3.3Å; I477-I481 WeakPolarHBondContact O-CG1 3.44Å; I477-I481 PolarHBondContact O-N 3.02Å
478	A	94.6	Very high	94.7	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60	-44.2	179	0	0	0	0	0	112.1	L390 F474 S475 V476 I481 F482	L390-A478 HydrophobicContact CD2-CB 4.31Å; F474-A478 VanDerWaalsContact O-CB 3.27Å; F474-A478 WeakPolarHBondContact O-CB 3.37Å; F474-A478 PolarHBondContact O-N 2.94Å; S475-A478 PolarHBondContact O-N 3.44Å; V476-A478 PolarHBondContact O-N 3.47Å; A478-I481 PolarHBondContact O-N 3.29Å; A478-F482 WeakPolarHBondContact O-CB 3.42Å; A478-F482 PolarHBondContact O-N 3.24Å
479	T	95.6	Very high	94.6	Very high	4 Å²	4	39.1 Å²	39.1	3%	0.025	21%	0.21	C	C	.	.	H	α-helix	trans	-66.2	-39.8	177.1	-58.9	0	0	0	0	111.7	S475 V476 I477 F482 S483 S503 L506 L507	S475-T479 WeakPolarHBondContact O-CB 3.07Å; S475-T479 PolarHBondContact O-N 3.37Å; S475-T479 PolarHBondContact O-OG1 2.66Å; V476-T479 PolarHBondContact O-N 3.26Å; I477-T479 PolarHBondContact O-N 2.82Å; T479-F482 PolarHBondContact O-N 2.95Å; T479-S483 WeakPolarHBondContact O-CB 3.35Å; T479-S483 PolarHBondContact O-N 3.03Å; T479-S483 PolarHBondContact O-OG 3.48Å; T479-S483 VanDerWaalsContact O-OG 3.1Å; T479-S503 WeakPolarHBondContact CG2-O 3.49Å; T479-L506 HydrophobicContact CG2-CB 4.4Å; T479-L507 HydrophobicContact CG2-CB 4.1Å
480	M	95.9	Very high	94.5	Very high	84 Å²	84	35.8 Å²	35.8	41%	0.414	19%	0.193	S	C	.	.	H	α-helix	trans	-66.8	-39.8	176.9	-71	-57.4	-60.6	0	0	112.7	V476 I477 S483 S484 F499	V476-M480 HydrophobicContact CG1-CG 4.47Å; V476-M480 VanDerWaalsContact O-CG 3.28Å; V476-M480 WeakPolarHBondContact O-CG 3.37Å; V476-M480 PolarHBondContact O-N 3.25Å; I477-M480 PolarHBondContact O-N 3.17Å; M480-S483 PolarHBondContact O-OG 2.81Å; M480-S484 WeakPolarHBondContact O-CB 3.35Å; M480-S484 PolarHBondContact O-N 3.35Å; M480-S484 PolarHBondContact O-OG 3.34Å; M480-F499 HydrophobicContact CE-CE1 4Å; M480-F499 HydrophobicContact CE-CZ 4.09Å
481	I	95.8	Very high	94.3	Very high	58 Å²	58	36.7 Å²	36.7	30%	0.297	20%	0.204	S	C	.	.	H	α-helix	trans	-61.8	-48.4	174.2	-69.6	167.8	0	0	0	109.8	L394 I477 A478 S484 V485	L394-I481 HydrophobicContact CB-CG2 4.4Å; L394-I481 HydrophobicContact CD2-CG2 3.98Å; I477-I481 HydrophobicContact CG2-CD1 3.7Å; I477-I481 HydrophobicContact CG2-CG1 4.3Å; I477-I481 VanDerWaalsContact O-CG1 3.3Å; I477-I481 WeakPolarHBondContact O-CG1 3.44Å; I477-I481 PolarHBondContact O-N 3.02Å; A478-I481 PolarHBondContact O-N 3.29Å; I481-S484 PolarHBondContact O-OG 2.73Å; I481-V485 WeakPolarHBondContact O-CG2 3.35Å; I481-V485 PolarHBondContact O-N 3.1Å
482	F	95.6	Very high	94.1	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.018	21%	0.207	C	C	.	.	H	α-helix	trans	-61.6	-50.1	178.3	158.4	-96.9	0	0	0	112.2	N393 G397 F426 A478 T479 V485 C486 F502 L506	N393-F482 HydrophobicContact CB-CB 3.78Å; N393-F482 HydrophobicContact CB-CD2 4.46Å; N393-F482 HydrophobicContact CB-CG 4.12Å; N393-F482 WeakPolarHBondContact O-CD2 3.38Å; G397-F482 VanDerWaalsContact CA-CE2 3.5Å; F426-F482 HydrophobicContact CD1-CE2 4.2Å; F426-F482 AromaticContact CD1-CZ 3.57Å; F426-F482 HydrophobicContact CD1-CZ 3.57Å; F426-F482 AromaticContact CE1-CE2 3.83Å; F426-F482 HydrophobicContact CE1-CE2 3.83Å; F426-F482 AromaticContact CE1-CZ 3.48Å; F426-F482 HydrophobicContact CE1-CZ 3.48Å; F426-F482 VanDerWaalsContact CE1-CZ 3.48Å; F426-F482 HydrophobicContact CG-CZ 4.26Å; F426-F482 HydrophobicContact CZ-CZ 4.11Å; A478-F482 WeakPolarHBondContact O-CB 3.42Å; A478-F482 PolarHBondContact O-N 3.24Å; T479-F482 PolarHBondContact O-N 2.95Å; F482-V485 PolarHBondContact O-N 3.31Å; F482-C486 HydrophobicContact CE2-CB 4.21Å; F482-C486 WeakPolarHBondContact O-CB 3.33Å; F482-C486 PolarHBondContact O-N 3.5Å; F482-C486 PolarHBondContact O-SG 3.05Å; F482-F502 HydrophobicContact CE1-CE1 4.43Å; F482-L506 HydrophobicContact CE1-CD1 3.6Å; F482-L506 HydrophobicContact CZ-CD1 4.27Å
483	S	95.1	Very high	93.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-67.4	-41.6	-175.9	65.7	0	0	0	0	111.5	T479 M480 V485 C486 Y487 F499 S503	T479-S483 WeakPolarHBondContact O-CB 3.35Å; T479-S483 PolarHBondContact O-N 3.03Å; T479-S483 PolarHBondContact O-OG 3.48Å; T479-S483 VanDerWaalsContact O-OG 3.1Å; M480-S483 PolarHBondContact O-OG 2.81Å; S483-V485 VanDerWaalsContact C-N 3.29Å; S483-V485 PolarHBondContact O-N 3.44Å; S483-C486 PolarHBondContact O-N 3.04Å; S483-Y487 WeakPolarHBondContact O-CB 3.44Å; S483-Y487 PolarHBondContact O-N 3.01Å; S483-F499 WeakPolarHBondContact OG-CE2 3.39Å; S483-S503 WeakPolarHBondContact CB-OG 3.21Å; S483-S503 PolarHBondContact OG-OG 3.45Å
484	S	94.9	Very high	93.6	Very high	55 Å²	55	37 Å²	37	39%	0.385	21%	0.206	S	C	.	.	H	α-helix	trans	-63.2	-32.1	179.8	59.5	0	0	0	0	113.2	M480 I481 W488	M480-S484 WeakPolarHBondContact O-CB 3.35Å; M480-S484 PolarHBondContact O-N 3.35Å; M480-S484 PolarHBondContact O-OG 3.34Å; I481-S484 PolarHBondContact O-OG 2.73Å; S484-W488 VanDerWaalsContact O-CD1 3.26Å
485	V	94.3	Very high	93.5	Very high	51 Å²	51	39.9 Å²	39.9	31%	0.309	22%	0.22	S	C	.	.	H	α-helix	trans	-80.7	-51.6	174.6	178.2	0	0	0	0	110.4	L394 L398 I481 F482 S483 T489	L394-V485 HydrophobicContact CD1-CB 3.61Å; L394-V485 HydrophobicContact CD1-CG1 3.85Å; L394-V485 HydrophobicContact CD1-CG2 3.85Å; L398-V485 HydrophobicContact CD2-CG1 4.21Å; I481-V485 WeakPolarHBondContact O-CG2 3.35Å; I481-V485 PolarHBondContact O-N 3.1Å; F482-V485 PolarHBondContact O-N 3.31Å; S483-V485 VanDerWaalsContact C-N 3.29Å; S483-V485 PolarHBondContact O-N 3.44Å; V485-T489 VanDerWaalsContact O-CB 3.31Å; V485-T489 WeakPolarHBondContact O-CB 3.35Å; V485-T489 PolarHBondContact O-N 3.4Å; V485-T489 PolarHBondContact O-OG1 2.88Å
486	C	93.1	Very high	93.5	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-73.7	-42.8	-169.6	-66.9	0	0	0	0	113.5	G397 F482 S483 W488 T489 L490	G397-C486 VanDerWaalsContact C-SG 3.54Å; G397-C486 WeakPolarHBondContact CA-SG 3.39Å; F482-C486 HydrophobicContact CE2-CB 4.21Å; F482-C486 WeakPolarHBondContact O-CB 3.33Å; F482-C486 PolarHBondContact O-N 3.5Å; F482-C486 PolarHBondContact O-SG 3.05Å; S483-C486 PolarHBondContact O-N 3.04Å; C486-W488 PolarHBondContact O-N 2.88Å; C486-T489 PolarHBondContact O-N 3.46Å; C486-L490 HydrophobicContact CB-CD1 4.25Å; C486-L490 VanDerWaalsContact O-CB 3.24Å; C486-L490 WeakPolarHBondContact O-CB 3.5Å; C486-L490 WeakPolarHBondContact O-CD1 3.47Å; C486-L490 WeakPolarHBondContact O-CG 3.27Å; C486-L490 PolarHBondContact O-N 3.28Å
487	Y	94.3	Very high	93.4	Very high	1 Å²	1	44.2 Å²	44.2	0%	0.004	25%	0.251	C	S	.	.	H	α-helix	trans	-59.9	-48.6	-173.2	-173	-98.3	0	0	0	112.4	S483 G491 L492 H493 R498 F499 F502	S483-Y487 WeakPolarHBondContact O-CB 3.44Å; S483-Y487 PolarHBondContact O-N 3.01Å; Y487-G491 PolarHBondContact O-N 3.37Å; Y487-L492 HydrophobicContact CD2-CB 3.81Å; Y487-L492 HydrophobicContact CD2-CD2 3.93Å; Y487-L492 HydrophobicContact CD2-CG 4.33Å; Y487-L492 HydrophobicContact CE1-CB 4.41Å; Y487-L492 HydrophobicContact CE2-CB 3.55Å; Y487-L492 HydrophobicContact CE2-CD2 3.85Å; Y487-L492 HydrophobicContact CE2-CG 4.29Å; Y487-L492 HydrophobicContact CG-CB 4.34Å; Y487-L492 PolarHBondContact O-N 3.08Å; Y487-H493 WeakPolarHBondContact CE1-O 3.35Å; Y487-H493 PolarHBondContact OH-O 3.22Å; Y487-R498 WeakPolarHBondContact OH-CB 3.28Å; Y487-F499 HydrophobicContact CD1-CB 3.94Å; Y487-F499 AromaticContact CD1-CD2 3.64Å; Y487-F499 HydrophobicContact CD1-CD2 3.64Å; Y487-F499 HydrophobicContact CD1-CG 4.24Å; Y487-F499 HydrophobicContact CD2-CD2 4.48Å; Y487-F499 HydrophobicContact CE1-CB 3.68Å; Y487-F499 HydrophobicContact CE1-CD2 4.26Å; Y487-F499 HydrophobicContact CE1-CG 4.47Å; Y487-F499 AromaticContact CG-CD2 3.75Å; Y487-F499 HydrophobicContact CG-CD2 3.75Å; Y487-F502 HydrophobicContact CD2-CB 4.07Å; Y487-F502 AromaticContact CD2-CD1 3.65Å; Y487-F502 HydrophobicContact CD2-CD1 3.65Å; Y487-F502 HydrophobicContact CD2-CD2 4.01Å; Y487-F502 HydrophobicContact CD2-CE1 4.02Å; Y487-F502 HydrophobicContact CD2-CE2 4.36Å; Y487-F502 AromaticContact CD2-CG 3.64Å; Y487-F502 HydrophobicContact CD2-CG 3.64Å; Y487-F502 HydrophobicContact CD2-CZ 4.35Å; Y487-F502 HydrophobicContact CE2-CB 3.88Å; Y487-F502 HydrophobicContact CE2-CD1 4.32Å; Y487-F502 HydrophobicContact CE2-CD2 4.13Å; Y487-F502 AromaticContact CE2-CG 3.87Å; Y487-F502 HydrophobicContact CE2-CG 3.87Å; Y487-F502 HydrophobicContact CG-CD1 4.39Å
488	W	94.4	Very high	93.3	Very high	108 Å²	108	41.6 Å²	41.6	41%	0.409	24%	0.236	S	C	.	.	H	α-helix	trans	-74.3	-36.8	-178.2	-62.2	100.8	0	0	0	112.5	S484 C486 G491 V496 F499	S484-W488 VanDerWaalsContact O-CD1 3.26Å; C486-W488 PolarHBondContact O-N 2.88Å; W488-G491 PolarHBondContact O-N 2.95Å; W488-V496 HydrophobicContact CH2-CG2 4.3Å; W488-F499 HydrophobicContact CZ2-CB 4.37Å; W488-F499 HydrophobicContact CZ2-CG 4.44Å; W488-F499 AromaticContact NE1-CD2 3.87Å
489	T	93.1	Very high	93.3	Very high	67 Å²	67	42.8 Å²	42.8	41%	0.411	24%	0.241	S	C	.	.	H	α-helix	trans	-71.4	-38.4	-179.6	-47.3	0	0	0	0	111.7	L401 V485 C486 G491	L401-T489 HydrophobicContact CD1-CG2 3.77Å; L401-T489 HydrophobicContact CD2-CG2 3.65Å; L401-T489 HydrophobicContact CG-CG2 4.32Å; V485-T489 VanDerWaalsContact O-CB 3.31Å; V485-T489 WeakPolarHBondContact O-CB 3.35Å; V485-T489 PolarHBondContact O-N 3.4Å; V485-T489 PolarHBondContact O-OG1 2.88Å; C486-T489 PolarHBondContact O-N 3.46Å; T489-G491 PolarHBondContact O-N 3.39Å
490	L	91.7	Very high	93.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-69.3	-20.6	174.7	-70	168.2	0	0	0	112.6	L401 L405 V407 L422 F426 C486 L492	L401-L490 HydrophobicContact CD1-CD2 3.66Å; L401-L490 HydrophobicContact CD1-CG 4.09Å; L405-L490 WeakPolarHBondContact O-CD2 3.19Å; V407-L490 WeakPolarHBondContact CB-O 3.4Å; V407-L490 HydrophobicContact CG2-CB 4.45Å; V407-L490 WeakPolarHBondContact CG2-O 3.25Å; V407-L490 PolarHBondContact N-O 3.37Å; L422-L490 HydrophobicContact CD1-CD1 4.25Å; L422-L490 HydrophobicContact CD1-CD2 4.04Å; L422-L490 HydrophobicContact CD2-CD1 4.14Å; L422-L490 HydrophobicContact CD2-CD2 4.08Å; F426-L490 HydrophobicContact CE2-CD1 4.07Å; F426-L490 HydrophobicContact CZ-CD1 3.71Å; C486-L490 HydrophobicContact CB-CD1 4.25Å; C486-L490 VanDerWaalsContact O-CB 3.24Å; C486-L490 WeakPolarHBondContact O-CB 3.5Å; C486-L490 WeakPolarHBondContact O-CD1 3.47Å; C486-L490 WeakPolarHBondContact O-CG 3.27Å; C486-L490 PolarHBondContact O-N 3.28Å; L490-L492 HydrophobicContact CB-CD1 3.32Å; L490-L492 HydrophobicContact CD1-CD1 3.97Å; L490-L492 HydrophobicContact CG-CD1 4.28Å
491	G	89.9	Confident	93.3	Very high	24 Å²	24	45.5 Å²	45.5	25%	0.247	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	37.1	179.7	0	0	0	0	0	113.4	Y487 W488 T489	Y487-G491 PolarHBondContact O-N 3.37Å; W488-G491 PolarHBondContact O-N 2.95Å; T489-G491 PolarHBondContact O-N 3.39Å
492	L	88.9	Confident	93.4	Very high	12 Å²	12	42.9 Å²	42.9	6%	0.063	24%	0.244	C	C	.	.			trans	-64.1	173.4	168.4	-80.7	84.9	0	0	0	110.5	Y487 L490 F502 E579	Y487-L492 HydrophobicContact CD2-CB 3.81Å; Y487-L492 HydrophobicContact CD2-CD2 3.93Å; Y487-L492 HydrophobicContact CD2-CG 4.33Å; Y487-L492 HydrophobicContact CE1-CB 4.41Å; Y487-L492 HydrophobicContact CE2-CB 3.55Å; Y487-L492 HydrophobicContact CE2-CD2 3.85Å; Y487-L492 HydrophobicContact CE2-CG 4.29Å; Y487-L492 HydrophobicContact CG-CB 4.34Å; Y487-L492 PolarHBondContact O-N 3.08Å; L490-L492 HydrophobicContact CB-CD1 3.32Å; L490-L492 HydrophobicContact CD1-CD1 3.97Å; L490-L492 HydrophobicContact CG-CD1 4.28Å; L492-F502 HydrophobicContact CD2-CD2 4.34Å; L492-F502 HydrophobicContact CD2-CE2 4.08Å; L492-E579 VanDerWaalsContact CB-OE2 3.3Å; L492-E579 WeakPolarHBondContact CB-OE2 3.42Å; L492-E579 WeakPolarHBondContact CD2-OE2 3.48Å; L492-E579 WeakPolarHBondContact CG-OE2 3.35Å
493	H	89.7	Confident	93.4	Very high	31 Å²	31	43 Å²	43	14%	0.144	25%	0.245	C	C	.	.			trans	-48.1	122.8	-174.1	-165.5	-69.8	0	0	0	112.7	Y487 E495 R498 E579	Y487-H493 WeakPolarHBondContact CE1-O 3.35Å; Y487-H493 PolarHBondContact OH-O 3.22Å; H493-E495 IonicContact CE1-OE2 3.91Å; H493-E495 PolarHBondContact O-N 3.03Å; H493-R498 PolarHBondContact CD2-NH1 3.02Å; H493-R498 WeakPolarHBondContact ND1-CD 3.46Å; H493-E579 PolarHBondContact N-OE2 2.99Å; H493-E579 VanDerWaalsContact N-OE2 3.11Å
494	P	87.8	Confident	93.5	Very high	100 Å²	100	44.4 Å²	44.4	65%	0.649	26%	0.257	S	S	*	.			trans	-75.6	16.4	-161	29.5	-37.2	0	0	0	116.1
495	E	92.6	Very high	93.6	Very high	90 Å²	90	41.8 Å²	41.8	42%	0.421	24%	0.239	S	C	.	.			trans	-93.8	130.3	-172.7	-171.4	179.4	-178.3	0	0	111.9	H493 A497 R498 F499	H493-E495 IonicContact CE1-OE2 3.91Å; H493-E495 PolarHBondContact O-N 3.03Å; E495-A497 VanDerWaalsContact C-N 3.32Å; E495-A497 HydrophobicContact CG-CB 4.4Å; E495-A497 PolarHBondContact O-N 3.07Å; E495-R498 HydrophobicContact CB-CB 4.33Å; E495-R498 HydrophobicContact CB-CG 4.07Å; E495-R498 HydrophobicContact CG-CG 4.43Å; E495-R498 PolarHBondContact O-N 3.32Å; E495-R498 VanDerWaalsContact O-N 3.11Å; E495-R498 IonicContact OE2-CZ 3.85Å; E495-R498 IonicContact OE2-NE 2.91Å; E495-R498 PolarHBondContact OE2-NE 2.99Å; E495-R498 IonicContact OE2-NH2 3.98Å; E495-F499 PolarHBondContact O-N 3.45Å
496	V	93.4	Very high	93.7	Very high	104 Å²	104	39.3 Å²	39.3	63%	0.63	22%	0.224	S	C	*	.	H	α-helix	trans	-63.2	-35.2	-175.6	-178.3	0	0	0	0	112.6	W488 R498 F499 G500	W488-V496 HydrophobicContact CH2-CG2 4.3Å; V496-R498 VanDerWaalsContact C-N 3.31Å; V496-R498 PolarHBondContact O-N 3.48Å; V496-F499 WeakPolarHBondContact O-CB 3.4Å; V496-F499 PolarHBondContact O-N 3.21Å; V496-G500 PolarHBondContact O-N 3.37Å; V496-G500 VanDerWaalsContact O-N 3.08Å
497	A	94.2	Very high	93.8	Very high	49 Å²	49	40.5 Å²	40.5	41%	0.405	23%	0.23	S	C	.	.	H	α-helix	trans	-62.1	-41.2	176.2	0	0	0	0	0	111.6	E495 G500 Y501	E495-A497 VanDerWaalsContact C-N 3.32Å; E495-A497 HydrophobicContact CG-CB 4.4Å; E495-A497 PolarHBondContact O-N 3.07Å; A497-G500 WeakPolarHBondContact O-CA 3.43Å; A497-G500 PolarHBondContact O-N 3.26Å; A497-G500 VanDerWaalsContact O-N 3.12Å; A497-Y501 WeakPolarHBondContact O-CD2 3.26Å; A497-Y501 PolarHBondContact O-N 3.22Å
498	R	93.6	Very high	94	Very high	31 Å²	31	40.4 Å²	40.4	12%	0.117	23%	0.23	C	C	.	.	H	α-helix	trans	-71.3	-31.9	178.7	-62.9	-174.9	-174.2	-144.3	8.7	113	Y487 H493 E495 V496 G500 Y501 F502 N578 Y581	Y487-R498 WeakPolarHBondContact OH-CB 3.28Å; H493-R498 PolarHBondContact CD2-NH1 3.02Å; H493-R498 WeakPolarHBondContact ND1-CD 3.46Å; E495-R498 HydrophobicContact CB-CB 4.33Å; E495-R498 HydrophobicContact CB-CG 4.07Å; E495-R498 HydrophobicContact CG-CG 4.43Å; E495-R498 PolarHBondContact O-N 3.32Å; E495-R498 VanDerWaalsContact O-N 3.11Å; E495-R498 IonicContact OE2-CZ 3.85Å; E495-R498 IonicContact OE2-NE 2.91Å; E495-R498 PolarHBondContact OE2-NE 2.99Å; E495-R498 IonicContact OE2-NH2 3.98Å; V496-R498 VanDerWaalsContact C-N 3.31Å; V496-R498 PolarHBondContact O-N 3.48Å; R498-G500 VanDerWaalsContact C-N 3.31Å; R498-Y501 PolarHBondContact O-N 3.08Å; R498-F502 VanDerWaalsContact O-CB 3.31Å; R498-F502 WeakPolarHBondContact O-CB 3.3Å; R498-F502 PolarHBondContact O-N 3.19Å; R498-N578 VanDerWaalsContact CA-OD1 3.32Å; R498-N578 WeakPolarHBondContact CA-OD1 3.17Å; R498-N578 VanDerWaalsContact CB-OD1 3.3Å; R498-N578 WeakPolarHBondContact CB-OD1 3.39Å; R498-N578 WeakPolarHBondContact CD-O 3.16Å; R498-N578 WeakPolarHBondContact CG-OD1 3.35Å; R498-N578 PolarHBondContact NH1-O 3.42Å; R498-N578 PolarHBondContact O-ND2 2.92Å; R498-N578 PolarHBondContact O-OD1 3.39Å; R498-Y581 VanDerWaalsContact CZ-O 3.25Å; R498-Y581 PolarHBondContact NH1-O 3.37Å; R498-Y581 PolarHBondContact NH2-O 3.03Å
499	F	96.1	Very high	94	Very high	26 Å²	26	35.3 Å²	35.3	11%	0.114	21%	0.21	C	C	.	.	H	α-helix	trans	-59.9	-42.4	166.8	167.2	-102.7	0	0	0	111.7	M480 S483 Y487 W488 E495 V496 F502 S503	M480-F499 HydrophobicContact CE-CE1 4Å; M480-F499 HydrophobicContact CE-CZ 4.09Å; S483-F499 WeakPolarHBondContact OG-CE2 3.39Å; Y487-F499 HydrophobicContact CD1-CB 3.94Å; Y487-F499 AromaticContact CD1-CD2 3.64Å; Y487-F499 HydrophobicContact CD1-CD2 3.64Å; Y487-F499 HydrophobicContact CD1-CG 4.24Å; Y487-F499 HydrophobicContact CD2-CD2 4.48Å; Y487-F499 HydrophobicContact CE1-CB 3.68Å; Y487-F499 HydrophobicContact CE1-CD2 4.26Å; Y487-F499 HydrophobicContact CE1-CG 4.47Å; Y487-F499 AromaticContact CG-CD2 3.75Å; Y487-F499 HydrophobicContact CG-CD2 3.75Å; W488-F499 HydrophobicContact CZ2-CB 4.37Å; W488-F499 HydrophobicContact CZ2-CG 4.44Å; W488-F499 AromaticContact NE1-CD2 3.87Å; E495-F499 PolarHBondContact O-N 3.45Å; V496-F499 WeakPolarHBondContact O-CB 3.4Å; V496-F499 PolarHBondContact O-N 3.21Å; F499-F502 PolarHBondContact O-N 3.28Å; F499-S503 WeakPolarHBondContact O-CB 3.3Å; F499-S503 PolarHBondContact O-N 2.87Å; F499-S503 PolarHBondContact O-OG 3.17Å
500	G	96.1	Very high	94.2	Very high	35 Å²	35	32.1 Å²	32.1	36%	0.361	19%	0.191	S	C	.	.	H	α-helix	trans	-60.4	-48.4	174.6	0	0	0	0	0	112.3	V496 A497 R498 F502 S503 A504	V496-G500 PolarHBondContact O-N 3.37Å; V496-G500 VanDerWaalsContact O-N 3.08Å; A497-G500 WeakPolarHBondContact O-CA 3.43Å; A497-G500 PolarHBondContact O-N 3.26Å; A497-G500 VanDerWaalsContact O-N 3.12Å; R498-G500 VanDerWaalsContact C-N 3.31Å; G500-F502 PolarHBondContact O-N 3.42Å; G500-S503 PolarHBondContact O-N 3.03Å; G500-A504 WeakPolarHBondContact O-CB 3.31Å; G500-A504 PolarHBondContact O-N 3.43Å
501	Y	95.9	Very high	94.4	Very high	110 Å²	110	32.4 Å²	32.4	43%	0.431	19%	0.192	S	C	.	.	H	α-helix	trans	-62.6	-41.4	175.9	-63.2	-43.5	0	0	0	112.8	A497 R498 A504 A505 F620 F624	A497-Y501 WeakPolarHBondContact O-CD2 3.26Å; A497-Y501 PolarHBondContact O-N 3.22Å; R498-Y501 PolarHBondContact O-N 3.08Å; Y501-A504 PolarHBondContact O-N 2.88Å; Y501-A505 WeakPolarHBondContact O-CB 3.25Å; Y501-A505 PolarHBondContact O-N 2.87Å; Y501-F620 HydrophobicContact CD2-CE1 4.35Å; Y501-F620 HydrophobicContact CD2-CZ 4.13Å; Y501-F620 HydrophobicContact CE2-CE1 4.45Å; Y501-F620 HydrophobicContact CG-CE1 4.45Å; Y501-F620 HydrophobicContact CG-CZ 4.15Å; Y501-F624 HydrophobicContact CD1-CE2 4.18Å; Y501-F624 HydrophobicContact CD1-CZ 4.09Å; Y501-F624 HydrophobicContact CG-CZ 4.42Å
502	F	96.3	Very high	94.8	Very high	3 Å²	3	31.4 Å²	31.4	1%	0.013	18%	0.181	C	C	.	.	H	α-helix	trans	-59.5	-47.7	174.8	176.7	-93.3	0	0	0	111.7	L423 F426 F482 Y487 L492 R498 F499 G500 A504 A505 L506 L575	L423-F502 HydrophobicContact CD2-CE2 4.35Å; F426-F502 HydrophobicContact CD2-CE2 4.15Å; F426-F502 AromaticContact CD2-CZ 3.95Å; F426-F502 HydrophobicContact CD2-CZ 3.95Å; F426-F502 HydrophobicContact CE2-CE2 4.34Å; F426-F502 AromaticContact CE2-CZ 3.93Å; F426-F502 HydrophobicContact CE2-CZ 3.93Å; F482-F502 HydrophobicContact CE1-CE1 4.43Å; Y487-F502 HydrophobicContact CD2-CB 4.07Å; Y487-F502 AromaticContact CD2-CD1 3.65Å; Y487-F502 HydrophobicContact CD2-CD1 3.65Å; Y487-F502 HydrophobicContact CD2-CD2 4.01Å; Y487-F502 HydrophobicContact CD2-CE1 4.02Å; Y487-F502 HydrophobicContact CD2-CE2 4.36Å; Y487-F502 AromaticContact CD2-CG 3.64Å; Y487-F502 HydrophobicContact CD2-CG 3.64Å; Y487-F502 HydrophobicContact CD2-CZ 4.35Å; Y487-F502 HydrophobicContact CE2-CB 3.88Å; Y487-F502 HydrophobicContact CE2-CD1 4.32Å; Y487-F502 HydrophobicContact CE2-CD2 4.13Å; Y487-F502 AromaticContact CE2-CG 3.87Å; Y487-F502 HydrophobicContact CE2-CG 3.87Å; Y487-F502 HydrophobicContact CG-CD1 4.39Å; L492-F502 HydrophobicContact CD2-CD2 4.34Å; L492-F502 HydrophobicContact CD2-CE2 4.08Å; R498-F502 VanDerWaalsContact O-CB 3.31Å; R498-F502 WeakPolarHBondContact O-CB 3.3Å; R498-F502 PolarHBondContact O-N 3.19Å; F499-F502 PolarHBondContact O-N 3.28Å; G500-F502 PolarHBondContact O-N 3.42Å; F502-A504 PolarHBondContact O-N 3.03Å; F502-A505 PolarHBondContact O-N 2.81Å; F502-L506 HydrophobicContact CD1-CD1 4.12Å; F502-L506 HydrophobicContact CD2-CD1 4.37Å; F502-L506 HydrophobicContact CE1-CD1 3.51Å; F502-L506 HydrophobicContact CE2-CD1 3.78Å; F502-L506 HydrophobicContact CZ-CD1 3.31Å; F502-L506 HydrophobicContact CZ-CG 4.49Å; F502-L506 WeakPolarHBondContact O-CG 3.4Å; F502-L506 PolarHBondContact O-N 2.75Å; F502-L506 VanDerWaalsContact O-N 3.08Å; F502-L575 HydrophobicContact CD2-CD2 3.58Å; F502-L575 HydrophobicContact CE2-CD2 4.1Å; F502-L575 HydrophobicContact CG-CD2 4.36Å
503	S	96.8	Very high	95.1	Very high	5 Å²	5	30.8 Å²	30.8	4%	0.035	18%	0.178	C	C	.	.	H	α-helix	trans	-63.3	-43.7	178.9	-57.1	0	0	0	0	111.6	T479 S483 F499 G500 L506 L507	T479-S503 WeakPolarHBondContact CG2-O 3.49Å; S483-S503 WeakPolarHBondContact CB-OG 3.21Å; S483-S503 PolarHBondContact OG-OG 3.45Å; F499-S503 WeakPolarHBondContact O-CB 3.3Å; F499-S503 PolarHBondContact O-N 2.87Å; F499-S503 PolarHBondContact O-OG 3.17Å; G500-S503 PolarHBondContact O-N 3.03Å; S503-L506 PolarHBondContact O-N 3.48Å; S503-L507 WeakPolarHBondContact O-CB 3.46Å; S503-L507 PolarHBondContact O-N 3.3Å
504	A	96.6	Very high	95.4	Very high	30 Å²	30	29.3 Å²	29.3	25%	0.248	17%	0.171	C	C	.	.	H	α-helix	trans	-66.8	-37.7	176.1	0	0	0	0	0	112.3	G500 Y501 F502 L506 L507 F624 Y628	G500-A504 WeakPolarHBondContact O-CB 3.31Å; G500-A504 PolarHBondContact O-N 3.43Å; Y501-A504 PolarHBondContact O-N 2.88Å; F502-A504 PolarHBondContact O-N 3.03Å; A504-L506 VanDerWaalsContact C-N 3.32Å; A504-L506 PolarHBondContact O-N 3.3Å; A504-L507 PolarHBondContact O-N 3.08Å; A504-F624 HydrophobicContact CB-CE1 4.01Å; A504-Y628 PolarHBondContact O-OH 2.87Å
505	A	96.4	Very high	95.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-66	-34	178.5	0	0	0	0	0	112.1	Y501 F502 P509 C571 I574 L575 F624	Y501-A505 WeakPolarHBondContact O-CB 3.25Å; Y501-A505 PolarHBondContact O-N 2.87Å; F502-A505 PolarHBondContact O-N 2.81Å; A505-P509 WeakPolarHBondContact O-CD 3.48Å; A505-P509 WeakPolarHBondContact O-CG 3.44Å; A505-C571 PolarHBondContact O-SG 3.3Å; A505-I574 HydrophobicContact CB-CG2 3.79Å; A505-L575 HydrophobicContact CB-CD2 3.74Å; A505-L575 HydrophobicContact CB-CG 4.11Å; A505-F624 HydrophobicContact CB-CE1 4.41Å; A505-F624 HydrophobicContact CB-CZ 4.4Å
506	L	96.1	Very high	96	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-87.7	-21	179.1	-65.8	-177.2	0	0	0	114.1	F426 T430 T479 F482 F502 S503 A504 A508 H510 L575	F426-L506 HydrophobicContact CB-CD1 4.15Å; F426-L506 HydrophobicContact CB-CD2 3.89Å; F426-L506 HydrophobicContact CG-CD1 4.37Å; T430-L506 HydrophobicContact CG2-CB 4.34Å; T430-L506 HydrophobicContact CG2-CD2 4.29Å; T479-L506 HydrophobicContact CG2-CB 4.4Å; F482-L506 HydrophobicContact CE1-CD1 3.6Å; F482-L506 HydrophobicContact CZ-CD1 4.27Å; F502-L506 HydrophobicContact CD1-CD1 4.12Å; F502-L506 HydrophobicContact CD2-CD1 4.37Å; F502-L506 HydrophobicContact CE1-CD1 3.51Å; F502-L506 HydrophobicContact CE2-CD1 3.78Å; F502-L506 HydrophobicContact CZ-CD1 3.31Å; F502-L506 HydrophobicContact CZ-CG 4.49Å; F502-L506 WeakPolarHBondContact O-CG 3.4Å; F502-L506 PolarHBondContact O-N 2.75Å; F502-L506 VanDerWaalsContact O-N 3.08Å; S503-L506 PolarHBondContact O-N 3.48Å; A504-L506 VanDerWaalsContact C-N 3.32Å; A504-L506 PolarHBondContact O-N 3.3Å; L506-A508 VanDerWaalsContact C-N 3.34Å; L506-H510 PolarHBondContact O-N 3.37Å; L506-L575 HydrophobicContact CD2-CD1 3.77Å; L506-L575 HydrophobicContact CG-CD2 4.45Å
507	L	97.1	Very high	96.1	Very high	24 Å²	24	17.2 Å²	17.2	13%	0.126	10%	0.1	C	C	.	.	H	α-helix	trans	-62.9	-41.2	171.7	177.4	61.9	0	0	0	111.6	V476 T479 S503 A504 H510 L511	V476-L507 HydrophobicContact CG2-CD1 4.1Å; V476-L507 HydrophobicContact CG2-CD2 3.83Å; T479-L507 HydrophobicContact CG2-CB 4.1Å; S503-L507 WeakPolarHBondContact O-CB 3.46Å; S503-L507 PolarHBondContact O-N 3.3Å; A504-L507 PolarHBondContact O-N 3.08Å; L507-H510 PolarHBondContact O-N 3.17Å; L507-L511 HydrophobicContact CD1-CD1 4.06Å; L507-L511 HydrophobicContact CD1-CG 4.11Å; L507-L511 HydrophobicContact CG-CD1 4.01Å; L507-L511 HydrophobicContact CG-CG 4.43Å; L507-L511 WeakPolarHBondContact O-CG 3.32Å; L507-L511 PolarHBondContact O-N 2.87Å
508	A	96.7	Very high	96.2	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-64	-52.4	-175.9	0	0	0	0	0	113.2	L506 H510 L511 I512 L627 Y628 I631	L506-A508 VanDerWaalsContact C-N 3.34Å; A508-H510 VanDerWaalsContact C-N 3.27Å; A508-H510 PolarHBondContact O-N 3.42Å; A508-L511 PolarHBondContact O-N 2.83Å; A508-I512 WeakPolarHBondContact O-CB 3.19Å; A508-I512 WeakPolarHBondContact O-CG1 3.41Å; A508-I512 PolarHBondContact O-N 2.99Å; A508-L627 HydrophobicContact CB-CD1 4.07Å; A508-L627 HydrophobicContact CB-CD2 3.87Å; A508-L627 HydrophobicContact CB-CG 3.64Å; A508-Y628 HydrophobicContact CB-CD2 4.19Å; A508-Y628 HydrophobicContact CB-CE1 4.27Å; A508-Y628 HydrophobicContact CB-CE2 3.88Å; A508-I631 HydrophobicContact CB-CD1 4.24Å
509	P	96.1	Very high	96.3	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-55.3	-39.6	173.6	-27.3	34.2	0	0	0	113.5	T430 P431 A505 I512 G513 F567 C571	T430-P509 WeakPolarHBondContact OG1-CB 3.2Å; P431-P509 VanDerWaalsContact CA-O 3.28Å; P431-P509 WeakPolarHBondContact CA-O 3.28Å; P431-P509 WeakPolarHBondContact CB-O 3.42Å; A505-P509 WeakPolarHBondContact O-CD 3.48Å; A505-P509 WeakPolarHBondContact O-CG 3.44Å; P509-I512 PolarHBondContact O-N 3.37Å; P509-G513 PolarHBondContact O-N 3.31Å; P509-F567 HydrophobicContact CB-CD2 4.35Å; P509-F567 HydrophobicContact CB-CE2 3.98Å; P509-F567 HydrophobicContact CG-CD2 4.44Å; P509-C571 HydrophobicContact CG-CB 4.17Å; P509-C571 WeakPolarHBondContact CG-SG 3.3Å
510	H	96.1	Very high	96.2	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-61.1	-46.4	176.7	-178.5	72.7	0	0	0	112.2	T430 T433 G434 S475 L506 L507 A508 E514	T430-H510 WeakPolarHBondContact O-CA 2.9Å; T430-H510 PolarHBondContact O-ND1 2.84Å; T433-H510 PolarHBondContact OG1-CE1 3.46Å; T433-H510 PolarHBondContact OG1-ND1 3.41Å; G434-H510 WeakPolarHBondContact CA-O 3.37Å; G434-H510 PolarHBondContact N-ND1 2.9Å; S475-H510 PolarHBondContact OG-CD2 2.83Å; S475-H510 PolarHBondContact OG-NE2 3.33Å; S475-H510 VanDerWaalsContact OG-NE2 3.13Å; L506-H510 PolarHBondContact O-N 3.37Å; L507-H510 PolarHBondContact O-N 3.17Å; A508-H510 VanDerWaalsContact C-N 3.27Å; A508-H510 PolarHBondContact O-N 3.42Å; H510-E514 PolarHBondContact O-N 2.89Å
511	L	96.7	Very high	96.1	Very high	6 Å²	6	12.4 Å²	12.4	3%	0.031	6%	0.063	C	C	.	.	H	α-helix	trans	-67.3	-38.7	174.7	-68.9	177.6	0	0	0	112.5	L472 L507 A508 E514 F515 I631	L472-L511 HydrophobicContact CD2-CD1 3.82Å; L472-L511 HydrophobicContact CD2-CD2 3.9Å; L507-L511 HydrophobicContact CD1-CD1 4.06Å; L507-L511 HydrophobicContact CD1-CG 4.11Å; L507-L511 HydrophobicContact CG-CD1 4.01Å; L507-L511 HydrophobicContact CG-CG 4.43Å; L507-L511 WeakPolarHBondContact O-CG 3.32Å; L507-L511 PolarHBondContact O-N 2.87Å; A508-L511 PolarHBondContact O-N 2.83Å; L511-E514 PolarHBondContact O-N 3.31Å; L511-F515 HydrophobicContact CB-CD2 4.29Å; L511-F515 HydrophobicContact CB-CE2 3.89Å; L511-F515 HydrophobicContact CD2-CE2 4.29Å; L511-F515 HydrophobicContact CD2-CZ 4.16Å; L511-F515 WeakPolarHBondContact O-CD2 3.49Å; L511-F515 VanDerWaalsContact O-CG 3.28Å; L511-F515 WeakPolarHBondContact O-CG 3.31Å; L511-F515 PolarHBondContact O-N 2.64Å; L511-I631 HydrophobicContact CB-CD1 4.07Å; L511-I631 HydrophobicContact CB-CG1 4.32Å; L511-I631 HydrophobicContact CD1-CD1 3.98Å
512	I	96.8	Very high	95.8	Very high	3 Å²	3	7.3 Å²	7.3	2%	0.015	4%	0.044	C	C	.	.	H	α-helix	trans	-62.2	-47.2	178.1	-72.2	165.2	0	0	0	110.6	A508 P509 E514 F515 L516 F567 L627 F630 I631 L634	A508-I512 WeakPolarHBondContact O-CB 3.19Å; A508-I512 WeakPolarHBondContact O-CG1 3.41Å; A508-I512 PolarHBondContact O-N 2.99Å; P509-I512 PolarHBondContact O-N 3.37Å; I512-E514 VanDerWaalsContact C-N 3.27Å; I512-E514 PolarHBondContact O-N 2.93Å; I512-F515 PolarHBondContact O-N 3.48Å; I512-L516 WeakPolarHBondContact O-CB 3.47Å; I512-L516 PolarHBondContact O-N 3.29Å; I512-F567 HydrophobicContact CD1-CB 3.74Å; I512-F567 HydrophobicContact CD1-CD1 4.39Å; I512-F567 HydrophobicContact CD1-CD2 4.03Å; I512-F567 HydrophobicContact CD1-CG 3.8Å; I512-F567 HydrophobicContact CG2-CD1 3.54Å; I512-F567 HydrophobicContact CG2-CD2 4.39Å; I512-F567 HydrophobicContact CG2-CE1 3.48Å; I512-F567 VanDerWaalsContact CG2-CE1 3.48Å; I512-F567 HydrophobicContact CG2-CE2 4.36Å; I512-F567 HydrophobicContact CG2-CG 4.01Å; I512-F567 HydrophobicContact CG2-CZ 3.92Å; I512-L627 HydrophobicContact CD1-CD1 4.09Å; I512-F630 HydrophobicContact CD1-CB 3.81Å; I512-F630 HydrophobicContact CD1-CG 4.47Å; I512-F630 HydrophobicContact CG1-CB 4.07Å; I512-I631 HydrophobicContact CG1-CG1 3.92Å; I512-L634 HydrophobicContact CB-CD1 4.35Å; I512-L634 HydrophobicContact CG1-CD1 4.42Å; I512-L634 HydrophobicContact CG2-CD1 3.87Å
513	G	95.8	Very high	95.6	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-59.8	-39.5	177	0	0	0	0	0	112.2	P431 P509 T517	P431-G513 WeakPolarHBondContact O-CA 3.06Å; P509-G513 PolarHBondContact O-N 3.31Å; G513-T517 WeakPolarHBondContact O-CB 3.47Å; G513-T517 PolarHBondContact O-N 2.75Å; G513-T517 VanDerWaalsContact O-N 3.17Å; G513-T517 PolarHBondContact O-OG1 3.26Å
514	E	95.8	Very high	95.3	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-67.2	-50.3	176.1	-170.6	148.6	-164.5	0	0	112.7	R389 G434 A438 Y467 V471 H510 L511 I512 T517 L518	R389-E514 IonicContact CZ-OE1 2.7Å; R389-E514 IonicContact CZ-OE2 2.63Å; R389-E514 IonicContact NH1-OE1 2.74Å; R389-E514 PolarHBondContact NH1-OE1 3.4Å; R389-E514 IonicContact NH1-OE2 3.9Å; R389-E514 VanDerWaalsContact NH2-CD 3.34Å; R389-E514 IonicContact NH2-OE1 3.3Å; R389-E514 PolarHBondContact NH2-OE1 2.84Å; R389-E514 IonicContact NH2-OE2 3.76Å; R389-E514 PolarHBondContact NH2-OE2 2.85Å; G434-E514 WeakPolarHBondContact O-CA 3.48Å; G434-E514 WeakPolarHBondContact O-CB 3.4Å; A438-E514 HydrophobicContact CB-CG 3.89Å; Y467-E514 HydrophobicContact CE1-CG 4.25Å; Y467-E514 WeakPolarHBondContact CE1-OE1 3.44Å; Y467-E514 PolarHBondContact OH-OE1 3.36Å; V471-E514 HydrophobicContact CG2-CG 4.35Å; V471-E514 WeakPolarHBondContact CG2-OE1 3.13Å; V471-E514 WeakPolarHBondContact CG2-OE2 3.41Å; H510-E514 PolarHBondContact O-N 2.89Å; L511-E514 PolarHBondContact O-N 3.31Å; I512-E514 VanDerWaalsContact C-N 3.27Å; I512-E514 PolarHBondContact O-N 2.93Å; E514-T517 WeakPolarHBondContact O-CB 3.4Å; E514-T517 PolarHBondContact O-N 3.43Å; E514-L518 WeakPolarHBondContact O-CG 3.27Å; E514-L518 PolarHBondContact O-N 3.47Å
515	F	96.4	Very high	94.8	Very high	4 Å²	4	19.1 Å²	19.1	2%	0.018	10%	0.097	C	C	.	.	H	α-helix	trans	-70	-36.4	-178.6	-60.3	-33.9	0	0	0	113.2	V468 V471 L472 L511 I512 T517 L518 V519 I631 L634 V635	V468-F515 HydrophobicContact CB-CE1 4.07Å; V468-F515 HydrophobicContact CG1-CE1 3.79Å; V468-F515 HydrophobicContact CG1-CZ 3.85Å; V468-F515 HydrophobicContact CG2-CD1 3.99Å; V468-F515 HydrophobicContact CG2-CE1 3.79Å; V471-F515 HydrophobicContact CG1-CE1 3.7Å; V471-F515 HydrophobicContact CG1-CZ 4.04Å; L472-F515 HydrophobicContact CD2-CZ 4.14Å; L511-F515 HydrophobicContact CB-CD2 4.29Å; L511-F515 HydrophobicContact CB-CE2 3.89Å; L511-F515 HydrophobicContact CD2-CE2 4.29Å; L511-F515 HydrophobicContact CD2-CZ 4.16Å; L511-F515 WeakPolarHBondContact O-CD2 3.49Å; L511-F515 VanDerWaalsContact O-CG 3.28Å; L511-F515 WeakPolarHBondContact O-CG 3.31Å; L511-F515 PolarHBondContact O-N 2.64Å; I512-F515 PolarHBondContact O-N 3.48Å; F515-T517 VanDerWaalsContact C-N 3.27Å; F515-T517 PolarHBondContact O-N 3.36Å; F515-L518 HydrophobicContact CD1-CD1 3.86Å; F515-L518 HydrophobicContact CE1-CD1 4.5Å; F515-L518 WeakPolarHBondContact O-CB 3.22Å; F515-L518 PolarHBondContact O-N 2.67Å; F515-V519 WeakPolarHBondContact O-CG2 3.28Å; F515-V519 PolarHBondContact O-N 3.07Å; F515-I631 HydrophobicContact CD2-CG2 3.84Å; F515-I631 HydrophobicContact CE2-CG2 3.54Å; F515-L634 HydrophobicContact CB-CB 3.98Å; F515-L634 HydrophobicContact CB-CD1 4.32Å; F515-V635 HydrophobicContact CD2-CG2 4.14Å; F515-V635 HydrophobicContact CE2-CG2 4.33Å; F515-V635 HydrophobicContact CG-CG2 4.29Å
516	L	96.2	Very high	94.6	Very high	36 Å²	36	22.7 Å²	22.7	19%	0.188	12%	0.116	C	C	.	.	H	α-helix	trans	-58.8	-42.8	171.6	177.9	62	0	0	0	110.9	I512 L518 V519 L520 V534 L634	I512-L516 WeakPolarHBondContact O-CB 3.47Å; I512-L516 PolarHBondContact O-N 3.29Å; L516-L518 VanDerWaalsContact C-N 3.34Å; L516-L518 PolarHBondContact O-N 2.9Å; L516-V519 PolarHBondContact O-N 3.07Å; L516-L520 HydrophobicContact CD1-CD1 4.28Å; L516-L520 HydrophobicContact CG-CD1 4.23Å; L516-L520 WeakPolarHBondContact O-CG 3.4Å; L516-L520 PolarHBondContact O-N 3.33Å; L516-V534 HydrophobicContact CD2-CG1 4.41Å; L516-L634 HydrophobicContact CB-CD1 4.37Å; L516-L634 HydrophobicContact CB-CD2 4.41Å; L516-L634 HydrophobicContact CD1-CD2 4.15Å
517	T	96.5	Very high	94.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-62.1	-41.4	175.6	-59.6	0	0	0	0	111.6	M435 A438 V439 G513 E514 F515 L520 L521 V530	M435-T517 WeakPolarHBondContact CA-OG1 3.3Å; M435-T517 WeakPolarHBondContact CB-OG1 3.17Å; M435-T517 HydrophobicContact CG-CG2 4.24Å; M435-T517 WeakPolarHBondContact CG-OG1 3.24Å; A438-T517 HydrophobicContact CB-CG2 3.58Å; V439-T517 HydrophobicContact CG2-CG2 3.43Å; V439-T517 VanDerWaalsContact CG2-CG2 3.43Å; G513-T517 WeakPolarHBondContact O-CB 3.47Å; G513-T517 PolarHBondContact O-N 2.75Å; G513-T517 VanDerWaalsContact O-N 3.17Å; G513-T517 PolarHBondContact O-OG1 3.26Å; E514-T517 WeakPolarHBondContact O-CB 3.4Å; E514-T517 PolarHBondContact O-N 3.43Å; F515-T517 VanDerWaalsContact C-N 3.27Å; F515-T517 PolarHBondContact O-N 3.36Å; T517-L520 PolarHBondContact O-N 3.44Å; T517-L521 HydrophobicContact CG2-CD1 3.92Å; T517-L521 HydrophobicContact CG2-CG 4.36Å; T517-L521 WeakPolarHBondContact O-CB 3.42Å; T517-L521 WeakPolarHBondContact O-CG 3.44Å; T517-L521 PolarHBondContact O-N 2.89Å; T517-V530 HydrophobicContact CG2-CG1 3.97Å
518	L	95.4	Very high	94.3	Very high	3 Å²	3	28.6 Å²	28.6	2%	0.016	15%	0.15	C	C	.	.	H	α-helix	trans	-62.7	-44.4	176.1	-65	177.4	0	0	0	112.6	A438 F442 L464 Y467 V468 E514 F515 L516 L520 L521 G522	A438-L518 HydrophobicContact CB-CD2 4.01Å; A438-L518 HydrophobicContact CB-CG 4.34Å; F442-L518 HydrophobicContact CB-CD2 3.75Å; F442-L518 HydrophobicContact CD1-CD2 3.78Å; F442-L518 HydrophobicContact CD2-CD2 3.44Å; F442-L518 VanDerWaalsContact CD2-CD2 3.44Å; F442-L518 HydrophobicContact CE1-CD2 4.24Å; F442-L518 HydrophobicContact CE2-CD2 3.93Å; F442-L518 HydrophobicContact CG-CD2 3.35Å; F442-L518 HydrophobicContact CZ-CD2 4.3Å; L464-L518 HydrophobicContact CD1-CB 3.82Å; L464-L518 HydrophobicContact CD1-CD1 3.92Å; L464-L518 HydrophobicContact CD1-CG 4.33Å; Y467-L518 HydrophobicContact CD1-CD1 3.33Å; Y467-L518 HydrophobicContact CD1-CD2 3.81Å; Y467-L518 HydrophobicContact CD1-CG 4.15Å; Y467-L518 HydrophobicContact CE1-CD1 3.64Å; Y467-L518 HydrophobicContact CE1-CD2 3.74Å; Y467-L518 HydrophobicContact CE1-CG 4.12Å; Y467-L518 HydrophobicContact CG-CD1 4.33Å; Y467-L518 HydrophobicContact CG-CD2 4.36Å; V468-L518 HydrophobicContact CG2-CD1 4Å; E514-L518 WeakPolarHBondContact O-CG 3.27Å; E514-L518 PolarHBondContact O-N 3.47Å; F515-L518 HydrophobicContact CD1-CD1 3.86Å; F515-L518 HydrophobicContact CE1-CD1 4.5Å; F515-L518 WeakPolarHBondContact O-CB 3.22Å; F515-L518 PolarHBondContact O-N 2.67Å; L516-L518 VanDerWaalsContact C-N 3.34Å; L516-L518 PolarHBondContact O-N 2.9Å; L518-L520 VanDerWaalsContact C-N 3.31Å; L518-L520 PolarHBondContact O-N 3.28Å; L518-L521 PolarHBondContact O-N 2.88Å; L518-G522 PolarHBondContact O-N 3.46Å
519	V	95.9	Very high	94.2	Very high	8 Å²	8	32.8 Å²	32.8	5%	0.048	17%	0.171	C	C	.	.	H	α-helix	trans	-57.1	-48.9	175.8	173.6	0	0	0	0	109.7	F515 L516 G522 I523 L634 L637 V641	F515-V519 WeakPolarHBondContact O-CG2 3.28Å; F515-V519 PolarHBondContact O-N 3.07Å; L516-V519 PolarHBondContact O-N 3.07Å; V519-G522 WeakPolarHBondContact O-CA 3.23Å; V519-G522 PolarHBondContact O-N 3.04Å; V519-I523 PolarHBondContact O-N 3.49Å; V519-L634 HydrophobicContact CG2-CD2 4.46Å; V519-L634 VanDerWaalsContact CG2-O 3.31Å; V519-L634 WeakPolarHBondContact CG2-O 3.49Å; V519-L637 HydrophobicContact CG1-CD2 3.93Å; V519-L637 HydrophobicContact CG1-CG 4.01Å; V519-V641 HydrophobicContact CG1-CG2 4.15Å
520	L	95.3	Very high	94.2	Very high	28 Å²	28	32.8 Å²	32.8	15%	0.147	17%	0.171	C	C	.	.	H	α-helix	trans	-68.2	-35.5	179.9	-71.6	170.2	0	0	0	112.9	L516 T517 L518 G522 I523 I524 V530 V533 V534	L516-L520 HydrophobicContact CD1-CD1 4.28Å; L516-L520 HydrophobicContact CG-CD1 4.23Å; L516-L520 WeakPolarHBondContact O-CG 3.4Å; L516-L520 PolarHBondContact O-N 3.33Å; T517-L520 PolarHBondContact O-N 3.44Å; L518-L520 VanDerWaalsContact C-N 3.31Å; L518-L520 PolarHBondContact O-N 3.28Å; L520-G522 PolarHBondContact O-N 2.93Å; L520-I523 PolarHBondContact O-N 2.9Å; L520-I523 VanDerWaalsContact O-N 3.1Å; L520-I524 HydrophobicContact CD2-CD1 4.41Å; L520-I524 WeakPolarHBondContact O-CA 3.36Å; L520-I524 WeakPolarHBondContact O-CB 3.05Å; L520-I524 PolarHBondContact O-N 3.34Å; L520-V530 HydrophobicContact CB-CG1 3.69Å; L520-V530 HydrophobicContact CB-CG2 4.23Å; L520-V530 HydrophobicContact CD1-CG1 4.5Å; L520-V533 HydrophobicContact CD1-CG1 4.29Å; L520-V534 HydrophobicContact CD1-CG2 3.35Å
521	L	93.5	Very high	94.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.5	-21.8	170.6	-76.5	168.8	0	0	0	112.6	F442 P443 R446 T517 L518 P527 V530 R645	F442-L521 HydrophobicContact CB-CD1 4.08Å; F442-L521 HydrophobicContact CD1-CB 4.08Å; F442-L521 HydrophobicContact CD1-CD1 3.86Å; F442-L521 HydrophobicContact CE1-CB 4.39Å; F442-L521 HydrophobicContact CG-CD1 4.4Å; P443-L521 HydrophobicContact CG-CD2 4.47Å; R446-L521 WeakPolarHBondContact CD-O 3.39Å; R446-L521 PolarHBondContact NH1-O 3.4Å; T517-L521 HydrophobicContact CG2-CD1 3.92Å; T517-L521 HydrophobicContact CG2-CG 4.36Å; T517-L521 WeakPolarHBondContact O-CB 3.42Å; T517-L521 WeakPolarHBondContact O-CG 3.44Å; T517-L521 PolarHBondContact O-N 2.89Å; L518-L521 PolarHBondContact O-N 2.88Å; L521-P527 HydrophobicContact CD2-CB 4.03Å; L521-P527 HydrophobicContact CD2-CG 4.26Å; L521-V530 HydrophobicContact CD2-CB 4.26Å; L521-V530 HydrophobicContact CD2-CG1 4.48Å; L521-V530 HydrophobicContact CD2-CG2 4Å; L521-V530 HydrophobicContact CG-CB 4.49Å; L521-V530 HydrophobicContact CG-CG1 4.19Å; L521-V530 HydrophobicContact CG-CG2 4.33Å; L521-R645 PolarHBondContact O-NH1 2.78Å; L521-R645 VanDerWaalsContact O-NH1 3.1Å
522	G	89.6	Confident	94	Very high	4 Å²	4	38.4 Å²	38.4	4%	0.041	21%	0.208	C	C	.	.	H	α-helix	trans	-69.8	-38.4	169.9	0	0	0	0	0	112.8	L518 V519 L520 F642 R645	L518-G522 PolarHBondContact O-N 3.46Å; V519-G522 WeakPolarHBondContact O-CA 3.23Å; V519-G522 PolarHBondContact O-N 3.04Å; L520-G522 PolarHBondContact O-N 2.93Å; G522-F642 VanDerWaalsContact CA-CE2 3.41Å; G522-R645 PolarHBondContact O-NH1 3.05Å
523	I	91.3	Very high	93.9	Very high	108 Å²	108	40.9 Å²	40.9	55%	0.554	22%	0.222	S	C	*	.	H	α-helix	trans	-88	-53.2	-177.6	-57.5	174.1	0	0	0	111.4	V519 L520 V641	V519-I523 PolarHBondContact O-N 3.49Å; L520-I523 PolarHBondContact O-N 2.9Å; L520-I523 VanDerWaalsContact O-N 3.1Å; I523-V641 HydrophobicContact CD1-CG1 4.49Å; I523-V641 HydrophobicContact CD1-CG2 4.17Å; I523-V641 HydrophobicContact CG1-CG1 3.61Å; I523-V641 HydrophobicContact CG1-CG2 4.14Å
524	I	91.9	Very high	93.9	Very high	47 Å²	47	40.9 Å²	40.9	24%	0.241	22%	0.222	C	C	.	.			trans	-94	126.3	-175.3	-57.7	173.1	0	0	0	109	R446 L520 I529 V530	R446-I524 PolarHBondContact NH1-O 2.98Å; R446-I524 VanDerWaalsContact NH1-O 3.12Å; L520-I524 HydrophobicContact CD2-CD1 4.41Å; L520-I524 WeakPolarHBondContact O-CA 3.36Å; L520-I524 WeakPolarHBondContact O-CB 3.05Å; L520-I524 PolarHBondContact O-N 3.34Å; I524-I529 HydrophobicContact CG2-CB 4.16Å; I524-I529 HydrophobicContact CG2-CG2 4.18Å; I524-V530 HydrophobicContact CB-CG2 3.65Å; I524-V530 HydrophobicContact CD1-CG2 4.23Å; I524-V530 HydrophobicContact CG1-CG2 4.48Å; I524-V530 HydrophobicContact CG2-CG2 3.81Å
525	Q	86.1	Confident	93.8	Very high	131 Å²	131	41.7 Å²	41.7	61%	0.612	23%	0.229	S	C	*	.	S	Bend	trans	-78.1	-32.6	-176.1	-68.2	-178.6	-2	0	0	113.1	R446 P527	R446-Q525 PolarHBondContact NH1-O 2.94Å; R446-Q525 PolarHBondContact NH2-O 3.27Å; Q525-P527 WeakPolarHBondContact O-CD 3.31Å
526	N	91.9	Very high	93.7	Very high	75 Å²	75	47.4 Å²	47.4	40%	0.401	26%	0.259	S	S	.	.			trans	-86.2	114.9	-178.1	-169.8	-30.5	0	0	0	111.5	N528 I529 V530	N526-N528 VanDerWaalsContact C-N 3.29Å; N526-N528 PolarHBondContact O-N 3.05Å; N526-N528 WeakPolarHBondContact OD1-CB 3.4Å; N526-N528 PolarHBondContact OD1-N 2.81Å; N526-I529 HydrophobicContact CB-CB 4.46Å; N526-I529 HydrophobicContact CB-CD1 3.93Å; N526-I529 HydrophobicContact CB-CG1 4.06Å; N526-I529 PolarHBondContact O-N 3.28Å; N526-V530 PolarHBondContact O-N 3.47Å
527	P	92.9	Very high	93.6	Very high	32 Å²	32	50 Å²	50	21%	0.208	27%	0.273	C	S	.	.	H	α-helix	trans	-62.7	-31.3	-178.4	-22.2	34.7	0	0	0	114.1	V439 P443 L521 Q525 I529 V530 N531	V439-P527 HydrophobicContact CG1-CB 4.04Å; P443-P527 HydrophobicContact CB-CG 4.02Å; P443-P527 HydrophobicContact CG-CB 4.03Å; P443-P527 HydrophobicContact CG-CG 3.69Å; L521-P527 HydrophobicContact CD2-CB 4.03Å; L521-P527 HydrophobicContact CD2-CG 4.26Å; Q525-P527 WeakPolarHBondContact O-CD 3.31Å; P527-I529 VanDerWaalsContact C-N 3.34Å; P527-I529 PolarHBondContact O-N 3.5Å; P527-V530 PolarHBondContact O-N 3.37Å; P527-N531 PolarHBondContact O-N 3.33Å
528	N	93.4	Very high	93.4	Very high	116 Å²	116	50 Å²	50	62%	0.62	27%	0.273	S	S	*	.	H	α-helix	trans	-67.3	-37.7	-178.5	-66.9	-23.7	0	0	0	111.6	N526 V530 N531 S532	N526-N528 VanDerWaalsContact C-N 3.29Å; N526-N528 PolarHBondContact O-N 3.05Å; N526-N528 WeakPolarHBondContact OD1-CB 3.4Å; N526-N528 PolarHBondContact OD1-N 2.81Å; N528-V530 VanDerWaalsContact C-N 3.35Å; N528-N531 WeakPolarHBondContact O-CB 3.25Å; N528-N531 PolarHBondContact O-N 3.26Å; N528-S532 PolarHBondContact O-N 2.79Å; N528-S532 VanDerWaalsContact O-N 3.16Å; N528-S532 PolarHBondContact O-OG 2.92Å
529	I	95.1	Very high	93.2	Very high	87 Å²	87	54.7 Å²	54.7	45%	0.446	30%	0.297	S	S	.	.	H	α-helix	trans	-65.2	-42.7	175	-60.7	179.4	0	0	0	109.9	I524 N526 P527 N531 S532 V533	I524-I529 HydrophobicContact CG2-CB 4.16Å; I524-I529 HydrophobicContact CG2-CG2 4.18Å; N526-I529 HydrophobicContact CB-CB 4.46Å; N526-I529 HydrophobicContact CB-CD1 3.93Å; N526-I529 HydrophobicContact CB-CG1 4.06Å; N526-I529 PolarHBondContact O-N 3.28Å; P527-I529 VanDerWaalsContact C-N 3.34Å; P527-I529 PolarHBondContact O-N 3.5Å; I529-N531 VanDerWaalsContact C-N 3.31Å; I529-N531 PolarHBondContact O-N 3.38Å; I529-S532 PolarHBondContact O-N 3.49Å; I529-V533 HydrophobicContact CG2-CG2 4.26Å; I529-V533 VanDerWaalsContact O-CG2 3.3Å; I529-V533 WeakPolarHBondContact O-CG2 3.34Å; I529-V533 PolarHBondContact O-N 2.92Å
530	V	95.5	Very high	93.1	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-60	-44.1	177	178.2	0	0	0	0	111	T517 L520 L521 I524 N526 P527 N528 S532 V533 V534	T517-V530 HydrophobicContact CG2-CG1 3.97Å; L520-V530 HydrophobicContact CB-CG1 3.69Å; L520-V530 HydrophobicContact CB-CG2 4.23Å; L520-V530 HydrophobicContact CD1-CG1 4.5Å; L521-V530 HydrophobicContact CD2-CB 4.26Å; L521-V530 HydrophobicContact CD2-CG1 4.48Å; L521-V530 HydrophobicContact CD2-CG2 4Å; L521-V530 HydrophobicContact CG-CB 4.49Å; L521-V530 HydrophobicContact CG-CG1 4.19Å; L521-V530 HydrophobicContact CG-CG2 4.33Å; I524-V530 HydrophobicContact CB-CG2 3.65Å; I524-V530 HydrophobicContact CD1-CG2 4.23Å; I524-V530 HydrophobicContact CG1-CG2 4.48Å; I524-V530 HydrophobicContact CG2-CG2 3.81Å; N526-V530 PolarHBondContact O-N 3.47Å; P527-V530 PolarHBondContact O-N 3.37Å; N528-V530 VanDerWaalsContact C-N 3.35Å; V530-S532 PolarHBondContact O-N 3.03Å; V530-V533 PolarHBondContact O-N 2.88Å; V530-V534 HydrophobicContact CG1-CG2 3.96Å; V530-V534 WeakPolarHBondContact O-CB 3.3Å; V530-V534 WeakPolarHBondContact O-CG2 3.48Å; V530-V534 PolarHBondContact O-N 3.27Å
531	N	93.5	Very high	93	Very high	43 Å²	43	55.1 Å²	55.1	23%	0.23	31%	0.307	C	S	.	.	H	α-helix	trans	-55.7	-50.7	177.1	-170.5	43.2	0	0	0	111.8	M435 V439 P527 N528 I529 V533 A535	M435-N531 WeakPolarHBondContact CE-OD1 3.28Å; M435-N531 PolarHBondContact SD-OD1 3.47Å; V439-N531 HydrophobicContact CG1-CB 4.34Å; V439-N531 HydrophobicContact CG2-CB 4.24Å; P527-N531 PolarHBondContact O-N 3.33Å; N528-N531 WeakPolarHBondContact O-CB 3.25Å; N528-N531 PolarHBondContact O-N 3.26Å; I529-N531 VanDerWaalsContact C-N 3.31Å; I529-N531 PolarHBondContact O-N 3.38Å; N531-V533 PolarHBondContact O-N 3.35Å; N531-A535 VanDerWaalsContact O-CB 3.28Å; N531-A535 WeakPolarHBondContact O-CB 3.17Å; N531-A535 PolarHBondContact O-N 3.49Å
532	S	95	Very high	93	Very high	82 Å²	82	55.2 Å²	55.2	57%	0.573	31%	0.307	S	S	*	.	H	α-helix	trans	-62.6	-42	178.5	-59.5	0	0	0	0	112.7	N528 I529 V530 L536	N528-S532 PolarHBondContact O-N 2.79Å; N528-S532 VanDerWaalsContact O-N 3.16Å; N528-S532 PolarHBondContact O-OG 2.92Å; I529-S532 PolarHBondContact O-N 3.49Å; V530-S532 PolarHBondContact O-N 3.03Å; S532-L536 WeakPolarHBondContact O-CB 3.42Å; S532-L536 PolarHBondContact O-N 3.3Å; S532-L536 VanDerWaalsContact O-N 3.07Å
533	V	95.6	Very high	93.1	Very high	54 Å²	54	59 Å²	59	33%	0.327	33%	0.326	S	S	.	.	H	α-helix	trans	-67.2	-46.7	-179.5	170.5	0	0	0	0	111.4	L520 I529 V530 N531 L536 L537	L520-V533 HydrophobicContact CD1-CG1 4.29Å; I529-V533 HydrophobicContact CG2-CG2 4.26Å; I529-V533 VanDerWaalsContact O-CG2 3.3Å; I529-V533 WeakPolarHBondContact O-CG2 3.34Å; I529-V533 PolarHBondContact O-N 2.92Å; V530-V533 PolarHBondContact O-N 2.88Å; N531-V533 PolarHBondContact O-N 3.35Å; V533-L536 PolarHBondContact O-N 3.44Å; V533-L537 HydrophobicContact CG1-CD1 3.89Å; V533-L537 HydrophobicContact CG1-CG 4.39Å; V533-L537 WeakPolarHBondContact O-CB 3.29Å; V533-L537 VanDerWaalsContact O-CG 3.3Å; V533-L537 WeakPolarHBondContact O-CG 3.4Å; V533-L537 PolarHBondContact O-N 3.31Å
534	V	94.8	Very high	93.1	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-67.6	-39.2	-179.2	175.2	0	0	0	0	111.3	M435 L516 L520 V530 L537 S538	M435-V534 HydrophobicContact CB-CB 4.49Å; M435-V534 HydrophobicContact CB-CG1 3.74Å; M435-V534 HydrophobicContact CG-CB 3.82Å; M435-V534 HydrophobicContact CG-CG1 3.63Å; M435-V534 HydrophobicContact SD-CB 3.56Å; M435-V534 VanDerWaalsContact SD-CB 3.56Å; M435-V534 HydrophobicContact SD-CG1 3.65Å; L516-V534 HydrophobicContact CD2-CG1 4.41Å; L520-V534 HydrophobicContact CD1-CG2 3.35Å; V530-V534 HydrophobicContact CG1-CG2 3.96Å; V530-V534 WeakPolarHBondContact O-CB 3.3Å; V530-V534 WeakPolarHBondContact O-CG2 3.48Å; V530-V534 PolarHBondContact O-N 3.27Å; V534-L537 PolarHBondContact O-N 3.06Å; V534-S538 VanDerWaalsContact O-CB 3.31Å; V534-S538 WeakPolarHBondContact O-CB 3.45Å; V534-S538 PolarHBondContact O-N 3.08Å; V534-S538 PolarHBondContact O-OG 3.48Å
535	A	93.8	Very high	93	Very high	17 Å²	17	53.2 Å²	53.2	14%	0.14	30%	0.296	C	S	.	.	H	α-helix	trans	-59.9	-46.8	174.3	0	0	0	0	0	111.3	Y432 M435 N531 S538 I539	Y432-A535 HydrophobicContact CD2-CB 4.01Å; Y432-A535 HydrophobicContact CE2-CB 3.86Å; M435-A535 HydrophobicContact CE-CB 4.41Å; M435-A535 HydrophobicContact SD-CB 4.17Å; N531-A535 VanDerWaalsContact O-CB 3.28Å; N531-A535 WeakPolarHBondContact O-CB 3.17Å; N531-A535 PolarHBondContact O-N 3.49Å; A535-S538 PolarHBondContact O-N 3.12Å; A535-I539 WeakPolarHBondContact O-CG1 3.22Å; A535-I539 PolarHBondContact O-N 2.94Å
536	L	95.2	Very high	93.1	Very high	124 Å²	124	47 Å²	47	65%	0.649	27%	0.268	S	S	*	.	H	α-helix	trans	-61	-47.3	177.1	-178.7	64.7	0	0	0	111.9	S532 V533 S538 I539 A540	S532-L536 WeakPolarHBondContact O-CB 3.42Å; S532-L536 PolarHBondContact O-N 3.3Å; S532-L536 VanDerWaalsContact O-N 3.07Å; V533-L536 PolarHBondContact O-N 3.44Å; L536-S538 VanDerWaalsContact C-N 3.33Å; L536-S538 PolarHBondContact O-N 3.35Å; L536-I539 PolarHBondContact O-N 2.87Å; L536-A540 WeakPolarHBondContact O-CB 3.05Å; L536-A540 PolarHBondContact O-N 3.11Å
537	L	93.5	Very high	92.8	Very high	90 Å²	90	43.6 Å²	43.6	47%	0.471	25%	0.25	S	C	.	.	H	α-helix	trans	-61.2	-41.3	177.9	-73.2	171.8	0	0	0	112	V533 V534 G541	V533-L537 HydrophobicContact CG1-CD1 3.89Å; V533-L537 HydrophobicContact CG1-CG 4.39Å; V533-L537 WeakPolarHBondContact O-CB 3.29Å; V533-L537 VanDerWaalsContact O-CG 3.3Å; V533-L537 WeakPolarHBondContact O-CG 3.4Å; V533-L537 PolarHBondContact O-N 3.31Å; V534-L537 PolarHBondContact O-N 3.06Å; L537-G541 PolarHBondContact O-N 3.45Å
538	S	92.4	Very high	92.5	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.014	25%	0.247	C	C	.	.	H	α-helix	trans	-66.9	-45.2	-178.3	-58.4	0	0	0	0	111.6	V534 A535 L536 V542 Q568	V534-S538 VanDerWaalsContact O-CB 3.31Å; V534-S538 WeakPolarHBondContact O-CB 3.45Å; V534-S538 PolarHBondContact O-N 3.08Å; V534-S538 PolarHBondContact O-OG 3.48Å; A535-S538 PolarHBondContact O-N 3.12Å; L536-S538 VanDerWaalsContact C-N 3.33Å; L536-S538 PolarHBondContact O-N 3.35Å; S538-V542 PolarHBondContact O-N 2.94Å; S538-Q568 PolarHBondContact O-NE2 3.41Å; S538-Q568 VanDerWaalsContact O-NE2 3.11Å
539	I	91.9	Very high	92.2	Very high	100 Å²	100	42.3 Å²	42.3	51%	0.513	24%	0.243	S	C	.	.	H	α-helix	trans	-71.5	-47.5	-179.9	-65.1	168.2	0	0	0	111.1	A535 L536 G541 V542 L543	A535-I539 WeakPolarHBondContact O-CG1 3.22Å; A535-I539 PolarHBondContact O-N 2.94Å; L536-I539 PolarHBondContact O-N 2.87Å; I539-G541 VanDerWaalsContact C-N 3.26Å; I539-G541 PolarHBondContact O-N 3.33Å; I539-V542 PolarHBondContact O-N 3.5Å; I539-V542 VanDerWaalsContact O-N 3.16Å; I539-L543 PolarHBondContact O-N 3.01Å
540	A	93.4	Very high	91.8	Very high	38 Å²	38	44.3 Å²	44.3	31%	0.314	25%	0.245	S	C	.	.	H	α-helix	trans	-61.4	-37.8	177.4	0	0	0	0	0	111.6	L536 V542 L543 I544	L536-A540 WeakPolarHBondContact O-CB 3.05Å; L536-A540 PolarHBondContact O-N 3.11Å; A540-V542 VanDerWaalsContact C-N 3.35Å; A540-V542 PolarHBondContact O-N 3.41Å; A540-L543 PolarHBondContact O-N 2.93Å; A540-I544 WeakPolarHBondContact O-CG1 3.49Å; A540-I544 PolarHBondContact O-N 3.41Å; A540-I544 VanDerWaalsContact O-N 3.13Å
541	G	93	Very high	91.3	Very high	8 Å²	8	45.7 Å²	45.7	8%	0.082	25%	0.252	C	S	.	.	H	α-helix	trans	-63.7	-36.8	175.8	0	0	0	0	0	113	L537 I539 G545	L537-G541 PolarHBondContact O-N 3.45Å; I539-G541 VanDerWaalsContact C-N 3.26Å; I539-G541 PolarHBondContact O-N 3.33Å; G541-G545 VanDerWaalsContact O-CA 3.26Å; G541-G545 WeakPolarHBondContact O-CA 3.19Å; G541-G545 PolarHBondContact O-N 2.62Å
542	V	93.4	Very high	90.8	Very high	2 Å²	2	44 Å²	44	1%	0.012	24%	0.243	C	C	.	.	H	α-helix	trans	-68.7	-43.1	174	163.5	0	0	0	0	111.3	Y424 V427 G428 S538 I539 A540 I544 G545 S546 Q568	Y424-V542 HydrophobicContact CD1-CG1 4.37Å; Y424-V542 HydrophobicContact CD2-CG1 3.46Å; Y424-V542 VanDerWaalsContact CD2-CG1 3.46Å; Y424-V542 HydrophobicContact CE1-CG1 4.1Å; Y424-V542 HydrophobicContact CE2-CB 4.5Å; Y424-V542 HydrophobicContact CE2-CG1 3.16Å; Y424-V542 HydrophobicContact CG-CG1 4.06Å; Y424-V542 VanDerWaalsContact CZ-CG1 3.49Å; V427-V542 HydrophobicContact CB-CG2 4.27Å; V427-V542 HydrophobicContact CG1-CG2 3.85Å; G428-V542 VanDerWaalsContact CA-CG2 3.48Å; S538-V542 PolarHBondContact O-N 2.94Å; I539-V542 PolarHBondContact O-N 3.5Å; I539-V542 VanDerWaalsContact O-N 3.16Å; A540-V542 VanDerWaalsContact C-N 3.35Å; A540-V542 PolarHBondContact O-N 3.41Å; V542-I544 VanDerWaalsContact C-N 3.29Å; V542-I544 PolarHBondContact O-N 2.8Å; V542-G545 PolarHBondContact O-N 3.41Å; V542-S546 WeakPolarHBondContact O-CB 3.45Å; V542-S546 PolarHBondContact O-N 3.29Å; V542-S546 PolarHBondContact O-OG 3.45Å; V542-Q568 HydrophobicContact CB-CG 4.29Å; V542-Q568 HydrophobicContact CG2-CB 4.13Å; V542-Q568 HydrophobicContact CG2-CG 3.46Å; V542-Q568 VanDerWaalsContact CG2-CG 3.46Å
543	L	92.3	Very high	90.3	Very high	83 Å²	83	45.9 Å²	45.9	44%	0.435	24%	0.243	S	C	.	.	H	α-helix	trans	-58.6	-41.9	-179.2	-178.9	64.7	0	0	0	112.1	I539 A540 V549	I539-L543 PolarHBondContact O-N 3.01Å; A540-L543 PolarHBondContact O-N 2.93Å; L543-V549 HydrophobicContact CD1-CB 4.05Å; L543-V549 HydrophobicContact CD1-CG1 3.77Å; L543-V549 HydrophobicContact CD1-CG2 4.14Å
544	I	91.6	Very high	89.8	Confident	33 Å²	33	49.8 Å²	49.8	17%	0.169	26%	0.257	C	S	.	.	H	α-helix	trans	-88.5	-36.9	-178	-59.8	165.6	0	0	0	111.5	A540 V542 M555 F559 I562 S563	A540-I544 WeakPolarHBondContact O-CG1 3.49Å; A540-I544 PolarHBondContact O-N 3.41Å; A540-I544 VanDerWaalsContact O-N 3.13Å; V542-I544 VanDerWaalsContact C-N 3.29Å; V542-I544 PolarHBondContact O-N 2.8Å; I544-M555 HydrophobicContact CG2-SD 4.43Å; I544-F559 HydrophobicContact CD1-CD1 4.01Å; I544-F559 HydrophobicContact CD1-CE1 4.33Å; I544-F559 HydrophobicContact CG1-CD1 4.31Å; I544-F559 HydrophobicContact CG2-CB 4.25Å; I544-F559 HydrophobicContact CG2-CD1 4.44Å; I544-F559 WeakPolarHBondContact CG2-O 3.31Å; I544-I562 HydrophobicContact CD1-CG2 4.41Å; I544-I562 HydrophobicContact CG2-CB 4.42Å; I544-I562 HydrophobicContact CG2-CG2 4.18Å; I544-S563 WeakPolarHBondContact O-CB 3.4Å
545	G	88.4	Confident	89.6	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-87.8	-32.7	-168.8	0	0	0	0	0	115.1	G541 V542 G547 I552 T566 K569	G541-G545 VanDerWaalsContact O-CA 3.26Å; G541-G545 WeakPolarHBondContact O-CA 3.19Å; G541-G545 PolarHBondContact O-N 2.62Å; V542-G545 PolarHBondContact O-N 3.41Å; G545-G547 PolarHBondContact O-N 3.5Å; G545-I552 WeakPolarHBondContact O-CD1 3.41Å; G545-T566 WeakPolarHBondContact CA-OG1 3.3Å; G545-K569 WeakPolarHBondContact O-CA 3.33Å; G545-K569 WeakPolarHBondContact O-CB 3.06Å
546	S	89	Confident	89.5	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.014	27%	0.272	C	S	.	.	S	Bend	trans	-70.3	-28.4	-168.1	61.2	0	0	0	0	115	V542 F548 S572	V542-S546 WeakPolarHBondContact O-CB 3.45Å; V542-S546 PolarHBondContact O-N 3.29Å; V542-S546 PolarHBondContact O-OG 3.45Å; S546-F548 PolarHBondContact O-N 3.38Å; S546-F548 PolarHBondContact OG-N 3.26Å; S546-S572 WeakPolarHBondContact CA-OG 3.21Å; S546-S572 WeakPolarHBondContact CB-OG 3.39Å
547	G	85.7	Confident	89.3	Confident	3 Å²	3	52.5 Å²	52.5	3%	0.031	27%	0.272	C	S	.	.	S	Bend	trans	76.4	-5.5	-171.8	0	0	0	0	0	114.9	G545 R550 T612	G545-G547 PolarHBondContact O-N 3.5Å; G547-R550 CarbonylContact C-O 3.52Å; G547-R550 WeakPolarHBondContact CA-O 3.45Å; G547-R550 CarbonylContact O-C 3.58Å; G547-T612 WeakPolarHBondContact O-CG2 3.46Å
548	F	86.9	Confident	89.3	Confident	31 Å²	31	51.9 Å²	51.9	14%	0.136	27%	0.273	C	S	.	.	S	Bend	trans	-78.4	-42.8	-175.5	-62.6	-31.7	0	0	0	113.9	V420 L423 Y424 S546 L576 T612	V420-F548 HydrophobicContact CG1-CB 3.63Å; V420-F548 HydrophobicContact CG1-CD1 3.96Å; V420-F548 HydrophobicContact CG1-CD2 4.4Å; V420-F548 HydrophobicContact CG1-CG 3.75Å; L423-F548 HydrophobicContact CB-CE2 3.87Å; L423-F548 HydrophobicContact CB-CZ 4.07Å; L423-F548 HydrophobicContact CD1-CZ 4.34Å; Y424-F548 HydrophobicContact CD2-CB 4.24Å; Y424-F548 HydrophobicContact CD2-CD2 4.16Å; S546-F548 PolarHBondContact O-N 3.38Å; S546-F548 PolarHBondContact OG-N 3.26Å; F548-L576 HydrophobicContact CE1-CB 4.3Å; F548-L576 HydrophobicContact CE1-CD1 3.98Å; F548-L576 HydrophobicContact CZ-CB 4.5Å; F548-T612 HydrophobicContact CD1-CG2 4.28Å
549	V	86.3	Confident	89.3	Confident	89 Å²	89	56.4 Å²	56.4	54%	0.539	29%	0.293	S	S	.	.	S	Bend	trans	-80	-33	-179	177.4	0	0	0	0	111.2	Y424 L543	Y424-V549 HydrophobicContact CD2-CG2 3.99Å; Y424-V549 HydrophobicContact CE2-CG2 3.36Å; L543-V549 HydrophobicContact CD1-CB 4.05Å; L543-V549 HydrophobicContact CD1-CG1 3.77Å; L543-V549 HydrophobicContact CD1-CG2 4.14Å
550	R	85.8	Confident	89.2	Confident	130 Å²	130	54.8 Å²	54.8	49%	0.491	28%	0.282	S	S	.	.	S	Bend	trans	-147.6	135.5	176.5	-179.8	171.2	-174.7	165	6.7	108.5	G547 I552 E554 M555	G547-R550 CarbonylContact C-O 3.52Å; G547-R550 WeakPolarHBondContact CA-O 3.45Å; G547-R550 CarbonylContact O-C 3.58Å; R550-I552 PolarHBondContact O-N 3.08Å; R550-E554 PolarHBondContact NH2-O 2.93Å; R550-M555 HydrophobicContact CB-CE 3.64Å; R550-M555 HydrophobicContact CG-CE 4Å; R550-M555 HydrophobicContact CG-CG 3.83Å; R550-M555 WeakPolarHBondContact O-CE 3.27Å
551	N	85.4	Confident	89.1	Confident	28 Å²	28	57.4 Å²	57.4	15%	0.15	29%	0.29	C	S	.	.			trans	-61.9	128.7	179.1	-169.7	-21.4	0	0	0	110.4	Q553 E554 M555 E611	N551-Q553 PolarHBondContact O-N 3.26Å; N551-Q553 PolarHBondContact OD1-N 3.11Å; N551-E554 HydrophobicContact CB-CB 4.29Å; N551-E554 HydrophobicContact CB-CG 4.1Å; N551-E554 PolarHBondContact O-N 3.11Å; N551-E554 VanDerWaalsContact O-N 3.15Å; N551-M555 WeakPolarHBondContact O-CG 3.45Å; N551-M555 PolarHBondContact O-N 2.74Å; N551-E611 PolarHBondContact ND2-O 3.4Å
552	I	83.1	Confident	89.1	Confident	7 Å²	7	60.8 Å²	60.8	4%	0.036	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-32.4	-176.1	-58.4	179.7	0	0	0	111	G545 R550 K560 K569	G545-I552 WeakPolarHBondContact O-CD1 3.41Å; R550-I552 PolarHBondContact O-N 3.08Å; I552-K560 HydrophobicContact CG2-CG 4.48Å; I552-K560 WeakPolarHBondContact O-CE 3.38Å; I552-K569 HydrophobicContact CD1-CD 4.39Å; I552-K569 HydrophobicContact CD1-CG 4.14Å
553	Q	84.1	Confident	89	Confident	122 Å²	122	60.7 Å²	60.7	57%	0.57	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-33.8	179.9	-65.1	-157.3	-19.2	0	0	113.1	N551 M555 K560 P614	N551-Q553 PolarHBondContact O-N 3.26Å; N551-Q553 PolarHBondContact OD1-N 3.11Å; Q553-M555 VanDerWaalsContact C-N 3.33Å; Q553-K560 VanDerWaalsContact O-CE 3.26Å; Q553-K560 WeakPolarHBondContact O-CE 3.36Å; Q553-K560 PolarHBondContact O-NZ 2.98Å; Q553-P614 HydrophobicContact CG-CG 4.35Å
554	E	86.7	Confident	88.9	Confident	137 Å²	137	61.9 Å²	61.9	64%	0.64	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-6.6	-179.4	-60.5	179.7	172.6	0	0	113.1	R550 N551	R550-E554 PolarHBondContact NH2-O 2.93Å; N551-E554 HydrophobicContact CB-CB 4.29Å; N551-E554 HydrophobicContact CB-CG 4.1Å; N551-E554 PolarHBondContact O-N 3.11Å; N551-E554 VanDerWaalsContact O-N 3.15Å
555	M	88.9	Confident	89	Confident	13 Å²	13	67.8 Å²	67.8	6%	0.064	33%	0.329	C	S	.	.	S	Bend	trans	-68	144	174.2	-75.3	-173.1	-177.5	0	0	111.5	I544 R550 N551 Q553 F559 K560	I544-M555 HydrophobicContact CG2-SD 4.43Å; R550-M555 HydrophobicContact CB-CE 3.64Å; R550-M555 HydrophobicContact CG-CE 4Å; R550-M555 HydrophobicContact CG-CG 3.83Å; R550-M555 WeakPolarHBondContact O-CE 3.27Å; N551-M555 WeakPolarHBondContact O-CG 3.45Å; N551-M555 PolarHBondContact O-N 2.74Å; Q553-M555 VanDerWaalsContact C-N 3.33Å; M555-F559 HydrophobicContact CB-CB 4.42Å; M555-F559 HydrophobicContact SD-CB 4.27Å; M555-K560 WeakPolarHBondContact O-CE 3.48Å
556	P	92.1	Very high	89.3	Confident	58 Å²	58	68.6 Å²	68.6	38%	0.377	33%	0.333	S	S	.	.			trans	-53.4	147.1	169	-24	33.4	0	0	0	111.8	P558 F559 K560	P556-P558 VanDerWaalsContact C-CD 3.48Å; P556-P558 VanDerWaalsContact O-N 3.16Å; P556-F559 HydrophobicContact CB-CD2 4.34Å; P556-F559 HydrophobicContact CG-CD2 4.37Å; P556-F559 PolarHBondContact O-N 3.41Å; P556-F559 VanDerWaalsContact O-N 3.08Å; P556-K560 PolarHBondContact O-N 3.29Å
557	I	92.4	Very high	89.6	Confident	126 Å²	126	69.2 Å²	69.2	65%	0.646	34%	0.336	S	S	*	.	H	α-helix	trans	-44.5	-48.5	-174.7	-58.4	166.2	0	0	0	113.9	F559 K560 I561	I557-F559 PolarHBondContact O-N 2.88Å; I557-K560 WeakPolarHBondContact O-CB 3.32Å; I557-K560 PolarHBondContact O-N 2.89Å; I557-I561 HydrophobicContact CG2-CD1 4.05Å; I557-I561 WeakPolarHBondContact O-CG1 2.88Å; I557-I561 PolarHBondContact O-N 3.5Å
558	P	93	Very high	90.1	Very high	77 Å²	77	69.3 Å²	69.3	50%	0.5	34%	0.335	S	S	.	.	H	α-helix	trans	-63.7	-42.9	-178.4	18.9	-29.3	0	0	0	113.5	P556 K560 I561 I562	P556-P558 VanDerWaalsContact C-CD 3.48Å; P556-P558 VanDerWaalsContact O-N 3.16Å; P558-K560 VanDerWaalsContact C-N 3.32Å; P558-K560 PolarHBondContact O-N 2.95Å; P558-I561 PolarHBondContact O-N 3.28Å; P558-I562 WeakPolarHBondContact O-CG1 3.5Å; P558-I562 PolarHBondContact O-N 3.47Å
559	F	91.1	Very high	90.4	Very high	97 Å²	97	68 Å²	68	43%	0.425	33%	0.33	S	S	.	.	H	α-helix	trans	-68.4	-34.5	177.5	-67.6	-64.4	0	0	0	112.1	I544 M555 P556 I557 I561 I562 S563	I544-F559 HydrophobicContact CD1-CD1 4.01Å; I544-F559 HydrophobicContact CD1-CE1 4.33Å; I544-F559 HydrophobicContact CG1-CD1 4.31Å; I544-F559 HydrophobicContact CG2-CB 4.25Å; I544-F559 HydrophobicContact CG2-CD1 4.44Å; I544-F559 WeakPolarHBondContact CG2-O 3.31Å; M555-F559 HydrophobicContact CB-CB 4.42Å; M555-F559 HydrophobicContact SD-CB 4.27Å; P556-F559 HydrophobicContact CB-CD2 4.34Å; P556-F559 HydrophobicContact CG-CD2 4.37Å; P556-F559 PolarHBondContact O-N 3.41Å; P556-F559 VanDerWaalsContact O-N 3.08Å; I557-F559 PolarHBondContact O-N 2.88Å; F559-I561 PolarHBondContact O-N 2.91Å; F559-I562 HydrophobicContact CD1-CD1 4.44Å; F559-I562 PolarHBondContact O-N 3.42Å; F559-S563 PolarHBondContact O-N 3.44Å
560	K	89.9	Confident	90.8	Very high	67 Å²	67	65 Å²	65	29%	0.291	31%	0.309	S	S	.	.	H	α-helix	trans	-58.7	-46.8	172.5	-173.8	178.7	-64.8	-179.8	0	111	I552 Q553 M555 P556 I557 P558 S563 Y564	I552-K560 HydrophobicContact CG2-CG 4.48Å; I552-K560 WeakPolarHBondContact O-CE 3.38Å; Q553-K560 VanDerWaalsContact O-CE 3.26Å; Q553-K560 WeakPolarHBondContact O-CE 3.36Å; Q553-K560 PolarHBondContact O-NZ 2.98Å; M555-K560 WeakPolarHBondContact O-CE 3.48Å; P556-K560 PolarHBondContact O-N 3.29Å; I557-K560 WeakPolarHBondContact O-CB 3.32Å; I557-K560 PolarHBondContact O-N 2.89Å; P558-K560 VanDerWaalsContact C-N 3.32Å; P558-K560 PolarHBondContact O-N 2.95Å; K560-S563 WeakPolarHBondContact O-CB 3.46Å; K560-S563 PolarHBondContact O-N 3.32Å; K560-S563 PolarHBondContact O-OG 3.48Å; K560-Y564 HydrophobicContact CG-CE2 4.04Å; K560-Y564 WeakPolarHBondContact O-CD2 3.49Å
561	I	92.6	Very high	91.3	Very high	93 Å²	93	58.9 Å²	58.9	48%	0.477	29%	0.286	S	S	.	.	H	α-helix	trans	-62	-46.9	176.1	-66.1	166.5	0	0	0	111.1	I557 P558 F559 S563 Y564 F565	I557-I561 HydrophobicContact CG2-CD1 4.05Å; I557-I561 WeakPolarHBondContact O-CG1 2.88Å; I557-I561 PolarHBondContact O-N 3.5Å; P558-I561 PolarHBondContact O-N 3.28Å; F559-I561 PolarHBondContact O-N 2.91Å; I561-S563 VanDerWaalsContact C-N 3.26Å; I561-S563 PolarHBondContact O-N 2.87Å; I561-Y564 PolarHBondContact O-N 3.16Å; I561-Y564 VanDerWaalsContact O-N 3.16Å; I561-F565 HydrophobicContact CG2-CD2 4.3Å; I561-F565 HydrophobicContact CG2-CE2 3.79Å; I561-F565 WeakPolarHBondContact O-CD2 3.3Å
562	I	92.3	Very high	91.8	Very high	78 Å²	78	57.6 Å²	57.6	40%	0.4	28%	0.279	S	S	.	.	H	α-helix	trans	-58.4	-40.3	179.1	-68.4	167.2	0	0	0	110.9	I544 P558 F559 Y564 F565	I544-I562 HydrophobicContact CD1-CG2 4.41Å; I544-I562 HydrophobicContact CG2-CB 4.42Å; I544-I562 HydrophobicContact CG2-CG2 4.18Å; P558-I562 WeakPolarHBondContact O-CG1 3.5Å; P558-I562 PolarHBondContact O-N 3.47Å; F559-I562 HydrophobicContact CD1-CD1 4.44Å; F559-I562 PolarHBondContact O-N 3.42Å; I562-Y564 PolarHBondContact O-N 3.2Å; I562-F565 PolarHBondContact O-N 3.36Å
563	S	90.8	Very high	92.3	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-55.8	-37.7	179.2	80.1	0	0	0	0	112.7	I544 F559 K560 I561 F565 T566 K569	I544-S563 WeakPolarHBondContact O-CB 3.4Å; F559-S563 PolarHBondContact O-N 3.44Å; K560-S563 WeakPolarHBondContact O-CB 3.46Å; K560-S563 PolarHBondContact O-N 3.32Å; K560-S563 PolarHBondContact O-OG 3.48Å; I561-S563 VanDerWaalsContact C-N 3.26Å; I561-S563 PolarHBondContact O-N 2.87Å; S563-F565 VanDerWaalsContact C-N 3.26Å; S563-F565 PolarHBondContact O-N 3.07Å; S563-T566 PolarHBondContact O-N 2.93Å; S563-T566 VanDerWaalsContact O-N 3.16Å; S563-T566 PolarHBondContact O-OG1 3.13Å; S563-K569 WeakPolarHBondContact O-CB 3.45Å; S563-K569 WeakPolarHBondContact O-CD 3.22Å
564	Y	91.8	Very high	92.9	Very high	109 Å²	109	51.5 Å²	51.5	43%	0.427	25%	0.251	S	S	.	.	H	α-helix	trans	-68.7	-20.5	178.4	-71.1	-79	0	0	0	113.7	K560 I561 I562 K569 Y570	K560-Y564 HydrophobicContact CG-CE2 4.04Å; K560-Y564 WeakPolarHBondContact O-CD2 3.49Å; I561-Y564 PolarHBondContact O-N 3.16Å; I561-Y564 VanDerWaalsContact O-N 3.16Å; I562-Y564 PolarHBondContact O-N 3.2Å; Y564-K569 HydrophobicContact CD1-CD 4.09Å; Y564-K569 HydrophobicContact CE1-CD 4.46Å; Y564-K569 HydrophobicContact CG-CD 4.48Å; Y564-Y570 WeakPolarHBondContact O-CE2 3.47Å; Y564-Y570 PolarHBondContact O-OH 3.05Å
565	F	93	Very high	93.3	Very high	157 Å²	157	45 Å²	45	69%	0.689	22%	0.22	S	C	*	.	H	α-helix	trans	-87.6	-7.5	175.2	-70	-69.3	0	0	0	113.5	I561 I562 S563	I561-F565 HydrophobicContact CG2-CD2 4.3Å; I561-F565 HydrophobicContact CG2-CE2 3.79Å; I561-F565 WeakPolarHBondContact O-CD2 3.3Å; I562-F565 PolarHBondContact O-N 3.36Å; S563-F565 VanDerWaalsContact C-N 3.26Å; S563-F565 PolarHBondContact O-N 3.07Å
566	T	94.3	Very high	93.5	Very high	16 Å²	16	44.4 Å²	44.4	10%	0.098	22%	0.217	C	C	.	.			trans	-90.4	136.7	-178.6	66.5	0	0	0	0	111.6	G545 S563 Q568 Y570	G545-T566 WeakPolarHBondContact CA-OG1 3.3Å; S563-T566 PolarHBondContact O-N 2.93Å; S563-T566 VanDerWaalsContact O-N 3.16Å; S563-T566 PolarHBondContact O-OG1 3.13Å; T566-Q568 PolarHBondContact O-N 2.85Å; T566-Y570 WeakPolarHBondContact O-CD2 3.48Å; T566-Y570 WeakPolarHBondContact O-CE2 3.48Å
567	F	95.6	Very high	93.6	Very high	16 Å²	16	42.2 Å²	42.2	7%	0.07	20%	0.203	C	C	.	.	H	α-helix	trans	-67.3	-25.6	171.7	64.6	-94.8	0	0	0	111.6	P431 P509 I512 K569 Y570 C571 L627 F630	P431-F567 HydrophobicContact CB-CE2 4.34Å; P431-F567 HydrophobicContact CB-CZ 4.01Å; P431-F567 HydrophobicContact CG-CE2 4.29Å; P431-F567 HydrophobicContact CG-CZ 4.19Å; P509-F567 HydrophobicContact CB-CD2 4.35Å; P509-F567 HydrophobicContact CB-CE2 3.98Å; P509-F567 HydrophobicContact CG-CD2 4.44Å; I512-F567 HydrophobicContact CD1-CB 3.74Å; I512-F567 HydrophobicContact CD1-CD1 4.39Å; I512-F567 HydrophobicContact CD1-CD2 4.03Å; I512-F567 HydrophobicContact CD1-CG 3.8Å; I512-F567 HydrophobicContact CG2-CD1 3.54Å; I512-F567 HydrophobicContact CG2-CD2 4.39Å; I512-F567 HydrophobicContact CG2-CE1 3.48Å; I512-F567 VanDerWaalsContact CG2-CE1 3.48Å; I512-F567 HydrophobicContact CG2-CE2 4.36Å; I512-F567 HydrophobicContact CG2-CG 4.01Å; I512-F567 HydrophobicContact CG2-CZ 3.92Å; F567-K569 VanDerWaalsContact C-N 3.29Å; F567-K569 PolarHBondContact O-N 3.5Å; F567-Y570 PolarHBondContact O-N 2.81Å; F567-C571 WeakPolarHBondContact O-CB 3.45Å; F567-C571 PolarHBondContact O-N 3.04Å; F567-L627 HydrophobicContact CB-CD1 4.03Å; F567-F630 HydrophobicContact CB-CD1 4.47Å; F567-F630 HydrophobicContact CB-CD2 3.98Å; F567-F630 HydrophobicContact CB-CE2 4.06Å; F567-F630 HydrophobicContact CB-CG 4.19Å; F567-F630 HydrophobicContact CB-CZ 4.33Å
568	Q	95.2	Very high	93.7	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.019	17%	0.174	C	C	.	.	H	α-helix	trans	-59.5	-38.1	179.8	-69	88.6	-25	0	0	112.3	V427 S538 V542 T566 S572	V427-Q568 HydrophobicContact CG1-CB 4.04Å; V427-Q568 HydrophobicContact CG1-CG 4.01Å; S538-Q568 PolarHBondContact O-NE2 3.41Å; S538-Q568 VanDerWaalsContact O-NE2 3.11Å; V542-Q568 HydrophobicContact CB-CG 4.29Å; V542-Q568 HydrophobicContact CG2-CB 4.13Å; V542-Q568 HydrophobicContact CG2-CG 3.46Å; V542-Q568 VanDerWaalsContact CG2-CG 3.46Å; T566-Q568 PolarHBondContact O-N 2.85Å; Q568-S572 VanDerWaalsContact O-CB 3.24Å; Q568-S572 WeakPolarHBondContact O-CB 3.32Å; Q568-S572 PolarHBondContact O-N 2.91Å; Q568-S572 PolarHBondContact O-OG 3.01Å
569	K	94.1	Very high	93.7	Very high	5 Å²	5	33 Å²	33	2%	0.022	15%	0.15	C	C	.	.	H	α-helix	trans	-58.1	-56.9	175	177	-178.7	170.5	62	0	111.9	G545 I552 S563 Y564 F567 C571 S572 E573	G545-K569 WeakPolarHBondContact O-CA 3.33Å; G545-K569 WeakPolarHBondContact O-CB 3.06Å; I552-K569 HydrophobicContact CD1-CD 4.39Å; I552-K569 HydrophobicContact CD1-CG 4.14Å; S563-K569 WeakPolarHBondContact O-CB 3.45Å; S563-K569 WeakPolarHBondContact O-CD 3.22Å; Y564-K569 HydrophobicContact CD1-CD 4.09Å; Y564-K569 HydrophobicContact CE1-CD 4.46Å; Y564-K569 HydrophobicContact CG-CD 4.48Å; F567-K569 VanDerWaalsContact C-N 3.29Å; F567-K569 PolarHBondContact O-N 3.5Å; K569-C571 VanDerWaalsContact C-N 3.3Å; K569-C571 PolarHBondContact O-N 2.85Å; K569-S572 PolarHBondContact O-N 2.83Å; K569-E573 VanDerWaalsContact CE-OE1 3.31Å; K569-E573 WeakPolarHBondContact CE-OE1 3.41Å; K569-E573 IonicContact NZ-OE1 2.7Å; K569-E573 PolarHBondContact NZ-OE1 3.4Å; K569-E573 WeakPolarHBondContact O-CG 3.39Å; K569-E573 PolarHBondContact O-N 3.38Å
570	Y	95.4	Very high	93.7	Very high	26 Å²	26	28.3 Å²	28.3	10%	0.102	13%	0.13	C	C	.	.	H	α-helix	trans	-63.9	-37.4	-177	-54.6	-75.6	0	0	0	111.7	Y564 T566 F567 I574 I626 F630	Y564-Y570 WeakPolarHBondContact O-CE2 3.47Å; Y564-Y570 PolarHBondContact O-OH 3.05Å; T566-Y570 WeakPolarHBondContact O-CD2 3.48Å; T566-Y570 WeakPolarHBondContact O-CE2 3.48Å; F567-Y570 PolarHBondContact O-N 2.81Å; Y570-I574 VanDerWaalsContact O-CD1 3.25Å; Y570-I574 WeakPolarHBondContact O-CD1 3.41Å; Y570-I574 WeakPolarHBondContact O-CG1 3.26Å; Y570-I574 PolarHBondContact O-N 3.48Å; Y570-I574 VanDerWaalsContact O-N 3.17Å; Y570-I626 HydrophobicContact CD1-CB 4.11Å; Y570-I626 HydrophobicContact CD1-CD1 4.14Å; Y570-I626 HydrophobicContact CD1-CG2 3.82Å; Y570-I626 HydrophobicContact CD2-CG2 3.68Å; Y570-I626 HydrophobicContact CE1-CB 4.31Å; Y570-I626 HydrophobicContact CE1-CD1 3.76Å; Y570-I626 HydrophobicContact CE1-CG2 3.76Å; Y570-I626 HydrophobicContact CE2-CG2 3.63Å; Y570-I626 HydrophobicContact CG-CB 4.29Å; Y570-I626 HydrophobicContact CG-CG2 3.78Å; Y570-F630 HydrophobicContact CD2-CE2 4.16Å; Y570-F630 HydrophobicContact CE2-CE2 4.29Å; Y570-F630 HydrophobicContact CE2-CZ 4.49Å
571	C	96.6	Very high	93.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-65.6	-44.4	174.1	-172.4	0	0	0	0	112.4	V427 A505 P509 F567 K569 I574 L575 L627	V427-C571 HydrophobicContact CG1-CB 4.25Å; A505-C571 PolarHBondContact O-SG 3.3Å; P509-C571 HydrophobicContact CG-CB 4.17Å; P509-C571 WeakPolarHBondContact CG-SG 3.3Å; F567-C571 WeakPolarHBondContact O-CB 3.45Å; F567-C571 PolarHBondContact O-N 3.04Å; K569-C571 VanDerWaalsContact C-N 3.3Å; K569-C571 PolarHBondContact O-N 2.85Å; C571-I574 PolarHBondContact O-N 3.44Å; C571-L575 WeakPolarHBondContact O-CG 3.43Å; C571-L575 PolarHBondContact O-N 3.36Å; C571-L627 HydrophobicContact CB-CD1 3.99Å; C571-L627 HydrophobicContact CB-CD2 3.99Å
572	S	94.6	Very high	93.3	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.007	15%	0.146	C	C	.	.	H	α-helix	trans	-67.1	-42.9	-179.5	-55.5	0	0	0	0	111.6	S546 Q568 K569 I574 L575 L576	S546-S572 WeakPolarHBondContact CA-OG 3.21Å; S546-S572 WeakPolarHBondContact CB-OG 3.39Å; Q568-S572 VanDerWaalsContact O-CB 3.24Å; Q568-S572 WeakPolarHBondContact O-CB 3.32Å; Q568-S572 PolarHBondContact O-N 2.91Å; Q568-S572 PolarHBondContact O-OG 3.01Å; K569-S572 PolarHBondContact O-N 2.83Å; S572-I574 VanDerWaalsContact C-N 3.32Å; S572-I574 PolarHBondContact O-N 2.63Å; S572-L575 PolarHBondContact O-N 2.87Å; S572-L576 WeakPolarHBondContact O-CB 3.34Å; S572-L576 PolarHBondContact O-N 2.87Å
573	E	94.2	Very high	93	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.009	13%	0.133	C	C	.	.	H	α-helix	trans	-60.5	-39.6	175.1	-72.7	-178	-170.1	0	0	111.6	K569 V577 A616 R619 N623	K569-E573 VanDerWaalsContact CE-OE1 3.31Å; K569-E573 WeakPolarHBondContact CE-OE1 3.41Å; K569-E573 IonicContact NZ-OE1 2.7Å; K569-E573 PolarHBondContact NZ-OE1 3.4Å; K569-E573 WeakPolarHBondContact O-CG 3.39Å; K569-E573 PolarHBondContact O-N 3.38Å; E573-V577 VanDerWaalsContact O-CG2 3.3Å; E573-V577 WeakPolarHBondContact O-CG2 3.17Å; E573-V577 PolarHBondContact O-N 3.41Å; E573-V577 VanDerWaalsContact O-N 3.07Å; E573-A616 HydrophobicContact CB-CB 4.23Å; E573-A616 HydrophobicContact CG-CB 4.37Å; E573-R619 IonicContact OE1-NH1 3.68Å; E573-R619 IonicContact OE1-NH2 3.96Å; E573-R619 IonicContact OE2-CZ 3.7Å; E573-R619 IonicContact OE2-NH1 3.19Å; E573-R619 PolarHBondContact OE2-NH1 2.86Å; E573-R619 IonicContact OE2-NH2 3.81Å; E573-N623 WeakPolarHBondContact CB-ND2 3.41Å; E573-N623 PolarHBondContact OE2-ND2 3.2Å
574	I	95.8	Very high	92.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.2	-51.7	174.6	-70.3	161.7	0	0	0	110.9	A505 Y570 C571 S572 L576 V577 N578 F620 N623 F624 L627	A505-I574 HydrophobicContact CB-CG2 3.79Å; Y570-I574 VanDerWaalsContact O-CD1 3.25Å; Y570-I574 WeakPolarHBondContact O-CD1 3.41Å; Y570-I574 WeakPolarHBondContact O-CG1 3.26Å; Y570-I574 PolarHBondContact O-N 3.48Å; Y570-I574 VanDerWaalsContact O-N 3.17Å; C571-I574 PolarHBondContact O-N 3.44Å; S572-I574 VanDerWaalsContact C-N 3.32Å; S572-I574 PolarHBondContact O-N 2.63Å; I574-L576 VanDerWaalsContact C-N 3.31Å; I574-L576 PolarHBondContact O-N 3.47Å; I574-V577 PolarHBondContact O-N 3.07Å; I574-N578 WeakPolarHBondContact O-CB 3.25Å; I574-N578 PolarHBondContact O-N 3.01Å; I574-F620 HydrophobicContact CB-CE2 4.42Å; I574-F620 HydrophobicContact CG2-CE2 3.87Å; I574-F620 HydrophobicContact CG2-CZ 4.34Å; I574-N623 HydrophobicContact CD1-CB 3.97Å; I574-N623 HydrophobicContact CG1-CB 3.69Å; I574-F624 HydrophobicContact CB-CE2 4.44Å; I574-F624 HydrophobicContact CD1-CB 4.44Å; I574-F624 HydrophobicContact CD1-CD1 4.1Å; I574-F624 HydrophobicContact CD1-CD2 3.92Å; I574-F624 HydrophobicContact CD1-CE1 4.33Å; I574-F624 HydrophobicContact CD1-CE2 4.17Å; I574-F624 HydrophobicContact CD1-CG 3.89Å; I574-F624 HydrophobicContact CD1-CZ 4.37Å; I574-F624 HydrophobicContact CG1-CD2 4.1Å; I574-F624 HydrophobicContact CG1-CE2 4.16Å; I574-F624 HydrophobicContact CG2-CD2 4.18Å; I574-F624 HydrophobicContact CG2-CE1 4.26Å; I574-F624 HydrophobicContact CG2-CE2 3.4Å; I574-F624 HydrophobicContact CG2-CZ 3.45Å; I574-F624 VanDerWaalsContact CG2-CZ 3.45Å; I574-L627 HydrophobicContact CD1-CB 4.36Å; I574-L627 HydrophobicContact CD1-CD2 3.8Å
575	L	95.2	Very high	92.4	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-65.2	-38.1	-176.9	-69.6	171	0	0	0	111.9	L423 V427 F502 A505 L506 C571 S572 N578 E579	L423-L575 HydrophobicContact CD1-CB 4.1Å; L423-L575 HydrophobicContact CD2-CB 3.92Å; L423-L575 HydrophobicContact CD2-CD1 4.32Å; L423-L575 HydrophobicContact CD2-CG 4.5Å; L423-L575 HydrophobicContact CG-CB 4.48Å; V427-L575 HydrophobicContact CG2-CD1 3.42Å; V427-L575 VanDerWaalsContact CG2-CD1 3.42Å; F502-L575 HydrophobicContact CD2-CD2 3.58Å; F502-L575 HydrophobicContact CE2-CD2 4.1Å; F502-L575 HydrophobicContact CG-CD2 4.36Å; A505-L575 HydrophobicContact CB-CD2 3.74Å; A505-L575 HydrophobicContact CB-CG 4.11Å; L506-L575 HydrophobicContact CD2-CD1 3.77Å; L506-L575 HydrophobicContact CG-CD2 4.45Å; C571-L575 WeakPolarHBondContact O-CG 3.43Å; C571-L575 PolarHBondContact O-N 3.36Å; S572-L575 PolarHBondContact O-N 2.87Å; L575-N578 PolarHBondContact O-N 3.3Å; L575-E579 WeakPolarHBondContact O-CB 3.45Å; L575-E579 PolarHBondContact O-N 3.17Å
576	L	93.9	Very high	91.8	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.3	-52.3	176	-178.2	72.9	0	0	0	110.8	F548 S572 I574 N578 E579 F580 F608 I609 T612	F548-L576 HydrophobicContact CE1-CB 4.3Å; F548-L576 HydrophobicContact CE1-CD1 3.98Å; F548-L576 HydrophobicContact CZ-CB 4.5Å; S572-L576 WeakPolarHBondContact O-CB 3.34Å; S572-L576 PolarHBondContact O-N 2.87Å; I574-L576 VanDerWaalsContact C-N 3.31Å; I574-L576 PolarHBondContact O-N 3.47Å; L576-N578 PolarHBondContact O-N 3.34Å; L576-E579 PolarHBondContact O-N 3.01Å; L576-F580 HydrophobicContact CD1-CD2 3.54Å; L576-F580 HydrophobicContact CD1-CE2 3.68Å; L576-F580 HydrophobicContact CD1-CG 4.31Å; L576-F580 HydrophobicContact CG-CD2 4.33Å; L576-F580 WeakPolarHBondContact O-CB 3.04Å; L576-F580 WeakPolarHBondContact O-CD2 3.41Å; L576-F580 PolarHBondContact O-N 3.33Å; L576-F608 HydrophobicContact CD1-CD1 3.82Å; L576-F608 HydrophobicContact CD1-CE1 3.48Å; L576-F608 VanDerWaalsContact CD1-CE1 3.48Å; L576-I609 HydrophobicContact CD2-CG1 4.49Å; L576-I609 HydrophobicContact CG-CG1 4.22Å; L576-T612 HydrophobicContact CD2-CG2 4.24Å
577	V	94.1	Very high	90.7	Very high	11 Å²	11	24.1 Å²	24.1	7%	0.067	14%	0.135	C	C	.	.	H	α-helix	trans	-63.7	-43	178	173.4	0	0	0	0	110.9	E573 I574 E579 Y581 I609 A616 T617 F620	E573-V577 VanDerWaalsContact O-CG2 3.3Å; E573-V577 WeakPolarHBondContact O-CG2 3.17Å; E573-V577 PolarHBondContact O-N 3.41Å; E573-V577 VanDerWaalsContact O-N 3.07Å; I574-V577 PolarHBondContact O-N 3.07Å; V577-E579 VanDerWaalsContact C-N 3.32Å; V577-E579 PolarHBondContact O-N 3.45Å; V577-Y581 WeakPolarHBondContact O-CB 3.33Å; V577-Y581 PolarHBondContact O-N 2.99Å; V577-Y581 VanDerWaalsContact O-N 3.08Å; V577-I609 HydrophobicContact CG2-CG2 4.13Å; V577-A616 HydrophobicContact CG2-CB 3.67Å; V577-T617 HydrophobicContact CG1-CG2 4.44Å; V577-T617 HydrophobicContact CG2-CG2 4.36Å; V577-F620 HydrophobicContact CB-CD2 3.86Å; V577-F620 HydrophobicContact CB-CE2 4.25Å; V577-F620 HydrophobicContact CG1-CD2 3.69Å; V577-F620 HydrophobicContact CG1-CE2 4.17Å; V577-F620 HydrophobicContact CG1-CG 4.37Å
578	N	94.7	Very high	89.2	Confident	7 Å²	7	25.3 Å²	25.3	4%	0.037	15%	0.151	C	C	.	.	H	α-helix	trans	-61.1	-39.5	-178.9	-174.1	63.1	0	0	0	112.7	R498 I574 L575 L576 F620	R498-N578 VanDerWaalsContact CA-OD1 3.32Å; R498-N578 WeakPolarHBondContact CA-OD1 3.17Å; R498-N578 VanDerWaalsContact CB-OD1 3.3Å; R498-N578 WeakPolarHBondContact CB-OD1 3.39Å; R498-N578 WeakPolarHBondContact CD-O 3.16Å; R498-N578 WeakPolarHBondContact CG-OD1 3.35Å; R498-N578 PolarHBondContact NH1-O 3.42Å; R498-N578 PolarHBondContact O-ND2 2.92Å; R498-N578 PolarHBondContact O-OD1 3.39Å; I574-N578 WeakPolarHBondContact O-CB 3.25Å; I574-N578 PolarHBondContact O-N 3.01Å; L575-N578 PolarHBondContact O-N 3.3Å; L576-N578 PolarHBondContact O-N 3.34Å; N578-F620 HydrophobicContact CB-CE2 4.26Å
579	E	92.6	Very high	87.4	Confident	2 Å²	2	31.2 Å²	31.2	1%	0.009	19%	0.193	C	C	.	.	H	α-helix	trans	-81.4	-49.8	179.8	179.8	59.9	-171.2	0	0	112.1	R419 L492 H493 L575 L576 V577 L583	R419-E579 IonicContact CZ-OE1 3.96Å; R419-E579 IonicContact NE-OE1 2.94Å; R419-E579 PolarHBondContact NE-OE1 3.37Å; L492-E579 VanDerWaalsContact CB-OE2 3.3Å; L492-E579 WeakPolarHBondContact CB-OE2 3.42Å; L492-E579 WeakPolarHBondContact CD2-OE2 3.48Å; L492-E579 WeakPolarHBondContact CG-OE2 3.35Å; H493-E579 PolarHBondContact N-OE2 2.99Å; H493-E579 VanDerWaalsContact N-OE2 3.11Å; L575-E579 WeakPolarHBondContact O-CB 3.45Å; L575-E579 PolarHBondContact O-N 3.17Å; L576-E579 PolarHBondContact O-N 3.01Å; V577-E579 VanDerWaalsContact C-N 3.32Å; V577-E579 PolarHBondContact O-N 3.45Å; E579-L583 HydrophobicContact CG-CD1 4.44Å; E579-L583 WeakPolarHBondContact O-CD1 3.17Å; E579-L583 WeakPolarHBondContact O-CG 3.21Å
580	F	90.8	Very high	85.5	Confident	0 Å²	0	34 Å²	34	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-85.8	-18.3	-167.7	-72.4	-94.4	0	0	0	114.6	I416 R419 V420 L423 L576 G582 L583 F585 G605 F608 I609	I416-F580 HydrophobicContact CG1-CE1 4.33Å; I416-F580 HydrophobicContact CG2-CE1 4.03Å; I416-F580 HydrophobicContact CG2-CZ 4.24Å; R419-F580 HydrophobicContact CB-CE2 4.19Å; R419-F580 HydrophobicContact CB-CZ 3.75Å; V420-F580 HydrophobicContact CG2-CZ 4.22Å; L423-F580 HydrophobicContact CD1-CE2 4.32Å; L576-F580 HydrophobicContact CD1-CD2 3.54Å; L576-F580 HydrophobicContact CD1-CE2 3.68Å; L576-F580 HydrophobicContact CD1-CG 4.31Å; L576-F580 HydrophobicContact CG-CD2 4.33Å; L576-F580 WeakPolarHBondContact O-CB 3.04Å; L576-F580 WeakPolarHBondContact O-CD2 3.41Å; L576-F580 PolarHBondContact O-N 3.33Å; F580-G582 PolarHBondContact O-N 2.94Å; F580-G582 VanDerWaalsContact O-N 3.17Å; F580-L583 PolarHBondContact O-N 3.45Å; F580-F585 AromaticContact CD1-CE2 3.89Å; F580-F585 HydrophobicContact CD1-CE2 3.89Å; F580-F585 AromaticContact CD1-CZ 3.64Å; F580-F585 HydrophobicContact CD1-CZ 3.64Å; F580-F585 HydrophobicContact CE1-CE2 4.1Å; F580-F585 AromaticContact CE1-CZ 3.67Å; F580-F585 HydrophobicContact CE1-CZ 3.67Å; F580-G605 WeakPolarHBondContact O-CA 3.34Å; F580-F608 AromaticContact CD1-CD1 3.79Å; F580-F608 HydrophobicContact CD1-CD1 3.79Å; F580-F608 HydrophobicContact CD2-CD1 4.37Å; F580-F608 AromaticContact CE1-CD1 3.66Å; F580-F608 HydrophobicContact CE1-CD1 3.66Å; F580-F608 HydrophobicContact CE1-CE1 4.04Å; F580-F608 HydrophobicContact CE1-CG 4.46Å; F580-F608 HydrophobicContact CE2-CD1 4.24Å; F580-F608 HydrophobicContact CE2-CE1 4.11Å; F580-F608 HydrophobicContact CG-CD1 4.15Å; F580-F608 AromaticContact CZ-CD1 3.88Å; F580-F608 HydrophobicContact CZ-CD1 3.88Å; F580-F608 AromaticContact CZ-CE1 3.8Å; F580-F608 HydrophobicContact CZ-CE1 3.8Å; F580-I609 HydrophobicContact CB-CD1 3.83Å; F580-I609 HydrophobicContact CB-CG1 3.88Å
581	Y	89.6	Confident	83.5	Confident	129 Å²	129	40.2 Å²	40.2	51%	0.506	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	117.7	-177.7	-171.2	-96.5	0	0	0	111.4	R498 V577 I606 T617	R498-Y581 VanDerWaalsContact CZ-O 3.25Å; R498-Y581 PolarHBondContact NH1-O 3.37Å; R498-Y581 PolarHBondContact NH2-O 3.03Å; V577-Y581 WeakPolarHBondContact O-CB 3.33Å; V577-Y581 PolarHBondContact O-N 2.99Å; V577-Y581 VanDerWaalsContact O-N 3.08Å; Y581-I606 HydrophobicContact CD2-CD1 4.38Å; Y581-I606 HydrophobicContact CE2-CD1 4.49Å; Y581-T617 HydrophobicContact CD2-CG2 4.24Å; Y581-T617 HydrophobicContact CE2-CG2 4.48Å
582	G	84.4	Confident	81.3	Confident	59 Å²	59	45.5 Å²	45.5	61%	0.608	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.4	8.1	-179.1	0	0	0	0	0	115.4	F580	F580-G582 PolarHBondContact O-N 2.94Å; F580-G582 VanDerWaalsContact O-N 3.17Å
583	L	86.4	Confident	79.2	Confident	24 Å²	24	46.2 Å²	46.2	13%	0.126	29%	0.285	C	S	.	.			trans	-84.5	137.3	170.4	-72.8	-177	0	0	0	111.7	E579 F580 F585 G605	E579-L583 HydrophobicContact CG-CD1 4.44Å; E579-L583 WeakPolarHBondContact O-CD1 3.17Å; E579-L583 WeakPolarHBondContact O-CG 3.21Å; F580-L583 PolarHBondContact O-N 3.45Å; L583-F585 HydrophobicContact CB-CE1 4.46Å; L583-F585 HydrophobicContact CB-CE2 4.48Å; L583-F585 HydrophobicContact CB-CZ 4.1Å; L583-F585 HydrophobicContact CD1-CE1 4.28Å; L583-F585 HydrophobicContact CD1-CZ 4.1Å; L583-G605 PolarHBondContact O-N 2.98Å
584	N	85.9	Confident	77.2	Confident	120 Å²	120	49.6 Å²	49.6	64%	0.642	31%	0.306	S	S	*	.	B	Isolated β-bridge	trans	-112.4	131.6	168.7	-70.5	-22.4	0	0	0	109.2
585	F	83.9	Confident	75	Confident	12 Å²	12	58.3 Å²	58.3	5%	0.053	35%	0.349	C	S	.	.			trans	-105.8	142.9	179.6	-57.6	-70.3	0	0	0	111.3	V411 A415 I416 F580 L583 T603	V411-F585 HydrophobicContact CG2-CB 3.41Å; V411-F585 VanDerWaalsContact CG2-CB 3.41Å; V411-F585 HydrophobicContact CG2-CG 4.27Å; A415-F585 HydrophobicContact CB-CD1 4.26Å; I416-F585 HydrophobicContact CD1-CD2 4.08Å; I416-F585 HydrophobicContact CD1-CE2 4.14Å; I416-F585 HydrophobicContact CG1-CD2 4.18Å; I416-F585 HydrophobicContact CG1-CE1 4.44Å; I416-F585 HydrophobicContact CG1-CE2 3.97Å; I416-F585 HydrophobicContact CG1-CG 4.5Å; I416-F585 HydrophobicContact CG1-CZ 4.12Å; F580-F585 AromaticContact CD1-CE2 3.89Å; F580-F585 HydrophobicContact CD1-CE2 3.89Å; F580-F585 AromaticContact CD1-CZ 3.64Å; F580-F585 HydrophobicContact CD1-CZ 3.64Å; F580-F585 HydrophobicContact CE1-CE2 4.1Å; F580-F585 AromaticContact CE1-CZ 3.67Å; F580-F585 HydrophobicContact CE1-CZ 3.67Å; L583-F585 HydrophobicContact CB-CE1 4.46Å; L583-F585 HydrophobicContact CB-CE2 4.48Å; L583-F585 HydrophobicContact CB-CZ 4.1Å; L583-F585 HydrophobicContact CD1-CE1 4.28Å; L583-F585 HydrophobicContact CD1-CZ 4.1Å; F585-T603 PolarHBondContact N-O 2.84Å
586	T	79.8	Confident	72.9	Confident	71 Å²	71	63 Å²	63	44%	0.436	38%	0.378	S	S	.	.	B	Isolated β-bridge	trans	-93	123.4	177.4	39.6	0	0	0	0	110	N409 N410 V411	N409-T586 PolarHBondContact O-N 2.9Å; N409-T586 PolarHBondContact O-OG1 2.9Å; N410-T586 CarbonylContact C-O 3.38Å; N410-T586 WeakPolarHBondContact CA-O 3.45Å; N410-T586 PolarHBondContact OD1-OG1 3.19Å; V411-T586 PolarHBondContact N-O 3.43Å
587	C	71.5	Confident	71.2	Confident	16 Å²	16	66.4 Å²	66.4	11%	0.108	40%	0.396	C	S	.	.			trans	-103.6	89.6	170.4	167.7	0	0	0	0	109.3	S593 C600	C587-S593 PolarHBondContact O-OG 3.16Å; C587-C600 HydrophobicContact CB-CB 3.8Å; C587-C600 WeakPolarHBondContact CB-SG 3.24Å; C587-C600 WeakPolarHBondContact SG-CB 3.36Å; C587-C600 CovalentContact SG-SG 2.02Å; C587-C600 PolarHBondContact SG-SG 2.86Å
588	G	65.1	Low	69.6	Low	41 Å²	41	71.4 Å²	71.4	42%	0.423	43%	0.429	S	S	.	.			trans	65.3	-170.8	174.8	0	0	0	0	0	113.8
589	S	57.4	Low	67.8	Low	128 Å²	128	77 Å²	77	90%	0.895	46%	0.456	S	S	*	.	S	Bend	trans	-103.1	4.9	-176.7	57.5	0	0	0	0	114.2
590	S	53.5	Low	66.4	Low	63 Å²	63	77 Å²	77	44%	0.441	46%	0.456	S	S	.	.	S	Bend	trans	-145.4	140.7	-176.5	55.6	0	0	0	0	113	V592 S593	S590-V592 PolarHBondContact O-N 2.67Å; S590-S593 PolarHBondContact O-N 3.38Å; S590-S593 PolarHBondContact O-OG 2.8Å
591	N	53.5	Low	65.1	Low	158 Å²	158	80 Å²	80	85%	0.845	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-6.4	178.9	-68.4	-15.1	0	0	0	114.3
592	V	50.7	Low	64.3	Low	110 Å²	110	76.1 Å²	76.1	67%	0.667	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-18.7	-178.6	-173.5	0	0	0	0	112.3	S590 T596	S590-V592 PolarHBondContact O-N 2.67Å; V592-T596 PolarHBondContact O-OG1 2.87Å
593	S	50	Low	63.9	Low	17 Å²	17	75.9 Å²	75.9	12%	0.119	45%	0.453	C	S	.	.	S	Bend	trans	-79.9	-13.3	177.1	52.1	0	0	0	0	114.5	C587 S590 N597	C587-S593 PolarHBondContact O-OG 3.16Å; S590-S593 PolarHBondContact O-N 3.38Å; S590-S593 PolarHBondContact O-OG 2.8Å; S593-N597 PolarHBondContact O-N 2.71Å
594	V	51.8	Low	63.8	Low	73 Å²	73	79.1 Å²	79.1	44%	0.442	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-30.2	-179.3	-177.4	0	0	0	0	112
595	M	49.2	Very low	63.7	Low	182 Å²	182	73.5 Å²	73.5	90%	0.897	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-13.8	178.6	-86.8	172.7	64.5	0	0	114.3
596	T	52.4	Low	63.9	Low	100 Å²	100	75.7 Å²	75.7	61%	0.613	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.1	-20.5	-168.6	47.2	0	0	0	0	114.6	V592	V592-T596 PolarHBondContact O-OG1 2.87Å
597	N	57.2	Low	64.2	Low	71 Å²	71	76 Å²	76	38%	0.38	45%	0.447	S	S	.	.			trans	-111.2	117.4	177.5	-92.7	-39.7	0	0	0	111.8	S593 M599 C600	S593-N597 PolarHBondContact O-N 2.71Å; N597-M599 PolarHBondContact O-N 3.41Å; N597-M599 VanDerWaalsContact O-N 3.09Å; N597-C600 PolarHBondContact O-N 3.38Å
598	P	61.2	Low	64.9	Low	117 Å²	117	76.4 Å²	76.4	76%	0.76	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-62.1	-20.6	179	24.8	-33	0	0	0	112.9	C600 A601	P598-C600 VanDerWaalsContact C-N 3.26Å; P598-C600 PolarHBondContact O-N 3.32Å; P598-A601 PolarHBondContact O-N 3.38Å
599	M	56	Low	65.9	Low	124 Å²	124	74.4 Å²	74.4	61%	0.611	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-70.4	-17.7	174.5	-72.2	-65.3	-130.9	0	0	113.7	V411 N597 A601	V411-M599 WeakPolarHBondContact CG1-O 3.32Å; N597-M599 PolarHBondContact O-N 3.41Å; N597-M599 VanDerWaalsContact O-N 3.09Å; M599-A601 VanDerWaalsContact C-N 3.3Å; M599-A601 PolarHBondContact O-N 2.91Å
600	C	63.6	Low	67.3	Low	2 Å²	2	72.1 Å²	72.1	1%	0.014	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-90.7	16.7	177.9	-72.1	0	0	0	0	114.1	C587 N597 P598 F602	C587-C600 HydrophobicContact CB-CB 3.8Å; C587-C600 WeakPolarHBondContact CB-SG 3.24Å; C587-C600 WeakPolarHBondContact SG-CB 3.36Å; C587-C600 CovalentContact SG-SG 2.02Å; C587-C600 PolarHBondContact SG-SG 2.86Å; N597-C600 PolarHBondContact O-N 3.38Å; P598-C600 VanDerWaalsContact C-N 3.26Å; P598-C600 PolarHBondContact O-N 3.32Å; C600-F602 PolarHBondContact O-N 2.7Å
601	A	64.8	Low	68.8	Low	62 Å²	62	73.7 Å²	73.7	51%	0.512	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-62.7	-27.1	178.6	0	0	0	0	0	113.5	P598 M599	P598-A601 PolarHBondContact O-N 3.38Å; M599-A601 VanDerWaalsContact C-N 3.3Å; M599-A601 PolarHBondContact O-N 2.91Å
602	F	71.8	Confident	70.2	Confident	48 Å²	48	66.8 Å²	66.8	21%	0.211	37%	0.365	C	S	.	.			trans	-111.3	110.2	-177.7	-54.7	-70.3	0	0	0	111.2	I416 C600 Q607 F608 E611	I416-F602 HydrophobicContact CD1-CB 3.82Å; C600-F602 PolarHBondContact O-N 2.7Å; F602-Q607 HydrophobicContact CD1-CB 3.82Å; F602-Q607 HydrophobicContact CE1-CB 4.47Å; F602-F608 HydrophobicContact CD1-CB 4.48Å; F602-E611 HydrophobicContact CE1-CB 4.48Å; F602-E611 VanDerWaalsContact CE1-OE2 3.32Å; F602-E611 WeakPolarHBondContact CE1-OE2 3.42Å; F602-E611 WeakPolarHBondContact CE2-OE2 3.44Å; F602-E611 WeakPolarHBondContact CZ-OE1 3.47Å; F602-E611 WeakPolarHBondContact CZ-OE2 3.26Å
603	T	76.9	Confident	71.8	Confident	54 Å²	54	61.8 Å²	61.8	33%	0.331	34%	0.335	S	S	.	.	S	Bend	trans	-101.6	-25.5	175.2	52.2	0	0	0	0	111.9	F585	F585-T603 PolarHBondContact N-O 2.84Å
604	Q	84.2	Confident	73.4	Confident	93 Å²	93	62.7 Å²	62.7	44%	0.435	34%	0.341	S	S	.	.	B	Isolated β-bridge	trans	-117.7	139.3	177.8	-62.1	-179.6	-7	0	0	110.7	I606 Q607	Q604-I606 HydrophobicContact CB-CG2 4.05Å; Q604-I606 PolarHBondContact O-N 3.35Å; Q604-Q607 HydrophobicContact CB-CG 4.31Å; Q604-Q607 WeakPolarHBondContact O-CB 3.09Å; Q604-Q607 PolarHBondContact O-N 3.5Å; Q604-Q607 VanDerWaalsContact O-N 3.14Å
605	G	83.9	Confident	74.8	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.01	33%	0.33	C	S	.	.	H	α-helix	trans	-61.5	-26.3	178.8	0	0	0	0	0	114.2	F580 L583 Q607 F608 I609	F580-G605 WeakPolarHBondContact O-CA 3.34Å; L583-G605 PolarHBondContact O-N 2.98Å; G605-Q607 VanDerWaalsContact C-N 3.31Å; G605-Q607 PolarHBondContact O-N 2.8Å; G605-F608 PolarHBondContact O-N 2.66Å; G605-I609 WeakPolarHBondContact O-CG1 3.32Å; G605-I609 PolarHBondContact O-N 3.01Å; G605-I609 VanDerWaalsContact O-N 3.08Å
606	I	86.8	Confident	76.6	Confident	58 Å²	58	51.6 Å²	51.6	30%	0.297	29%	0.287	S	S	.	.	H	α-helix	trans	-64.4	-34.6	176.3	-166.4	62	0	0	0	112.8	Y581 Q604 F608 I609 E610 T617	Y581-I606 HydrophobicContact CD2-CD1 4.38Å; Y581-I606 HydrophobicContact CE2-CD1 4.49Å; Q604-I606 HydrophobicContact CB-CG2 4.05Å; Q604-I606 PolarHBondContact O-N 3.35Å; I606-F608 VanDerWaalsContact C-N 3.32Å; I606-F608 PolarHBondContact O-N 3.34Å; I606-I609 HydrophobicContact CD1-CD1 4.38Å; I606-I609 PolarHBondContact O-N 3.39Å; I606-E610 PolarHBondContact O-N 3.34Å; I606-T617 HydrophobicContact CD1-CG2 3.74Å
607	Q	85.6	Confident	78.2	Confident	79 Å²	79	48.9 Å²	48.9	37%	0.369	27%	0.271	S	S	.	.	H	α-helix	trans	-65	-40.8	178.3	-64.8	172.9	-30.6	0	0	110.5	F602 Q604 G605 E610 E611	F602-Q607 HydrophobicContact CD1-CB 3.82Å; F602-Q607 HydrophobicContact CE1-CB 4.47Å; Q604-Q607 HydrophobicContact CB-CG 4.31Å; Q604-Q607 WeakPolarHBondContact O-CB 3.09Å; Q604-Q607 PolarHBondContact O-N 3.5Å; Q604-Q607 VanDerWaalsContact O-N 3.14Å; G605-Q607 VanDerWaalsContact C-N 3.31Å; G605-Q607 PolarHBondContact O-N 2.8Å; Q607-E610 PolarHBondContact O-N 3.09Å; Q607-E611 PolarHBondContact O-N 3.25Å; Q607-E611 VanDerWaalsContact O-N 3.11Å
608	F	86.3	Confident	79.8	Confident	23 Å²	23	50 Å²	50	10%	0.101	28%	0.284	C	S	.	.	H	α-helix	trans	-68	-37.5	176.5	-175.8	-110.3	0	0	0	112.6	I416 V420 L576 F580 F602 G605 I606 T612	I416-F608 HydrophobicContact CG2-CD1 4.18Å; I416-F608 HydrophobicContact CG2-CD2 3.96Å; I416-F608 HydrophobicContact CG2-CE1 3.98Å; I416-F608 HydrophobicContact CG2-CE2 3.77Å; I416-F608 HydrophobicContact CG2-CG 4.18Å; I416-F608 HydrophobicContact CG2-CZ 3.8Å; V420-F608 HydrophobicContact CG2-CE1 3.6Å; V420-F608 HydrophobicContact CG2-CZ 3.43Å; V420-F608 VanDerWaalsContact CG2-CZ 3.43Å; L576-F608 HydrophobicContact CD1-CD1 3.82Å; L576-F608 HydrophobicContact CD1-CE1 3.48Å; L576-F608 VanDerWaalsContact CD1-CE1 3.48Å; F580-F608 AromaticContact CD1-CD1 3.79Å; F580-F608 HydrophobicContact CD1-CD1 3.79Å; F580-F608 HydrophobicContact CD2-CD1 4.37Å; F580-F608 AromaticContact CE1-CD1 3.66Å; F580-F608 HydrophobicContact CE1-CD1 3.66Å; F580-F608 HydrophobicContact CE1-CE1 4.04Å; F580-F608 HydrophobicContact CE1-CG 4.46Å; F580-F608 HydrophobicContact CE2-CD1 4.24Å; F580-F608 HydrophobicContact CE2-CE1 4.11Å; F580-F608 HydrophobicContact CG-CD1 4.15Å; F580-F608 AromaticContact CZ-CD1 3.88Å; F580-F608 HydrophobicContact CZ-CD1 3.88Å; F580-F608 AromaticContact CZ-CE1 3.8Å; F580-F608 HydrophobicContact CZ-CE1 3.8Å; F602-F608 HydrophobicContact CD1-CB 4.48Å; G605-F608 PolarHBondContact O-N 2.66Å; I606-F608 VanDerWaalsContact C-N 3.32Å; I606-F608 PolarHBondContact O-N 3.34Å; F608-T612 WeakPolarHBondContact CZ-OG1 3.35Å; F608-T612 WeakPolarHBondContact O-CB 3.4Å; F608-T612 PolarHBondContact O-N 3.2Å; F608-T612 PolarHBondContact O-OG1 3.16Å
609	I	87.7	Confident	81.3	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-62.2	-48.6	175.1	-66.2	164.6	0	0	0	110.7	L576 V577 F580 G605 I606 E611 T612 S613 A616 T617	L576-I609 HydrophobicContact CD2-CG1 4.49Å; L576-I609 HydrophobicContact CG-CG1 4.22Å; V577-I609 HydrophobicContact CG2-CG2 4.13Å; F580-I609 HydrophobicContact CB-CD1 3.83Å; F580-I609 HydrophobicContact CB-CG1 3.88Å; G605-I609 WeakPolarHBondContact O-CG1 3.32Å; G605-I609 PolarHBondContact O-N 3.01Å; G605-I609 VanDerWaalsContact O-N 3.08Å; I606-I609 HydrophobicContact CD1-CD1 4.38Å; I606-I609 PolarHBondContact O-N 3.39Å; I609-E611 VanDerWaalsContact C-N 3.33Å; I609-E611 PolarHBondContact O-N 3.34Å; I609-T612 PolarHBondContact O-N 2.92Å; I609-S613 CarbonylContact O-C 3.2Å; I609-S613 WeakPolarHBondContact O-CA 3.41Å; I609-S613 PolarHBondContact O-N 3.03Å; I609-A616 HydrophobicContact CG2-CB 4.38Å; I609-T617 HydrophobicContact CG2-CG2 3.99Å
610	E	86.3	Confident	83	Confident	80 Å²	80	43.3 Å²	43.3	37%	0.374	24%	0.238	S	C	.	.	H	α-helix	trans	-67.2	-33.6	-177.7	-71.7	-60	151.5	0	0	112.7	I606 Q607 P614 G615	I606-E610 PolarHBondContact O-N 3.34Å; Q607-E610 PolarHBondContact O-N 3.09Å; E610-P614 WeakPolarHBondContact O-CB 3.23Å; E610-P614 WeakPolarHBondContact O-CD 3.47Å; E610-P614 VanDerWaalsContact OE2-CA 3.28Å; E610-P614 WeakPolarHBondContact OE2-CA 3.28Å; E610-P614 WeakPolarHBondContact OE2-CB 3.19Å; E610-G615 PolarHBondContact OE2-N 3.2Å
611	E	84.6	Confident	84.4	Confident	96 Å²	96	48.4 Å²	48.4	45%	0.449	27%	0.269	S	S	.	.	H	α-helix	trans	-67.4	-48.6	173.8	-173.8	-173.6	-148.3	0	0	111.6	N551 F602 Q607 I609	N551-E611 PolarHBondContact ND2-O 3.4Å; F602-E611 HydrophobicContact CE1-CB 4.48Å; F602-E611 VanDerWaalsContact CE1-OE2 3.32Å; F602-E611 WeakPolarHBondContact CE1-OE2 3.42Å; F602-E611 WeakPolarHBondContact CE2-OE2 3.44Å; F602-E611 WeakPolarHBondContact CZ-OE1 3.47Å; F602-E611 WeakPolarHBondContact CZ-OE2 3.26Å; Q607-E611 PolarHBondContact O-N 3.25Å; Q607-E611 VanDerWaalsContact O-N 3.11Å; I609-E611 VanDerWaalsContact C-N 3.33Å; I609-E611 PolarHBondContact O-N 3.34Å
612	T	83.1	Confident	85.9	Confident	12 Å²	12	49.9 Å²	49.9	7%	0.074	27%	0.267	C	S	.	.	H	α-helix	trans	-78.7	-38	-172.2	-50.3	0	0	0	0	112.4	G547 F548 L576 F608 I609	G547-T612 WeakPolarHBondContact O-CG2 3.46Å; F548-T612 HydrophobicContact CD1-CG2 4.28Å; L576-T612 HydrophobicContact CD2-CG2 4.24Å; F608-T612 WeakPolarHBondContact CZ-OG1 3.35Å; F608-T612 WeakPolarHBondContact O-CB 3.4Å; F608-T612 PolarHBondContact O-N 3.2Å; F608-T612 PolarHBondContact O-OG1 3.16Å; I609-T612 PolarHBondContact O-N 2.92Å
613	S	83.9	Confident	87	Confident	5 Å²	5	47.6 Å²	47.6	4%	0.035	26%	0.257	C	S	.	.	S	Bend	trans	-155.3	77.8	-173.1	-73.4	0	0	0	0	111.1	I609 A616	I609-S613 CarbonylContact O-C 3.2Å; I609-S613 WeakPolarHBondContact O-CA 3.41Å; I609-S613 PolarHBondContact O-N 3.03Å; S613-A616 WeakPolarHBondContact O-CB 3.39Å; S613-A616 PolarHBondContact O-N 3.48Å; S613-A616 VanDerWaalsContact O-N 3.13Å
614	P	83.4	Confident	87.9	Confident	37 Å²	37	46.6 Å²	46.6	24%	0.24	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	139.9	-174.9	21.5	-30.6	0	0	0	112.4	Q553 E610 A616 R619	Q553-P614 HydrophobicContact CG-CG 4.35Å; E610-P614 WeakPolarHBondContact O-CB 3.23Å; E610-P614 WeakPolarHBondContact O-CD 3.47Å; E610-P614 VanDerWaalsContact OE2-CA 3.28Å; E610-P614 WeakPolarHBondContact OE2-CA 3.28Å; E610-P614 WeakPolarHBondContact OE2-CB 3.19Å; P614-A616 PolarHBondContact O-N 2.82Å; P614-R619 PolarHBondContact O-NH2 3.32Å
615	G	82.3	Confident	88.5	Confident	21 Å²	21	48.5 Å²	48.5	22%	0.216	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	16.7	-175.5	0	0	0	0	0	114.9	E610 S618 R619	E610-G615 PolarHBondContact OE2-N 3.2Å; G615-S618 PolarHBondContact O-OG 3.41Å; G615-S618 VanDerWaalsContact O-OG 3.11Å; G615-R619 WeakPolarHBondContact O-CG 3.42Å; G615-R619 PolarHBondContact O-N 2.92Å; G615-R619 PolarHBondContact O-NE 3.35Å
616	A	86.6	Confident	89.1	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.3	-29.5	171.3	0	0	0	0	0	112	E573 V577 I609 S613 P614 R619 F620	E573-A616 HydrophobicContact CB-CB 4.23Å; E573-A616 HydrophobicContact CG-CB 4.37Å; V577-A616 HydrophobicContact CG2-CB 3.67Å; I609-A616 HydrophobicContact CG2-CB 4.38Å; S613-A616 WeakPolarHBondContact O-CB 3.39Å; S613-A616 PolarHBondContact O-N 3.48Å; S613-A616 VanDerWaalsContact O-N 3.13Å; P614-A616 PolarHBondContact O-N 2.82Å; A616-R619 CarbonylContact O-C 3.57Å; A616-R619 PolarHBondContact O-N 3.11Å; A616-F620 PolarHBondContact O-N 2.85Å
617	T	86.9	Confident	89.6	Confident	44 Å²	44	47.7 Å²	47.7	27%	0.27	26%	0.256	S	S	.	.	H	α-helix	trans	-60.1	-46.8	178.1	51.1	0	0	0	0	112.4	V577 Y581 I606 I609	V577-T617 HydrophobicContact CG1-CG2 4.44Å; V577-T617 HydrophobicContact CG2-CG2 4.36Å; Y581-T617 HydrophobicContact CD2-CG2 4.24Å; Y581-T617 HydrophobicContact CE2-CG2 4.48Å; I606-T617 HydrophobicContact CD1-CG2 3.74Å; I609-T617 HydrophobicContact CG2-CG2 3.99Å
618	S	90.6	Very high	90.1	Very high	95 Å²	95	47.6 Å²	47.6	66%	0.664	25%	0.252	S	S	*	.	H	α-helix	trans	-73.2	-28.9	177.1	60.4	0	0	0	0	112.8	G615	G615-S618 PolarHBondContact O-OG 3.41Å; G615-S618 VanDerWaalsContact O-OG 3.11Å
619	R	92.4	Very high	90.6	Very high	66 Å²	66	49.3 Å²	49.3	25%	0.249	27%	0.268	C	S	.	.	H	α-helix	trans	-87.3	0.3	-179.1	-67.3	-178	-71.7	136.8	-3.4	114.2	E573 P614 G615 A616 T621 M622 N623	E573-R619 IonicContact OE1-NH1 3.68Å; E573-R619 IonicContact OE1-NH2 3.96Å; E573-R619 IonicContact OE2-CZ 3.7Å; E573-R619 IonicContact OE2-NH1 3.19Å; E573-R619 PolarHBondContact OE2-NH1 2.86Å; E573-R619 IonicContact OE2-NH2 3.81Å; P614-R619 PolarHBondContact O-NH2 3.32Å; G615-R619 WeakPolarHBondContact O-CG 3.42Å; G615-R619 PolarHBondContact O-N 2.92Å; G615-R619 PolarHBondContact O-NE 3.35Å; A616-R619 CarbonylContact O-C 3.57Å; A616-R619 PolarHBondContact O-N 3.11Å; R619-T621 PolarHBondContact O-N 3.46Å; R619-M622 HydrophobicContact CB-CE 4.27Å; R619-M622 HydrophobicContact CG-CE 4.04Å; R619-M622 PolarHBondContact O-N 3.08Å; R619-M622 VanDerWaalsContact O-N 3.11Å; R619-N623 WeakPolarHBondContact O-CB 3.04Å; R619-N623 VanDerWaalsContact O-CG 3.31Å; R619-N623 PolarHBondContact O-N 2.85Å
620	F	92.5	Very high	91	Very high	33 Å²	33	51.6 Å²	51.6	15%	0.145	28%	0.278	C	S	.	.	H	α-helix	trans	-51.9	-48	-173	-176.5	-100.9	0	0	0	114	Y501 I574 V577 N578 A616 N623 F624	Y501-F620 HydrophobicContact CD2-CE1 4.35Å; Y501-F620 HydrophobicContact CD2-CZ 4.13Å; Y501-F620 HydrophobicContact CE2-CE1 4.45Å; Y501-F620 HydrophobicContact CG-CE1 4.45Å; Y501-F620 HydrophobicContact CG-CZ 4.15Å; I574-F620 HydrophobicContact CB-CE2 4.42Å; I574-F620 HydrophobicContact CG2-CE2 3.87Å; I574-F620 HydrophobicContact CG2-CZ 4.34Å; V577-F620 HydrophobicContact CB-CD2 3.86Å; V577-F620 HydrophobicContact CB-CE2 4.25Å; V577-F620 HydrophobicContact CG1-CD2 3.69Å; V577-F620 HydrophobicContact CG1-CE2 4.17Å; V577-F620 HydrophobicContact CG1-CG 4.37Å; N578-F620 HydrophobicContact CB-CE2 4.26Å; A616-F620 PolarHBondContact O-N 2.85Å; F620-N623 PolarHBondContact O-N 2.74Å; F620-F624 HydrophobicContact CD1-CD2 4.5Å; F620-F624 HydrophobicContact CD1-CE2 4.46Å; F620-F624 HydrophobicContact CE1-CD2 4.19Å; F620-F624 AromaticContact CE1-CE2 3.76Å; F620-F624 HydrophobicContact CE1-CE2 3.76Å; F620-F624 HydrophobicContact CE2-CE2 4.15Å; F620-F624 HydrophobicContact CZ-CD2 4.37Å; F620-F624 AromaticContact CZ-CE2 3.6Å; F620-F624 HydrophobicContact CZ-CE2 3.6Å; F620-F624 PolarHBondContact O-N 3.48Å
621	T	92.9	Very high	91.5	Very high	110 Å²	110	48.8 Å²	48.8	68%	0.675	27%	0.265	S	S	*	.	H	α-helix	trans	-68.5	-40.9	179.4	52.5	0	0	0	0	112.3	R619 N623 F624 L625	R619-T621 PolarHBondContact O-N 3.46Å; T621-N623 VanDerWaalsContact C-N 3.32Å; T621-N623 PolarHBondContact O-N 2.7Å; T621-F624 PolarHBondContact O-N 3.17Å; T621-L625 PolarHBondContact O-N 3.19Å
622	M	95	Very high	92	Very high	92 Å²	92	47.5 Å²	47.5	45%	0.453	27%	0.265	S	S	.	.	H	α-helix	trans	-64.8	-37.5	176.1	-170.7	-176.7	73.3	0	0	111.4	R619 F624 L625 I626	R619-M622 HydrophobicContact CB-CE 4.27Å; R619-M622 HydrophobicContact CG-CE 4.04Å; R619-M622 PolarHBondContact O-N 3.08Å; R619-M622 VanDerWaalsContact O-N 3.11Å; M622-F624 VanDerWaalsContact C-N 3.32Å; M622-F624 PolarHBondContact O-N 2.93Å; M622-L625 WeakPolarHBondContact O-CB 3.38Å; M622-L625 PolarHBondContact O-N 2.7Å; M622-L625 VanDerWaalsContact O-N 3.16Å; M622-I626 HydrophobicContact CE-CD1 4.04Å; M622-I626 HydrophobicContact CG-CD1 3.96Å; M622-I626 HydrophobicContact CG-CG1 4.43Å; M622-I626 WeakPolarHBondContact O-CG1 3.3Å; M622-I626 PolarHBondContact O-N 3.37Å; M622-I626 HydrophobicContact SD-CD1 4.42Å
623	N	95.1	Very high	92.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.9	-38	178.2	-75.6	-8.9	0	0	0	111.6	E573 I574 R619 F620 T621 I626 L627	E573-N623 WeakPolarHBondContact CB-ND2 3.41Å; E573-N623 PolarHBondContact OE2-ND2 3.2Å; I574-N623 HydrophobicContact CD1-CB 3.97Å; I574-N623 HydrophobicContact CG1-CB 3.69Å; R619-N623 WeakPolarHBondContact O-CB 3.04Å; R619-N623 VanDerWaalsContact O-CG 3.31Å; R619-N623 PolarHBondContact O-N 2.85Å; F620-N623 PolarHBondContact O-N 2.74Å; T621-N623 VanDerWaalsContact C-N 3.32Å; T621-N623 PolarHBondContact O-N 2.7Å; N623-I626 PolarHBondContact O-N 2.9Å; N623-L627 WeakPolarHBondContact O-CB 3.42Å; N623-L627 PolarHBondContact O-N 3.22Å
624	F	95.8	Very high	93.3	Very high	34 Å²	34	50.4 Å²	50.4	15%	0.149	29%	0.287	C	S	.	.	H	α-helix	trans	-62	-44.9	172.5	-93.3	-76.3	0	0	0	112	Y501 A504 A505 I574 F620 T621 M622 I626 L627 Y628	Y501-F624 HydrophobicContact CD1-CE2 4.18Å; Y501-F624 HydrophobicContact CD1-CZ 4.09Å; Y501-F624 HydrophobicContact CG-CZ 4.42Å; A504-F624 HydrophobicContact CB-CE1 4.01Å; A505-F624 HydrophobicContact CB-CE1 4.41Å; A505-F624 HydrophobicContact CB-CZ 4.4Å; I574-F624 HydrophobicContact CB-CE2 4.44Å; I574-F624 HydrophobicContact CD1-CB 4.44Å; I574-F624 HydrophobicContact CD1-CD1 4.1Å; I574-F624 HydrophobicContact CD1-CD2 3.92Å; I574-F624 HydrophobicContact CD1-CE1 4.33Å; I574-F624 HydrophobicContact CD1-CE2 4.17Å; I574-F624 HydrophobicContact CD1-CG 3.89Å; I574-F624 HydrophobicContact CD1-CZ 4.37Å; I574-F624 HydrophobicContact CG1-CD2 4.1Å; I574-F624 HydrophobicContact CG1-CE2 4.16Å; I574-F624 HydrophobicContact CG2-CD2 4.18Å; I574-F624 HydrophobicContact CG2-CE1 4.26Å; I574-F624 HydrophobicContact CG2-CE2 3.4Å; I574-F624 HydrophobicContact CG2-CZ 3.45Å; I574-F624 VanDerWaalsContact CG2-CZ 3.45Å; F620-F624 HydrophobicContact CD1-CD2 4.5Å; F620-F624 HydrophobicContact CD1-CE2 4.46Å; F620-F624 HydrophobicContact CE1-CD2 4.19Å; F620-F624 AromaticContact CE1-CE2 3.76Å; F620-F624 HydrophobicContact CE1-CE2 3.76Å; F620-F624 HydrophobicContact CE2-CE2 4.15Å; F620-F624 HydrophobicContact CZ-CD2 4.37Å; F620-F624 AromaticContact CZ-CE2 3.6Å; F620-F624 HydrophobicContact CZ-CE2 3.6Å; F620-F624 PolarHBondContact O-N 3.48Å; T621-F624 PolarHBondContact O-N 3.17Å; M622-F624 VanDerWaalsContact C-N 3.32Å; M622-F624 PolarHBondContact O-N 2.93Å; F624-I626 PolarHBondContact O-N 3.07Å; F624-L627 PolarHBondContact O-N 3.16Å; F624-Y628 HydrophobicContact CD1-CD2 4.29Å; F624-Y628 HydrophobicContact CD1-CE2 4.05Å; F624-Y628 HydrophobicContact CE1-CE2 4.45Å; F624-Y628 WeakPolarHBondContact O-CD2 3.38Å; F624-Y628 PolarHBondContact O-N 3.31Å
625	L	96.8	Very high	93.9	Very high	132 Å²	132	49.7 Å²	49.7	69%	0.691	28%	0.282	S	S	*	.	H	α-helix	trans	-59.7	-46.8	177.6	-177.3	67.9	0	0	0	111.2	T621 M622 S629	T621-L625 PolarHBondContact O-N 3.19Å; M622-L625 WeakPolarHBondContact O-CB 3.38Å; M622-L625 PolarHBondContact O-N 2.7Å; M622-L625 VanDerWaalsContact O-N 3.16Å; L625-S629 WeakPolarHBondContact O-CB 3.36Å; L625-S629 PolarHBondContact O-N 2.63Å
626	I	96.4	Very high	94.5	Very high	42 Å²	42	53.8 Å²	53.8	22%	0.215	30%	0.298	C	S	.	.	H	α-helix	trans	-65.5	-46.6	179	-64.8	168.9	0	0	0	110.7	Y570 M622 N623 F624 Y628 S629 F630	Y570-I626 HydrophobicContact CD1-CB 4.11Å; Y570-I626 HydrophobicContact CD1-CD1 4.14Å; Y570-I626 HydrophobicContact CD1-CG2 3.82Å; Y570-I626 HydrophobicContact CD2-CG2 3.68Å; Y570-I626 HydrophobicContact CE1-CB 4.31Å; Y570-I626 HydrophobicContact CE1-CD1 3.76Å; Y570-I626 HydrophobicContact CE1-CG2 3.76Å; Y570-I626 HydrophobicContact CE2-CG2 3.63Å; Y570-I626 HydrophobicContact CG-CB 4.29Å; Y570-I626 HydrophobicContact CG-CG2 3.78Å; M622-I626 HydrophobicContact CE-CD1 4.04Å; M622-I626 HydrophobicContact CG-CD1 3.96Å; M622-I626 HydrophobicContact CG-CG1 4.43Å; M622-I626 WeakPolarHBondContact O-CG1 3.3Å; M622-I626 PolarHBondContact O-N 3.37Å; M622-I626 HydrophobicContact SD-CD1 4.42Å; N623-I626 PolarHBondContact O-N 2.9Å; F624-I626 PolarHBondContact O-N 3.07Å; I626-Y628 VanDerWaalsContact C-N 3.34Å; I626-Y628 PolarHBondContact O-N 2.98Å; I626-S629 WeakPolarHBondContact O-CB 3.31Å; I626-S629 PolarHBondContact O-N 3.33Å; I626-S629 VanDerWaalsContact O-N 3.07Å; I626-S629 PolarHBondContact O-OG 3.3Å; I626-F630 HydrophobicContact CG2-CE2 4.09Å; I626-F630 VanDerWaalsContact O-CD2 3.26Å; I626-F630 WeakPolarHBondContact O-CD2 3.33Å
627	L	96.9	Very high	95	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-57.4	-46.8	-179.8	176.9	59.8	0	0	0	111.6	A508 I512 F567 C571 I574 N623 F624 S629	A508-L627 HydrophobicContact CB-CD1 4.07Å; A508-L627 HydrophobicContact CB-CD2 3.87Å; A508-L627 HydrophobicContact CB-CG 3.64Å; I512-L627 HydrophobicContact CD1-CD1 4.09Å; F567-L627 HydrophobicContact CB-CD1 4.03Å; C571-L627 HydrophobicContact CB-CD1 3.99Å; C571-L627 HydrophobicContact CB-CD2 3.99Å; I574-L627 HydrophobicContact CD1-CB 4.36Å; I574-L627 HydrophobicContact CD1-CD2 3.8Å; N623-L627 WeakPolarHBondContact O-CB 3.42Å; N623-L627 PolarHBondContact O-N 3.22Å; F624-L627 PolarHBondContact O-N 3.16Å; L627-S629 VanDerWaalsContact C-N 3.31Å; L627-S629 PolarHBondContact O-N 2.91Å
628	Y	96.9	Very high	95.4	Very high	77 Å²	77	56 Å²	56	30%	0.302	31%	0.308	S	S	.	.	H	α-helix	trans	-74.3	-20	178.5	-84.8	-95	0	0	0	113.3	A504 A508 F624 I626 F630 I631 P632	A504-Y628 PolarHBondContact O-OH 2.87Å; A508-Y628 HydrophobicContact CB-CD2 4.19Å; A508-Y628 HydrophobicContact CB-CE1 4.27Å; A508-Y628 HydrophobicContact CB-CE2 3.88Å; F624-Y628 HydrophobicContact CD1-CD2 4.29Å; F624-Y628 HydrophobicContact CD1-CE2 4.05Å; F624-Y628 HydrophobicContact CE1-CE2 4.45Å; F624-Y628 WeakPolarHBondContact O-CD2 3.38Å; F624-Y628 PolarHBondContact O-N 3.31Å; I626-Y628 VanDerWaalsContact C-N 3.34Å; I626-Y628 PolarHBondContact O-N 2.98Å; Y628-F630 PolarHBondContact O-N 3.31Å; Y628-I631 HydrophobicContact CD1-CD1 3.8Å; Y628-I631 HydrophobicContact CE1-CD1 4.16Å; Y628-I631 PolarHBondContact O-N 2.92Å; Y628-P632 WeakPolarHBondContact O-CD 3.49Å
629	S	96.9	Very high	95.6	Very high	60 Å²	60	53.7 Å²	53.7	42%	0.42	29%	0.288	S	S	.	.	H	α-helix	trans	-65.1	-25.3	176.7	78.9	0	0	0	0	113.9	L625 I626 L627 I631 P632 A633	L625-S629 WeakPolarHBondContact O-CB 3.36Å; L625-S629 PolarHBondContact O-N 2.63Å; I626-S629 WeakPolarHBondContact O-CB 3.31Å; I626-S629 PolarHBondContact O-N 3.33Å; I626-S629 VanDerWaalsContact O-N 3.07Å; I626-S629 PolarHBondContact O-OG 3.3Å; L627-S629 VanDerWaalsContact C-N 3.31Å; L627-S629 PolarHBondContact O-N 2.91Å; S629-I631 VanDerWaalsContact C-N 3.28Å; S629-I631 PolarHBondContact O-N 3.04Å; S629-P632 VanDerWaalsContact O-CD 3.29Å; S629-P632 WeakPolarHBondContact O-CD 3.42Å; S629-P632 WeakPolarHBondContact O-CG 3.37Å; S629-A633 WeakPolarHBondContact O-CB 3.39Å; S629-A633 PolarHBondContact O-N 3.49Å
630	F	96.2	Very high	95.7	Very high	48 Å²	48	53.9 Å²	53.9	21%	0.211	30%	0.296	C	S	.	.	H	α-helix	trans	-63.6	-33.4	175.8	-76.9	-90	0	0	0	112.6	I512 F567 Y570 I626 Y628 A633 L634	I512-F630 HydrophobicContact CD1-CB 3.81Å; I512-F630 HydrophobicContact CD1-CG 4.47Å; I512-F630 HydrophobicContact CG1-CB 4.07Å; F567-F630 HydrophobicContact CB-CD1 4.47Å; F567-F630 HydrophobicContact CB-CD2 3.98Å; F567-F630 HydrophobicContact CB-CE2 4.06Å; F567-F630 HydrophobicContact CB-CG 4.19Å; F567-F630 HydrophobicContact CB-CZ 4.33Å; Y570-F630 HydrophobicContact CD2-CE2 4.16Å; Y570-F630 HydrophobicContact CE2-CE2 4.29Å; Y570-F630 HydrophobicContact CE2-CZ 4.49Å; I626-F630 HydrophobicContact CG2-CE2 4.09Å; I626-F630 VanDerWaalsContact O-CD2 3.26Å; I626-F630 WeakPolarHBondContact O-CD2 3.33Å; Y628-F630 PolarHBondContact O-N 3.31Å; F630-A633 PolarHBondContact O-N 3.3Å; F630-L634 WeakPolarHBondContact O-CB 3.35Å; F630-L634 VanDerWaalsContact O-CG 3.27Å; F630-L634 WeakPolarHBondContact O-CG 3.34Å; F630-L634 PolarHBondContact O-N 3.08Å
631	I	96	Very high	95.8	Very high	21 Å²	21	53.1 Å²	53.1	11%	0.108	29%	0.294	C	S	.	.	H	α-helix	trans	-62.6	-59.6	-177.5	-66.4	167.8	0	0	0	112.1	A508 L511 I512 F515 Y628 S629 A633 L634 V635	A508-I631 HydrophobicContact CB-CD1 4.24Å; L511-I631 HydrophobicContact CB-CD1 4.07Å; L511-I631 HydrophobicContact CB-CG1 4.32Å; L511-I631 HydrophobicContact CD1-CD1 3.98Å; I512-I631 HydrophobicContact CG1-CG1 3.92Å; F515-I631 HydrophobicContact CD2-CG2 3.84Å; F515-I631 HydrophobicContact CE2-CG2 3.54Å; Y628-I631 HydrophobicContact CD1-CD1 3.8Å; Y628-I631 HydrophobicContact CE1-CD1 4.16Å; Y628-I631 PolarHBondContact O-N 2.92Å; S629-I631 VanDerWaalsContact C-N 3.28Å; S629-I631 PolarHBondContact O-N 3.04Å; I631-A633 VanDerWaalsContact C-N 3.26Å; I631-A633 PolarHBondContact O-N 3.35Å; I631-L634 PolarHBondContact O-N 3.24Å; I631-V635 WeakPolarHBondContact O-CG2 3.36Å; I631-V635 PolarHBondContact O-N 2.92Å; I631-V635 VanDerWaalsContact O-N 3.08Å
632	P	96.5	Very high	95.8	Very high	69 Å²	69	48 Å²	48	45%	0.448	26%	0.263	S	S	.	.	H	α-helix	trans	-63	-34.3	178	25.5	-33.3	0	0	0	111.8	Y628 S629 L634 V635 I636	Y628-P632 WeakPolarHBondContact O-CD 3.49Å; S629-P632 VanDerWaalsContact O-CD 3.29Å; S629-P632 WeakPolarHBondContact O-CD 3.42Å; S629-P632 WeakPolarHBondContact O-CG 3.37Å; P632-L634 PolarHBondContact O-N 3.49Å; P632-V635 PolarHBondContact O-N 3.3Å; P632-I636 WeakPolarHBondContact O-CB 3.4Å; P632-I636 WeakPolarHBondContact O-CD1 3.2Å; P632-I636 VanDerWaalsContact O-CG1 3.22Å; P632-I636 WeakPolarHBondContact O-CG1 3.44Å; P632-I636 PolarHBondContact O-N 3.04Å
633	A	96.8	Very high	95.6	Very high	56 Å²	56	49.7 Å²	49.7	46%	0.463	27%	0.267	S	S	.	.	H	α-helix	trans	-60	-45.6	175.5	0	0	0	0	0	112.2	S629 F630 I631 I636 L637	S629-A633 WeakPolarHBondContact O-CB 3.39Å; S629-A633 PolarHBondContact O-N 3.49Å; F630-A633 PolarHBondContact O-N 3.3Å; I631-A633 VanDerWaalsContact C-N 3.26Å; I631-A633 PolarHBondContact O-N 3.35Å; A633-I636 PolarHBondContact O-N 2.97Å; A633-L637 VanDerWaalsContact O-CB 3.32Å; A633-L637 WeakPolarHBondContact O-CB 2.95Å; A633-L637 PolarHBondContact O-N 3.5Å
634	L	96.5	Very high	95.3	Very high	22 Å²	22	53.9 Å²	53.9	12%	0.115	29%	0.289	C	S	.	.	H	α-helix	trans	-65.7	-37.8	176.5	-74.8	169	0	0	0	112.5	I512 F515 L516 V519 F630 I631 P632 L637 G638	I512-L634 HydrophobicContact CB-CD1 4.35Å; I512-L634 HydrophobicContact CG1-CD1 4.42Å; I512-L634 HydrophobicContact CG2-CD1 3.87Å; F515-L634 HydrophobicContact CB-CB 3.98Å; F515-L634 HydrophobicContact CB-CD1 4.32Å; L516-L634 HydrophobicContact CB-CD1 4.37Å; L516-L634 HydrophobicContact CB-CD2 4.41Å; L516-L634 HydrophobicContact CD1-CD2 4.15Å; V519-L634 HydrophobicContact CG2-CD2 4.46Å; V519-L634 VanDerWaalsContact CG2-O 3.31Å; V519-L634 WeakPolarHBondContact CG2-O 3.49Å; F630-L634 WeakPolarHBondContact O-CB 3.35Å; F630-L634 VanDerWaalsContact O-CG 3.27Å; F630-L634 WeakPolarHBondContact O-CG 3.34Å; F630-L634 PolarHBondContact O-N 3.08Å; I631-L634 PolarHBondContact O-N 3.24Å; P632-L634 PolarHBondContact O-N 3.49Å; L634-L637 PolarHBondContact O-N 3.09Å; L634-G638 PolarHBondContact O-N 3.05Å
635	V	95.2	Very high	94.8	Very high	22 Å²	22	52.8 Å²	52.8	13%	0.133	28%	0.284	C	S	.	.	H	α-helix	trans	-65.9	-45.4	176.6	174.5	0	0	0	0	111	L465 V468 F515 I631 P632 G638 I639	L465-V635 HydrophobicContact CD1-CG1 4.47Å; V468-V635 HydrophobicContact CG1-CG1 4.2Å; V468-V635 HydrophobicContact CG1-CG2 3.71Å; V468-V635 HydrophobicContact CG2-CG2 4.26Å; F515-V635 HydrophobicContact CD2-CG2 4.14Å; F515-V635 HydrophobicContact CE2-CG2 4.33Å; F515-V635 HydrophobicContact CG-CG2 4.29Å; I631-V635 WeakPolarHBondContact O-CG2 3.36Å; I631-V635 PolarHBondContact O-N 2.92Å; I631-V635 VanDerWaalsContact O-N 3.08Å; P632-V635 PolarHBondContact O-N 3.3Å; V635-G638 PolarHBondContact O-N 2.02Å; V635-I639 HydrophobicContact CG1-CD1 4.25Å; V635-I639 WeakPolarHBondContact O-CG1 3.47Å; V635-I639 PolarHBondContact O-N 3.11Å
636	I	96.3	Very high	94	Very high	107 Å²	107	47.8 Å²	47.8	55%	0.549	26%	0.258	S	S	.	.	H	α-helix	trans	-62.3	-45.9	176.9	-66.7	163.4	0	0	0	110.2	P632 A633 G638 I639 V640	P632-I636 WeakPolarHBondContact O-CB 3.4Å; P632-I636 WeakPolarHBondContact O-CD1 3.2Å; P632-I636 VanDerWaalsContact O-CG1 3.22Å; P632-I636 WeakPolarHBondContact O-CG1 3.44Å; P632-I636 PolarHBondContact O-N 3.04Å; A633-I636 PolarHBondContact O-N 2.97Å; I636-G638 VanDerWaalsContact C-N 3.28Å; I636-G638 PolarHBondContact O-N 3.4Å; I636-I639 PolarHBondContact O-N 2.93Å; I636-V640 WeakPolarHBondContact O-CG2 3.45Å; I636-V640 PolarHBondContact O-N 3.47Å
637	L	96.4	Very high	93	Very high	87 Å²	87	50.7 Å²	50.7	46%	0.455	27%	0.27	S	S	.	.	H	α-helix	trans	-58.7	-42.5	175	-179.7	61.5	0	0	0	111.2	V519 A633 L634 V640 V641	V519-L637 HydrophobicContact CG1-CD2 3.93Å; V519-L637 HydrophobicContact CG1-CG 4.01Å; A633-L637 VanDerWaalsContact O-CB 3.32Å; A633-L637 WeakPolarHBondContact O-CB 2.95Å; A633-L637 PolarHBondContact O-N 3.5Å; L634-L637 PolarHBondContact O-N 3.09Å; L637-V640 PolarHBondContact O-N 3.28Å; L637-V641 HydrophobicContact CD1-CG2 4.38Å; L637-V641 HydrophobicContact CG-CG2 4.46Å; L637-V641 WeakPolarHBondContact O-CB 3.16Å; L637-V641 WeakPolarHBondContact O-CG2 3.07Å; L637-V641 PolarHBondContact O-N 3.3Å
638	G	94.6	Very high	91.8	Very high	2 Å²	2	56 Å²	56	2%	0.021	30%	0.298	C	S	.	.	H	α-helix	trans	-59.4	-46.1	174.9	0	0	0	0	0	112.3	L464 L634 V635 I636 V640 V641 F642	L464-G638 WeakPolarHBondContact CD2-O 3.04Å; L634-G638 PolarHBondContact O-N 3.05Å; V635-G638 PolarHBondContact O-N 2.02Å; I636-G638 VanDerWaalsContact C-N 3.28Å; I636-G638 PolarHBondContact O-N 3.4Å; G638-V640 VanDerWaalsContact C-N 3.3Å; G638-V640 PolarHBondContact O-N 3.13Å; G638-V641 PolarHBondContact O-N 3.28Å; G638-F642 VanDerWaalsContact O-CD2 3.25Å; G638-F642 WeakPolarHBondContact O-CD2 3.12Å; G638-F642 PolarHBondContact O-N 3.39Å
639	I	94.9	Very high	90.4	Very high	48 Å²	48	54.3 Å²	54.3	25%	0.246	29%	0.294	C	S	.	.	H	α-helix	trans	-58.3	-44.9	176.5	-68.5	165.8	0	0	0	110.6	W461 L464 V635 I636 F642 K643	W461-I639 HydrophobicContact CB-CG2 4.05Å; W461-I639 HydrophobicContact CG-CG2 4.29Å; L464-I639 HydrophobicContact CD2-CG1 4.47Å; V635-I639 HydrophobicContact CG1-CD1 4.25Å; V635-I639 WeakPolarHBondContact O-CG1 3.47Å; V635-I639 PolarHBondContact O-N 3.11Å; I636-I639 PolarHBondContact O-N 2.93Å; I639-F642 PolarHBondContact O-N 3.2Å; I639-K643 VanDerWaalsContact O-CB 3.31Å; I639-K643 WeakPolarHBondContact O-CB 3.06Å; I639-K643 PolarHBondContact O-N 3.14Å
640	V	95.1	Very high	88.2	Confident	70 Å²	70	53.5 Å²	53.5	42%	0.424	29%	0.288	S	S	.	.	H	α-helix	trans	-62.1	-47.4	177	174.2	0	0	0	0	110.8	I636 L637 G638 F642 K643 I644	I636-V640 WeakPolarHBondContact O-CG2 3.45Å; I636-V640 PolarHBondContact O-N 3.47Å; L637-V640 PolarHBondContact O-N 3.28Å; G638-V640 VanDerWaalsContact C-N 3.3Å; G638-V640 PolarHBondContact O-N 3.13Å; V640-F642 PolarHBondContact O-N 2.81Å; V640-K643 PolarHBondContact O-N 3.08Å; V640-I644 HydrophobicContact CG1-CD1 3.74Å; V640-I644 HydrophobicContact CG1-CG1 4.41Å; V640-I644 VanDerWaalsContact O-CG1 3.3Å; V640-I644 WeakPolarHBondContact O-CG1 3.33Å; V640-I644 PolarHBondContact O-N 3.48Å
641	V	94.6	Very high	85.6	Confident	17 Å²	17	58.6 Å²	58.6	10%	0.103	31%	0.306	C	S	.	.	H	α-helix	trans	-58.9	-45.4	178.1	165.4	0	0	0	0	111.4	V519 I523 L637 G638 K643 I644 R645	V519-V641 HydrophobicContact CG1-CG2 4.15Å; I523-V641 HydrophobicContact CD1-CG1 4.49Å; I523-V641 HydrophobicContact CD1-CG2 4.17Å; I523-V641 HydrophobicContact CG1-CG1 3.61Å; I523-V641 HydrophobicContact CG1-CG2 4.14Å; L637-V641 HydrophobicContact CD1-CG2 4.38Å; L637-V641 HydrophobicContact CG-CG2 4.46Å; L637-V641 WeakPolarHBondContact O-CB 3.16Å; L637-V641 WeakPolarHBondContact O-CG2 3.07Å; L637-V641 PolarHBondContact O-N 3.3Å; G638-V641 PolarHBondContact O-N 3.28Å; V641-K643 VanDerWaalsContact C-N 3.35Å; V641-K643 PolarHBondContact O-N 3.46Å; V641-I644 PolarHBondContact O-N 3.03Å; V641-R645 VanDerWaalsContact O-CB 3.31Å; V641-R645 WeakPolarHBondContact O-CB 3.28Å; V641-R645 PolarHBondContact O-N 3.48Å
642	F	92.1	Very high	85.1	Confident	3 Å²	3	60.5 Å²	60.5	1%	0.013	32%	0.316	C	S	.	.	H	α-helix	trans	-71	-31.3	-179.7	-83.5	-105.4	0	0	0	112.5	F442 R446 K460 W461 L464 G522 G638 I639 V640 R645 D646	F442-F642 AromaticContact CE1-CE1 3.91Å; F442-F642 HydrophobicContact CE1-CE1 3.91Å; F442-F642 AromaticContact CE1-CZ 3.48Å; F442-F642 HydrophobicContact CE1-CZ 3.48Å; F442-F642 VanDerWaalsContact CE1-CZ 3.48Å; F442-F642 AromaticContact CZ-CE1 3.69Å; F442-F642 HydrophobicContact CZ-CE1 3.69Å; F442-F642 AromaticContact CZ-CZ 3.52Å; F442-F642 HydrophobicContact CZ-CZ 3.52Å; R446-F642 HydrophobicContact CG-CE1 4.33Å; K460-F642 HydrophobicContact CB-CB 4.43Å; K460-F642 HydrophobicContact CB-CD1 4.16Å; W461-F642 HydrophobicContact CB-CB 4.23Å; L464-F642 HydrophobicContact CB-CD1 4.43Å; L464-F642 HydrophobicContact CB-CD2 4.45Å; L464-F642 HydrophobicContact CB-CG 4.31Å; L464-F642 HydrophobicContact CD1-CD2 4.29Å; L464-F642 HydrophobicContact CD1-CE2 3.9Å; L464-F642 HydrophobicContact CD1-CZ 4.23Å; L464-F642 HydrophobicContact CD2-CD2 3.72Å; L464-F642 HydrophobicContact CD2-CE2 4.15Å; L464-F642 HydrophobicContact CD2-CG 4.2Å; L464-F642 HydrophobicContact CG-CD2 4.37Å; L464-F642 HydrophobicContact CG-CE2 4.46Å; G522-F642 VanDerWaalsContact CA-CE2 3.41Å; G638-F642 VanDerWaalsContact O-CD2 3.25Å; G638-F642 WeakPolarHBondContact O-CD2 3.12Å; G638-F642 PolarHBondContact O-N 3.39Å; I639-F642 PolarHBondContact O-N 3.2Å; V640-F642 PolarHBondContact O-N 2.81Å; F642-R645 WeakPolarHBondContact O-CB 3.46Å; F642-R645 PolarHBondContact O-N 3.42Å; F642-D646 PolarHBondContact O-N 3.48Å
643	K	90.6	Very high	84.5	Confident	126 Å²	126	60 Å²	60	55%	0.548	31%	0.309	S	S	.	.	H	α-helix	trans	-68.4	-36.9	171.5	-168.2	173.6	-176.6	176.5	0	112.2	I639 V640 V641 D646 H647	I639-K643 VanDerWaalsContact O-CB 3.31Å; I639-K643 WeakPolarHBondContact O-CB 3.06Å; I639-K643 PolarHBondContact O-N 3.14Å; V640-K643 PolarHBondContact O-N 3.08Å; V641-K643 VanDerWaalsContact C-N 3.35Å; V641-K643 PolarHBondContact O-N 3.46Å; K643-D646 WeakPolarHBondContact O-CB 3.47Å; K643-H647 PolarHBondContact O-ND1 3.11Å
644	I	89.2	Confident	83.8	Confident	89 Å²	89	60.2 Å²	60.2	46%	0.456	30%	0.3	S	S	.	.	H	α-helix	trans	-70.1	-38.5	171.7	-66.5	167.7	0	0	0	110.3	V640 V641 D646 H647 L648	V640-I644 HydrophobicContact CG1-CD1 3.74Å; V640-I644 HydrophobicContact CG1-CG1 4.41Å; V640-I644 VanDerWaalsContact O-CG1 3.3Å; V640-I644 WeakPolarHBondContact O-CG1 3.33Å; V640-I644 PolarHBondContact O-N 3.48Å; V641-I644 PolarHBondContact O-N 3.03Å; I644-D646 VanDerWaalsContact C-N 3.3Å; I644-D646 PolarHBondContact O-N 3.3Å; I644-H647 CarbonylContact O-C 3.57Å; I644-H647 WeakPolarHBondContact O-CA 3.42Å; I644-H647 WeakPolarHBondContact O-CB 3.44Å; I644-H647 PolarHBondContact O-N 3.18Å; I644-L648 HydrophobicContact CG2-CD1 3.91Å; I644-L648 HydrophobicContact CG2-CG 4.09Å; I644-L648 PolarHBondContact O-N 2.82Å
645	R	85.9	Confident	83	Confident	11 Å²	11	62.5 Å²	62.5	4%	0.042	31%	0.311	C	S	.	.	H	α-helix	trans	-60.9	-37.4	177.4	-175.5	-167.9	175.8	102.6	-1.7	112.1	D450 L521 G522 V641 F642 H647 L648 I649	D450-R645 IonicContact OD1-CZ 2.71Å; D450-R645 IonicContact OD1-NE 2.98Å; D450-R645 PolarHBondContact OD1-NE 3.04Å; D450-R645 VanDerWaalsContact OD1-NE 3.17Å; D450-R645 IonicContact OD1-NH2 2.72Å; D450-R645 IonicContact OD2-CZ 3.69Å; D450-R645 IonicContact OD2-NE 3.78Å; D450-R645 IonicContact OD2-NH2 3.94Å; D450-R645 PolarHBondContact OD2-NH2 2.96Å; L521-R645 PolarHBondContact O-NH1 2.78Å; L521-R645 VanDerWaalsContact O-NH1 3.1Å; G522-R645 PolarHBondContact O-NH1 3.05Å; V641-R645 VanDerWaalsContact O-CB 3.31Å; V641-R645 WeakPolarHBondContact O-CB 3.28Å; V641-R645 PolarHBondContact O-N 3.48Å; F642-R645 WeakPolarHBondContact O-CB 3.46Å; F642-R645 PolarHBondContact O-N 3.42Å; R645-H647 PolarHBondContact O-N 3.22Å; R645-L648 PolarHBondContact O-N 3.39Å; R645-I649 HydrophobicContact CG-CD1 3.74Å; R645-I649 HydrophobicContact CG-CG1 4.22Å; R645-I649 PolarHBondContact O-N 3.3Å
646	D	79.4	Confident	82.3	Confident	27 Å²	27	65 Å²	65	14%	0.144	32%	0.322	C	S	.	.	H	α-helix	trans	-50.9	-46.5	169.5	-80.8	-29.3	0	0	0	110.4	K460 F642 K643 I644 S650	K460-D646 WeakPolarHBondContact CB-OD1 3.31Å; K460-D646 WeakPolarHBondContact CD-OD1 3.36Å; K460-D646 WeakPolarHBondContact CE-OD1 3.39Å; K460-D646 WeakPolarHBondContact CG-OD1 3.48Å; K460-D646 IonicContact NZ-OD1 3.17Å; F642-D646 PolarHBondContact O-N 3.48Å; K643-D646 WeakPolarHBondContact O-CB 3.47Å; I644-D646 VanDerWaalsContact C-N 3.3Å; I644-D646 PolarHBondContact O-N 3.3Å; D646-S650 VanDerWaalsContact O-CB 3.24Å; D646-S650 WeakPolarHBondContact O-CB 3.49Å; D646-S650 PolarHBondContact O-N 3.15Å; D646-S650 VanDerWaalsContact O-N 3.17Å; D646-S650 PolarHBondContact O-OG 2.89Å; D646-S650 VanDerWaalsContact O-OG 3.06Å
647	H	75.4	Confident	81.3	Confident	102 Å²	102	62.2 Å²	62.2	47%	0.472	31%	0.307	S	S	.	.	H	α-helix	trans	-71.6	-40.4	179.8	-68.7	37.2	0	0	0	112.1	K643 I644 R645 S650 R651	K643-H647 PolarHBondContact O-ND1 3.11Å; I644-H647 CarbonylContact O-C 3.57Å; I644-H647 WeakPolarHBondContact O-CA 3.42Å; I644-H647 WeakPolarHBondContact O-CB 3.44Å; I644-H647 PolarHBondContact O-N 3.18Å; R645-H647 PolarHBondContact O-N 3.22Å; H647-S650 WeakPolarHBondContact CA-OG 3.46Å; H647-S650 PolarHBondContact O-N 3.2Å; H647-S650 PolarHBondContact O-OG 3.19Å; H647-R651 VanDerWaalsContact O-CB 3.24Å; H647-R651 WeakPolarHBondContact O-CB 3.39Å; H647-R651 VanDerWaalsContact O-CG 3.26Å; H647-R651 WeakPolarHBondContact O-CG 3.32Å; H647-R651 PolarHBondContact O-N 3.5Å
648	L	72.1	Confident	80.2	Confident	112 Å²	112	60.4 Å²	60.4	59%	0.586	30%	0.297	S	S	*	.	H	α-helix	trans	-67.6	-38.2	-179	-72	171.5	0	0	0	113.6	I644 R645	I644-L648 HydrophobicContact CG2-CD1 3.91Å; I644-L648 HydrophobicContact CG2-CG 4.09Å; I644-L648 PolarHBondContact O-N 2.82Å; R645-L648 PolarHBondContact O-N 3.39Å
649	I	66.6	Low	79.1	Confident	41 Å²	41	64.9 Å²	64.9	21%	0.21	32%	0.318	C	S	.	.	H	α-helix	trans	-78.6	-27.7	178.1	-67.7	177.9	0	0	0	110.9	D450 R645	D450-I649 WeakPolarHBondContact OD1-CD1 2.78Å; R645-I649 HydrophobicContact CG-CD1 3.74Å; R645-I649 HydrophobicContact CG-CG1 4.22Å; R645-I649 PolarHBondContact O-N 3.3Å
650	S	52.4	Low	77.8	Confident	44 Å²	44	66.3 Å²	66.3	31%	0.308	32%	0.324	S	S	.	.	H	α-helix	trans	-80.6	-16.4	172.1	76	0	0	0	0	114.3	R105 D646 H647	R105-S650 PolarHBondContact N-O 2.75Å; D646-S650 VanDerWaalsContact O-CB 3.24Å; D646-S650 WeakPolarHBondContact O-CB 3.49Å; D646-S650 PolarHBondContact O-N 3.15Å; D646-S650 VanDerWaalsContact O-N 3.17Å; D646-S650 PolarHBondContact O-OG 2.89Å; D646-S650 VanDerWaalsContact O-OG 3.06Å; H647-S650 WeakPolarHBondContact CA-OG 3.46Å; H647-S650 PolarHBondContact O-N 3.2Å; H647-S650 PolarHBondContact O-OG 3.19Å
651	R	40.4	Very low	76.3	Confident	154 Å²	154	66 Å²	66	58%	0.581	32%	0.315	S	S	*	.			trans	-86.7	0	176.6	-87.5	-170.1	168.7	-178.9	0.2	109.8	R104 R105 T106 H647	R104-R651 CarbonylContact C-O 3.58Å; R104-R651 WeakPolarHBondContact CA-O 3.26Å; R104-R651 WeakPolarHBondContact CB-O 3.21Å; R105-R651 HydrophobicContact CB-CG 4.02Å; R105-R651 HydrophobicContact CG-CG 4.49Å; R105-R651 PolarHBondContact N-O 2.99Å; T106-R651 VanDerWaalsContact CG2-O 3.32Å; T106-R651 WeakPolarHBondContact CG2-O 3.39Å; T106-R651 PolarHBondContact N-O 3.41Å; T106-R651 PolarHBondContact OG1-O 3.33Å; H647-R651 VanDerWaalsContact O-CB 3.24Å; H647-R651 WeakPolarHBondContact O-CB 3.39Å; H647-R651 VanDerWaalsContact O-CG 3.26Å; H647-R651 WeakPolarHBondContact O-CG 3.32Å; H647-R651 PolarHBondContact O-N 3.5Å

Retrieved 651 of 651 residues in 3194.4 ms (Link to these results)

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