A0A3Q0KTC9_SCHMA Loading...

Protein TAPT1 homolog

AlphaFold DB , UniProt , Accession A0A3Q0KTC9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 823 aa.

						>A0A3Q0KTC9_SCHMA|A0A3Q0KTC9
MFNEFVQQSSESDGDWEVHDPFKNFKFTRYLKEEVVQSIRKKQYEDGTSKCGPFTNRAYTFVTIPRYLESVVYLRLFMAYGMLQCLDHLLVIYTFLPLRCFLAGLNLMLRISSGIFQFFTSFNQYHDTPSSKTSRLTLLYNYELRDLIKFSLLCICTVILTKYDSSMAYHEIRTQSVIKIYIFFNLLEVADRLLSAVCQDALDDLLFTISKPRSDSVLSNNLEENSFIFWRDVVLQYCFAFFCLIAHCFLLLCQVTTLNVAFNSQNKSLITVFISNNFVELKGNVFRKMGKTNLFQIACADVRERFHYCVWFSIIVCRNMNESGWNLDDLQTILIDVTYILLAEVAVDWIKHSFITKFNVIPSNVYEEYTVSIAYDLLLCHQGKNTSDYSDLLSRRMGLTPIPLSCLINAMLFQTIRSPSTLCLTLPFVVSALFAVKVATNLTLMSMAYSHIREYINAASTVQQDENCSLNNDKTAGIFTTTEKGNVKQPRPILSEKEIRISSRKPPFGFTGYDQPTRDEDCFLPTGLRYRKFKSDSGPVDITANMDINHSLTSEDTSEFAGNKLRVLSPISTGSIWNELIEPYQSIMASATGTPKSLYEPSESTPLTPLSRIGSANRIFNSGNNKLEIECERSFRGSCVFQTEDKPQFTTYTNTPIATSHHEGLHVWNRYEMTSILGELYGNKDESFTAMVRPHSACVLLRPRYYSIDLGILSTFLKSMECNIRITDETPIKDGSAQGNESNPSYTFNRIHKRRIRTMTESSGTAPLHPSRDPTIPILWERSSRNSTANQFVLDQLKPITPGRVKQPLSDIDRYSMVEEQIS
					

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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	32.9	Very low	31.5	Very low	190 Å²	190	141.2 Å²	141.2	94%	0.936	71%	0.712	S	S	*	*				0	-80.2	0	-148	177.1	-71.5	0	0	111.1	N3 E4 F5	M1-N3 PolarHBondContact O-N 3.42Å; M1-E4 WeakPolarHBondContact CA-OE2 3.42Å; M1-E4 PolarHBondContact N-OE2 3.39Å; M1-E4 WeakPolarHBondContact O-CB 3.38Å; M1-E4 PolarHBondContact O-N 3.36Å; M1-F5 PolarHBondContact O-N 3.13Å
2	F	30.5	Very low	31.7	Very low	174 Å²	174	138.2 Å²	138.2	76%	0.763	71%	0.714	S	S	*	*	H	α-helix	trans	-58.4	-44.7	-176.3	-145.5	-88.1	0	0	0	113.3	E4 F5	F2-E4 PolarHBondContact O-N 3.35Å; F2-F5 WeakPolarHBondContact O-CB 3.2Å; F2-F5 PolarHBondContact O-N 3.48Å; F2-F5 VanDerWaalsContact O-N 3.16Å
3	N	33.8	Very low	31.6	Very low	135 Å²	135	139.8 Å²	139.8	72%	0.722	72%	0.724	S	S	*	*	H	α-helix	trans	-67.1	-18.6	176.9	-64.7	19.2	0	0	0	114.4	M1	M1-N3 PolarHBondContact O-N 3.42Å
4	E	36.7	Very low	31.6	Very low	131 Å²	131	133.4 Å²	133.4	61%	0.612	71%	0.71	S	S	*	*	H	α-helix	trans	-81	-28.7	175.3	-69.5	160.9	115.9	0	0	110.9	M1 F2 Q7	M1-E4 WeakPolarHBondContact CA-OE2 3.42Å; M1-E4 PolarHBondContact N-OE2 3.39Å; M1-E4 WeakPolarHBondContact O-CB 3.38Å; M1-E4 PolarHBondContact O-N 3.36Å; F2-E4 PolarHBondContact O-N 3.35Å; E4-Q7 PolarHBondContact O-N 3.39Å
5	F	30.5	Very low	32	Very low	166 Å²	166	135.7 Å²	135.7	73%	0.728	72%	0.722	S	S	*	*	H	α-helix	trans	-69.6	-42.2	179.3	-139.7	-86.4	0	0	0	111.9	M1 F2 Q7 Q8	M1-F5 PolarHBondContact O-N 3.13Å; F2-F5 WeakPolarHBondContact O-CB 3.2Å; F2-F5 PolarHBondContact O-N 3.48Å; F2-F5 VanDerWaalsContact O-N 3.16Å; F5-Q7 PolarHBondContact O-N 3.21Å; F5-Q8 PolarHBondContact O-N 3.18Å
6	V	32.7	Very low	32.2	Very low	94 Å²	94	142 Å²	142	57%	0.57	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-28.5	175.6	178	0	0	0	0	112.2	S9	V6-S9 PolarHBondContact O-OG 2.88Å
7	Q	31.1	Very low	32.5	Very low	154 Å²	154	142.5 Å²	142.5	72%	0.72	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-0.4	-176.3	-157.2	163.7	12.7	0	0	113.8	E4 F5	E4-Q7 PolarHBondContact O-N 3.39Å; F5-Q7 PolarHBondContact O-N 3.21Å
8	Q	30	Very low	33	Very low	158 Å²	158	142.7 Å²	142.7	74%	0.738	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	-10.7	171.3	-67.9	-162.1	-98	0	0	113.9	F5	F5-Q8 PolarHBondContact O-N 3.18Å
9	S	27.7	Very low	34.4	Very low	92 Å²	92	142.6 Å²	142.6	64%	0.643	74%	0.735	S	S	*	*	S	Bend	trans	-95.5	13.1	-175.5	60.1	0	0	0	0	114.7	V6	V6-S9 PolarHBondContact O-OG 2.88Å
10	S	30	Very low	35.9	Very low	82 Å²	82	139.9 Å²	139.9	57%	0.573	72%	0.722	S	S	*	*	S	Bend	trans	-128.9	16	-175.7	69.7	0	0	0	0	114.7
11	E	30.8	Very low	37.3	Very low	177 Å²	177	137.7 Å²	137.7	83%	0.827	72%	0.717	S	S	*	*			trans	-112.9	40	174.3	-67.8	-173.3	150	0	0	110.8
12	S	33.5	Very low	39.2	Very low	105 Å²	105	136.1 Å²	136.1	73%	0.734	71%	0.705	S	S	*	*			trans	-99.3	4.3	172.8	55.5	0	0	0	0	113.9	G14	S12-G14 PolarHBondContact O-N 2.69Å
13	D	30.7	Very low	41.2	Very low	159 Å²	159	136.1 Å²	136.1	85%	0.85	71%	0.705	S	S	*	*	S	Bend	trans	-89.4	82.3	177.5	-86	-35.1	0	0	0	111.8
14	G	31.5	Very low	42.8	Very low	51 Å²	51	136 Å²	136	53%	0.526	70%	0.704	S	S	.	*			trans	84.4	91.2	157.3	0	0	0	0	0	117.6	S12 W16	S12-G14 PolarHBondContact O-N 2.69Å; G14-W16 PolarHBondContact O-N 3.43Å
15	D	37.7	Very low	44.5	Very low	167 Å²	167	135 Å²	135	89%	0.893	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	17.6	171.3	-81.3	-46.8	0	0	0	116.5
16	W	35.9	Very low	46.9	Very low	237 Å²	237	133.8 Å²	133.8	90%	0.898	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.7	-3.5	-172.2	-58.3	103.1	0	0	0	114.7	G14 V18	G14-W16 PolarHBondContact O-N 3.43Å; W16-V18 PolarHBondContact O-N 3.45Å
17	E	36.8	Very low	49.2	Very low	150 Å²	150	135.3 Å²	135.3	70%	0.701	69%	0.692	S	S	*	*			trans	-75	111.8	165.8	-83	-145.8	157.8	0	0	111	H19	E17-H19 VanDerWaalsContact C-N 3.26Å; E17-H19 PolarHBondContact O-N 2.8Å; E17-H19 IonicContact OE2-CE1 2.7Å; E17-H19 PolarHBondContact OE2-CE1 3.06Å; E17-H19 IonicContact OE2-ND1 3.61Å; E17-H19 PolarHBondContact OE2-ND1 3.36Å
18	V	41.1	Very low	51.6	Low	146 Å²	146	133.3 Å²	133.3	89%	0.885	69%	0.69	S	S	*	*			trans	-72.1	85.8	164.9	-177.3	0	0	0	0	108.3	W16 D20	W16-V18 PolarHBondContact O-N 3.45Å; V18-D20 PolarHBondContact O-N 3.2Å
19	H	59.7	Low	53.9	Low	141 Å²	141	133.7 Å²	133.7	65%	0.653	69%	0.685	S	S	*	*			trans	-57.2	131.4	177.1	-63.7	-31.2	0	0	0	111.3	E17 P21	E17-H19 VanDerWaalsContact C-N 3.26Å; E17-H19 PolarHBondContact O-N 2.8Å; E17-H19 IonicContact OE2-CE1 2.7Å; E17-H19 PolarHBondContact OE2-CE1 3.06Å; E17-H19 IonicContact OE2-ND1 3.61Å; E17-H19 PolarHBondContact OE2-ND1 3.36Å; H19-P21 WeakPolarHBondContact O-CD 3.3Å; H19-P21 VanDerWaalsContact O-N 3.12Å
20	D	63.9	Low	56.4	Low	88 Å²	88	134.1 Å²	134.1	47%	0.471	67%	0.673	S	S	.	*			trans	-55.8	113.9	175.6	170.7	11	0	0	0	110.6	V18 F22 K23	V18-D20 PolarHBondContact O-N 3.2Å; D20-F22 PolarHBondContact O-N 2.86Å; D20-F22 VanDerWaalsContact O-N 3.16Å; D20-F22 PolarHBondContact OD1-N 3.48Å; D20-K23 HydrophobicContact CB-CB 4.13Å; D20-K23 VanDerWaalsContact O-CB 3.31Å; D20-K23 WeakPolarHBondContact O-CB 3.46Å; D20-K23 PolarHBondContact O-N 2.87Å; D20-K23 VanDerWaalsContact O-N 3.14Å
21	P	66.4	Low	58.8	Low	94 Å²	94	133.9 Å²	133.9	61%	0.61	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-22.3	-172.2	27.1	-35.4	0	0	0	112.7	H19	H19-P21 WeakPolarHBondContact O-CD 3.3Å; H19-P21 VanDerWaalsContact O-N 3.12Å
22	F	73.1	Confident	61.2	Low	157 Å²	157	131.4 Å²	131.4	69%	0.689	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-27.2	179.4	-61.1	-71.8	0	0	0	112.6	D20 N24 F25	D20-F22 PolarHBondContact O-N 2.86Å; D20-F22 VanDerWaalsContact O-N 3.16Å; D20-F22 PolarHBondContact OD1-N 3.48Å; F22-N24 PolarHBondContact O-N 3.24Å; F22-F25 PolarHBondContact O-N 3.37Å
23	K	72	Confident	63.4	Low	174 Å²	174	128.4 Å²	128.4	76%	0.757	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	-24.5	-175.2	-160.5	172.6	178.3	-179	0	114	D20	D20-K23 HydrophobicContact CB-CB 4.13Å; D20-K23 VanDerWaalsContact O-CB 3.31Å; D20-K23 WeakPolarHBondContact O-CB 3.46Å; D20-K23 PolarHBondContact O-N 2.87Å; D20-K23 VanDerWaalsContact O-N 3.14Å
24	N	67.3	Low	65.8	Low	134 Å²	134	126.1 Å²	126.1	72%	0.717	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.4	14.9	174.6	-89.4	-46.8	0	0	0	113.6	F22 K26	F22-N24 PolarHBondContact O-N 3.24Å; N24-K26 PolarHBondContact O-N 2.95Å; N24-K26 VanDerWaalsContact O-N 3.09Å
25	F	73	Confident	68.2	Low	108 Å²	108	129.2 Å²	129.2	47%	0.474	62%	0.619	S	S	.	*			trans	-70.9	106.4	-175.5	-175.3	-96.7	0	0	0	112.1	F22 F27 Y30	F22-F25 PolarHBondContact O-N 3.37Å; F25-F27 HydrophobicContact CE1-CB 4.14Å; F25-F27 HydrophobicContact CE1-CD2 4.29Å; F25-F27 HydrophobicContact CZ-CD2 4.32Å; F25-Y30 HydrophobicContact CE2-CD1 4.29Å; F25-Y30 HydrophobicContact CE2-CD2 4.3Å; F25-Y30 AromaticContact CE2-CG 3.81Å; F25-Y30 HydrophobicContact CE2-CG 3.81Å; F25-Y30 HydrophobicContact CZ-CD1 4Å; F25-Y30 AromaticContact CZ-CG 3.94Å; F25-Y30 HydrophobicContact CZ-CG 3.94Å
26	K	80.3	Confident	70.3	Confident	142 Å²	142	125.4 Å²	125.4	62%	0.617	60%	0.601	S	S	*	*			trans	-105.4	111.3	169.9	-68.7	-179.4	179.7	177	0	108.9	N24 T28 R29 Y30	N24-K26 PolarHBondContact O-N 2.95Å; N24-K26 VanDerWaalsContact O-N 3.09Å; K26-T28 PolarHBondContact O-N 2.88Å; K26-T28 VanDerWaalsContact O-N 3.12Å; K26-R29 HydrophobicContact CB-CB 4.01Å; K26-R29 WeakPolarHBondContact O-CA 3.29Å; K26-R29 WeakPolarHBondContact O-CB 3.36Å; K26-R29 PolarHBondContact O-N 2.94Å; K26-Y30 PolarHBondContact O-N 3.34Å
27	F	80.5	Confident	72.4	Confident	126 Å²	126	117.7 Å²	117.7	55%	0.553	58%	0.575	S	S	*	*	H	α-helix	trans	-53.7	-35	-178.1	-177.2	-109.9	0	0	0	113.5	F25 Y30 L31	F25-F27 HydrophobicContact CE1-CB 4.14Å; F25-F27 HydrophobicContact CE1-CD2 4.29Å; F25-F27 HydrophobicContact CZ-CD2 4.32Å; F27-Y30 HydrophobicContact CD2-CD1 4.33Å; F27-Y30 HydrophobicContact CE2-CD1 4.44Å; F27-Y30 PolarHBondContact O-N 2.75Å; F27-L31 HydrophobicContact CD1-CD1 4.07Å; F27-L31 HydrophobicContact CD1-CG 4.47Å; F27-L31 HydrophobicContact CE1-CD1 3.39Å; F27-L31 HydrophobicContact CE1-CG 4.01Å; F27-L31 HydrophobicContact CE2-CD1 4.41Å; F27-L31 HydrophobicContact CE2-CG 4.2Å; F27-L31 HydrophobicContact CZ-CD1 3.59Å; F27-L31 HydrophobicContact CZ-CD2 4.27Å; F27-L31 HydrophobicContact CZ-CG 3.85Å; F27-L31 PolarHBondContact O-N 2.87Å
28	T	81.4	Confident	74.1	Confident	112 Å²	112	112.5 Å²	112.5	69%	0.687	56%	0.555	S	S	*	*	H	α-helix	trans	-68.6	-32.8	174.1	51.5	0	0	0	0	113.6	K26 K32	K26-T28 PolarHBondContact O-N 2.88Å; K26-T28 VanDerWaalsContact O-N 3.12Å; T28-K32 WeakPolarHBondContact O-CB 3.32Å; T28-K32 PolarHBondContact O-N 3.01Å; T28-K32 VanDerWaalsContact O-N 3.07Å
29	R	78.1	Confident	75.7	Confident	165 Å²	165	109.5 Å²	109.5	62%	0.623	53%	0.533	S	S	*	.	H	α-helix	trans	-72	-39.8	171.4	-172.7	-179.5	-178.1	177.2	1.6	110.5	K26 K32 E33	K26-R29 HydrophobicContact CB-CB 4.01Å; K26-R29 WeakPolarHBondContact O-CA 3.29Å; K26-R29 WeakPolarHBondContact O-CB 3.36Å; K26-R29 PolarHBondContact O-N 2.94Å; R29-K32 PolarHBondContact O-N 3.38Å; R29-E33 WeakPolarHBondContact O-CB 3.31Å; R29-E33 PolarHBondContact O-N 3.01Å
30	Y	80	Confident	76	Confident	101 Å²	101	108.9 Å²	108.9	40%	0.396	53%	0.525	S	S	.	.	H	α-helix	trans	-61.4	-55.2	175.4	174.1	-113.6	0	0	0	111.8	F25 K26 F27 K32 E33 E34	F25-Y30 HydrophobicContact CE2-CD1 4.29Å; F25-Y30 HydrophobicContact CE2-CD2 4.3Å; F25-Y30 AromaticContact CE2-CG 3.81Å; F25-Y30 HydrophobicContact CE2-CG 3.81Å; F25-Y30 HydrophobicContact CZ-CD1 4Å; F25-Y30 AromaticContact CZ-CG 3.94Å; F25-Y30 HydrophobicContact CZ-CG 3.94Å; K26-Y30 PolarHBondContact O-N 3.34Å; F27-Y30 HydrophobicContact CD2-CD1 4.33Å; F27-Y30 HydrophobicContact CE2-CD1 4.44Å; F27-Y30 PolarHBondContact O-N 2.75Å; Y30-K32 VanDerWaalsContact C-N 3.31Å; Y30-K32 PolarHBondContact O-N 2.97Å; Y30-E33 PolarHBondContact O-N 3.11Å; Y30-E34 WeakPolarHBondContact CE2-OE2 3.43Å; Y30-E34 VanDerWaalsContact CZ-OE2 3.29Å; Y30-E34 PolarHBondContact O-N 2.87Å; Y30-E34 PolarHBondContact OH-OE2 3.08Å
31	L	82.1	Confident	76.4	Confident	77 Å²	77	110 Å²	110	40%	0.403	53%	0.526	S	S	.	.	H	α-helix	trans	-59.7	-38.7	175.8	-77.9	-176.9	0	0	0	112.8	F27 E33 E34 V35	F27-L31 HydrophobicContact CD1-CD1 4.07Å; F27-L31 HydrophobicContact CD1-CG 4.47Å; F27-L31 HydrophobicContact CE1-CD1 3.39Å; F27-L31 HydrophobicContact CE1-CG 4.01Å; F27-L31 HydrophobicContact CE2-CD1 4.41Å; F27-L31 HydrophobicContact CE2-CG 4.2Å; F27-L31 HydrophobicContact CZ-CD1 3.59Å; F27-L31 HydrophobicContact CZ-CD2 4.27Å; F27-L31 HydrophobicContact CZ-CG 3.85Å; F27-L31 PolarHBondContact O-N 2.87Å; L31-E33 VanDerWaalsContact C-N 3.28Å; L31-E33 PolarHBondContact O-N 2.72Å; L31-E34 PolarHBondContact O-N 2.84Å; L31-V35 VanDerWaalsContact O-CB 3.29Å; L31-V35 WeakPolarHBondContact O-CB 3.47Å; L31-V35 VanDerWaalsContact O-CG2 3.3Å; L31-V35 WeakPolarHBondContact O-CG2 3.23Å; L31-V35 PolarHBondContact O-N 3.06Å
32	K	80.4	Confident	76.6	Confident	125 Å²	125	111 Å²	111	54%	0.543	52%	0.521	S	S	.	.	H	α-helix	trans	-62.4	-36.4	174.5	-179.1	174.7	174.9	179.3	0	111.7	T28 R29 Y30 V36	T28-K32 WeakPolarHBondContact O-CB 3.32Å; T28-K32 PolarHBondContact O-N 3.01Å; T28-K32 VanDerWaalsContact O-N 3.07Å; R29-K32 PolarHBondContact O-N 3.38Å; Y30-K32 VanDerWaalsContact C-N 3.31Å; Y30-K32 PolarHBondContact O-N 2.97Å; K32-V36 HydrophobicContact CG-CB 4.47Å; K32-V36 HydrophobicContact CG-CG2 4.3Å; K32-V36 WeakPolarHBondContact O-CA 3.47Å; K32-V36 WeakPolarHBondContact O-CB 3.24Å; K32-V36 WeakPolarHBondContact O-CG2 3.45Å; K32-V36 PolarHBondContact O-N 2.9Å
33	E	79.7	Confident	76.1	Confident	42 Å²	42	108.1 Å²	108.1	20%	0.196	51%	0.509	C	S	.	.	H	α-helix	trans	-76.9	-38.5	178	-162.6	55.6	-149.6	0	0	112.7	R29 Y30 L31 Q37 S38 I39	R29-E33 WeakPolarHBondContact O-CB 3.31Å; R29-E33 PolarHBondContact O-N 3.01Å; Y30-E33 PolarHBondContact O-N 3.11Å; L31-E33 VanDerWaalsContact C-N 3.28Å; L31-E33 PolarHBondContact O-N 2.72Å; E33-Q37 WeakPolarHBondContact O-CA 3.41Å; E33-Q37 WeakPolarHBondContact O-CG 3.05Å; E33-Q37 PolarHBondContact O-N 3.39Å; E33-Q37 WeakPolarHBondContact OE1-CA 3.42Å; E33-S38 VanDerWaalsContact CD-N 3.26Å; E33-S38 PolarHBondContact OE1-N 3.43Å; E33-S38 WeakPolarHBondContact OE2-CA 3.38Å; E33-S38 WeakPolarHBondContact OE2-CB 3.44Å; E33-S38 PolarHBondContact OE2-N 3.29Å; E33-S38 PolarHBondContact OE2-OG 3.44Å; E33-I39 HydrophobicContact CG-CD1 4.21Å; E33-I39 VanDerWaalsContact OE1-CB 3.32Å; E33-I39 WeakPolarHBondContact OE1-CB 3.34Å; E33-I39 PolarHBondContact OE1-N 3Å; E33-I39 PolarHBondContact OE2-N 3.5Å
34	E	81.9	Confident	75.7	Confident	111 Å²	111	107.5 Å²	107.5	52%	0.519	50%	0.503	S	S	.	.	H	α-helix	trans	-66.4	-41.2	176.6	-155.8	68.9	-121.4	0	0	111.7	Y30 L31	Y30-E34 WeakPolarHBondContact CE2-OE2 3.43Å; Y30-E34 VanDerWaalsContact CZ-OE2 3.29Å; Y30-E34 PolarHBondContact O-N 2.87Å; Y30-E34 PolarHBondContact OH-OE2 3.08Å; L31-E34 PolarHBondContact O-N 2.84Å
35	V	81.1	Confident	75.7	Confident	117 Å²	117	107.2 Å²	107.2	71%	0.709	50%	0.498	S	S	*	.	H	α-helix	trans	-86.3	-38.7	-176.7	178	0	0	0	0	113.3	L31	L31-V35 VanDerWaalsContact O-CB 3.29Å; L31-V35 WeakPolarHBondContact O-CB 3.47Å; L31-V35 VanDerWaalsContact O-CG2 3.3Å; L31-V35 WeakPolarHBondContact O-CG2 3.23Å; L31-V35 PolarHBondContact O-N 3.06Å
36	V	82.6	Confident	75.1	Confident	86 Å²	86	106.2 Å²	106.2	52%	0.521	50%	0.497	S	S	.	.	H	α-helix	trans	-108.5	-15.9	-173.4	-165.4	0	0	0	0	112.6	K32 S38	K32-V36 HydrophobicContact CG-CB 4.47Å; K32-V36 HydrophobicContact CG-CG2 4.3Å; K32-V36 WeakPolarHBondContact O-CA 3.47Å; K32-V36 WeakPolarHBondContact O-CB 3.24Å; K32-V36 WeakPolarHBondContact O-CG2 3.45Å; K32-V36 PolarHBondContact O-N 2.9Å; V36-S38 VanDerWaalsContact C-N 3.26Å; V36-S38 PolarHBondContact O-N 3.28Å
37	Q	79.1	Confident	73.9	Confident	76 Å²	76	101 Å²	101	36%	0.355	48%	0.484	S	S	.	.			trans	50.5	48.1	-178.8	-58.2	177	5.8	0	0	111.3	E33 I39 R40 K41	E33-Q37 WeakPolarHBondContact O-CA 3.41Å; E33-Q37 WeakPolarHBondContact O-CG 3.05Å; E33-Q37 PolarHBondContact O-N 3.39Å; E33-Q37 WeakPolarHBondContact OE1-CA 3.42Å; Q37-I39 PolarHBondContact O-N 3.37Å; Q37-R40 HydrophobicContact CB-CB 4.03Å; Q37-R40 CarbonylContact O-C 3.57Å; Q37-R40 WeakPolarHBondContact O-CB 3.47Å; Q37-R40 PolarHBondContact O-N 2.92Å; Q37-R40 VanDerWaalsContact O-N 3.14Å; Q37-R40 VanDerWaalsContact OE1-CZ 3.26Å; Q37-K41 PolarHBondContact O-N 3.25Å
38	S	73.4	Confident	72.4	Confident	40 Å²	40	99.7 Å²	99.7	28%	0.28	49%	0.486	S	S	.	.	H	α-helix	trans	-68.1	-31.8	-167.7	68.7	0	0	0	0	114.3	E33 V36 K42	E33-S38 VanDerWaalsContact CD-N 3.26Å; E33-S38 PolarHBondContact OE1-N 3.43Å; E33-S38 WeakPolarHBondContact OE2-CA 3.38Å; E33-S38 WeakPolarHBondContact OE2-CB 3.44Å; E33-S38 PolarHBondContact OE2-N 3.29Å; E33-S38 PolarHBondContact OE2-OG 3.44Å; V36-S38 VanDerWaalsContact C-N 3.26Å; V36-S38 PolarHBondContact O-N 3.28Å; S38-K42 WeakPolarHBondContact O-CB 3.44Å; S38-K42 PolarHBondContact O-N 3.5Å
39	I	73.4	Confident	70.8	Confident	83 Å²	83	96.1 Å²	96.1	43%	0.426	47%	0.466	S	S	.	.	H	α-helix	trans	-69.3	-44	170.6	-60.8	167.8	0	0	0	109.3	E33 Q37 K41 K42 Q43	E33-I39 HydrophobicContact CG-CD1 4.21Å; E33-I39 VanDerWaalsContact OE1-CB 3.32Å; E33-I39 WeakPolarHBondContact OE1-CB 3.34Å; E33-I39 PolarHBondContact OE1-N 3Å; E33-I39 PolarHBondContact OE2-N 3.5Å; Q37-I39 PolarHBondContact O-N 3.37Å; I39-K41 PolarHBondContact O-N 3.19Å; I39-K42 PolarHBondContact O-N 3.11Å; I39-Q43 WeakPolarHBondContact O-CG 3.43Å; I39-Q43 PolarHBondContact O-N 2.94Å
40	R	67	Low	69.2	Low	129 Å²	129	97 Å²	97	49%	0.487	47%	0.474	S	S	.	.	H	α-helix	trans	-61	-44	176.8	-169.5	-173.9	-64.7	-177.2	-3.5	111.4	Q37 Q43 Y44	Q37-R40 HydrophobicContact CB-CB 4.03Å; Q37-R40 CarbonylContact O-C 3.57Å; Q37-R40 WeakPolarHBondContact O-CB 3.47Å; Q37-R40 PolarHBondContact O-N 2.92Å; Q37-R40 VanDerWaalsContact O-N 3.14Å; Q37-R40 VanDerWaalsContact OE1-CZ 3.26Å; R40-Q43 PolarHBondContact O-N 3.21Å; R40-Y44 HydrophobicContact CG-CD2 4.28Å; R40-Y44 HydrophobicContact CG-CE2 3.9Å; R40-Y44 WeakPolarHBondContact O-CD2 3.12Å; R40-Y44 PolarHBondContact O-N 3.38Å; R40-Y44 VanDerWaalsContact O-N 3.15Å
41	K	71.6	Confident	67.7	Low	112 Å²	112	95 Å²	95	49%	0.487	47%	0.474	S	S	.	.	H	α-helix	trans	-60.8	-44.8	174	-174.6	173.2	-179.2	-73.6	0	111	Q37 I39 Q43 Y44 E45	Q37-K41 PolarHBondContact O-N 3.25Å; I39-K41 PolarHBondContact O-N 3.19Å; K41-Q43 PolarHBondContact O-N 3.33Å; K41-Y44 WeakPolarHBondContact O-CB 3.29Å; K41-Y44 PolarHBondContact O-N 3.28Å; K41-Y44 VanDerWaalsContact O-N 3.15Å; K41-E45 IonicContact NZ-OE1 3.29Å; K41-E45 PolarHBondContact NZ-OE1 2.97Å; K41-E45 IonicContact NZ-OE2 3.88Å; K41-E45 PolarHBondContact NZ-OE2 3.5Å; K41-E45 WeakPolarHBondContact O-CG 3.13Å; K41-E45 PolarHBondContact O-N 3.46Å
42	K	69.9	Low	66.4	Low	115 Å²	115	92.8 Å²	92.8	50%	0.5	47%	0.47	S	S	.	.	H	α-helix	trans	-62.2	-39.9	176	-159.9	-165.4	176.5	-145.3	0	112.2	S38 I39 Y44 E45 D46	S38-K42 WeakPolarHBondContact O-CB 3.44Å; S38-K42 PolarHBondContact O-N 3.5Å; I39-K42 PolarHBondContact O-N 3.11Å; K42-Y44 VanDerWaalsContact C-N 3.27Å; K42-Y44 PolarHBondContact O-N 3.2Å; K42-E45 CarbonylContact O-C 3.6Å; K42-E45 PolarHBondContact O-N 3.22Å; K42-D46 WeakPolarHBondContact CE-OD1 3.4Å; K42-D46 WeakPolarHBondContact CE-OD2 3.48Å; K42-D46 IonicContact NZ-OD1 3.84Å; K42-D46 IonicContact NZ-OD2 3.14Å; K42-D46 PolarHBondContact NZ-OD2 3.21Å; K42-D46 VanDerWaalsContact NZ-OD2 3.14Å; K42-D46 WeakPolarHBondContact O-CB 3.31Å; K42-D46 PolarHBondContact O-N 3.32Å
43	Q	63.2	Low	65.1	Low	95 Å²	95	91.2 Å²	91.2	44%	0.444	47%	0.473	S	S	.	.	H	α-helix	trans	-61.3	-34.4	174.9	-73	173.6	-28.9	0	0	112.8	I39 R40 K41 G47 T48 S49	I39-Q43 WeakPolarHBondContact O-CG 3.43Å; I39-Q43 PolarHBondContact O-N 2.94Å; R40-Q43 PolarHBondContact O-N 3.21Å; K41-Q43 PolarHBondContact O-N 3.33Å; Q43-G47 PolarHBondContact O-N 3.39Å; Q43-T48 PolarHBondContact O-N 3.07Å; Q43-T48 PolarHBondContact O-OG1 2.84Å; Q43-S49 VanDerWaalsContact O-CB 3.29Å; Q43-S49 WeakPolarHBondContact O-CB 3.39Å; Q43-S49 PolarHBondContact O-N 3.18Å; Q43-S49 PolarHBondContact O-OG 3.47Å
44	Y	63.1	Low	63.8	Low	162 Å²	162	97.4 Å²	97.4	64%	0.635	50%	0.499	S	S	*	.	H	α-helix	trans	-69.6	-35.4	171.5	-76.7	-66.5	0	0	0	112.9	R40 K41 K42 S49	R40-Y44 HydrophobicContact CG-CD2 4.28Å; R40-Y44 HydrophobicContact CG-CE2 3.9Å; R40-Y44 WeakPolarHBondContact O-CD2 3.12Å; R40-Y44 PolarHBondContact O-N 3.38Å; R40-Y44 VanDerWaalsContact O-N 3.15Å; K41-Y44 WeakPolarHBondContact O-CB 3.29Å; K41-Y44 PolarHBondContact O-N 3.28Å; K41-Y44 VanDerWaalsContact O-N 3.15Å; K42-Y44 VanDerWaalsContact C-N 3.27Å; K42-Y44 PolarHBondContact O-N 3.2Å; Y44-S49 WeakPolarHBondContact CA-OG 3.4Å; Y44-S49 WeakPolarHBondContact CD1-OG 3.45Å
45	E	67.9	Low	62.6	Low	127 Å²	127	95.2 Å²	95.2	59%	0.593	49%	0.493	S	S	*	.	H	α-helix	trans	-76.7	-41.9	179.1	-69.6	173.1	152.6	0	0	112.8	K41 K42 G47	K41-E45 IonicContact NZ-OE1 3.29Å; K41-E45 PolarHBondContact NZ-OE1 2.97Å; K41-E45 IonicContact NZ-OE2 3.88Å; K41-E45 PolarHBondContact NZ-OE2 3.5Å; K41-E45 WeakPolarHBondContact O-CG 3.13Å; K41-E45 PolarHBondContact O-N 3.46Å; K42-E45 CarbonylContact O-C 3.6Å; K42-E45 PolarHBondContact O-N 3.22Å; E45-G47 PolarHBondContact O-N 2.64Å
46	D	61.7	Low	61.8	Low	88 Å²	88	93.9 Å²	93.9	47%	0.471	48%	0.482	S	S	.	.	S	Bend	trans	-69.5	-7.7	174.9	-69.3	-16.1	0	0	0	112.1	K42 T48	K42-D46 WeakPolarHBondContact CE-OD1 3.4Å; K42-D46 WeakPolarHBondContact CE-OD2 3.48Å; K42-D46 IonicContact NZ-OD1 3.84Å; K42-D46 IonicContact NZ-OD2 3.14Å; K42-D46 PolarHBondContact NZ-OD2 3.21Å; K42-D46 VanDerWaalsContact NZ-OD2 3.14Å; K42-D46 WeakPolarHBondContact O-CB 3.31Å; K42-D46 PolarHBondContact O-N 3.32Å; D46-T48 HydrophobicContact CB-CG2 4.17Å; D46-T48 PolarHBondContact O-N 2.88Å
47	G	53.5	Low	60.9	Low	32 Å²	32	95.8 Å²	95.8	33%	0.33	48%	0.48	S	S	.	.	S	Bend	trans	67.8	1.9	-177	0	0	0	0	0	115	Q43 E45 S49 K50	Q43-G47 PolarHBondContact O-N 3.39Å; E45-G47 PolarHBondContact O-N 2.64Å; G47-S49 VanDerWaalsContact C-N 3.27Å; G47-S49 PolarHBondContact O-N 3.25Å; G47-K50 WeakPolarHBondContact O-CG 3.3Å; G47-K50 PolarHBondContact O-N 3.3Å
48	T	50	Low	60.2	Low	98 Å²	98	94.6 Å²	94.6	60%	0.601	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-17	178.3	52.6	0	0	0	0	112.5	Q43 D46 K50	Q43-T48 PolarHBondContact O-N 3.07Å; Q43-T48 PolarHBondContact O-OG1 2.84Å; D46-T48 HydrophobicContact CB-CG2 4.17Å; D46-T48 PolarHBondContact O-N 2.88Å; T48-K50 PolarHBondContact O-N 3.26Å
49	S	47.1	Very low	59.9	Low	37 Å²	37	99.6 Å²	99.6	26%	0.259	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	11.6	170	75.1	0	0	0	0	114.6	Q43 Y44 G47 C51	Q43-S49 VanDerWaalsContact O-CB 3.29Å; Q43-S49 WeakPolarHBondContact O-CB 3.39Å; Q43-S49 PolarHBondContact O-N 3.18Å; Q43-S49 PolarHBondContact O-OG 3.47Å; Y44-S49 WeakPolarHBondContact CA-OG 3.4Å; Y44-S49 WeakPolarHBondContact CD1-OG 3.45Å; G47-S49 VanDerWaalsContact C-N 3.27Å; G47-S49 PolarHBondContact O-N 3.25Å; S49-C51 VanDerWaalsContact C-N 3.29Å; S49-C51 PolarHBondContact O-N 3.2Å
50	K	45.7	Very low	59.5	Low	184 Å²	184	96.9 Å²	96.9	80%	0.8	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	91.5	170.8	-82.2	174.3	-178.8	173.7	0	109.3	G47 T48	G47-K50 WeakPolarHBondContact O-CG 3.3Å; G47-K50 PolarHBondContact O-N 3.3Å; T48-K50 PolarHBondContact O-N 3.26Å
51	C	48.4	Very low	59.6	Low	58 Å²	58	93.7 Å²	93.7	39%	0.392	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	86.3	-178.3	-151.7	0	0	0	0	114.9	S49 T55 N56	S49-C51 VanDerWaalsContact C-N 3.29Å; S49-C51 PolarHBondContact O-N 3.2Å; C51-T55 WeakPolarHBondContact CA-OG1 3.47Å; C51-N56 WeakPolarHBondContact SG-CA 3.48Å; C51-N56 PolarHBondContact SG-N 3.33Å
52	G	53	Low	59.5	Low	31 Å²	31	93.5 Å²	93.5	32%	0.32	48%	0.482	S	S	.	.			trans	-64.7	168.5	163.6	0	0	0	0	0	112.8	F54 T55 N56	G52-F54 VanDerWaalsContact C-N 3.28Å; G52-F54 PolarHBondContact O-N 3.04Å; G52-T55 PolarHBondContact N-OG1 3.31Å; G52-T55 PolarHBondContact O-N 2.79Å; G52-T55 VanDerWaalsContact O-N 3.13Å; G52-T55 PolarHBondContact O-OG1 2.97Å; G52-N56 PolarHBondContact O-N 3.34Å
53	P	53.4	Low	59.5	Low	93 Å²	93	89.8 Å²	89.8	60%	0.604	47%	0.469	S	S	*	.	H	α-helix	trans	-61.7	-32.2	-170.8	23	-33.9	0	0	0	113.9	R57	P53-R57 WeakPolarHBondContact O-CG 3.31Å; P53-R57 PolarHBondContact O-N 2.99Å
54	F	52.8	Low	59.8	Low	172 Å²	172	85.2 Å²	85.2	75%	0.754	45%	0.448	S	S	*	.	H	α-helix	trans	-71.5	-43.7	176	-64	-75.3	0	0	0	112.6	G52 N56 R57 A58	G52-F54 VanDerWaalsContact C-N 3.28Å; G52-F54 PolarHBondContact O-N 3.04Å; F54-N56 VanDerWaalsContact C-N 3.3Å; F54-N56 PolarHBondContact O-N 3.38Å; F54-R57 PolarHBondContact O-N 3.36Å; F54-A58 PolarHBondContact O-N 3.39Å
55	T	56.8	Low	60	Low	64 Å²	64	79 Å²	79	39%	0.393	43%	0.427	S	S	.	.	H	α-helix	trans	-63.8	-37.8	173.3	37.7	0	0	0	0	111.2	C51 G52 R57 A58 Y59	C51-T55 WeakPolarHBondContact CA-OG1 3.47Å; G52-T55 PolarHBondContact N-OG1 3.31Å; G52-T55 PolarHBondContact O-N 2.79Å; G52-T55 VanDerWaalsContact O-N 3.13Å; G52-T55 PolarHBondContact O-OG1 2.97Å; T55-R57 PolarHBondContact O-N 3.4Å; T55-A58 WeakPolarHBondContact O-CB 3.25Å; T55-A58 PolarHBondContact O-N 3.28Å; T55-A58 VanDerWaalsContact O-N 3.09Å; T55-Y59 WeakPolarHBondContact O-CD2 3.48Å; T55-Y59 PolarHBondContact O-N 3.13Å
56	N	65.3	Low	59.9	Low	89 Å²	89	81.4 Å²	81.4	48%	0.476	43%	0.431	S	S	.	.	H	α-helix	trans	-60.7	-50.6	178.9	-161.8	-6	0	0	0	110.4	C51 G52 F54 A58 Y59 T60	C51-N56 WeakPolarHBondContact SG-CA 3.48Å; C51-N56 PolarHBondContact SG-N 3.33Å; G52-N56 PolarHBondContact O-N 3.34Å; F54-N56 VanDerWaalsContact C-N 3.3Å; F54-N56 PolarHBondContact O-N 3.38Å; N56-A58 PolarHBondContact O-N 2.98Å; N56-A58 VanDerWaalsContact O-N 3.15Å; N56-Y59 PolarHBondContact O-N 2.94Å; N56-Y59 VanDerWaalsContact O-N 3.09Å; N56-T60 PolarHBondContact O-N 3.2Å; N56-T60 PolarHBondContact O-OG1 2.98Å
57	R	63.2	Low	60	Low	126 Å²	126	81.7 Å²	81.7	48%	0.475	43%	0.426	S	S	.	.	H	α-helix	trans	-57.5	-29.7	174.1	-69.5	174.2	-179.8	-176.6	-0.2	114.3	P53 F54 T55 F61	P53-R57 WeakPolarHBondContact O-CG 3.31Å; P53-R57 PolarHBondContact O-N 2.99Å; F54-R57 PolarHBondContact O-N 3.36Å; T55-R57 PolarHBondContact O-N 3.4Å; R57-F61 PolarHBondContact O-N 3.33Å
58	A	64.2	Low	60.2	Low	52 Å²	52	80.2 Å²	80.2	43%	0.43	41%	0.411	S	S	.	.	H	α-helix	trans	-76.1	-44.6	174.6	0	0	0	0	0	112	F54 T55 N56 F61 V62	F54-A58 PolarHBondContact O-N 3.39Å; T55-A58 WeakPolarHBondContact O-CB 3.25Å; T55-A58 PolarHBondContact O-N 3.28Å; T55-A58 VanDerWaalsContact O-N 3.09Å; N56-A58 PolarHBondContact O-N 2.98Å; N56-A58 VanDerWaalsContact O-N 3.15Å; A58-F61 PolarHBondContact O-N 2.87Å; A58-V62 WeakPolarHBondContact O-CG2 3.12Å; A58-V62 PolarHBondContact O-N 3.35Å
59	Y	66.6	Low	60.7	Low	145 Å²	145	76.9 Å²	76.9	57%	0.569	39%	0.388	S	S	*	.	H	α-helix	trans	-62.7	-39.9	173.4	-73.8	-64.2	0	0	0	111.9	T55 N56 F61 V62 T63	T55-Y59 WeakPolarHBondContact O-CD2 3.48Å; T55-Y59 PolarHBondContact O-N 3.13Å; N56-Y59 PolarHBondContact O-N 2.94Å; N56-Y59 VanDerWaalsContact O-N 3.09Å; Y59-F61 PolarHBondContact O-N 3.3Å; Y59-V62 PolarHBondContact O-N 2.98Å; Y59-T63 VanDerWaalsContact O-CB 3.3Å; Y59-T63 WeakPolarHBondContact O-CB 3.41Å; Y59-T63 PolarHBondContact O-N 3.37Å; Y59-T63 PolarHBondContact O-OG1 3.34Å
60	T	65.1	Low	61	Low	25 Å²	25	76.9 Å²	76.9	15%	0.153	39%	0.388	C	S	.	.	H	α-helix	trans	-53.6	-54.7	171.7	-53	0	0	0	0	110.4	N56 V62 T63 I64	N56-T60 PolarHBondContact O-N 3.2Å; N56-T60 PolarHBondContact O-OG1 2.98Å; T60-V62 VanDerWaalsContact C-N 3.33Å; T60-V62 PolarHBondContact O-N 3.44Å; T60-T63 PolarHBondContact O-N 2.9Å; T60-I64 HydrophobicContact CG2-CD1 3.58Å; T60-I64 HydrophobicContact CG2-CG1 4.32Å; T60-I64 WeakPolarHBondContact O-CD1 3.47Å; T60-I64 WeakPolarHBondContact O-CG1 3.23Å; T60-I64 PolarHBondContact O-N 3.43Å
61	F	68.7	Low	61.2	Low	63 Å²	63	74.2 Å²	74.2	28%	0.276	39%	0.387	S	S	.	.	H	α-helix	trans	-58.6	-39.6	179.8	-173.9	-92.9	0	0	0	113.3	R57 A58 Y59 P65 S353 F354 K357	R57-F61 PolarHBondContact O-N 3.33Å; A58-F61 PolarHBondContact O-N 2.87Å; Y59-F61 PolarHBondContact O-N 3.3Å; F61-P65 WeakPolarHBondContact O-CD 3.38Å; F61-S353 WeakPolarHBondContact CD2-O 3.32Å; F61-F354 HydrophobicContact CE2-CD1 4.33Å; F61-F354 HydrophobicContact CE2-CD2 4.36Å; F61-F354 HydrophobicContact CE2-CE1 4.19Å; F61-F354 HydrophobicContact CE2-CE2 4.23Å; F61-F354 HydrophobicContact CE2-CG 4.4Å; F61-F354 HydrophobicContact CE2-CZ 4.14Å; F61-F354 HydrophobicContact CZ-CE2 4.44Å; F61-F354 HydrophobicContact CZ-CZ 4.38Å; F61-K357 HydrophobicContact CB-CD 4.29Å; F61-K357 HydrophobicContact CD2-CD 3.67Å; F61-K357 HydrophobicContact CE2-CD 4.45Å; F61-K357 HydrophobicContact CG-CD 4.31Å
62	V	70.4	Confident	61.3	Low	107 Å²	107	77.4 Å²	77.4	65%	0.648	40%	0.404	S	S	*	.	H	α-helix	trans	-77.9	-28.3	179.3	174.6	0	0	0	0	112.7	A58 Y59 T60	A58-V62 WeakPolarHBondContact O-CG2 3.12Å; A58-V62 PolarHBondContact O-N 3.35Å; Y59-V62 PolarHBondContact O-N 2.98Å; T60-V62 VanDerWaalsContact C-N 3.33Å; T60-V62 PolarHBondContact O-N 3.44Å
63	T	70	Confident	60.7	Low	37 Å²	37	83.6 Å²	83.6	23%	0.227	42%	0.419	C	S	.	.	H	α-helix	trans	-92.1	-17.9	-176.4	-39.3	0	0	0	0	112.6	Y59 T60 R66 Y67	Y59-T63 VanDerWaalsContact O-CB 3.3Å; Y59-T63 WeakPolarHBondContact O-CB 3.41Å; Y59-T63 PolarHBondContact O-N 3.37Å; Y59-T63 PolarHBondContact O-OG1 3.34Å; T60-T63 PolarHBondContact O-N 2.9Å; T63-R66 HydrophobicContact CG2-CB 4.3Å; T63-R66 CarbonylContact O-C 3.59Å; T63-R66 WeakPolarHBondContact O-CA 3.37Å; T63-R66 VanDerWaalsContact O-CB 3.29Å; T63-R66 WeakPolarHBondContact O-CB 3.4Å; T63-R66 PolarHBondContact O-N 3.33Å; T63-Y67 HydrophobicContact CG2-CD2 3.72Å; T63-Y67 HydrophobicContact CG2-CE2 3.41Å; T63-Y67 VanDerWaalsContact CG2-CE2 3.41Å; T63-Y67 VanDerWaalsContact O-CD2 3.27Å; T63-Y67 WeakPolarHBondContact O-CD2 3.48Å; T63-Y67 PolarHBondContact O-N 2.86Å
64	I	69.5	Low	60.3	Low	0 Å²	0	85 Å²	85	0%	0	42%	0.421	C	S	.	.	H	α-helix	trans	-59.2	-45.6	177.1	-78.6	161.2	0	0	0	113.6	T60 R66 Y67 L68 H352 S353 T356	T60-I64 HydrophobicContact CG2-CD1 3.58Å; T60-I64 HydrophobicContact CG2-CG1 4.32Å; T60-I64 WeakPolarHBondContact O-CD1 3.47Å; T60-I64 WeakPolarHBondContact O-CG1 3.23Å; T60-I64 PolarHBondContact O-N 3.43Å; I64-R66 PolarHBondContact O-N 2.92Å; I64-Y67 CarbonylContact O-C 3.57Å; I64-Y67 WeakPolarHBondContact O-CA 3.34Å; I64-Y67 PolarHBondContact O-N 2.86Å; I64-L68 HydrophobicContact CG2-CD1 3.53Å; I64-L68 HydrophobicContact CG2-CG 3.99Å; I64-L68 WeakPolarHBondContact O-CG 3.42Å; I64-L68 PolarHBondContact O-N 2.96Å; I64-H352 HydrophobicContact CG2-CB 4.27Å; I64-S353 WeakPolarHBondContact CG2-OG 3.39Å; I64-T356 HydrophobicContact CD1-CG2 4.15Å; I64-T356 WeakPolarHBondContact CD1-OG1 3.46Å
65	P	67.4	Low	60.2	Low	30 Å²	30	82.7 Å²	82.7	20%	0.195	41%	0.407	C	S	.	.	H	α-helix	trans	-53.5	-37.2	171.3	-28.1	36.3	0	0	0	112.8	F61 E69 W349	F61-P65 WeakPolarHBondContact O-CD 3.38Å; P65-E69 PolarHBondContact O-N 3.46Å; P65-W349 HydrophobicContact CB-CB 4.35Å; P65-W349 HydrophobicContact CB-CD2 3.78Å; P65-W349 HydrophobicContact CB-CE3 3.89Å; P65-W349 HydrophobicContact CB-CG 3.98Å; P65-W349 HydrophobicContact CG-CB 4.16Å; P65-W349 HydrophobicContact CG-CD2 4.44Å; P65-W349 HydrophobicContact CG-CE3 4.45Å; P65-W349 HydrophobicContact CG-CG 4.33Å
66	R	66	Low	60.9	Low	179 Å²	179	81.2 Å²	81.2	68%	0.675	40%	0.397	S	S	*	.	H	α-helix	trans	-70.4	-29.7	176.1	-173.7	-179	177.8	-175.3	-0.5	113.2	T63 I64 S70 L76	T63-R66 HydrophobicContact CG2-CB 4.3Å; T63-R66 CarbonylContact O-C 3.59Å; T63-R66 WeakPolarHBondContact O-CA 3.37Å; T63-R66 VanDerWaalsContact O-CB 3.29Å; T63-R66 WeakPolarHBondContact O-CB 3.4Å; T63-R66 PolarHBondContact O-N 3.33Å; I64-R66 PolarHBondContact O-N 2.92Å; R66-S70 WeakPolarHBondContact O-CB 3.24Å; R66-L76 WeakPolarHBondContact O-CD1 3.33Å
67	Y	62	Low	61.7	Low	93 Å²	93	77.1 Å²	77.1	37%	0.365	37%	0.374	S	S	.	.	H	α-helix	trans	-85.9	-24	175.1	-78.5	-66.4	0	0	0	114.1	T63 I64 L76 S363	T63-Y67 HydrophobicContact CG2-CD2 3.72Å; T63-Y67 HydrophobicContact CG2-CE2 3.41Å; T63-Y67 VanDerWaalsContact CG2-CE2 3.41Å; T63-Y67 VanDerWaalsContact O-CD2 3.27Å; T63-Y67 WeakPolarHBondContact O-CD2 3.48Å; T63-Y67 PolarHBondContact O-N 2.86Å; I64-Y67 CarbonylContact O-C 3.57Å; I64-Y67 WeakPolarHBondContact O-CA 3.34Å; I64-Y67 PolarHBondContact O-N 2.86Å; Y67-L76 WeakPolarHBondContact O-CD2 3.14Å; Y67-S363 WeakPolarHBondContact CD2-OG 3.1Å; Y67-S363 WeakPolarHBondContact CE2-OG 3.49Å
68	L	58.7	Low	62.9	Low	2 Å²	2	71.3 Å²	71.3	1%	0.01	35%	0.353	C	S	.	.	H	α-helix	trans	-77.1	-45.5	176.6	-70.4	165.5	0	0	0	111.5	I64 M78 H352 Y366	I64-L68 HydrophobicContact CG2-CD1 3.53Å; I64-L68 HydrophobicContact CG2-CG 3.99Å; I64-L68 WeakPolarHBondContact O-CG 3.42Å; I64-L68 PolarHBondContact O-N 2.96Å; L68-M78 HydrophobicContact CB-CG 4.45Å; L68-M78 VanDerWaalsContact O-CG 3.31Å; L68-M78 WeakPolarHBondContact O-CG 3.49Å; L68-H352 HydrophobicContact CD1-CB 3.63Å; L68-H352 HydrophobicContact CD2-CB 4.17Å; L68-H352 HydrophobicContact CG-CB 4.49Å; L68-Y366 HydrophobicContact CD2-CD1 3.93Å; L68-Y366 HydrophobicContact CD2-CD2 4.47Å; L68-Y366 HydrophobicContact CD2-CE1 3.62Å; L68-Y366 HydrophobicContact CD2-CE2 4.22Å; L68-Y366 HydrophobicContact CD2-CG 4.35Å
69	E	60.9	Low	63.9	Low	28 Å²	28	70.7 Å²	70.7	13%	0.131	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-151.9	-2.9	-151.5	-144.3	-164.5	-82.3	0	0	117.8	P65 V71 R305 V345 W349	P65-E69 PolarHBondContact O-N 3.46Å; E69-V71 WeakPolarHBondContact O-CA 3.38Å; E69-V71 PolarHBondContact O-N 3.01Å; E69-R305 VanDerWaalsContact CD-NH1 3.33Å; E69-R305 IonicContact OE1-CZ 3.54Å; E69-R305 IonicContact OE1-NH1 3.12Å; E69-R305 PolarHBondContact OE1-NH1 2.69Å; E69-R305 IonicContact OE1-NH2 3.13Å; E69-R305 PolarHBondContact OE1-NH2 2.92Å; E69-V345 WeakPolarHBondContact OE2-CG1 3.29Å; E69-V345 WeakPolarHBondContact OE2-CG2 3.27Å; E69-W349 HydrophobicContact CB-CZ2 4.39Å; E69-W349 PolarHBondContact OE1-NE1 3.49Å; E69-W349 WeakPolarHBondContact OE2-CZ2 3.2Å
70	S	52.3	Low	65	Low	36 Å²	36	63.8 Å²	63.8	25%	0.252	32%	0.321	S	S	.	.			trans	-44.6	93.4	-172.3	171.7	0	0	0	0	114.8	R66 V72 Y73	R66-S70 WeakPolarHBondContact O-CB 3.24Å; S70-V72 PolarHBondContact O-N 3.26Å; S70-Y73 PolarHBondContact O-N 2.92Å
71	V	51	Low	66.2	Low	129 Å²	129	62.6 Å²	62.6	78%	0.782	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-29.2	-165.4	-179.8	0	0	0	0	114.8	E69 Y73	E69-V71 WeakPolarHBondContact O-CA 3.38Å; E69-V71 PolarHBondContact O-N 3.01Å; V71-Y73 PolarHBondContact O-N 3.33Å
72	V	50.2	Low	67.3	Low	124 Å²	124	61.7 Å²	61.7	75%	0.752	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-21.1	176.8	-176.5	0	0	0	0	113	S70	S70-V72 PolarHBondContact O-N 3.26Å
73	Y	41.1	Very low	68.4	Low	162 Å²	162	58 Å²	58	64%	0.635	29%	0.287	S	S	*	.			trans	-130.7	111.7	172.9	-72.3	-79.4	0	0	0	111.2	S70 V71 R75	S70-Y73 PolarHBondContact O-N 2.92Å; V71-Y73 PolarHBondContact O-N 3.33Å; Y73-R75 PolarHBondContact O-N 3.01Å
74	L	43.5	Very low	69.4	Low	121 Å²	121	56.4 Å²	56.4	63%	0.634	28%	0.277	S	S	*	.	S	Bend	trans	-67	30.1	177	-165.4	111.9	0	0	0	114.1	M447	L74-M447 HydrophobicContact CD2-SD 4.23Å; L74-M447 WeakPolarHBondContact O-CE 3.22Å
75	R	52.3	Low	70.5	Confident	124 Å²	124	56.4 Å²	56.4	47%	0.468	28%	0.277	S	S	.	.			trans	-115.4	19.5	-159.8	-154.8	179.5	-175.7	173.3	-1.4	113.6	Y73 E454	Y73-R75 PolarHBondContact O-N 3.01Å; R75-E454 IonicContact CZ-OE1 2.69Å; R75-E454 IonicContact CZ-OE2 3.35Å; R75-E454 IonicContact NE-OE2 2.77Å; R75-E454 IonicContact NH2-OE1 3.82Å; R75-E454 PolarHBondContact NH2-OE1 3.35Å; R75-E454 IonicContact NH2-OE2 2.68Å; R75-E454 PolarHBondContact NH2-OE2 2.86Å
76	L	69.7	Low	71.8	Confident	34 Å²	34	57.8 Å²	57.8	18%	0.178	28%	0.283	C	S	.	.	S	Bend	trans	-126.5	155.2	-167.2	-58.9	172.7	0	0	0	111.6	R66 Y67 M78 A79 Y80	R66-L76 WeakPolarHBondContact O-CD1 3.33Å; Y67-L76 WeakPolarHBondContact O-CD2 3.14Å; L76-M78 VanDerWaalsContact C-N 3.31Å; L76-M78 PolarHBondContact O-N 3.47Å; L76-M78 VanDerWaalsContact O-N 3.13Å; L76-A79 PolarHBondContact O-N 2.93Å; L76-Y80 PolarHBondContact O-N 3.34Å; L76-Y80 VanDerWaalsContact O-N 3.09Å
77	F	83.7	Confident	73.1	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.009	25%	0.252	C	S	.	.	H	α-helix	trans	-43.6	-50.6	-169.8	177.3	-90.4	0	0	0	113.8	A79 Y80 G81 F295 A298 V302 Y369 T370 I373	F77-A79 PolarHBondContact O-N 3.03Å; F77-Y80 PolarHBondContact O-N 3.25Å; F77-G81 PolarHBondContact O-N 2.97Å; F77-F295 HydrophobicContact CE2-CD2 4.46Å; F77-F295 HydrophobicContact CE2-CE2 4.14Å; F77-A298 HydrophobicContact CD1-CB 4.32Å; F77-A298 HydrophobicContact CE1-CB 3.49Å; F77-A298 VanDerWaalsContact CE1-CB 3.49Å; F77-A298 HydrophobicContact CZ-CB 3.76Å; F77-V302 HydrophobicContact CD1-CG2 4.26Å; F77-V302 HydrophobicContact CE1-CG2 3.8Å; F77-Y369 HydrophobicContact CE2-CD2 4.35Å; F77-Y369 HydrophobicContact CE2-CG 4.43Å; F77-T370 WeakPolarHBondContact CA-OG1 3.46Å; F77-T370 WeakPolarHBondContact CB-OG1 3.38Å; F77-I373 HydrophobicContact CD2-CD1 4.13Å; F77-I373 HydrophobicContact CE2-CD1 3.41Å; F77-I373 VanDerWaalsContact CE2-CD1 3.41Å; F77-I373 HydrophobicContact CZ-CD1 4.07Å
78	M	87.4	Confident	74.5	Confident	4 Å²	4	45.6 Å²	45.6	2%	0.02	24%	0.237	C	C	.	.	H	α-helix	trans	-63.8	-43.6	-175.4	-56.4	-60.5	-78.2	0	0	111.9	L68 L76 G81 M82 D301 V302	L68-M78 HydrophobicContact CB-CG 4.45Å; L68-M78 VanDerWaalsContact O-CG 3.31Å; L68-M78 WeakPolarHBondContact O-CG 3.49Å; L76-M78 VanDerWaalsContact C-N 3.31Å; L76-M78 PolarHBondContact O-N 3.47Å; L76-M78 VanDerWaalsContact O-N 3.13Å; M78-G81 PolarHBondContact O-N 3.05Å; M78-M82 WeakPolarHBondContact O-CB 3.39Å; M78-M82 WeakPolarHBondContact O-CG 3.45Å; M78-M82 PolarHBondContact O-N 3.47Å; M78-D301 HydrophobicContact CE-CB 4.02Å; M78-V302 HydrophobicContact CE-CG2 3.99Å; M78-V302 HydrophobicContact SD-CG2 3.71Å
79	A	85.7	Confident	76.2	Confident	39 Å²	39	46.2 Å²	46.2	32%	0.322	24%	0.24	S	C	.	.	H	α-helix	trans	-70.2	-40.5	-179.5	0	0	0	0	0	112	L76 F77 M82 L83	L76-A79 PolarHBondContact O-N 2.93Å; F77-A79 PolarHBondContact O-N 3.03Å; A79-M82 PolarHBondContact O-N 3.32Å; A79-L83 WeakPolarHBondContact O-CB 3.25Å; A79-L83 PolarHBondContact O-N 3.44Å
80	Y	89.2	Confident	77.7	Confident	1 Å²	1	45.2 Å²	45.2	0%	0.004	24%	0.236	C	C	.	.	H	α-helix	trans	-63.9	-43.2	175.1	-176	-108.8	0	0	0	111.5	L76 F77 L83 Q84 T370 I373 A374 L377 L444 M447	L76-Y80 PolarHBondContact O-N 3.34Å; L76-Y80 VanDerWaalsContact O-N 3.09Å; F77-Y80 PolarHBondContact O-N 3.25Å; Y80-L83 PolarHBondContact O-N 3.05Å; Y80-Q84 WeakPolarHBondContact O-CB 3.27Å; Y80-Q84 PolarHBondContact O-N 3.34Å; Y80-T370 HydrophobicContact CD1-CG2 4.12Å; Y80-T370 HydrophobicContact CG-CG2 4.36Å; Y80-I373 HydrophobicContact CD1-CG2 4.31Å; Y80-I373 HydrophobicContact CE1-CB 4.11Å; Y80-I373 HydrophobicContact CE1-CG2 3.74Å; Y80-A374 HydrophobicContact CE1-CB 4.35Å; Y80-A374 WeakPolarHBondContact OH-CA 3.35Å; Y80-L377 WeakPolarHBondContact OH-CD2 3.32Å; Y80-L444 HydrophobicContact CD2-CD2 3.75Å; Y80-L444 HydrophobicContact CE2-CD2 3.41Å; Y80-L444 VanDerWaalsContact CE2-CD2 3.41Å; Y80-M447 HydrophobicContact CD2-CB 4.29Å; Y80-M447 HydrophobicContact CD2-CE 3.78Å; Y80-M447 HydrophobicContact CD2-SD 4.2Å; Y80-M447 HydrophobicContact CE2-CB 4.11Å; Y80-M447 HydrophobicContact CG-CE 4.49Å
81	G	91.4	Very high	79.6	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.1	-44.6	174.8	0	0	0	0	0	113.4	F77 M78 L83 Q84 C85	F77-G81 PolarHBondContact O-N 2.97Å; M78-G81 PolarHBondContact O-N 3.05Å; G81-L83 VanDerWaalsContact C-N 3.33Å; G81-L83 PolarHBondContact O-N 2.85Å; G81-Q84 CarbonylContact O-C 3.54Å; G81-Q84 WeakPolarHBondContact O-CB 3.24Å; G81-Q84 PolarHBondContact O-N 3.28Å; G81-Q84 VanDerWaalsContact O-N 3.14Å; G81-C85 PolarHBondContact O-N 3.09Å; G81-C85 PolarHBondContact O-SG 3.12Å; G81-C85 VanDerWaalsContact O-SG 3.34Å
82	M	91.3	Very high	81.6	Confident	44 Å²	44	39.7 Å²	39.7	22%	0.217	20%	0.2	C	C	.	.	H	α-helix	trans	-59.9	-42.7	175.2	-74.5	-73.5	-74.2	0	0	112	M78 A79 Q84 C85 L86 V302 R305 F306 C309	M78-M82 WeakPolarHBondContact O-CB 3.39Å; M78-M82 WeakPolarHBondContact O-CG 3.45Å; M78-M82 PolarHBondContact O-N 3.47Å; A79-M82 PolarHBondContact O-N 3.32Å; M82-Q84 VanDerWaalsContact C-N 3.34Å; M82-C85 PolarHBondContact O-N 3.29Å; M82-L86 PolarHBondContact O-N 3.36Å; M82-V302 VanDerWaalsContact SD-O 3.39Å; M82-R305 HydrophobicContact CE-CB 4.2Å; M82-R305 HydrophobicContact SD-CB 3.68Å; M82-F306 HydrophobicContact CE-CB 4.38Å; M82-F306 HydrophobicContact CE-CD2 4.44Å; M82-F306 HydrophobicContact SD-CB 3.79Å; M82-F306 HydrophobicContact SD-CD2 4.46Å; M82-F306 PolarHBondContact SD-N 3.32Å; M82-F306 VanDerWaalsContact SD-N 3.42Å; M82-C309 HydrophobicContact CE-CB 4.47Å
83	L	92.1	Very high	83.6	Confident	30 Å²	30	36.1 Å²	36.1	16%	0.157	17%	0.173	C	C	.	.	H	α-helix	trans	-65	-37.7	175.4	-175	63.1	0	0	0	111.6	A79 Y80 G81 L86 D87 T440 L444 M447	A79-L83 WeakPolarHBondContact O-CB 3.25Å; A79-L83 PolarHBondContact O-N 3.44Å; Y80-L83 PolarHBondContact O-N 3.05Å; G81-L83 VanDerWaalsContact C-N 3.33Å; G81-L83 PolarHBondContact O-N 2.85Å; L83-L86 PolarHBondContact O-N 3.3Å; L83-D87 WeakPolarHBondContact O-CB 3.36Å; L83-D87 PolarHBondContact O-N 2.95Å; L83-T440 HydrophobicContact CD1-CG2 3.74Å; L83-L444 HydrophobicContact CB-CD2 4.03Å; L83-L444 HydrophobicContact CD2-CD2 3.7Å; L83-L444 HydrophobicContact CD2-CG 3.75Å; L83-L444 HydrophobicContact CG-CD1 4.15Å; L83-L444 HydrophobicContact CG-CD2 3.7Å; L83-L444 HydrophobicContact CG-CG 3.72Å; L83-M447 HydrophobicContact CD2-SD 4.35Å
84	Q	91.8	Very high	86.1	Confident	2 Å²	2	29 Å²	29	1%	0.009	15%	0.146	C	C	.	.	H	α-helix	trans	-66.8	-37.4	173.7	-170.2	65.5	29.5	0	0	112.2	Y80 G81 M82 D87 H88 M397 L444	Y80-Q84 WeakPolarHBondContact O-CB 3.27Å; Y80-Q84 PolarHBondContact O-N 3.34Å; G81-Q84 CarbonylContact O-C 3.54Å; G81-Q84 WeakPolarHBondContact O-CB 3.24Å; G81-Q84 PolarHBondContact O-N 3.28Å; G81-Q84 VanDerWaalsContact O-N 3.14Å; M82-Q84 VanDerWaalsContact C-N 3.34Å; Q84-D87 PolarHBondContact O-N 3.42Å; Q84-H88 PolarHBondContact NE2-CE1 3.44Å; Q84-H88 VanDerWaalsContact NE2-CE1 3.27Å; Q84-H88 PolarHBondContact O-N 3.23Å; Q84-H88 PolarHBondContact O-ND1 3.07Å; Q84-M397 HydrophobicContact CB-CE 4.06Å; Q84-M397 HydrophobicContact CG-CE 4.02Å; Q84-L444 HydrophobicContact CB-CD2 4.36Å
85	C	93.4	Very high	88.3	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.3	-43.6	173.4	-67.9	0	0	0	0	111.8	G81 M82 D87 H88 L89 F306 L399	G81-C85 PolarHBondContact O-N 3.09Å; G81-C85 PolarHBondContact O-SG 3.12Å; G81-C85 VanDerWaalsContact O-SG 3.34Å; M82-C85 PolarHBondContact O-N 3.29Å; C85-D87 VanDerWaalsContact C-N 3.32Å; C85-D87 PolarHBondContact O-N 3.45Å; C85-H88 PolarHBondContact O-N 2.79Å; C85-L89 PolarHBondContact O-N 3.35Å; C85-L89 VanDerWaalsContact O-N 3.07Å; C85-F306 HydrophobicContact CB-CB 4.05Å; C85-F306 HydrophobicContact CB-CD1 3.8Å; C85-F306 HydrophobicContact CB-CD2 3.65Å; C85-F306 HydrophobicContact CB-CE1 4.13Å; C85-F306 HydrophobicContact CB-CE2 4Å; C85-F306 HydrophobicContact CB-CG 3.54Å; C85-F306 HydrophobicContact CB-CZ 4.22Å; C85-L399 HydrophobicContact CB-CD2 3.92Å
86	L	93.5	Very high	90.1	Very high	60 Å²	60	21 Å²	21	31%	0.314	11%	0.11	S	C	.	.	H	α-helix	trans	-59.5	-42.5	172.9	-179.8	60.8	0	0	0	111.7	M82 L83 H88 L89 L90 F306 T440	M82-L86 PolarHBondContact O-N 3.36Å; L83-L86 PolarHBondContact O-N 3.3Å; L86-H88 VanDerWaalsContact C-N 3.35Å; L86-H88 PolarHBondContact O-N 3.1Å; L86-L89 PolarHBondContact O-N 3.18Å; L86-L90 HydrophobicContact CD1-CD1 4.02Å; L86-L90 HydrophobicContact CD1-CG 4.12Å; L86-L90 HydrophobicContact CG-CD1 3.82Å; L86-L90 HydrophobicContact CG-CG 4.36Å; L86-L90 WeakPolarHBondContact O-CB 3.41Å; L86-L90 VanDerWaalsContact O-CG 3.29Å; L86-L90 WeakPolarHBondContact O-CG 3.4Å; L86-L90 PolarHBondContact O-N 3.39Å; L86-F306 HydrophobicContact CB-CE2 3.91Å; L86-F306 HydrophobicContact CB-CZ 4.49Å; L86-F306 HydrophobicContact CD1-CE2 4.45Å; L86-T440 HydrophobicContact CD2-CG2 3.91Å; L86-T440 HydrophobicContact CG-CG2 4.3Å
87	D	93	Very high	91.2	Very high	7 Å²	7	21.5 Å²	21.5	4%	0.037	12%	0.116	C	C	.	.	H	α-helix	trans	-63.5	-37.3	-178.9	-164.2	64.6	0	0	0	112.8	L83 Q84 C85 V91 K437 T440 N441 L444	L83-D87 WeakPolarHBondContact O-CB 3.36Å; L83-D87 PolarHBondContact O-N 2.95Å; Q84-D87 PolarHBondContact O-N 3.42Å; C85-D87 VanDerWaalsContact C-N 3.32Å; C85-D87 PolarHBondContact O-N 3.45Å; D87-V91 WeakPolarHBondContact O-CG2 3.48Å; D87-V91 PolarHBondContact O-N 2.85Å; D87-K437 PolarHBondContact O-NZ 2.87Å; D87-K437 IonicContact OD1-NZ 3.52Å; D87-K437 PolarHBondContact OD1-NZ 3.29Å; D87-K437 IonicContact OD2-NZ 2.7Å; D87-K437 PolarHBondContact OD2-NZ 3.45Å; D87-T440 PolarHBondContact OD1-OG1 3.26Å; D87-N441 PolarHBondContact OD1-N 2.72Å; D87-L444 HydrophobicContact CB-CD1 3.38Å; D87-L444 VanDerWaalsContact CG-CD1 3.48Å
88	H	92.2	Very high	91.5	Very high	9 Å²	9	25.2 Å²	25.2	4%	0.042	14%	0.135	C	C	.	.	H	α-helix	trans	-69.8	-43.2	171.8	-69	106.7	0	0	0	112.6	Q84 C85 L86 L90 V91 S390 S394 L399	Q84-H88 PolarHBondContact NE2-CE1 3.44Å; Q84-H88 VanDerWaalsContact NE2-CE1 3.27Å; Q84-H88 PolarHBondContact O-N 3.23Å; Q84-H88 PolarHBondContact O-ND1 3.07Å; C85-H88 PolarHBondContact O-N 2.79Å; L86-H88 VanDerWaalsContact C-N 3.35Å; L86-H88 PolarHBondContact O-N 3.1Å; H88-L90 VanDerWaalsContact C-N 3.3Å; H88-L90 PolarHBondContact O-N 3.19Å; H88-V91 WeakPolarHBondContact O-CB 3.42Å; H88-V91 PolarHBondContact O-N 3.38Å; H88-V91 VanDerWaalsContact O-N 3.16Å; H88-S390 PolarHBondContact NE2-O 2.88Å; H88-S390 VanDerWaalsContact NE2-O 3.13Å; H88-S394 PolarHBondContact NE2-N 2.91Å; H88-L399 HydrophobicContact CB-CD2 4.22Å
89	L	94.1	Very high	91.6	Very high	14 Å²	14	29.3 Å²	29.3	7%	0.073	15%	0.151	C	C	.	.	H	α-helix	trans	-59.3	-44.3	176.4	-179.9	58.4	0	0	0	111	C85 L86 V91 I92 Y93 F306 L404 S405 I408	C85-L89 PolarHBondContact O-N 3.35Å; C85-L89 VanDerWaalsContact O-N 3.07Å; L86-L89 PolarHBondContact O-N 3.18Å; L89-V91 VanDerWaalsContact C-N 3.27Å; L89-V91 PolarHBondContact O-N 3.24Å; L89-I92 PolarHBondContact O-N 3.05Å; L89-I92 VanDerWaalsContact O-N 3.1Å; L89-Y93 HydrophobicContact CD1-CD2 4.37Å; L89-Y93 HydrophobicContact CD1-CE2 3.84Å; L89-Y93 HydrophobicContact CG-CD2 4.43Å; L89-Y93 HydrophobicContact CG-CE2 4.22Å; L89-Y93 WeakPolarHBondContact O-CD2 3.41Å; L89-F306 HydrophobicContact CB-CE1 4.36Å; L89-F306 HydrophobicContact CB-CZ 3.98Å; L89-F306 HydrophobicContact CD2-CE1 4.1Å; L89-F306 HydrophobicContact CD2-CZ 3.68Å; L89-F306 HydrophobicContact CG-CZ 4.48Å; L89-L404 HydrophobicContact CD1-CD2 3.53Å; L89-L404 HydrophobicContact CD2-CD2 3.73Å; L89-L404 HydrophobicContact CG-CD2 4.23Å; L89-S405 VanDerWaalsContact CD1-OG 3.3Å; L89-S405 WeakPolarHBondContact CD1-OG 3.49Å; L89-I408 HydrophobicContact CD1-CD1 4.36Å; L89-I408 HydrophobicContact CD2-CD1 3.87Å
90	L	93.7	Very high	91.8	Very high	8 Å²	8	27.9 Å²	27.9	4%	0.042	14%	0.138	C	C	.	.	H	α-helix	trans	-64.1	-26.6	178.3	-72	169.2	0	0	0	113.2	L86 H88 I92 Y93 T94 L433 V436 K437 T440	L86-L90 HydrophobicContact CD1-CD1 4.02Å; L86-L90 HydrophobicContact CD1-CG 4.12Å; L86-L90 HydrophobicContact CG-CD1 3.82Å; L86-L90 HydrophobicContact CG-CG 4.36Å; L86-L90 WeakPolarHBondContact O-CB 3.41Å; L86-L90 VanDerWaalsContact O-CG 3.29Å; L86-L90 WeakPolarHBondContact O-CG 3.4Å; L86-L90 PolarHBondContact O-N 3.39Å; H88-L90 VanDerWaalsContact C-N 3.3Å; H88-L90 PolarHBondContact O-N 3.19Å; L90-I92 VanDerWaalsContact C-N 3.27Å; L90-I92 PolarHBondContact O-N 2.92Å; L90-Y93 PolarHBondContact O-N 2.64Å; L90-T94 WeakPolarHBondContact O-CB 3.27Å; L90-T94 WeakPolarHBondContact O-CG2 3.46Å; L90-T94 PolarHBondContact O-N 3.22Å; L90-T94 PolarHBondContact O-OG1 3.42Å; L90-L433 HydrophobicContact CD2-CB 4.48Å; L90-L433 HydrophobicContact CD2-CD2 3.8Å; L90-V436 HydrophobicContact CD1-CG1 3.81Å; L90-K437 HydrophobicContact CB-CB 4.09Å; L90-K437 HydrophobicContact CB-CD 3.72Å; L90-K437 HydrophobicContact CB-CG 4.33Å; L90-K437 HydrophobicContact CD1-CB 4.36Å; L90-T440 HydrophobicContact CD1-CG2 3.94Å
91	V	91.8	Very high	91.8	Very high	35 Å²	35	34.3 Å²	34.3	21%	0.212	17%	0.166	C	C	.	.	H	α-helix	trans	-59.8	-38	172.5	168.6	0	0	0	0	111.5	D87 H88 L89 Y93 T94 F95 L96	D87-V91 WeakPolarHBondContact O-CG2 3.48Å; D87-V91 PolarHBondContact O-N 2.85Å; H88-V91 WeakPolarHBondContact O-CB 3.42Å; H88-V91 PolarHBondContact O-N 3.38Å; H88-V91 VanDerWaalsContact O-N 3.16Å; L89-V91 VanDerWaalsContact C-N 3.27Å; L89-V91 PolarHBondContact O-N 3.24Å; V91-Y93 VanDerWaalsContact C-N 3.31Å; V91-Y93 PolarHBondContact O-N 2.98Å; V91-T94 PolarHBondContact O-N 3.33Å; V91-F95 HydrophobicContact CG1-CB 4.35Å; V91-F95 HydrophobicContact CG2-CD2 4.44Å; V91-F95 PolarHBondContact O-N 3.18Å; V91-F95 VanDerWaalsContact O-N 3.09Å; V91-L96 PolarHBondContact O-N 2.91Å
92	I	92.8	Very high	91.8	Very high	13 Å²	13	38.4 Å²	38.4	7%	0.067	19%	0.188	C	C	.	.	H	α-helix	trans	-68.3	-31.8	180	-63.4	-172.3	0	0	0	111.8	L89 L90 L96 P97 L153 P401 I402 S405	L89-I92 PolarHBondContact O-N 3.05Å; L89-I92 VanDerWaalsContact O-N 3.1Å; L90-I92 VanDerWaalsContact C-N 3.27Å; L90-I92 PolarHBondContact O-N 2.92Å; I92-L96 HydrophobicContact CG2-CD2 4.18Å; I92-P97 VanDerWaalsContact O-CD 3.25Å; I92-P97 WeakPolarHBondContact O-CD 3.19Å; I92-P97 WeakPolarHBondContact O-CG 3.3Å; I92-L153 HydrophobicContact CG2-CD1 4.27Å; I92-L153 HydrophobicContact CG2-CD2 3.57Å; I92-P401 VanDerWaalsContact CD1-C 3.46Å; I92-P401 HydrophobicContact CD1-CB 3.66Å; I92-P401 HydrophobicContact CD1-CG 3.93Å; I92-P401 WeakPolarHBondContact CD1-O 3.36Å; I92-I402 HydrophobicContact CD1-CB 4.5Å; I92-I402 HydrophobicContact CD1-CG1 3.91Å; I92-S405 WeakPolarHBondContact CG2-OG 3.45Å
93	Y	92.4	Very high	91.6	Very high	50 Å²	50	36.5 Å²	36.5	20%	0.196	18%	0.179	C	C	.	.	H	α-helix	trans	-85.9	-23.3	178.3	-73.7	-74.6	0	0	0	114.6	L89 L90 V91 S405 I408 N409 L433	L89-Y93 HydrophobicContact CD1-CD2 4.37Å; L89-Y93 HydrophobicContact CD1-CE2 3.84Å; L89-Y93 HydrophobicContact CG-CD2 4.43Å; L89-Y93 HydrophobicContact CG-CE2 4.22Å; L89-Y93 WeakPolarHBondContact O-CD2 3.41Å; L90-Y93 PolarHBondContact O-N 2.64Å; V91-Y93 VanDerWaalsContact C-N 3.31Å; V91-Y93 PolarHBondContact O-N 2.98Å; Y93-S405 PolarHBondContact OH-O 3.47Å; Y93-I408 WeakPolarHBondContact OH-CG2 3.49Å; Y93-N409 WeakPolarHBondContact CE1-OD1 3.41Å; Y93-N409 PolarHBondContact OH-OD1 2.83Å; Y93-L433 HydrophobicContact CG-CD1 4.44Å
94	T	92.3	Very high	91.3	Very high	11 Å²	11	36.2 Å²	36.2	7%	0.067	18%	0.183	C	C	.	.	H	α-helix	trans	-112.8	-64.7	-170.2	57.3	0	0	0	0	112.8	L90 V91 L98 L433 F434 K437	L90-T94 WeakPolarHBondContact O-CB 3.27Å; L90-T94 WeakPolarHBondContact O-CG2 3.46Å; L90-T94 PolarHBondContact O-N 3.22Å; L90-T94 PolarHBondContact O-OG1 3.42Å; V91-T94 PolarHBondContact O-N 3.33Å; T94-L98 WeakPolarHBondContact O-CB 3.42Å; T94-L433 HydrophobicContact CG2-CB 4.26Å; T94-F434 HydrophobicContact CG2-CB 4.3Å; T94-F434 HydrophobicContact CG2-CD2 4.42Å; T94-K437 HydrophobicContact CG2-CB 4.03Å; T94-K437 HydrophobicContact CG2-CG 4.43Å
95	F	90.7	Very high	91.2	Very high	67 Å²	67	39.8 Å²	39.8	29%	0.294	20%	0.202	S	C	.	.	H	α-helix	trans	-83	-35.7	-173.3	-71.3	-67.8	0	0	0	113.3	V91 L98 R99 F434 K437	V91-F95 HydrophobicContact CG1-CB 4.35Å; V91-F95 HydrophobicContact CG2-CD2 4.44Å; V91-F95 PolarHBondContact O-N 3.18Å; V91-F95 VanDerWaalsContact O-N 3.09Å; F95-L98 PolarHBondContact O-N 3.44Å; F95-R99 WeakPolarHBondContact O-CB 3.27Å; F95-R99 VanDerWaalsContact O-CG 3.27Å; F95-R99 WeakPolarHBondContact O-CG 3.5Å; F95-R99 PolarHBondContact O-N 3Å; F95-F434 HydrophobicContact CE1-CE2 4.14Å; F95-F434 HydrophobicContact CZ-CE2 4.16Å; F95-K437 HydrophobicContact CD2-CG 4.27Å; F95-K437 HydrophobicContact CE2-CD 4.32Å; F95-K437 HydrophobicContact CE2-CG 3.75Å
96	L	90.5	Very high	90.8	Very high	11 Å²	11	42.5 Å²	42.5	6%	0.058	22%	0.217	C	C	.	.	H	α-helix	trans	-61.7	-50.1	179.7	-177.1	67.4	0	0	0	112.2	V91 I92 L98 R99 C100 D146 K149 F150 L153	V91-L96 PolarHBondContact O-N 2.91Å; I92-L96 HydrophobicContact CG2-CD2 4.18Å; L96-L98 VanDerWaalsContact C-N 3.34Å; L96-L98 PolarHBondContact O-N 2.94Å; L96-R99 PolarHBondContact O-N 3.34Å; L96-C100 PolarHBondContact O-N 3.5Å; L96-C100 PolarHBondContact O-SG 3.39Å; L96-D146 HydrophobicContact CD1-CB 4.18Å; L96-D146 WeakPolarHBondContact CD1-O 3.5Å; L96-K149 HydrophobicContact CD1-CB 4.21Å; L96-K149 HydrophobicContact CD2-CB 4.44Å; L96-F150 HydrophobicContact CD1-CB 4.47Å; L96-F150 HydrophobicContact CD2-CB 4.41Å; L96-F150 HydrophobicContact CG-CB 4.3Å; L96-F150 HydrophobicContact CG-CD2 4.39Å; L96-L153 HydrophobicContact CD2-CD2 4.07Å
97	P	91.6	Very high	90.4	Very high	45 Å²	45	41.9 Å²	41.9	29%	0.292	21%	0.213	S	C	.	.	H	α-helix	trans	-67.6	-36.3	-179.7	-18.1	34.2	0	0	0	111.5	I92 C100 F101 F150	I92-P97 VanDerWaalsContact O-CD 3.25Å; I92-P97 WeakPolarHBondContact O-CD 3.19Å; I92-P97 WeakPolarHBondContact O-CG 3.3Å; P97-C100 PolarHBondContact O-N 2.93Å; P97-F101 WeakPolarHBondContact O-CB 3.38Å; P97-F101 PolarHBondContact O-N 3.26Å; P97-F150 HydrophobicContact CB-CE2 4.18Å; P97-F150 HydrophobicContact CG-CE2 4.41Å
98	L	90.3	Very high	90.1	Very high	80 Å²	80	47 Å²	47	42%	0.419	24%	0.238	S	C	.	.	H	α-helix	trans	-62.8	-44.8	175.9	179	61.2	0	0	0	112.1	T94 F95 L96 F101 L102	T94-L98 WeakPolarHBondContact O-CB 3.42Å; F95-L98 PolarHBondContact O-N 3.44Å; L96-L98 VanDerWaalsContact C-N 3.34Å; L96-L98 PolarHBondContact O-N 2.94Å; L98-F101 PolarHBondContact O-N 3.12Å; L98-L102 HydrophobicContact CD1-CD1 4.4Å; L98-L102 HydrophobicContact CG-CD1 4.33Å; L98-L102 VanDerWaalsContact O-CG 3.32Å; L98-L102 WeakPolarHBondContact O-CG 3.44Å; L98-L102 PolarHBondContact O-N 3.04Å
99	R	90.2	Very high	89.7	Confident	90 Å²	90	51.5 Å²	51.5	34%	0.34	26%	0.262	S	S	.	.	H	α-helix	trans	-65.5	-40.8	175.5	-72.3	178.7	-165.4	169.6	5.8	111.9	F95 L96 L102 A103 D146	F95-R99 WeakPolarHBondContact O-CB 3.27Å; F95-R99 VanDerWaalsContact O-CG 3.27Å; F95-R99 WeakPolarHBondContact O-CG 3.5Å; F95-R99 PolarHBondContact O-N 3Å; L96-R99 PolarHBondContact O-N 3.34Å; R99-L102 PolarHBondContact O-N 3.41Å; R99-A103 WeakPolarHBondContact O-CB 3.42Å; R99-A103 PolarHBondContact O-N 3.32Å; R99-D146 WeakPolarHBondContact CD-OD2 3.37Å; R99-D146 IonicContact CZ-OD2 3.55Å; R99-D146 IonicContact NE-OD2 2.71Å; R99-D146 IonicContact NH1-OD2 2.77Å; R99-D146 PolarHBondContact NH1-OD2 3.35Å
100	C	89.1	Confident	89.1	Confident	8 Å²	8	55.7 Å²	55.7	5%	0.054	28%	0.277	C	S	.	.	H	α-helix	trans	-67.2	-36	176.8	-65.4	0	0	0	0	112.3	L96 P97 G104 D146 L147 F150	L96-C100 PolarHBondContact O-N 3.5Å; L96-C100 PolarHBondContact O-SG 3.39Å; P97-C100 PolarHBondContact O-N 2.93Å; C100-G104 PolarHBondContact O-N 2.86Å; C100-D146 PolarHBondContact SG-O 3.13Å; C100-D146 VanDerWaalsContact SG-O 3.36Å; C100-L147 HydrophobicContact CB-CD2 3.94Å; C100-F150 HydrophobicContact CB-CB 4.32Å; C100-F150 HydrophobicContact CB-CD1 4.1Å; C100-F150 HydrophobicContact CB-CD2 4.47Å; C100-F150 HydrophobicContact CB-CG 4.05Å; C100-F150 WeakPolarHBondContact SG-CB 3.31Å
101	F	90.4	Very high	88.6	Confident	137 Å²	137	58.6 Å²	58.6	60%	0.601	29%	0.292	S	S	*	.	H	α-helix	trans	-63.3	-45.8	171.2	177.6	-101	0	0	0	111.8	P97 L98 G104 L105	P97-F101 WeakPolarHBondContact O-CB 3.38Å; P97-F101 PolarHBondContact O-N 3.26Å; L98-F101 PolarHBondContact O-N 3.12Å; F101-G104 PolarHBondContact O-N 3.37Å; F101-L105 HydrophobicContact CE1-CD1 4.33Å; F101-L105 HydrophobicContact CZ-CD1 4.48Å; F101-L105 WeakPolarHBondContact O-CB 3.39Å; F101-L105 PolarHBondContact O-N 3.28Å
102	L	90.1	Very high	88.1	Confident	86 Å²	86	60 Å²	60	45%	0.45	30%	0.303	S	S	.	.	H	α-helix	trans	-64.8	-41	176.1	-70.2	170	0	0	0	112.4	L98 R99 L105 N106	L98-L102 HydrophobicContact CD1-CD1 4.4Å; L98-L102 HydrophobicContact CG-CD1 4.33Å; L98-L102 VanDerWaalsContact O-CG 3.32Å; L98-L102 WeakPolarHBondContact O-CG 3.44Å; L98-L102 PolarHBondContact O-N 3.04Å; R99-L102 PolarHBondContact O-N 3.41Å; L102-L105 PolarHBondContact O-N 3.08Å; L102-N106 WeakPolarHBondContact O-CB 3.5Å; L102-N106 VanDerWaalsContact O-CG 3.26Å; L102-N106 PolarHBondContact O-N 2.89Å
103	A	87.6	Confident	87.5	Confident	4 Å²	4	61.8 Å²	61.8	3%	0.033	32%	0.317	C	S	.	.	H	α-helix	trans	-63.9	-39.6	173.7	0	0	0	0	0	111.8	R99 N106 L107 E143 L147	R99-A103 WeakPolarHBondContact O-CB 3.42Å; R99-A103 PolarHBondContact O-N 3.32Å; A103-N106 PolarHBondContact O-N 2.92Å; A103-L107 WeakPolarHBondContact O-CB 3.34Å; A103-L107 PolarHBondContact O-N 3.4Å; A103-E143 HydrophobicContact CB-CB 4.02Å; A103-E143 HydrophobicContact CB-CG 4.23Å; A103-L147 HydrophobicContact CB-CD1 4.07Å; A103-L147 HydrophobicContact CB-CD2 4.41Å; A103-L147 HydrophobicContact CB-CG 4.18Å
104	G	87	Confident	86.7	Confident	24 Å²	24	61.2 Å²	61.2	25%	0.247	33%	0.326	C	S	.	.	H	α-helix	trans	-64.7	-39.1	173.2	0	0	0	0	0	113.1	C100 F101 L107 M108	C100-G104 PolarHBondContact O-N 2.86Å; F101-G104 PolarHBondContact O-N 3.37Å; G104-L107 WeakPolarHBondContact O-CB 3.38Å; G104-L107 PolarHBondContact O-N 3.19Å; G104-M108 VanDerWaalsContact O-CG 3.3Å; G104-M108 WeakPolarHBondContact O-CG 3.4Å; G104-M108 PolarHBondContact O-N 2.95Å
105	L	88.3	Confident	86.1	Confident	76 Å²	76	65 Å²	65	40%	0.398	35%	0.345	S	S	.	.	H	α-helix	trans	-67.7	-44.5	174.6	-172.2	152.6	0	0	0	111.2	F101 L102 L107 M108 L109	F101-L105 HydrophobicContact CE1-CD1 4.33Å; F101-L105 HydrophobicContact CZ-CD1 4.48Å; F101-L105 WeakPolarHBondContact O-CB 3.39Å; F101-L105 PolarHBondContact O-N 3.28Å; L102-L105 PolarHBondContact O-N 3.08Å; L105-L107 VanDerWaalsContact C-N 3.34Å; L105-L107 PolarHBondContact O-N 3.45Å; L105-M108 PolarHBondContact O-N 3Å; L105-L109 HydrophobicContact CD2-CD1 3.59Å; L105-L109 HydrophobicContact CD2-CG 4.12Å; L105-L109 WeakPolarHBondContact O-CG 3.24Å; L105-L109 PolarHBondContact O-N 3.42Å
106	N	86.3	Confident	85.6	Confident	58 Å²	58	68.4 Å²	68.4	31%	0.31	36%	0.36	S	S	.	.	H	α-helix	trans	-57.9	-45.3	172.6	-75.1	-14	0	0	0	111.5	L102 A103 L109 R110 E143	L102-N106 WeakPolarHBondContact O-CB 3.5Å; L102-N106 VanDerWaalsContact O-CG 3.26Å; L102-N106 PolarHBondContact O-N 2.89Å; A103-N106 PolarHBondContact O-N 2.92Å; N106-L109 PolarHBondContact O-N 3.31Å; N106-R110 WeakPolarHBondContact O-CB 3.46Å; N106-R110 WeakPolarHBondContact O-CD 3.38Å; N106-R110 WeakPolarHBondContact O-CG 3.37Å; N106-R110 PolarHBondContact O-N 3.48Å; N106-E143 PolarHBondContact ND2-OE1 2.88Å
107	L	85.1	Confident	84.8	Confident	46 Å²	46	72.3 Å²	72.3	24%	0.241	38%	0.378	C	S	.	.	H	α-helix	trans	-57.8	-49.1	174.9	169	60	0	0	0	111.4	A103 G104 L105 R110 I111 L138 L139	A103-L107 WeakPolarHBondContact O-CB 3.34Å; A103-L107 PolarHBondContact O-N 3.4Å; G104-L107 WeakPolarHBondContact O-CB 3.38Å; G104-L107 PolarHBondContact O-N 3.19Å; L105-L107 VanDerWaalsContact C-N 3.34Å; L105-L107 PolarHBondContact O-N 3.45Å; L107-R110 PolarHBondContact O-N 3.2Å; L107-I111 HydrophobicContact CD1-CD1 3.6Å; L107-I111 HydrophobicContact CD1-CG1 4.19Å; L107-I111 HydrophobicContact CG-CD1 4.01Å; L107-I111 WeakPolarHBondContact O-CG1 3.12Å; L107-I111 PolarHBondContact O-N 2.99Å; L107-L138 HydrophobicContact CD1-CD2 3.3Å; L107-L139 HydrophobicContact CD1-CD1 4.33Å
108	M	85.7	Confident	83.9	Confident	115 Å²	115	76.5 Å²	76.5	57%	0.567	39%	0.392	S	S	*	.	H	α-helix	trans	-64.3	-41.4	178.2	-71.7	-65.5	130	0	0	112.8	G104 L105 R110 I111 S112	G104-M108 VanDerWaalsContact O-CG 3.3Å; G104-M108 WeakPolarHBondContact O-CG 3.4Å; G104-M108 PolarHBondContact O-N 2.95Å; L105-M108 PolarHBondContact O-N 3Å; M108-R110 VanDerWaalsContact C-N 3.35Å; M108-I111 HydrophobicContact CE-CD1 4.17Å; M108-I111 PolarHBondContact O-N 3.1Å; M108-S112 WeakPolarHBondContact O-CB 3.34Å; M108-S112 PolarHBondContact O-N 3.39Å; M108-S112 PolarHBondContact O-OG 2.97Å
109	L	84.8	Confident	83.2	Confident	104 Å²	104	79.3 Å²	79.3	55%	0.545	40%	0.401	S	S	.	.	H	α-helix	trans	-66.8	-33.7	175.4	-70.3	-177.8	0	0	0	112.8	L105 N106 S112 S113	L105-L109 HydrophobicContact CD2-CD1 3.59Å; L105-L109 HydrophobicContact CD2-CG 4.12Å; L105-L109 WeakPolarHBondContact O-CG 3.24Å; L105-L109 PolarHBondContact O-N 3.42Å; N106-L109 PolarHBondContact O-N 3.31Å; L109-S112 PolarHBondContact O-OG 2.72Å; L109-S113 WeakPolarHBondContact O-CB 3.22Å; L109-S113 PolarHBondContact O-N 2.9Å
110	R	80	Confident	82.1	Confident	101 Å²	101	77.9 Å²	77.9	38%	0.381	40%	0.402	S	S	.	.	H	α-helix	trans	-70.7	-40.2	174.2	-72.3	168.3	-171.8	-89.9	9	111.7	N106 L107 M108 G114 L138	N106-R110 WeakPolarHBondContact O-CB 3.46Å; N106-R110 WeakPolarHBondContact O-CD 3.38Å; N106-R110 WeakPolarHBondContact O-CG 3.37Å; N106-R110 PolarHBondContact O-N 3.48Å; L107-R110 PolarHBondContact O-N 3.2Å; M108-R110 VanDerWaalsContact C-N 3.35Å; R110-G114 PolarHBondContact O-N 3.36Å; R110-L138 WeakPolarHBondContact CD-O 3.31Å
111	I	83	Confident	80.8	Confident	69 Å²	69	81.6 Å²	81.6	35%	0.354	43%	0.428	S	S	.	.	H	α-helix	trans	-65.1	-48.4	174.8	-70.4	166.3	0	0	0	110.5	L107 M108 S113 G114 I115	L107-I111 HydrophobicContact CD1-CD1 3.6Å; L107-I111 HydrophobicContact CD1-CG1 4.19Å; L107-I111 HydrophobicContact CG-CD1 4.01Å; L107-I111 WeakPolarHBondContact O-CG1 3.12Å; L107-I111 PolarHBondContact O-N 2.99Å; M108-I111 HydrophobicContact CE-CD1 4.17Å; M108-I111 PolarHBondContact O-N 3.1Å; I111-S113 PolarHBondContact O-N 2.91Å; I111-G114 PolarHBondContact O-N 3.14Å; I111-I115 HydrophobicContact CG2-CD1 3.76Å; I111-I115 WeakPolarHBondContact O-CG1 3.45Å; I111-I115 PolarHBondContact O-N 3.48Å
112	S	82.4	Confident	79.5	Confident	64 Å²	64	82.3 Å²	82.3	45%	0.448	43%	0.432	S	S	.	.	H	α-helix	trans	-66.2	-38.5	179.8	67.5	0	0	0	0	112.4	M108 L109 I115 F116	M108-S112 WeakPolarHBondContact O-CB 3.34Å; M108-S112 PolarHBondContact O-N 3.39Å; M108-S112 PolarHBondContact O-OG 2.97Å; L109-S112 PolarHBondContact O-OG 2.72Å; S112-I115 PolarHBondContact O-N 2.95Å; S112-F116 VanDerWaalsContact O-CB 3.28Å; S112-F116 WeakPolarHBondContact O-CB 3.14Å; S112-F116 PolarHBondContact O-N 3.01Å
113	S	79.5	Confident	78	Confident	52 Å²	52	85.6 Å²	85.6	36%	0.364	45%	0.449	S	S	.	.	H	α-helix	trans	-65.5	-38.2	172.1	-173.7	0	0	0	0	112.3	L109 I111 F116 Q117	L109-S113 WeakPolarHBondContact O-CB 3.22Å; L109-S113 PolarHBondContact O-N 2.9Å; I111-S113 PolarHBondContact O-N 2.91Å; S113-F116 PolarHBondContact O-N 3.5Å; S113-Q117 WeakPolarHBondContact O-CB 3.34Å; S113-Q117 VanDerWaalsContact O-CG 3.31Å; S113-Q117 WeakPolarHBondContact O-CG 3.44Å; S113-Q117 PolarHBondContact O-N 2.87Å
114	G	75.4	Confident	76.3	Confident	38 Å²	38	92.8 Å²	92.8	39%	0.392	48%	0.482	S	S	.	.	H	α-helix	trans	-64.4	-43.5	173.9	0	0	0	0	0	113	R110 I111 Q117 F118	R110-G114 PolarHBondContact O-N 3.36Å; I111-G114 PolarHBondContact O-N 3.14Å; G114-Q117 PolarHBondContact O-N 3.19Å; G114-F118 WeakPolarHBondContact O-CB 3.25Å; G114-F118 PolarHBondContact O-N 2.96Å
115	I	80.7	Confident	74.2	Confident	89 Å²	89	102 Å²	102	46%	0.456	51%	0.511	S	S	.	.	H	α-helix	trans	-64.2	-44.4	174.1	-68.5	166.3	0	0	0	110.6	I111 S112 F118 F119	I111-I115 HydrophobicContact CG2-CD1 3.76Å; I111-I115 WeakPolarHBondContact O-CG1 3.45Å; I111-I115 PolarHBondContact O-N 3.48Å; S112-I115 PolarHBondContact O-N 2.95Å; I115-F118 WeakPolarHBondContact O-CB 3.41Å; I115-F118 PolarHBondContact O-N 3.26Å; I115-F119 HydrophobicContact CG2-CD2 3.78Å; I115-F119 HydrophobicContact CG2-CE2 3.68Å; I115-F119 VanDerWaalsContact O-CD2 3.27Å; I115-F119 WeakPolarHBondContact O-CD2 3.28Å; I115-F119 PolarHBondContact O-N 3.38Å
116	F	80.2	Confident	71.9	Confident	140 Å²	140	106.4 Å²	106.4	61%	0.614	53%	0.529	S	S	*	.	H	α-helix	trans	-61.7	-45.2	176	-177.1	-97.6	0	0	0	111.7	S112 S113 F118 F119 T120	S112-F116 VanDerWaalsContact O-CB 3.28Å; S112-F116 WeakPolarHBondContact O-CB 3.14Å; S112-F116 PolarHBondContact O-N 3.01Å; S113-F116 PolarHBondContact O-N 3.5Å; F116-F118 VanDerWaalsContact C-N 3.35Å; F116-F118 PolarHBondContact O-N 2.92Å; F116-F119 PolarHBondContact O-N 2.93Å; F116-T120 HydrophobicContact CD1-CG2 4.2Å; F116-T120 HydrophobicContact CE1-CG2 3.79Å; F116-T120 HydrophobicContact CE2-CG2 4.49Å; F116-T120 HydrophobicContact CZ-CG2 3.95Å; F116-T120 PolarHBondContact O-N 3.03Å; F116-T120 PolarHBondContact O-OG1 3.48Å
117	Q	72.9	Confident	69.8	Low	92 Å²	92	109.3 Å²	109.3	43%	0.43	55%	0.545	S	S	.	.	H	α-helix	trans	-59.9	-43.8	174.7	-77.5	179.2	27.4	0	0	111.7	S113 G114 F119 T120 S121	S113-Q117 WeakPolarHBondContact O-CB 3.34Å; S113-Q117 VanDerWaalsContact O-CG 3.31Å; S113-Q117 WeakPolarHBondContact O-CG 3.44Å; S113-Q117 PolarHBondContact O-N 2.87Å; G114-Q117 PolarHBondContact O-N 3.19Å; Q117-F119 PolarHBondContact O-N 3.45Å; Q117-T120 WeakPolarHBondContact CA-OG1 3.47Å; Q117-T120 PolarHBondContact O-N 2.85Å; Q117-T120 PolarHBondContact O-OG1 2.71Å; Q117-S121 WeakPolarHBondContact O-CB 3.32Å; Q117-S121 PolarHBondContact O-N 3.06Å; Q117-S121 PolarHBondContact O-OG 2.86Å
118	F	73.2	Confident	67.6	Low	134 Å²	134	113.7 Å²	113.7	59%	0.588	57%	0.574	S	S	*	*	H	α-helix	trans	-57.8	-46.4	175.1	-174.8	-111.2	0	0	0	111.9	G114 I115 F116 S121 F122	G114-F118 WeakPolarHBondContact O-CB 3.25Å; G114-F118 PolarHBondContact O-N 2.96Å; I115-F118 WeakPolarHBondContact O-CB 3.41Å; I115-F118 PolarHBondContact O-N 3.26Å; F116-F118 VanDerWaalsContact C-N 3.35Å; F116-F118 PolarHBondContact O-N 2.92Å; F118-S121 PolarHBondContact O-N 2.81Å; F118-F122 HydrophobicContact CD1-CE2 4.19Å; F118-F122 HydrophobicContact CE1-CD2 4.48Å; F118-F122 AromaticContact CE1-CE2 3.7Å; F118-F122 HydrophobicContact CE1-CE2 3.7Å; F118-F122 HydrophobicContact CE2-CE2 4.09Å; F118-F122 AromaticContact CZ-CE2 3.65Å; F118-F122 HydrophobicContact CZ-CE2 3.65Å; F118-F122 HydrophobicContact CZ-CZ 4.28Å; F118-F122 WeakPolarHBondContact O-CD2 3.37Å; F118-F122 PolarHBondContact O-N 3.02Å
119	F	74.5	Confident	65.8	Low	138 Å²	138	113.2 Å²	113.2	61%	0.605	58%	0.579	S	S	*	*	H	α-helix	trans	-63.9	-40.1	173.6	-82	-67.1	0	0	0	113.3	I115 F116 Q117	I115-F119 HydrophobicContact CG2-CD2 3.78Å; I115-F119 HydrophobicContact CG2-CE2 3.68Å; I115-F119 VanDerWaalsContact O-CD2 3.27Å; I115-F119 WeakPolarHBondContact O-CD2 3.28Å; I115-F119 PolarHBondContact O-N 3.38Å; F116-F119 PolarHBondContact O-N 2.93Å; Q117-F119 PolarHBondContact O-N 3.45Å
120	T	68.3	Low	63.6	Low	61 Å²	61	113.3 Å²	113.3	37%	0.374	59%	0.588	S	S	.	*	H	α-helix	trans	-69.4	-36.3	176.7	55.1	0	0	0	0	112.9	F116 Q117 F122 N123 Q124	F116-T120 HydrophobicContact CD1-CG2 4.2Å; F116-T120 HydrophobicContact CE1-CG2 3.79Å; F116-T120 HydrophobicContact CE2-CG2 4.49Å; F116-T120 HydrophobicContact CZ-CG2 3.95Å; F116-T120 PolarHBondContact O-N 3.03Å; F116-T120 PolarHBondContact O-OG1 3.48Å; Q117-T120 WeakPolarHBondContact CA-OG1 3.47Å; Q117-T120 PolarHBondContact O-N 2.85Å; Q117-T120 PolarHBondContact O-OG1 2.71Å; T120-F122 VanDerWaalsContact C-N 3.28Å; T120-F122 PolarHBondContact O-N 3.16Å; T120-N123 PolarHBondContact O-N 2.89Å; T120-Q124 PolarHBondContact O-N 2.88Å
121	S	60.9	Low	61.8	Low	86 Å²	86	111.9 Å²	111.9	60%	0.601	59%	0.594	S	S	*	*	H	α-helix	trans	-68.4	-24	179.2	-72.3	0	0	0	0	113.3	Q117 F118 N123 Q124	Q117-S121 WeakPolarHBondContact O-CB 3.32Å; Q117-S121 PolarHBondContact O-N 3.06Å; Q117-S121 PolarHBondContact O-OG 2.86Å; F118-S121 PolarHBondContact O-N 2.81Å; S121-N123 PolarHBondContact O-N 2.93Å; S121-Q124 PolarHBondContact O-N 2.73Å
122	F	63.6	Low	59.7	Low	152 Å²	152	117 Å²	117	67%	0.667	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-25.3	169.6	-92.9	-70.3	0	0	0	113.4	F118 T120	F118-F122 HydrophobicContact CD1-CE2 4.19Å; F118-F122 HydrophobicContact CE1-CD2 4.48Å; F118-F122 AromaticContact CE1-CE2 3.7Å; F118-F122 HydrophobicContact CE1-CE2 3.7Å; F118-F122 HydrophobicContact CE2-CE2 4.09Å; F118-F122 AromaticContact CZ-CE2 3.65Å; F118-F122 HydrophobicContact CZ-CE2 3.65Å; F118-F122 HydrophobicContact CZ-CZ 4.28Å; F118-F122 WeakPolarHBondContact O-CD2 3.37Å; F118-F122 PolarHBondContact O-N 3.02Å; T120-F122 VanDerWaalsContact C-N 3.28Å; T120-F122 PolarHBondContact O-N 3.16Å
123	N	57.8	Low	57.9	Low	154 Å²	154	118.7 Å²	118.7	82%	0.824	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-8.9	-179.6	-80.4	-17.2	0	0	0	114.4	T120 S121	T120-N123 PolarHBondContact O-N 2.89Å; S121-N123 PolarHBondContact O-N 2.93Å
124	Q	51.8	Low	56.2	Low	155 Å²	155	120 Å²	120	72%	0.724	63%	0.631	S	S	*	*			trans	-122.7	84.1	-175.2	-166.1	167.1	3.3	0	0	112.5	T120 S121 H126	T120-Q124 PolarHBondContact O-N 2.88Å; S121-Q124 PolarHBondContact O-N 2.73Å; Q124-H126 PolarHBondContact O-N 3.45Å; Q124-H126 VanDerWaalsContact O-N 3.13Å
125	Y	43.4	Very low	54.5	Low	218 Å²	218	125.9 Å²	125.9	86%	0.855	64%	0.641	S	S	*	*			trans	-74.8	91.1	170.7	-171.3	-85.9	0	0	0	110.3
126	H	41.1	Very low	52.8	Low	168 Å²	168	128.8 Å²	128.8	78%	0.778	66%	0.657	S	S	*	*			trans	-155.3	142.4	160.4	-139.4	-81	0	0	0	112.1	Q124	Q124-H126 PolarHBondContact O-N 3.45Å; Q124-H126 VanDerWaalsContact O-N 3.13Å
127	D	40.8	Very low	51.4	Low	120 Å²	120	125.7 Å²	125.7	64%	0.642	65%	0.65	S	S	*	*			trans	-76.3	140.5	-168.9	-75	-74.5	0	0	0	115.6
128	T	40.1	Very low	50.6	Low	138 Å²	138	124.1 Å²	124.1	85%	0.847	64%	0.644	S	S	*	*			trans	-170.1	103.9	130.4	14.6	0	0	0	0	110.7	S130	T128-S130 PolarHBondContact O-N 3.22Å
129	P	46.7	Very low	50.2	Low	105 Å²	105	119.2 Å²	119.2	68%	0.682	62%	0.624	S	S	*	*			trans	-91.4	82.6	-176.7	34.7	-34.2	0	0	0	113
130	S	39.1	Very low	50.4	Low	105 Å²	105	118.7 Å²	118.7	73%	0.734	62%	0.619	S	S	*	*			trans	-145.9	144.2	163.8	-168.6	0	0	0	0	111.5	T128	T128-S130 PolarHBondContact O-N 3.22Å
131	S	42.5	Very low	51.1	Low	72 Å²	72	117.6 Å²	117.6	50%	0.503	61%	0.61	S	S	.	*			trans	70.9	42.6	-170.4	79.3	0	0	0	0	117.3	R135	S131-R135 PolarHBondContact O-NE 2.82Å; S131-R135 PolarHBondContact O-NH2 3.42Å; S131-R135 VanDerWaalsContact O-NH2 3.07Å
132	K	38.4	Very low	52.1	Low	176 Å²	176	119.7 Å²	119.7	77%	0.765	61%	0.606	S	S	*	*			trans	-78.8	-13.6	169.3	-80.4	-172.6	173.6	179.9	0	114.9
133	T	45.3	Very low	53.2	Low	100 Å²	100	113 Å²	113	61%	0.613	58%	0.576	S	S	*	*	S	Bend	trans	-102.9	-27.4	-166	-32	0	0	0	0	115.8	R135 L222	T133-R135 PolarHBondContact O-N 2.88Å; T133-L222 HydrophobicContact CG2-CD1 3.73Å
134	S	42.9	Very low	54.5	Low	80 Å²	80	106.8 Å²	106.8	56%	0.559	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-75.2	-21.5	-176	54.8	0	0	0	0	114.4	L136 T137	S134-L136 VanDerWaalsContact C-N 3.34Å; S134-L136 PolarHBondContact O-N 3.49Å; S134-T137 PolarHBondContact O-N 3.29Å; S134-T137 PolarHBondContact O-OG1 3.45Å
135	R	40.2	Very low	56.2	Low	160 Å²	160	100 Å²	100	60%	0.604	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-75.5	-12	-172	-79.4	-178	-92.1	-177	-10.7	115.3	S131 T133 T137	S131-R135 PolarHBondContact O-NE 2.82Å; S131-R135 PolarHBondContact O-NH2 3.42Å; S131-R135 VanDerWaalsContact O-NH2 3.07Å; T133-R135 PolarHBondContact O-N 2.88Å; R135-T137 PolarHBondContact O-N 2.88Å
136	L	44.4	Very low	58.5	Low	151 Å²	151	89.9 Å²	89.9	79%	0.791	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-83	6.4	173.2	-149.6	75.6	0	0	0	113.5	S134 L138	S134-L136 VanDerWaalsContact C-N 3.34Å; S134-L136 PolarHBondContact O-N 3.49Å; L136-L138 PolarHBondContact O-N 3.29Å
137	T	52.2	Low	60.8	Low	74 Å²	74	84.1 Å²	84.1	45%	0.454	45%	0.446	S	S	.	.			trans	-74.7	66.4	165.7	-38.7	0	0	0	0	109.1	S134 R135 L139	S134-T137 PolarHBondContact O-N 3.29Å; S134-T137 PolarHBondContact O-OG1 3.45Å; R135-T137 PolarHBondContact O-N 2.88Å; T137-L139 PolarHBondContact O-N 2.96Å
138	L	56.2	Low	63.3	Low	59 Å²	59	79.4 Å²	79.4	31%	0.309	42%	0.421	S	S	.	.			trans	-74.3	-24.8	-155.5	-162.5	148.1	0	0	0	113.6	L107 R110 L136	L107-L138 HydrophobicContact CD1-CD2 3.3Å; R110-L138 WeakPolarHBondContact CD-O 3.31Å; L136-L138 PolarHBondContact O-N 3.29Å
139	L	64.9	Low	65.9	Low	31 Å²	31	73.9 Å²	73.9	16%	0.162	39%	0.385	C	S	.	.	S	Bend	trans	-126.6	151.3	168.2	-62.2	92	0	0	0	109.5	L107 T137 E143 L147	L107-L139 HydrophobicContact CD1-CD1 4.33Å; T137-L139 PolarHBondContact O-N 2.96Å; L139-E143 WeakPolarHBondContact CA-OE2 3.35Å; L139-E143 HydrophobicContact CB-CB 4.23Å; L139-E143 HydrophobicContact CD2-CB 4.21Å; L139-L147 HydrophobicContact CD2-CD1 3.44Å; L139-L147 VanDerWaalsContact CD2-CD1 3.44Å
140	Y	77.5	Confident	68.1	Low	128 Å²	128	72 Å²	72	50%	0.502	37%	0.367	S	S	.	.			trans	-71.5	151.8	169.3	-65	-77.1	0	0	0	111.1	Y142 E143 L144	Y140-Y142 HydrophobicContact CD1-CE1 4.3Å; Y140-Y142 AromaticContact CD2-CE1 3.85Å; Y140-Y142 HydrophobicContact CD2-CE1 3.85Å; Y140-Y142 AromaticContact CD2-CZ 3.88Å; Y140-Y142 WeakPolarHBondContact CD2-OH 3.44Å; Y140-Y142 HydrophobicContact CG-CD1 4.33Å; Y140-Y142 AromaticContact CG-CE1 3.57Å; Y140-Y142 HydrophobicContact CG-CE1 3.57Å; Y140-Y142 PolarHBondContact O-N 3.37Å; Y140-Y142 VanDerWaalsContact O-N 3.12Å; Y140-E143 WeakPolarHBondContact CD2-OE2 3.34Å; Y140-E143 PolarHBondContact N-OE2 3.41Å; Y140-E143 WeakPolarHBondContact O-CB 3.41Å; Y140-E143 PolarHBondContact O-N 2.82Å; Y140-L144 PolarHBondContact O-N 3.2Å; Y140-L144 VanDerWaalsContact O-N 3.11Å
141	N	83.1	Confident	70.8	Confident	37 Å²	37	69 Å²	69	20%	0.198	35%	0.346	C	S	.	.	H	α-helix	trans	-55.8	-33.1	-179.1	-73.5	12.6	0	0	0	113.1	L144 R145 I209 S210 K211 R213	N141-L144 PolarHBondContact O-N 3.24Å; N141-R145 WeakPolarHBondContact O-CB 3.42Å; N141-R145 PolarHBondContact O-N 3.46Å; N141-I209 PolarHBondContact ND2-O 3.03Å; N141-S210 PolarHBondContact ND2-O 3.37Å; N141-K211 PolarHBondContact ND2-O 3.46Å; N141-K211 VanDerWaalsContact ND2-O 3.15Å; N141-R213 PolarHBondContact OD1-NH1 3.22Å
142	Y	82.2	Confident	73.3	Confident	131 Å²	131	65.7 Å²	65.7	51%	0.514	32%	0.322	S	S	.	.	H	α-helix	trans	-70.6	-34.5	176.1	70.4	-96.7	0	0	0	113.2	Y140 D146	Y140-Y142 HydrophobicContact CD1-CE1 4.3Å; Y140-Y142 AromaticContact CD2-CE1 3.85Å; Y140-Y142 HydrophobicContact CD2-CE1 3.85Å; Y140-Y142 AromaticContact CD2-CZ 3.88Å; Y140-Y142 WeakPolarHBondContact CD2-OH 3.44Å; Y140-Y142 HydrophobicContact CG-CD1 4.33Å; Y140-Y142 AromaticContact CG-CE1 3.57Å; Y140-Y142 HydrophobicContact CG-CE1 3.57Å; Y140-Y142 PolarHBondContact O-N 3.37Å; Y140-Y142 VanDerWaalsContact O-N 3.12Å; Y142-D146 PolarHBondContact O-N 3.44Å
143	E	85.8	Confident	76.1	Confident	10 Å²	10	57.7 Å²	57.7	5%	0.047	29%	0.288	C	S	.	.	H	α-helix	trans	-67	-42.6	174.4	-63.5	177	126.9	0	0	109.9	A103 N106 L139 Y140 L147	A103-E143 HydrophobicContact CB-CB 4.02Å; A103-E143 HydrophobicContact CB-CG 4.23Å; N106-E143 PolarHBondContact ND2-OE1 2.88Å; L139-E143 WeakPolarHBondContact CA-OE2 3.35Å; L139-E143 HydrophobicContact CB-CB 4.23Å; L139-E143 HydrophobicContact CD2-CB 4.21Å; Y140-E143 WeakPolarHBondContact CD2-OE2 3.34Å; Y140-E143 PolarHBondContact N-OE2 3.41Å; Y140-E143 WeakPolarHBondContact O-CB 3.41Å; Y140-E143 PolarHBondContact O-N 2.82Å; E143-L147 WeakPolarHBondContact O-CB 3.01Å; E143-L147 VanDerWaalsContact O-CG 3.25Å; E143-L147 WeakPolarHBondContact O-CG 3.45Å; E143-L147 PolarHBondContact O-N 3.41Å
144	L	85.8	Confident	78.5	Confident	24 Å²	24	55.2 Å²	55.2	13%	0.126	27%	0.274	C	S	.	.	H	α-helix	trans	-63.6	-42.5	177.9	-158.5	79.9	0	0	0	112	Y140 N141 L147 I148 I209	Y140-L144 PolarHBondContact O-N 3.2Å; Y140-L144 VanDerWaalsContact O-N 3.11Å; N141-L144 PolarHBondContact O-N 3.24Å; L144-L147 PolarHBondContact O-N 3.42Å; L144-I148 HydrophobicContact CD2-CD1 4.39Å; L144-I148 HydrophobicContact CG-CD1 4.13Å; L144-I148 WeakPolarHBondContact O-CB 3.49Å; L144-I148 WeakPolarHBondContact O-CG1 3.45Å; L144-I148 PolarHBondContact O-N 3.11Å; L144-I209 HydrophobicContact CB-CG2 4.24Å; L144-I209 HydrophobicContact CD2-CG2 4.03Å; L144-I209 HydrophobicContact CG-CG2 4.45Å
145	R	88.5	Confident	81	Confident	12 Å²	12	54.7 Å²	54.7	5%	0.045	26%	0.264	C	S	.	.	H	α-helix	trans	-60.3	-50.1	178.2	-171.2	-162	62.1	-162.3	-13.6	111.8	N141 I148 K149 L206 I209 S387 D388	N141-R145 WeakPolarHBondContact O-CB 3.42Å; N141-R145 PolarHBondContact O-N 3.46Å; R145-I148 PolarHBondContact O-N 3.27Å; R145-K149 PolarHBondContact O-N 3.33Å; R145-L206 HydrophobicContact CG-CB 4.16Å; R145-L206 HydrophobicContact CG-CD1 4.2Å; R145-L206 HydrophobicContact CG-CD2 3.7Å; R145-L206 HydrophobicContact CG-CG 4.18Å; R145-I209 HydrophobicContact CB-CG2 4.13Å; R145-S387 VanDerWaalsContact NH2-CB 3.29Å; R145-S387 PolarHBondContact NH2-OG 2.83Å; R145-D388 IonicContact CZ-OD1 3.7Å; R145-D388 IonicContact NH1-OD1 2.79Å; R145-D388 PolarHBondContact NH1-OD1 3.16Å
146	D	90.2	Very high	83.7	Confident	7 Å²	7	47.1 Å²	47.1	4%	0.037	24%	0.236	C	C	.	.	H	α-helix	trans	-69.2	-37.2	-177.5	-71.9	23.8	0	0	0	110.5	L96 R99 C100 Y142 I148 K149 F150	L96-D146 HydrophobicContact CD1-CB 4.18Å; L96-D146 WeakPolarHBondContact CD1-O 3.5Å; R99-D146 WeakPolarHBondContact CD-OD2 3.37Å; R99-D146 IonicContact CZ-OD2 3.55Å; R99-D146 IonicContact NE-OD2 2.71Å; R99-D146 IonicContact NH1-OD2 2.77Å; R99-D146 PolarHBondContact NH1-OD2 3.35Å; C100-D146 PolarHBondContact SG-O 3.13Å; C100-D146 VanDerWaalsContact SG-O 3.36Å; Y142-D146 PolarHBondContact O-N 3.44Å; D146-I148 PolarHBondContact O-N 2.95Å; D146-K149 PolarHBondContact O-N 3.2Å; D146-F150 WeakPolarHBondContact O-CB 3.42Å; D146-F150 PolarHBondContact O-N 2.86Å
147	L	90.9	Very high	86.1	Confident	46 Å²	46	40.4 Å²	40.4	24%	0.241	20%	0.201	C	C	.	.	H	α-helix	trans	-61	-37	169.9	-76.2	169.8	0	0	0	113.6	C100 A103 L139 E143 L144 F150 S151	C100-L147 HydrophobicContact CB-CD2 3.94Å; A103-L147 HydrophobicContact CB-CD1 4.07Å; A103-L147 HydrophobicContact CB-CD2 4.41Å; A103-L147 HydrophobicContact CB-CG 4.18Å; L139-L147 HydrophobicContact CD2-CD1 3.44Å; L139-L147 VanDerWaalsContact CD2-CD1 3.44Å; E143-L147 WeakPolarHBondContact O-CB 3.01Å; E143-L147 VanDerWaalsContact O-CG 3.25Å; E143-L147 WeakPolarHBondContact O-CG 3.45Å; E143-L147 PolarHBondContact O-N 3.41Å; L144-L147 PolarHBondContact O-N 3.42Å; L147-F150 PolarHBondContact O-N 3.37Å; L147-S151 VanDerWaalsContact O-CB 3.25Å; L147-S151 WeakPolarHBondContact O-CB 3.27Å; L147-S151 PolarHBondContact O-N 3.15Å
148	I	92.6	Very high	88.2	Confident	21 Å²	21	40.9 Å²	40.9	11%	0.108	20%	0.204	C	C	.	.	H	α-helix	trans	-73.1	-39.3	179	-79.2	171.1	0	0	0	111.7	L144 R145 D146 F150 S151 L152 L205 I209 Y237	L144-I148 HydrophobicContact CD2-CD1 4.39Å; L144-I148 HydrophobicContact CG-CD1 4.13Å; L144-I148 WeakPolarHBondContact O-CB 3.49Å; L144-I148 WeakPolarHBondContact O-CG1 3.45Å; L144-I148 PolarHBondContact O-N 3.11Å; R145-I148 PolarHBondContact O-N 3.27Å; D146-I148 PolarHBondContact O-N 2.95Å; I148-F150 VanDerWaalsContact C-N 3.33Å; I148-F150 PolarHBondContact O-N 3.1Å; I148-S151 PolarHBondContact O-N 3.36Å; I148-L152 HydrophobicContact CG2-CD1 4.29Å; I148-L152 WeakPolarHBondContact O-CG 3.46Å; I148-L152 PolarHBondContact O-N 3.28Å; I148-L205 HydrophobicContact CG2-CD2 3.89Å; I148-L205 HydrophobicContact CG2-CG 4.39Å; I148-I209 HydrophobicContact CB-CD1 4.17Å; I148-I209 HydrophobicContact CD1-CD1 3.4Å; I148-I209 HydrophobicContact CD1-CG1 4.01Å; I148-I209 HydrophobicContact CG1-CD1 4.35Å; I148-I209 HydrophobicContact CG2-CD1 3.92Å; I148-Y237 HydrophobicContact CG2-CD2 3.97Å; I148-Y237 HydrophobicContact CG2-CE2 4.11Å
149	K	93.6	Very high	90	Very high	22 Å²	22	40.9 Å²	40.9	10%	0.096	20%	0.204	C	C	.	.	H	α-helix	trans	-56.9	-46.2	168.8	-71.5	-176.6	-178.8	177.1	0	111.7	L96 R145 D146 L153 L206 D391 I402	L96-K149 HydrophobicContact CD1-CB 4.21Å; L96-K149 HydrophobicContact CD2-CB 4.44Å; R145-K149 PolarHBondContact O-N 3.33Å; D146-K149 PolarHBondContact O-N 3.2Å; K149-L153 WeakPolarHBondContact O-CB 3.49Å; K149-L153 PolarHBondContact O-N 3.27Å; K149-L206 HydrophobicContact CD-CD1 4.46Å; K149-L206 HydrophobicContact CG-CD1 4.45Å; K149-L206 HydrophobicContact CG-CD2 4.31Å; K149-D391 IonicContact NZ-OD1 2.67Å; K149-D391 PolarHBondContact NZ-OD1 3.17Å; K149-D391 IonicContact NZ-OD2 2.67Å; K149-D391 PolarHBondContact NZ-OD2 2.91Å; K149-I402 HydrophobicContact CB-CD1 4.34Å; K149-I402 HydrophobicContact CG-CD1 4.3Å
150	F	94.6	Very high	91.4	Very high	66 Å²	66	39.4 Å²	39.4	29%	0.289	20%	0.196	S	C	.	.	H	α-helix	trans	-68.3	-37.2	179.2	-177.1	-101.3	0	0	0	113	L96 P97 C100 D146 L147 I148 L153 C154	L96-F150 HydrophobicContact CD1-CB 4.47Å; L96-F150 HydrophobicContact CD2-CB 4.41Å; L96-F150 HydrophobicContact CG-CB 4.3Å; L96-F150 HydrophobicContact CG-CD2 4.39Å; P97-F150 HydrophobicContact CB-CE2 4.18Å; P97-F150 HydrophobicContact CG-CE2 4.41Å; C100-F150 HydrophobicContact CB-CB 4.32Å; C100-F150 HydrophobicContact CB-CD1 4.1Å; C100-F150 HydrophobicContact CB-CD2 4.47Å; C100-F150 HydrophobicContact CB-CG 4.05Å; C100-F150 WeakPolarHBondContact SG-CB 3.31Å; D146-F150 WeakPolarHBondContact O-CB 3.42Å; D146-F150 PolarHBondContact O-N 2.86Å; L147-F150 PolarHBondContact O-N 3.37Å; I148-F150 VanDerWaalsContact C-N 3.33Å; I148-F150 PolarHBondContact O-N 3.1Å; F150-L153 HydrophobicContact CD2-CD2 4.44Å; F150-L153 PolarHBondContact O-N 2.91Å; F150-C154 WeakPolarHBondContact O-CB 3.39Å; F150-C154 PolarHBondContact O-N 3.26Å; F150-C154 PolarHBondContact O-SG 3.28Å
151	S	94.8	Very high	92	Very high	43 Å²	43	35.6 Å²	35.6	30%	0.301	19%	0.186	S	C	.	.	H	α-helix	trans	-60	-50.6	174.1	177.7	0	0	0	0	111.5	L147 I148 L153 C154 I155 Y237	L147-S151 VanDerWaalsContact O-CB 3.25Å; L147-S151 WeakPolarHBondContact O-CB 3.27Å; L147-S151 PolarHBondContact O-N 3.15Å; I148-S151 PolarHBondContact O-N 3.36Å; S151-L153 PolarHBondContact O-N 3.09Å; S151-C154 PolarHBondContact O-N 2.71Å; S151-I155 WeakPolarHBondContact O-CG1 3.3Å; S151-I155 PolarHBondContact O-N 2.85Å; S151-Y237 PolarHBondContact OG-OH 3.22Å
152	L	96.3	Very high	92.4	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-60.2	-45.8	177	-72.8	169.3	0	0	0	112.2	I148 C154 C156 L202 L205 Y237 F241 L244	I148-L152 HydrophobicContact CG2-CD1 4.29Å; I148-L152 WeakPolarHBondContact O-CG 3.46Å; I148-L152 PolarHBondContact O-N 3.28Å; L152-C154 PolarHBondContact O-N 2.93Å; L152-C156 WeakPolarHBondContact O-CB 3.37Å; L152-C156 PolarHBondContact O-N 3.05Å; L152-C156 PolarHBondContact O-SG 2.88Å; L152-L202 HydrophobicContact CD1-CD2 3.73Å; L152-L205 HydrophobicContact CD1-CD2 4.08Å; L152-Y237 HydrophobicContact CD1-CE2 4.39Å; L152-Y237 HydrophobicContact CD2-CD1 4.47Å; L152-Y237 HydrophobicContact CD2-CD2 4.23Å; L152-Y237 HydrophobicContact CD2-CE1 3.95Å; L152-Y237 HydrophobicContact CD2-CE2 3.72Å; L152-Y237 HydrophobicContact CG-CD2 4.36Å; L152-Y237 HydrophobicContact CG-CE2 3.72Å; L152-F241 HydrophobicContact CD2-CB 3.78Å; L152-F241 HydrophobicContact CD2-CD2 4.27Å; L152-L244 HydrophobicContact CB-CD2 3.81Å
153	L	96	Very high	92.8	Very high	9 Å²	9	39.7 Å²	39.7	5%	0.047	20%	0.203	C	C	.	.	H	α-helix	trans	-55.8	-48.1	174.2	174	68.2	0	0	0	112	I92 L96 K149 F150 S151 T157 I402	I92-L153 HydrophobicContact CG2-CD1 4.27Å; I92-L153 HydrophobicContact CG2-CD2 3.57Å; L96-L153 HydrophobicContact CD2-CD2 4.07Å; K149-L153 WeakPolarHBondContact O-CB 3.49Å; K149-L153 PolarHBondContact O-N 3.27Å; F150-L153 HydrophobicContact CD2-CD2 4.44Å; F150-L153 PolarHBondContact O-N 2.91Å; S151-L153 PolarHBondContact O-N 3.09Å; L153-T157 VanDerWaalsContact O-CB 3.22Å; L153-T157 WeakPolarHBondContact O-CB 3.37Å; L153-T157 PolarHBondContact O-N 2.89Å; L153-T157 PolarHBondContact O-OG1 3.41Å; L153-I402 HydrophobicContact CB-CG2 4.22Å; L153-I402 HydrophobicContact CD1-CG2 4.31Å
154	C	95.2	Very high	92.9	Very high	48 Å²	48	43.2 Å²	43.2	32%	0.324	22%	0.222	S	C	.	.	H	α-helix	trans	-66	-48.3	-178.9	-77.5	0	0	0	0	112.3	F150 S151 L152 T157 V158	F150-C154 WeakPolarHBondContact O-CB 3.39Å; F150-C154 PolarHBondContact O-N 3.26Å; F150-C154 PolarHBondContact O-SG 3.28Å; S151-C154 PolarHBondContact O-N 2.71Å; L152-C154 PolarHBondContact O-N 2.93Å; C154-T157 PolarHBondContact O-N 3.47Å; C154-V158 VanDerWaalsContact O-CG2 3.32Å; C154-V158 WeakPolarHBondContact O-CG2 3.39Å; C154-V158 PolarHBondContact O-N 3.17Å
155	I	96.3	Very high	92.8	Very high	69 Å²	69	42.4 Å²	42.4	35%	0.354	22%	0.218	S	C	.	.	H	α-helix	trans	-65.1	-43.8	-179	-61.6	175.8	0	0	0	110.5	S151 V158 I159 Y237 F241	S151-I155 WeakPolarHBondContact O-CG1 3.3Å; S151-I155 PolarHBondContact O-N 2.85Å; I155-V158 PolarHBondContact O-N 3.3Å; I155-I159 HydrophobicContact CG2-CD1 3.91Å; I155-I159 WeakPolarHBondContact O-CG1 3.09Å; I155-I159 PolarHBondContact O-N 3.43Å; I155-Y237 WeakPolarHBondContact CD1-OH 3.26Å; I155-F241 HydrophobicContact CB-CE2 4.38Å; I155-F241 HydrophobicContact CG2-CD2 4.45Å; I155-F241 HydrophobicContact CG2-CE2 3.62Å; I155-F241 HydrophobicContact CG2-CZ 4.12Å
156	C	96.9	Very high	92.7	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.9	-40.2	178	-63.1	0	0	0	0	112.3	L152 I159 L160 I245 C406	L152-C156 WeakPolarHBondContact O-CB 3.37Å; L152-C156 PolarHBondContact O-N 3.05Å; L152-C156 PolarHBondContact O-SG 2.88Å; C156-I159 PolarHBondContact O-N 2.92Å; C156-L160 PolarHBondContact O-N 2.75Å; C156-I245 HydrophobicContact CB-CD1 3.98Å; C156-C406 HydrophobicContact CB-CB 4.43Å
157	T	95.6	Very high	92.6	Very high	11 Å²	11	49.4 Å²	49.4	7%	0.067	26%	0.259	C	S	.	.	H	α-helix	trans	-59.1	-47.1	172.4	-62.5	0	0	0	0	111.2	L153 C154 I159 L160 T161 N409 F413	L153-T157 VanDerWaalsContact O-CB 3.22Å; L153-T157 WeakPolarHBondContact O-CB 3.37Å; L153-T157 PolarHBondContact O-N 2.89Å; L153-T157 PolarHBondContact O-OG1 3.41Å; C154-T157 PolarHBondContact O-N 3.47Å; T157-I159 PolarHBondContact O-N 3.19Å; T157-L160 PolarHBondContact O-N 3.34Å; T157-T161 HydrophobicContact CG2-CG2 4.5Å; T157-T161 WeakPolarHBondContact O-CG2 2.99Å; T157-T161 PolarHBondContact O-N 3.48Å; T157-T161 PolarHBondContact O-OG1 3.44Å; T157-N409 HydrophobicContact CG2-CB 3.48Å; T157-N409 VanDerWaalsContact CG2-CB 3.48Å; T157-N409 PolarHBondContact OG1-ND2 3.15Å; T157-F413 HydrophobicContact CG2-CD2 4.21Å; T157-F413 HydrophobicContact CG2-CE2 3.99Å
158	V	94.4	Very high	92.4	Very high	84 Å²	84	47.3 Å²	47.3	51%	0.509	25%	0.249	S	C	.	.	H	α-helix	trans	-60.4	-45.5	179.2	167.8	0	0	0	0	110.8	C154 I155 T161 K162	C154-V158 VanDerWaalsContact O-CG2 3.32Å; C154-V158 WeakPolarHBondContact O-CG2 3.39Å; C154-V158 PolarHBondContact O-N 3.17Å; I155-V158 PolarHBondContact O-N 3.3Å; V158-T161 PolarHBondContact O-N 2.9Å; V158-T161 PolarHBondContact O-OG1 2.85Å; V158-K162 WeakPolarHBondContact O-CG 3.09Å; V158-K162 PolarHBondContact O-N 2.68Å
159	I	95.1	Very high	92.3	Very high	59 Å²	59	47.6 Å²	47.6	30%	0.303	25%	0.249	S	C	.	.	H	α-helix	trans	-62.8	-46	178.5	-67.1	167.2	0	0	0	111.3	I155 C156 T157 T161 K162 Y163 F241 I245 F249	I155-I159 HydrophobicContact CG2-CD1 3.91Å; I155-I159 WeakPolarHBondContact O-CG1 3.09Å; I155-I159 PolarHBondContact O-N 3.43Å; C156-I159 PolarHBondContact O-N 2.92Å; T157-I159 PolarHBondContact O-N 3.19Å; I159-T161 VanDerWaalsContact C-N 3.32Å; I159-T161 PolarHBondContact O-N 3.5Å; I159-K162 PolarHBondContact O-N 3.48Å; I159-Y163 PolarHBondContact O-N 3.11Å; I159-F241 HydrophobicContact CD1-CE2 3.97Å; I159-F241 HydrophobicContact CD1-CZ 3.58Å; I159-I245 HydrophobicContact CB-CD1 3.94Å; I159-I245 HydrophobicContact CD1-CD1 4.25Å; I159-I245 HydrophobicContact CG2-CD1 3.81Å; I159-I245 HydrophobicContact CG2-CG1 4.31Å; I159-F249 HydrophobicContact CG2-CE2 4.41Å; I159-F249 HydrophobicContact CG2-CZ 4.06Å
160	L	93.4	Very high	92	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.5	-35.9	177.5	-97.8	65.2	0	0	0	112.8	C156 T157 K162 Y163 I245 C248 F249 L252 A410	C156-L160 PolarHBondContact O-N 2.75Å; T157-L160 PolarHBondContact O-N 3.34Å; L160-K162 PolarHBondContact O-N 2.92Å; L160-Y163 PolarHBondContact O-N 3.2Å; L160-I245 HydrophobicContact CD1-CD1 3.64Å; L160-C248 HydrophobicContact CD1-CB 3.53Å; L160-C248 HydrophobicContact CD2-CB 3.75Å; L160-C248 HydrophobicContact CG-CB 4.28Å; L160-F249 HydrophobicContact CD1-CE1 4.43Å; L160-L252 HydrophobicContact CG-CD2 4.46Å; L160-A410 HydrophobicContact CB-CB 3.61Å; L160-A410 HydrophobicContact CD2-CB 4.25Å
161	T	90.8	Very high	91.6	Very high	47 Å²	47	52.4 Å²	52.4	29%	0.288	27%	0.272	S	S	.	.	H	α-helix	trans	-68.6	-14.2	174.8	60.4	0	0	0	0	114.2	T157 V158 I159 A410 F413	T157-T161 HydrophobicContact CG2-CG2 4.5Å; T157-T161 WeakPolarHBondContact O-CG2 2.99Å; T157-T161 PolarHBondContact O-N 3.48Å; T157-T161 PolarHBondContact O-OG1 3.44Å; V158-T161 PolarHBondContact O-N 2.9Å; V158-T161 PolarHBondContact O-OG1 2.85Å; I159-T161 VanDerWaalsContact C-N 3.32Å; I159-T161 PolarHBondContact O-N 3.5Å; T161-A410 HydrophobicContact CG2-CB 4.13Å; T161-F413 HydrophobicContact CG2-CB 3.91Å; T161-F413 HydrophobicContact CG2-CD2 3.88Å; T161-F413 HydrophobicContact CG2-CG 4.32Å
162	K	91	Very high	91.3	Very high	175 Å²	175	51.2 Å²	51.2	76%	0.761	26%	0.263	S	S	*	.	H	α-helix	trans	-90.1	-12.7	173.4	-62.4	-59.3	179.3	-174.4	0	113.9	V158 I159 L160	V158-K162 WeakPolarHBondContact O-CG 3.09Å; V158-K162 PolarHBondContact O-N 2.68Å; I159-K162 PolarHBondContact O-N 3.48Å; L160-K162 PolarHBondContact O-N 2.92Å
163	Y	90.6	Very high	90.9	Very high	80 Å²	80	58 Å²	58	31%	0.314	29%	0.288	S	S	.	.	S	Bend	trans	-84.8	131.4	179	179.8	-93.8	0	0	0	111	I159 L160 S165 A168 F249 L252 Q414	I159-Y163 PolarHBondContact O-N 3.11Å; L160-Y163 PolarHBondContact O-N 3.2Å; Y163-S165 PolarHBondContact O-N 3.22Å; Y163-A168 HydrophobicContact CE1-CB 3.68Å; Y163-A168 WeakPolarHBondContact OH-CB 3.41Å; Y163-F249 AromaticContact CD2-CE1 3.9Å; Y163-F249 HydrophobicContact CD2-CE1 3.9Å; Y163-F249 HydrophobicContact CE2-CE1 4.46Å; Y163-F249 HydrophobicContact CG-CE1 4.01Å; Y163-L252 HydrophobicContact CD1-CD2 3.52Å; Y163-L252 HydrophobicContact CE1-CD2 3.85Å; Y163-L252 HydrophobicContact CG-CD2 4.39Å; Y163-Q414 PolarHBondContact O-NE2 2.99Å
164	D	87.7	Confident	90.4	Very high	84 Å²	84	62.8 Å²	62.8	45%	0.449	32%	0.318	S	S	.	.			trans	-79.1	103.3	-177.6	-177.3	23.1	0	0	0	112.4	S166 M167 A168	D164-S166 PolarHBondContact O-N 3.46Å; D164-S166 WeakPolarHBondContact OD1-CA 3.38Å; D164-S166 WeakPolarHBondContact OD1-CB 3.24Å; D164-S166 PolarHBondContact OD1-N 3.27Å; D164-S166 PolarHBondContact OD1-OG 3.39Å; D164-M167 HydrophobicContact CB-CB 4.09Å; D164-M167 PolarHBondContact O-N 3.34Å; D164-M167 WeakPolarHBondContact OD2-CB 3.49Å; D164-M167 PolarHBondContact OD2-N 2.99Å; D164-A168 PolarHBondContact O-N 3.35Å
165	S	85.1	Confident	90.1	Very high	7 Å²	7	64.2 Å²	64.2	5%	0.049	32%	0.319	C	S	.	.	H	α-helix	trans	-62	-18.9	173.7	-160.7	0	0	0	0	113.3	Y163 Y169 R318 Q414	Y163-S165 PolarHBondContact O-N 3.22Å; S165-Y169 VanDerWaalsContact O-CB 3.31Å; S165-Y169 WeakPolarHBondContact O-CB 3.34Å; S165-Y169 PolarHBondContact O-N 2.68Å; S165-R318 PolarHBondContact OG-NH1 3.46Å; S165-R318 PolarHBondContact OG-NH2 3.29Å; S165-Q414 PolarHBondContact OG-OE1 3.49Å
166	S	85.3	Confident	89.7	Confident	63 Å²	63	63.7 Å²	63.7	44%	0.441	32%	0.322	S	S	.	.	H	α-helix	trans	-77.2	-49.7	176.1	-27.4	0	0	0	0	110.9	D164 A168 Y169 H170	D164-S166 PolarHBondContact O-N 3.46Å; D164-S166 WeakPolarHBondContact OD1-CA 3.38Å; D164-S166 WeakPolarHBondContact OD1-CB 3.24Å; D164-S166 PolarHBondContact OD1-N 3.27Å; D164-S166 PolarHBondContact OD1-OG 3.39Å; S166-A168 PolarHBondContact O-N 3.19Å; S166-Y169 PolarHBondContact O-N 2.92Å; S166-H170 PolarHBondContact O-CD2 3.39Å; S166-H170 PolarHBondContact O-N 3.06Å
167	M	88.6	Confident	88.9	Confident	102 Å²	102	66.6 Å²	66.6	50%	0.502	34%	0.34	S	S	.	.	H	α-helix	trans	-54.1	-51.1	172.8	-171.6	68.5	-174.6	0	0	111.1	D164 Y169 H170 E171	D164-M167 HydrophobicContact CB-CB 4.09Å; D164-M167 PolarHBondContact O-N 3.34Å; D164-M167 WeakPolarHBondContact OD2-CB 3.49Å; D164-M167 PolarHBondContact OD2-N 2.99Å; M167-Y169 PolarHBondContact O-N 3.19Å; M167-H170 PolarHBondContact O-N 2.98Å; M167-H170 VanDerWaalsContact O-N 3.11Å; M167-E171 HydrophobicContact CE-CG 3.98Å; M167-E171 VanDerWaalsContact CE-OE1 3.24Å; M167-E171 WeakPolarHBondContact CE-OE1 3.42Å; M167-E171 HydrophobicContact CG-CG 4.41Å; M167-E171 WeakPolarHBondContact O-CG 3.05Å; M167-E171 PolarHBondContact O-N 2.92Å
168	A	87.4	Confident	88.2	Confident	2 Å²	2	71.2 Å²	71.2	2%	0.017	36%	0.363	C	S	.	.	H	α-helix	trans	-59.3	-43.1	179	0	0	0	0	0	113.1	Y163 D164 S166 H170 I172 T256	Y163-A168 HydrophobicContact CE1-CB 3.68Å; Y163-A168 WeakPolarHBondContact OH-CB 3.41Å; D164-A168 PolarHBondContact O-N 3.35Å; S166-A168 PolarHBondContact O-N 3.19Å; A168-H170 VanDerWaalsContact C-N 3.35Å; A168-I172 WeakPolarHBondContact O-CB 3.28Å; A168-I172 VanDerWaalsContact O-CG1 3.3Å; A168-I172 WeakPolarHBondContact O-CG1 3.47Å; A168-I172 PolarHBondContact O-N 3.33Å; A168-T256 HydrophobicContact CB-CG2 4.25Å
169	Y	89.1	Confident	87.8	Confident	27 Å²	27	72.8 Å²	72.8	11%	0.106	36%	0.363	C	S	.	.	H	α-helix	trans	-61.4	-42.9	175	175.9	-104.1	0	0	0	111.5	S165 S166 M167 R173 V260	S165-Y169 VanDerWaalsContact O-CB 3.31Å; S165-Y169 WeakPolarHBondContact O-CB 3.34Å; S165-Y169 PolarHBondContact O-N 2.68Å; S166-Y169 PolarHBondContact O-N 2.92Å; M167-Y169 PolarHBondContact O-N 3.19Å; Y169-R173 WeakPolarHBondContact O-CB 3.33Å; Y169-R173 PolarHBondContact O-N 2.91Å; Y169-V260 HydrophobicContact CD2-CG2 3.36Å; Y169-V260 HydrophobicContact CE2-CB 4.36Å; Y169-V260 HydrophobicContact CE2-CG2 3.57Å; Y169-V260 HydrophobicContact CG-CG2 4.23Å
170	H	87.9	Confident	87.4	Confident	91 Å²	91	70.5 Å²	70.5	42%	0.421	35%	0.351	S	S	.	.	H	α-helix	trans	-69.3	-43.7	178	-70.7	-32.8	0	0	0	113.3	S166 M167 A168 I172 R173 T174	S166-H170 PolarHBondContact O-CD2 3.39Å; S166-H170 PolarHBondContact O-N 3.06Å; M167-H170 PolarHBondContact O-N 2.98Å; M167-H170 VanDerWaalsContact O-N 3.11Å; A168-H170 VanDerWaalsContact C-N 3.35Å; H170-I172 PolarHBondContact O-N 3.42Å; H170-R173 PolarHBondContact ND1-NH2 3.4Å; H170-R173 PolarHBondContact O-N 3.48Å; H170-T174 WeakPolarHBondContact O-CG2 3.16Å; H170-T174 PolarHBondContact O-N 3.32Å
171	E	87.1	Confident	86.9	Confident	98 Å²	98	73.7 Å²	73.7	46%	0.458	36%	0.364	S	S	.	.	H	α-helix	trans	-57.2	-50.5	175.6	-74.1	-176.8	161.1	0	0	111.5	M167 R173 T174	M167-E171 HydrophobicContact CE-CG 3.98Å; M167-E171 VanDerWaalsContact CE-OE1 3.24Å; M167-E171 WeakPolarHBondContact CE-OE1 3.42Å; M167-E171 HydrophobicContact CG-CG 4.41Å; M167-E171 WeakPolarHBondContact O-CG 3.05Å; M167-E171 PolarHBondContact O-N 2.92Å; E171-R173 PolarHBondContact O-N 3.11Å; E171-T174 PolarHBondContact O-N 2.95Å; E171-T174 PolarHBondContact O-OG1 3.33Å
172	I	87.5	Confident	86.7	Confident	19 Å²	19	76.3 Å²	76.3	10%	0.097	38%	0.375	C	S	.	.	H	α-helix	trans	-67.3	-38.5	-179.6	-62.3	166.4	0	0	0	110.9	A168 H170 T174 Q175 T256 V260	A168-I172 WeakPolarHBondContact O-CB 3.28Å; A168-I172 VanDerWaalsContact O-CG1 3.3Å; A168-I172 WeakPolarHBondContact O-CG1 3.47Å; A168-I172 PolarHBondContact O-N 3.33Å; H170-I172 PolarHBondContact O-N 3.42Å; I172-T174 PolarHBondContact O-N 3.05Å; I172-Q175 WeakPolarHBondContact O-CB 3.37Å; I172-Q175 PolarHBondContact O-N 3.21Å; I172-T256 VanDerWaalsContact CD1-OG1 3.25Å; I172-T256 WeakPolarHBondContact CD1-OG1 3.17Å; I172-V260 HydrophobicContact CB-CG2 4.14Å; I172-V260 HydrophobicContact CG2-CB 4.18Å; I172-V260 HydrophobicContact CG2-CG1 4.23Å; I172-V260 HydrophobicContact CG2-CG2 4.01Å
173	R	87.1	Confident	86.5	Confident	144 Å²	144	71.6 Å²	71.6	54%	0.543	35%	0.354	S	S	.	.	H	α-helix	trans	-63.1	-21.1	176.3	-169.3	-177.5	71.8	168.6	0.8	113.8	Y169 H170 E171 Q175 V260	Y169-R173 WeakPolarHBondContact O-CB 3.33Å; Y169-R173 PolarHBondContact O-N 2.91Å; H170-R173 PolarHBondContact ND1-NH2 3.4Å; H170-R173 PolarHBondContact O-N 3.48Å; E171-R173 PolarHBondContact O-N 3.11Å; R173-Q175 VanDerWaalsContact C-N 3.3Å; R173-V260 HydrophobicContact CB-CG1 4.16Å; R173-V260 HydrophobicContact CB-CG2 4.28Å; R173-V260 HydrophobicContact CG-CG1 4.49Å
174	T	87.2	Confident	86.4	Confident	109 Å²	109	68.4 Å²	68.4	67%	0.669	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-9.1	172.7	64.5	0	0	0	0	114.2	H170 E171 I172	H170-T174 WeakPolarHBondContact O-CG2 3.16Å; H170-T174 PolarHBondContact O-N 3.32Å; E171-T174 PolarHBondContact O-N 2.95Å; E171-T174 PolarHBondContact O-OG1 3.33Å; I172-T174 PolarHBondContact O-N 3.05Å
175	Q	88.6	Confident	86.3	Confident	77 Å²	77	65.8 Å²	65.8	36%	0.36	33%	0.328	S	S	.	.	S	Bend	trans	-81.1	152.9	180	-57.8	-51.9	-43.4	0	0	112.6	I172 R173 K179 I180	I172-Q175 WeakPolarHBondContact O-CB 3.37Å; I172-Q175 PolarHBondContact O-N 3.21Å; R173-Q175 VanDerWaalsContact C-N 3.3Å; Q175-K179 HydrophobicContact CB-CB 4.44Å; Q175-K179 HydrophobicContact CB-CD 4.48Å; Q175-K179 VanDerWaalsContact OE1-CD 3.23Å; Q175-I180 HydrophobicContact CB-CD1 4.35Å; Q175-I180 HydrophobicContact CB-CG1 3.99Å
176	S	87.1	Confident	86.6	Confident	58 Å²	58	70.6 Å²	70.6	41%	0.406	35%	0.353	S	S	.	.			trans	-74.9	147.7	173.2	57.2	0	0	0	0	111.7	I178 K179 I180	S176-I178 PolarHBondContact O-N 3.34Å; S176-I178 VanDerWaalsContact O-N 3.1Å; S176-K179 WeakPolarHBondContact O-CA 3.42Å; S176-K179 WeakPolarHBondContact O-CB 3.39Å; S176-K179 PolarHBondContact O-N 3.4Å; S176-I180 PolarHBondContact O-N 3.35Å
177	V	80.3	Confident	86.9	Confident	62 Å²	62	68 Å²	68	38%	0.376	33%	0.334	S	S	.	.	H	α-helix	trans	-49.1	-41.1	-178.9	173.7	0	0	0	0	112.9	K179 I180 Y181 S268	V177-K179 PolarHBondContact O-N 3.01Å; V177-I180 PolarHBondContact O-N 2.71Å; V177-Y181 PolarHBondContact O-N 2.87Å; V177-S268 WeakPolarHBondContact CG1-OG 3.46Å
178	I	80.6	Confident	87	Confident	107 Å²	107	64.6 Å²	64.6	55%	0.549	32%	0.317	S	S	.	.	H	α-helix	trans	-66.3	-32.9	178.7	-171.1	62.4	0	0	0	113.3	S176 Y181 I182	S176-I178 PolarHBondContact O-N 3.34Å; S176-I178 VanDerWaalsContact O-N 3.1Å; I178-Y181 HydrophobicContact CD1-CD1 4.04Å; I178-I182 WeakPolarHBondContact O-CG1 3.28Å; I178-I182 PolarHBondContact O-N 2.97Å
179	K	86.2	Confident	87.2	Confident	117 Å²	117	68.5 Å²	68.5	51%	0.509	34%	0.34	S	S	.	.	H	α-helix	trans	-71.3	-41.8	171.9	-70.7	-178.1	-178.5	-174.1	0	111	Q175 S176 V177 Y181 I182 F183	Q175-K179 HydrophobicContact CB-CB 4.44Å; Q175-K179 HydrophobicContact CB-CD 4.48Å; Q175-K179 VanDerWaalsContact OE1-CD 3.23Å; S176-K179 WeakPolarHBondContact O-CA 3.42Å; S176-K179 WeakPolarHBondContact O-CB 3.39Å; S176-K179 PolarHBondContact O-N 3.4Å; V177-K179 PolarHBondContact O-N 3.01Å; K179-Y181 VanDerWaalsContact C-N 3.29Å; K179-Y181 PolarHBondContact O-N 3.29Å; K179-I182 PolarHBondContact O-N 3.43Å; K179-F183 VanDerWaalsContact O-CB 3.27Å; K179-F183 WeakPolarHBondContact O-CB 3.32Å; K179-F183 PolarHBondContact O-N 3.11Å
180	I	86.2	Confident	87.4	Confident	11 Å²	11	68.6 Å²	68.6	6%	0.056	35%	0.347	C	S	.	.	H	α-helix	trans	-58.9	-42.4	178	-67.9	172.2	0	0	0	110.4	Q175 S176 V177 F183 F184 T257 V260 V272	Q175-I180 HydrophobicContact CB-CD1 4.35Å; Q175-I180 HydrophobicContact CB-CG1 3.99Å; S176-I180 PolarHBondContact O-N 3.35Å; V177-I180 PolarHBondContact O-N 2.71Å; I180-F183 PolarHBondContact O-N 3.22Å; I180-F184 WeakPolarHBondContact O-CB 3.33Å; I180-F184 PolarHBondContact O-N 2.86Å; I180-T257 HydrophobicContact CG2-CG2 3.86Å; I180-V260 HydrophobicContact CD1-CG1 4.29Å; I180-V272 HydrophobicContact CG2-CG2 4.35Å
181	Y	83.7	Confident	87.7	Confident	68 Å²	68	64.5 Å²	64.5	27%	0.267	33%	0.328	S	S	.	.	H	α-helix	trans	-57.3	-53.4	172	160.2	-110.9	0	0	0	113.2	V177 I178 K179 F183 F184 N185 S275	V177-Y181 PolarHBondContact O-N 2.87Å; I178-Y181 HydrophobicContact CD1-CD1 4.04Å; K179-Y181 VanDerWaalsContact C-N 3.29Å; K179-Y181 PolarHBondContact O-N 3.29Å; Y181-F183 VanDerWaalsContact C-N 3.27Å; Y181-F183 PolarHBondContact O-N 2.83Å; Y181-F184 PolarHBondContact O-N 3.47Å; Y181-N185 VanDerWaalsContact CD2-ND2 3.34Å; Y181-N185 WeakPolarHBondContact CD2-ND2 3.14Å; Y181-N185 WeakPolarHBondContact CE2-ND2 3.26Å; Y181-N185 PolarHBondContact O-N 3.29Å; Y181-N185 PolarHBondContact O-ND2 3.12Å; Y181-S275 WeakPolarHBondContact CD2-OG 3.48Å; Y181-S275 VanDerWaalsContact CE2-CB 3.42Å; Y181-S275 WeakPolarHBondContact CE2-OG 3.24Å
182	I	87.2	Confident	87.9	Confident	101 Å²	101	64 Å²	64	52%	0.518	32%	0.322	S	S	.	.	H	α-helix	trans	-62.4	-39	-179.6	-65.4	168.9	0	0	0	110.5	I178 K179 L186	I178-I182 WeakPolarHBondContact O-CG1 3.28Å; I178-I182 PolarHBondContact O-N 2.97Å; K179-I182 PolarHBondContact O-N 3.43Å; I182-L186 WeakPolarHBondContact O-CB 3.47Å; I182-L186 PolarHBondContact O-N 2.78Å
183	F	86.9	Confident	88.1	Confident	76 Å²	76	68.6 Å²	68.6	33%	0.333	35%	0.346	S	S	.	.	H	α-helix	trans	-65.3	-39.9	177.3	-171.4	-122	0	0	0	112.2	K179 I180 Y181 L186 L187 C253 T257	K179-F183 VanDerWaalsContact O-CB 3.27Å; K179-F183 WeakPolarHBondContact O-CB 3.32Å; K179-F183 PolarHBondContact O-N 3.11Å; I180-F183 PolarHBondContact O-N 3.22Å; Y181-F183 VanDerWaalsContact C-N 3.27Å; Y181-F183 PolarHBondContact O-N 2.83Å; F183-L186 PolarHBondContact O-N 3.41Å; F183-L187 HydrophobicContact CD1-CD1 3.79Å; F183-L187 HydrophobicContact CD1-CG 4.44Å; F183-L187 HydrophobicContact CE1-CD1 3.58Å; F183-L187 HydrophobicContact CE1-CG 4.26Å; F183-L187 HydrophobicContact CE2-CD2 4.44Å; F183-L187 HydrophobicContact CE2-CG 4.33Å; F183-L187 HydrophobicContact CG-CD1 4.36Å; F183-L187 HydrophobicContact CZ-CD1 3.97Å; F183-L187 HydrophobicContact CZ-CD2 4.21Å; F183-L187 HydrophobicContact CZ-CG 4.2Å; F183-L187 WeakPolarHBondContact O-CB 3.49Å; F183-L187 VanDerWaalsContact O-CG 3.3Å; F183-L187 WeakPolarHBondContact O-CG 3.37Å; F183-L187 PolarHBondContact O-N 3.28Å; F183-C253 HydrophobicContact CZ-CB 4.47Å; F183-T257 HydrophobicContact CD1-CG2 4.31Å; F183-T257 WeakPolarHBondContact CE1-OG1 3.32Å
184	F	86.9	Confident	88.5	Confident	14 Å²	14	63.4 Å²	63.4	6%	0.061	33%	0.329	C	S	.	.	H	α-helix	trans	-62	-47.5	176.6	-166.9	-92.1	0	0	0	112	I180 Y181 L186 L187 E188 T257 V272 N276	I180-F184 WeakPolarHBondContact O-CB 3.33Å; I180-F184 PolarHBondContact O-N 2.86Å; Y181-F184 PolarHBondContact O-N 3.47Å; F184-L186 VanDerWaalsContact C-N 3.32Å; F184-L186 PolarHBondContact O-N 3.13Å; F184-L187 PolarHBondContact O-N 3.25Å; F184-E188 PolarHBondContact O-N 2.9Å; F184-T257 HydrophobicContact CD2-CG2 4.31Å; F184-V272 HydrophobicContact CB-CG1 4.05Å; F184-V272 HydrophobicContact CD1-CG1 3.88Å; F184-V272 HydrophobicContact CD2-CG1 4.13Å; F184-V272 HydrophobicContact CE1-CG1 4.39Å; F184-V272 HydrophobicContact CG-CG1 3.74Å; F184-N276 HydrophobicContact CD1-CB 4.43Å; F184-N276 WeakPolarHBondContact CD1-OD1 3.39Å; F184-N276 HydrophobicContact CE1-CB 4.28Å
185	N	87.1	Confident	88.7	Confident	29 Å²	29	58.5 Å²	58.5	16%	0.155	30%	0.299	C	S	.	.	H	α-helix	trans	-61	-41.3	176.1	-76.4	-113.8	0	0	0	111.5	Y181 E188 V189	Y181-N185 VanDerWaalsContact CD2-ND2 3.34Å; Y181-N185 WeakPolarHBondContact CD2-ND2 3.14Å; Y181-N185 WeakPolarHBondContact CE2-ND2 3.26Å; Y181-N185 PolarHBondContact O-N 3.29Å; Y181-N185 PolarHBondContact O-ND2 3.12Å; N185-E188 PolarHBondContact O-N 3.37Å; N185-V189 WeakPolarHBondContact O-CG2 3.36Å; N185-V189 PolarHBondContact O-N 3.3Å; N185-V189 VanDerWaalsContact O-N 3.11Å
186	L	90.7	Very high	88.9	Confident	107 Å²	107	57 Å²	57	56%	0.56	30%	0.3	S	S	*	.	H	α-helix	trans	-66	-41.4	177.7	-178.5	149.1	0	0	0	111.9	I182 F183 F184 A190	I182-L186 WeakPolarHBondContact O-CB 3.47Å; I182-L186 PolarHBondContact O-N 2.78Å; F183-L186 PolarHBondContact O-N 3.41Å; F184-L186 VanDerWaalsContact C-N 3.32Å; F184-L186 PolarHBondContact O-N 3.13Å; L186-A190 VanDerWaalsContact O-CB 3.24Å; L186-A190 WeakPolarHBondContact O-CB 3.34Å; L186-A190 PolarHBondContact O-N 3.37Å
187	L	92.4	Very high	89.2	Confident	10 Å²	10	57.3 Å²	57.3	5%	0.052	30%	0.299	C	S	.	.	H	α-helix	trans	-63.7	-40.8	174.6	-75.3	171.9	0	0	0	111.6	F183 F184 A190 D191 L250 C253 Q254	F183-L187 HydrophobicContact CD1-CD1 3.79Å; F183-L187 HydrophobicContact CD1-CG 4.44Å; F183-L187 HydrophobicContact CE1-CD1 3.58Å; F183-L187 HydrophobicContact CE1-CG 4.26Å; F183-L187 HydrophobicContact CE2-CD2 4.44Å; F183-L187 HydrophobicContact CE2-CG 4.33Å; F183-L187 HydrophobicContact CG-CD1 4.36Å; F183-L187 HydrophobicContact CZ-CD1 3.97Å; F183-L187 HydrophobicContact CZ-CD2 4.21Å; F183-L187 HydrophobicContact CZ-CG 4.2Å; F183-L187 WeakPolarHBondContact O-CB 3.49Å; F183-L187 VanDerWaalsContact O-CG 3.3Å; F183-L187 WeakPolarHBondContact O-CG 3.37Å; F183-L187 PolarHBondContact O-N 3.28Å; F184-L187 PolarHBondContact O-N 3.25Å; L187-A190 PolarHBondContact O-N 3.12Å; L187-D191 PolarHBondContact O-N 3.23Å; L187-L250 HydrophobicContact CD2-CD2 4.16Å; L187-L250 HydrophobicContact CD2-CG 4.1Å; L187-C253 HydrophobicContact CD1-CB 4.1Å; L187-C253 HydrophobicContact CD2-CB 3.87Å; L187-Q254 HydrophobicContact CB-CG 3.77Å; L187-Q254 HydrophobicContact CD1-CG 3.98Å; L187-Q254 HydrophobicContact CG-CG 4.34Å; L187-Q254 PolarHBondContact O-NE2 3.38Å
188	E	90.2	Very high	89.9	Confident	30 Å²	30	54.5 Å²	54.5	14%	0.14	28%	0.282	C	S	.	.	H	α-helix	trans	-64.3	-47.1	179.1	-163.5	-139.4	109.1	0	0	112.2	F184 N185 A190 D191 R192 N276	F184-E188 PolarHBondContact O-N 2.9Å; N185-E188 PolarHBondContact O-N 3.37Å; E188-A190 VanDerWaalsContact C-N 3.27Å; E188-A190 PolarHBondContact O-N 3.21Å; E188-D191 PolarHBondContact O-N 3.38Å; E188-R192 WeakPolarHBondContact O-CG 3.16Å; E188-R192 PolarHBondContact O-N 3.46Å; E188-R192 VanDerWaalsContact O-N 3.11Å; E188-R192 IonicContact OE1-CZ 3.1Å; E188-R192 IonicContact OE1-NE 2.71Å; E188-R192 PolarHBondContact OE1-NE 3.32Å; E188-R192 IonicContact OE1-NH2 2.7Å; E188-R192 PolarHBondContact OE1-NH2 3.07Å; E188-N276 PolarHBondContact OE2-ND2 2.83Å; E188-N276 PolarHBondContact OE2-OD1 3.32Å
189	V	90.9	Very high	90.4	Very high	83 Å²	83	50.6 Å²	50.6	50%	0.503	26%	0.262	S	S	.	.	H	α-helix	trans	-60.5	-39.5	173.6	173.6	0	0	0	0	111.1	N185 R192 L193	N185-V189 WeakPolarHBondContact O-CG2 3.36Å; N185-V189 PolarHBondContact O-N 3.3Å; N185-V189 VanDerWaalsContact O-N 3.11Å; V189-R192 PolarHBondContact O-N 2.76Å; V189-L193 HydrophobicContact CG1-CD1 4.08Å; V189-L193 WeakPolarHBondContact O-CG 3.32Å; V189-L193 PolarHBondContact O-N 3.37Å; V189-L193 VanDerWaalsContact O-N 3.12Å
190	A	94.1	Very high	90.7	Very high	30 Å²	30	49.8 Å²	49.8	25%	0.248	26%	0.263	C	S	.	.	H	α-helix	trans	-68.8	-35.2	177.5	0	0	0	0	0	112.8	L186 L187 E188 L193 L194 L250	L186-A190 VanDerWaalsContact O-CB 3.24Å; L186-A190 WeakPolarHBondContact O-CB 3.34Å; L186-A190 PolarHBondContact O-N 3.37Å; L187-A190 PolarHBondContact O-N 3.12Å; E188-A190 VanDerWaalsContact C-N 3.27Å; E188-A190 PolarHBondContact O-N 3.21Å; A190-L193 PolarHBondContact O-N 3.32Å; A190-L194 WeakPolarHBondContact O-CB 3.49Å; A190-L194 PolarHBondContact O-N 3.43Å; A190-L250 VanDerWaalsContact C-CD1 3.5Å; A190-L250 HydrophobicContact CB-CD1 3.63Å; A190-L250 HydrophobicContact CB-CG 4.46Å
191	D	93.2	Very high	91.1	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-62.1	-46.4	172.3	171.6	75	0	0	0	111.1	L187 E188 L193 L194 S195 H247 L250 R303	L187-D191 PolarHBondContact O-N 3.23Å; E188-D191 PolarHBondContact O-N 3.38Å; D191-L193 VanDerWaalsContact C-N 3.32Å; D191-L193 PolarHBondContact O-N 2.86Å; D191-L194 PolarHBondContact O-N 3.47Å; D191-S195 WeakPolarHBondContact O-CB 3.45Å; D191-S195 PolarHBondContact O-N 3.24Å; D191-S195 PolarHBondContact O-OG 2.99Å; D191-S195 PolarHBondContact OD1-OG 3.41Å; D191-H247 IonicContact OD1-CD2 3.78Å; D191-H247 IonicContact OD1-CE1 3.7Å; D191-H247 IonicContact OD1-NE2 2.78Å; D191-H247 PolarHBondContact OD1-NE2 3.1Å; D191-L250 HydrophobicContact CB-CD2 3.98Å; D191-R303 IonicContact OD2-CZ 3.66Å; D191-R303 IonicContact OD2-NH1 2.79Å; D191-R303 PolarHBondContact OD2-NH1 3.34Å; D191-R303 IonicContact OD2-NH2 3.61Å
192	R	91.6	Very high	91.5	Very high	87 Å²	87	47 Å²	47	33%	0.328	25%	0.254	S	S	.	.	H	α-helix	trans	-58.7	-44.6	178.7	-65.9	178.8	-169.1	-99.3	-5.5	111.1	E188 V189 E304	E188-R192 WeakPolarHBondContact O-CG 3.16Å; E188-R192 PolarHBondContact O-N 3.46Å; E188-R192 VanDerWaalsContact O-N 3.11Å; E188-R192 IonicContact OE1-CZ 3.1Å; E188-R192 IonicContact OE1-NE 2.71Å; E188-R192 PolarHBondContact OE1-NE 3.32Å; E188-R192 IonicContact OE1-NH2 2.7Å; E188-R192 PolarHBondContact OE1-NH2 3.07Å; V189-R192 PolarHBondContact O-N 2.76Å; R192-E304 IonicContact CZ-OE2 3.75Å; R192-E304 IonicContact NH2-OE2 2.89Å; R192-E304 PolarHBondContact NH2-OE2 2.84Å
193	L	92.9	Very high	91.7	Very high	117 Å²	117	44.9 Å²	44.9	61%	0.613	24%	0.243	S	C	*	.	H	α-helix	trans	-68.8	-48.1	178.1	-70.4	169.8	0	0	0	112.8	V189 A190 D191 A196 V197	V189-L193 HydrophobicContact CG1-CD1 4.08Å; V189-L193 WeakPolarHBondContact O-CG 3.32Å; V189-L193 PolarHBondContact O-N 3.37Å; V189-L193 VanDerWaalsContact O-N 3.12Å; A190-L193 PolarHBondContact O-N 3.32Å; D191-L193 VanDerWaalsContact C-N 3.32Å; D191-L193 PolarHBondContact O-N 2.86Å; L193-A196 PolarHBondContact O-N 3.48Å; L193-V197 PolarHBondContact O-N 3.06Å
194	L	94.2	Very high	91.9	Very high	35 Å²	35	45 Å²	45	18%	0.183	25%	0.247	C	C	.	.	H	α-helix	trans	-77	-28.5	-173	-170.8	51.6	0	0	0	112.3	A190 D191 A196 V197 C198 A246 H247 L250	A190-L194 WeakPolarHBondContact O-CB 3.49Å; A190-L194 PolarHBondContact O-N 3.43Å; D191-L194 PolarHBondContact O-N 3.47Å; L194-A196 VanDerWaalsContact C-N 3.32Å; L194-A196 PolarHBondContact O-N 3.08Å; L194-V197 PolarHBondContact O-N 2.82Å; L194-C198 VanDerWaalsContact O-CB 3.26Å; L194-C198 WeakPolarHBondContact O-CB 3.25Å; L194-C198 PolarHBondContact O-N 3.34Å; L194-C198 PolarHBondContact O-SG 3.04Å; L194-A246 HydrophobicContact CD2-CB 3.95Å; L194-H247 HydrophobicContact CD2-CB 3.95Å; L194-H247 HydrophobicContact CG-CB 3.92Å; L194-L250 HydrophobicContact CB-CD1 4.3Å; L194-L250 HydrophobicContact CD2-CD1 3.87Å
195	S	92.5	Very high	92.2	Very high	5 Å²	5	44.3 Å²	44.3	4%	0.035	24%	0.244	C	C	.	.	H	α-helix	trans	-56.9	-44.7	169.4	-68.5	0	0	0	0	111.8	D191 Q199 H247 T400	D191-S195 WeakPolarHBondContact O-CB 3.45Å; D191-S195 PolarHBondContact O-N 3.24Å; D191-S195 PolarHBondContact O-OG 2.99Å; D191-S195 PolarHBondContact OD1-OG 3.41Å; S195-Q199 WeakPolarHBondContact O-CG 3.3Å; S195-Q199 PolarHBondContact O-N 2.96Å; S195-Q199 VanDerWaalsContact O-N 3.07Å; S195-H247 PolarHBondContact OG-CE1 3.27Å; S195-H247 PolarHBondContact OG-NE2 3.22Å; S195-T400 PolarHBondContact O-OG1 2.99Å
196	A	91.8	Very high	92.4	Very high	46 Å²	46	43.5 Å²	43.5	38%	0.38	24%	0.24	S	C	.	.	H	α-helix	trans	-66.2	-52.2	178.3	0	0	0	0	0	111.4	L193 L194 C198 Q199 D200	L193-A196 PolarHBondContact O-N 3.48Å; L194-A196 VanDerWaalsContact C-N 3.32Å; L194-A196 PolarHBondContact O-N 3.08Å; A196-C198 PolarHBondContact O-N 3.45Å; A196-Q199 WeakPolarHBondContact O-CB 3.41Å; A196-Q199 PolarHBondContact O-N 3.47Å; A196-D200 PolarHBondContact O-N 3.26Å
197	V	94.2	Very high	92.3	Very high	65 Å²	65	45.5 Å²	45.5	39%	0.394	24%	0.244	S	C	.	.	H	α-helix	trans	-59.3	-35.3	178.2	176	0	0	0	0	112	L193 L194 A201	L193-V197 PolarHBondContact O-N 3.06Å; L194-V197 PolarHBondContact O-N 2.82Å; V197-A201 WeakPolarHBondContact O-CB 3.21Å; V197-A201 PolarHBondContact O-N 3.45Å
198	C	93.8	Very high	92.1	Very high	2 Å²	2	46 Å²	46	1%	0.014	25%	0.248	C	C	.	.	H	α-helix	trans	-69.5	-35.6	174.2	-71.9	0	0	0	0	113.2	L194 A196 L202 C243 T400	L194-C198 VanDerWaalsContact O-CB 3.26Å; L194-C198 WeakPolarHBondContact O-CB 3.25Å; L194-C198 PolarHBondContact O-N 3.34Å; L194-C198 PolarHBondContact O-SG 3.04Å; A196-C198 PolarHBondContact O-N 3.45Å; C198-L202 VanDerWaalsContact O-CB 3.32Å; C198-L202 WeakPolarHBondContact O-CB 3.46Å; C198-L202 WeakPolarHBondContact O-CD1 3.27Å; C198-L202 WeakPolarHBondContact O-CG 3.49Å; C198-L202 PolarHBondContact O-N 3.45Å; C198-L202 VanDerWaalsContact O-N 3.08Å; C198-C243 PolarHBondContact SG-O 2.99Å; C198-C243 VanDerWaalsContact SG-O 3.36Å; C198-T400 HydrophobicContact CB-CG2 4.2Å
199	Q	92.1	Very high	92.1	Very high	26 Å²	26	44.6 Å²	44.6	12%	0.121	24%	0.241	C	C	.	.	H	α-helix	trans	-66.1	-50.2	174.9	-74	166.3	30.5	0	0	110.2	S195 A196 A201 L202 D203 G398 T400	S195-Q199 WeakPolarHBondContact O-CG 3.3Å; S195-Q199 PolarHBondContact O-N 2.96Å; S195-Q199 VanDerWaalsContact O-N 3.07Å; A196-Q199 WeakPolarHBondContact O-CB 3.41Å; A196-Q199 PolarHBondContact O-N 3.47Å; Q199-A201 PolarHBondContact O-N 3.44Å; Q199-L202 PolarHBondContact O-N 2.95Å; Q199-D203 WeakPolarHBondContact O-CB 3.28Å; Q199-D203 PolarHBondContact O-N 3.47Å; Q199-G398 VanDerWaalsContact NE2-C 3.29Å; Q199-G398 PolarHBondContact NE2-O 3.49Å; Q199-T400 HydrophobicContact CG-CG2 4.26Å; Q199-T400 PolarHBondContact NE2-OG1 3.06Å
200	D	92.9	Very high	91.8	Very high	100 Å²	100	43.3 Å²	43.3	54%	0.535	24%	0.236	S	C	.	.	H	α-helix	trans	-62.2	-43.2	179.5	-63.1	-28.2	0	0	0	112.2	A196 L202 D203 D204	A196-D200 PolarHBondContact O-N 3.26Å; D200-L202 VanDerWaalsContact C-N 3.34Å; D200-L202 PolarHBondContact O-N 3.23Å; D200-D203 PolarHBondContact O-N 2.99Å; D200-D204 WeakPolarHBondContact O-CB 3.45Å; D200-D204 PolarHBondContact O-N 3.36Å
201	A	93.6	Very high	91.2	Very high	6 Å²	6	48.1 Å²	48.1	5%	0.05	25%	0.251	C	S	.	.	H	α-helix	trans	-68	-31	178.6	0	0	0	0	0	113.3	V197 Q199 F239 A240	V197-A201 WeakPolarHBondContact O-CB 3.21Å; V197-A201 PolarHBondContact O-N 3.45Å; Q199-A201 PolarHBondContact O-N 3.44Å; A201-F239 HydrophobicContact CB-CD1 3.82Å; A201-F239 HydrophobicContact CB-CE1 3.61Å; A201-A240 HydrophobicContact CB-CB 4.33Å
202	L	93.3	Very high	89.9	Confident	15 Å²	15	52.6 Å²	52.6	8%	0.079	28%	0.281	C	S	.	.	H	α-helix	trans	-72.4	-51.6	171	-74.1	168.6	0	0	0	110	L152 C198 Q199 D200 D204 L205 L206 A240 I402	L152-L202 HydrophobicContact CD1-CD2 3.73Å; C198-L202 VanDerWaalsContact O-CB 3.32Å; C198-L202 WeakPolarHBondContact O-CB 3.46Å; C198-L202 WeakPolarHBondContact O-CD1 3.27Å; C198-L202 WeakPolarHBondContact O-CG 3.49Å; C198-L202 PolarHBondContact O-N 3.45Å; C198-L202 VanDerWaalsContact O-N 3.08Å; Q199-L202 PolarHBondContact O-N 2.95Å; D200-L202 VanDerWaalsContact C-N 3.34Å; D200-L202 PolarHBondContact O-N 3.23Å; L202-D204 VanDerWaalsContact C-N 3.31Å; L202-D204 PolarHBondContact O-N 2.87Å; L202-L205 WeakPolarHBondContact O-CB 3.18Å; L202-L205 PolarHBondContact O-N 3.45Å; L202-L205 VanDerWaalsContact O-N 3.12Å; L202-L206 VanDerWaalsContact O-CG 3.27Å; L202-L206 WeakPolarHBondContact O-CG 3.2Å; L202-L206 PolarHBondContact O-N 3.29Å; L202-A240 HydrophobicContact CD2-CB 4.38Å; L202-I402 HydrophobicContact CD1-CD1 4.15Å
203	D	90.4	Very high	88.5	Confident	55 Å²	55	53.7 Å²	53.7	29%	0.294	29%	0.285	S	S	.	.	H	α-helix	trans	-59.1	-38.7	-176.4	-81.5	-5	0	0	0	112.5	Q199 D200 L206 F207 R395	Q199-D203 WeakPolarHBondContact O-CB 3.28Å; Q199-D203 PolarHBondContact O-N 3.47Å; D200-D203 PolarHBondContact O-N 2.99Å; D203-L206 PolarHBondContact O-N 2.9Å; D203-F207 WeakPolarHBondContact O-CB 3.26Å; D203-F207 PolarHBondContact O-N 3.01Å; D203-R395 WeakPolarHBondContact OD2-CD 3.45Å
204	D	91.9	Very high	86.6	Confident	78 Å²	78	52.7 Å²	52.7	42%	0.417	29%	0.288	S	S	.	.	H	α-helix	trans	-61.9	-46.8	173.7	-178.8	42.9	0	0	0	112.6	D200 L202 L206 F207 T208 Q236	D200-D204 WeakPolarHBondContact O-CB 3.45Å; D200-D204 PolarHBondContact O-N 3.36Å; L202-D204 VanDerWaalsContact C-N 3.31Å; L202-D204 PolarHBondContact O-N 2.87Å; D204-L206 PolarHBondContact O-N 3.27Å; D204-F207 PolarHBondContact O-N 3.29Å; D204-T208 PolarHBondContact O-N 3.5Å; D204-T208 PolarHBondContact O-OG1 3.12Å; D204-Q236 PolarHBondContact OD1-NE2 3.31Å; D204-Q236 PolarHBondContact OD2-NE2 2.86Å
205	L	93.4	Very high	84.3	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-59.3	-48.3	174.1	171.8	62.4	0	0	0	111.4	I148 L152 L202 F207 T208 I209 V233 Q236 Y237 A240	I148-L205 HydrophobicContact CG2-CD2 3.89Å; I148-L205 HydrophobicContact CG2-CG 4.39Å; L152-L205 HydrophobicContact CD1-CD2 4.08Å; L202-L205 WeakPolarHBondContact O-CB 3.18Å; L202-L205 PolarHBondContact O-N 3.45Å; L202-L205 VanDerWaalsContact O-N 3.12Å; L205-F207 VanDerWaalsContact C-N 3.32Å; L205-F207 PolarHBondContact O-N 3.38Å; L205-T208 PolarHBondContact O-N 3.4Å; L205-I209 HydrophobicContact CD1-CD1 3.83Å; L205-I209 HydrophobicContact CD1-CG1 4.44Å; L205-I209 HydrophobicContact CG-CD1 3.86Å; L205-I209 WeakPolarHBondContact O-CB 3.39Å; L205-I209 VanDerWaalsContact O-CD1 3.28Å; L205-I209 WeakPolarHBondContact O-CD1 3.5Å; L205-I209 VanDerWaalsContact O-CG1 3.26Å; L205-I209 WeakPolarHBondContact O-CG1 3.48Å; L205-I209 PolarHBondContact O-N 2.93Å; L205-V233 HydrophobicContact CD1-CG1 4.29Å; L205-Q236 HydrophobicContact CB-CB 4.22Å; L205-Q236 HydrophobicContact CD1-CB 3.89Å; L205-Y237 HydrophobicContact CD2-CD2 4.29Å; L205-A240 HydrophobicContact CD2-CB 3.99Å
206	L	90.5	Very high	82.3	Confident	13 Å²	13	60.6 Å²	60.6	7%	0.068	34%	0.335	C	S	.	.	H	α-helix	trans	-68.5	-31.5	-179.4	-55.4	-174.5	0	0	0	112	R145 K149 L202 D203 D204 I209 S210	R145-L206 HydrophobicContact CG-CB 4.16Å; R145-L206 HydrophobicContact CG-CD1 4.2Å; R145-L206 HydrophobicContact CG-CD2 3.7Å; R145-L206 HydrophobicContact CG-CG 4.18Å; K149-L206 HydrophobicContact CD-CD1 4.46Å; K149-L206 HydrophobicContact CG-CD1 4.45Å; K149-L206 HydrophobicContact CG-CD2 4.31Å; L202-L206 VanDerWaalsContact O-CG 3.27Å; L202-L206 WeakPolarHBondContact O-CG 3.2Å; L202-L206 PolarHBondContact O-N 3.29Å; D203-L206 PolarHBondContact O-N 2.9Å; D204-L206 PolarHBondContact O-N 3.27Å; L206-I209 HydrophobicContact CD2-CD1 4.23Å; L206-S210 VanDerWaalsContact O-CB 3.25Å; L206-S210 WeakPolarHBondContact O-CB 3.11Å; L206-S210 PolarHBondContact O-N 3.47Å; L206-S210 PolarHBondContact O-OG 3.46Å
207	F	88.6	Confident	80.3	Confident	148 Å²	148	65 Å²	65	65%	0.649	36%	0.357	S	S	*	.	H	α-helix	trans	-65.7	-48.6	172.5	177	-103	0	0	0	111.7	D203 D204 L205 I209 S210 K211	D203-F207 WeakPolarHBondContact O-CB 3.26Å; D203-F207 PolarHBondContact O-N 3.01Å; D204-F207 PolarHBondContact O-N 3.29Å; L205-F207 VanDerWaalsContact C-N 3.32Å; L205-F207 PolarHBondContact O-N 3.38Å; F207-I209 VanDerWaalsContact C-N 3.33Å; F207-I209 PolarHBondContact O-N 2.86Å; F207-S210 PolarHBondContact O-N 3.45Å; F207-K211 PolarHBondContact O-N 2.89Å
208	T	89.1	Confident	78.2	Confident	22 Å²	22	67.8 Å²	67.8	14%	0.135	37%	0.369	C	S	.	.	H	α-helix	trans	-60	-42.4	176.1	-58.6	0	0	0	0	111.9	D204 L205 S210 K211 F229 V233 Q236	D204-T208 PolarHBondContact O-N 3.5Å; D204-T208 PolarHBondContact O-OG1 3.12Å; L205-T208 PolarHBondContact O-N 3.4Å; T208-S210 VanDerWaalsContact C-N 3.29Å; T208-S210 PolarHBondContact O-N 3.11Å; T208-K211 VanDerWaalsContact O-CB 3.24Å; T208-K211 WeakPolarHBondContact O-CB 3.25Å; T208-K211 PolarHBondContact O-N 2.87Å; T208-F229 HydrophobicContact CG2-CE2 4.17Å; T208-F229 WeakPolarHBondContact O-CE2 3.5Å; T208-V233 HydrophobicContact CG2-CG2 3.69Å; T208-Q236 VanDerWaalsContact OG1-CD 3.29Å; T208-Q236 PolarHBondContact OG1-NE2 3.07Å; T208-Q236 PolarHBondContact OG1-OE1 3.4Å
209	I	88.4	Confident	76.3	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-59.5	-39.9	172.7	-73.2	158.7	0	0	0	111.9	N141 L144 R145 I148 L205 L206 F207 K211 V233	N141-I209 PolarHBondContact ND2-O 3.03Å; L144-I209 HydrophobicContact CB-CG2 4.24Å; L144-I209 HydrophobicContact CD2-CG2 4.03Å; L144-I209 HydrophobicContact CG-CG2 4.45Å; R145-I209 HydrophobicContact CB-CG2 4.13Å; I148-I209 HydrophobicContact CB-CD1 4.17Å; I148-I209 HydrophobicContact CD1-CD1 3.4Å; I148-I209 HydrophobicContact CD1-CG1 4.01Å; I148-I209 HydrophobicContact CG1-CD1 4.35Å; I148-I209 HydrophobicContact CG2-CD1 3.92Å; L205-I209 HydrophobicContact CD1-CD1 3.83Å; L205-I209 HydrophobicContact CD1-CG1 4.44Å; L205-I209 HydrophobicContact CG-CD1 3.86Å; L205-I209 WeakPolarHBondContact O-CB 3.39Å; L205-I209 VanDerWaalsContact O-CD1 3.28Å; L205-I209 WeakPolarHBondContact O-CD1 3.5Å; L205-I209 VanDerWaalsContact O-CG1 3.26Å; L205-I209 WeakPolarHBondContact O-CG1 3.48Å; L205-I209 PolarHBondContact O-N 2.93Å; L206-I209 HydrophobicContact CD2-CD1 4.23Å; F207-I209 VanDerWaalsContact C-N 3.33Å; F207-I209 PolarHBondContact O-N 2.86Å; I209-K211 VanDerWaalsContact C-N 3.32Å; I209-V233 HydrophobicContact CG1-CG1 4.38Å
210	S	84.9	Confident	74.6	Confident	56 Å²	56	76.9 Å²	76.9	39%	0.392	43%	0.425	S	S	.	.	H	α-helix	trans	-76.4	-19.6	-176	-61.8	0	0	0	0	113.3	N141 L206 F207 T208	N141-S210 PolarHBondContact ND2-O 3.37Å; L206-S210 VanDerWaalsContact O-CB 3.25Å; L206-S210 WeakPolarHBondContact O-CB 3.11Å; L206-S210 PolarHBondContact O-N 3.47Å; L206-S210 PolarHBondContact O-OG 3.46Å; F207-S210 PolarHBondContact O-N 3.45Å; T208-S210 VanDerWaalsContact C-N 3.29Å; T208-S210 PolarHBondContact O-N 3.11Å
211	K	81.5	Confident	73	Confident	131 Å²	131	75.7 Å²	75.7	57%	0.57	42%	0.419	S	S	*	.	S	Bend	trans	-46.9	126.7	178.7	-170.1	175.7	-177.9	177.3	0	110.7	N141 F207 T208 I209 R213	N141-K211 PolarHBondContact ND2-O 3.46Å; N141-K211 VanDerWaalsContact ND2-O 3.15Å; F207-K211 PolarHBondContact O-N 2.89Å; T208-K211 VanDerWaalsContact O-CB 3.24Å; T208-K211 WeakPolarHBondContact O-CB 3.25Å; T208-K211 PolarHBondContact O-N 2.87Å; I209-K211 VanDerWaalsContact C-N 3.32Å; K211-R213 PolarHBondContact O-N 3.3Å
212	P	66.4	Low	71.4	Confident	98 Å²	98	78.1 Å²	78.1	64%	0.636	43%	0.431	S	S	*	.			trans	-64.2	131.5	179.7	25.6	-33.2	0	0	0	109.7	S214	P212-S214 PolarHBondContact O-N 2.91Å
213	R	62.7	Low	70.1	Confident	110 Å²	110	85.3 Å²	85.3	42%	0.415	46%	0.464	S	S	.	.			trans	-72.8	67.6	167.2	-66.8	-174.3	179.6	88.1	0.3	109	N141 K211 D215	N141-R213 PolarHBondContact OD1-NH1 3.22Å; K211-R213 PolarHBondContact O-N 3.3Å; R213-D215 PolarHBondContact O-N 3.42Å
214	S	52.4	Low	69.3	Low	96 Å²	96	88.9 Å²	88.9	67%	0.671	48%	0.479	S	S	*	.			trans	-72.4	92.5	-173.3	-179.1	0	0	0	0	110.8	P212 S216	P212-S214 PolarHBondContact O-N 2.91Å; S214-S216 PolarHBondContact O-N 2.96Å
215	D	46.8	Very low	68.5	Low	135 Å²	135	89.8 Å²	89.8	72%	0.722	48%	0.483	S	S	*	.			trans	37.4	79	155.9	-59.8	-28.6	0	0	0	115.3	R213 V217	R213-D215 PolarHBondContact O-N 3.42Å; D215-V217 HydrophobicContact CB-CG2 4.05Å; D215-V217 PolarHBondContact O-N 3.24Å
216	S	49.7	Very low	67.9	Low	71 Å²	71	92.6 Å²	92.6	50%	0.497	50%	0.503	S	S	.	.			trans	-69.5	77.5	166	56.9	0	0	0	0	110.2	S214 L218 L222	S214-S216 PolarHBondContact O-N 2.96Å; S216-L218 PolarHBondContact O-N 3.39Å; S216-L218 VanDerWaalsContact O-N 3.11Å; S216-L222 VanDerWaalsContact OG-CD2 3.25Å; S216-L222 WeakPolarHBondContact OG-CD2 3.49Å
217	V	49.9	Very low	67.6	Low	138 Å²	138	99.2 Å²	99.2	84%	0.836	53%	0.532	S	S	*	.			trans	-68.3	-2.6	-176	170.7	0	0	0	0	113.5	D215	D215-V217 HydrophobicContact CB-CG2 4.05Å; D215-V217 PolarHBondContact O-N 3.24Å
218	L	49.3	Very low	67.5	Low	123 Å²	123	95.5 Å²	95.5	64%	0.644	52%	0.518	S	S	*	.	S	Bend	trans	-111.3	114	173.6	-161.9	67.1	0	0	0	110.5	S216 N220	S216-L218 PolarHBondContact O-N 3.39Å; S216-L218 VanDerWaalsContact O-N 3.11Å; L218-N220 VanDerWaalsContact C-N 3.28Å; L218-N220 PolarHBondContact O-N 2.97Å; L218-N220 VanDerWaalsContact O-N 3.12Å
219	S	54.5	Low	67.4	Low	88 Å²	88	96.3 Å²	96.3	62%	0.615	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-16.8	-161.3	50.7	0	0	0	0	116.8
220	N	56.3	Low	67.4	Low	131 Å²	131	101.7 Å²	101.7	70%	0.701	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-26.4	-165.3	-62.4	15.9	0	0	0	113	L218 L222	L218-N220 VanDerWaalsContact C-N 3.28Å; L218-N220 PolarHBondContact O-N 2.97Å; L218-N220 VanDerWaalsContact O-N 3.12Å; N220-L222 PolarHBondContact O-N 3.02Å
221	N	58.7	Low	67.7	Low	76 Å²	76	104.8 Å²	104.8	41%	0.406	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	13.9	-179	-56.8	28.9	0	0	0	111.8	N225	N221-N225 WeakPolarHBondContact O-CB 3.24Å; N221-N225 PolarHBondContact O-N 3.47Å; N221-N225 PolarHBondContact O-ND2 3.34Å
222	L	60.2	Low	68.1	Low	57 Å²	57	101.2 Å²	101.2	30%	0.298	53%	0.53	S	S	.	.	H	α-helix	trans	-67	-43.9	-173.4	-107.5	163.1	0	0	0	112.3	T133 S216 N220 S226	T133-L222 HydrophobicContact CG2-CD1 3.73Å; S216-L222 VanDerWaalsContact OG-CD2 3.25Å; S216-L222 WeakPolarHBondContact OG-CD2 3.49Å; N220-L222 PolarHBondContact O-N 3.02Å; L222-S226 VanDerWaalsContact O-CB 3.24Å; L222-S226 WeakPolarHBondContact O-CB 3.49Å; L222-S226 PolarHBondContact O-N 2.81Å; L222-S226 VanDerWaalsContact O-N 3.09Å
223	E	67.6	Low	69.3	Low	166 Å²	166	96.8 Å²	96.8	78%	0.776	50%	0.502	S	S	*	.	H	α-helix	trans	-72.7	-44.4	-175.9	-60	-168.1	155.2	0	0	111.8	S226 F227	E223-S226 PolarHBondContact O-N 3.04Å; E223-F227 WeakPolarHBondContact O-CB 3.14Å; E223-F227 PolarHBondContact O-N 3.03Å
224	E	73.2	Confident	70.8	Confident	130 Å²	130	95.5 Å²	95.5	61%	0.607	51%	0.506	S	S	*	.	H	α-helix	trans	-60.3	-48.5	176.8	-63.9	-172.5	147.7	0	0	112.1	S226 F227 I228	E224-S226 VanDerWaalsContact C-N 3.32Å; E224-S226 PolarHBondContact O-N 3.41Å; E224-F227 PolarHBondContact O-N 2.97Å; E224-I228 WeakPolarHBondContact O-CB 3.11Å; E224-I228 VanDerWaalsContact O-CG1 3.29Å; E224-I228 WeakPolarHBondContact O-CG1 3.47Å; E224-I228 PolarHBondContact O-N 3.31Å
225	N	75.3	Confident	72.8	Confident	96 Å²	96	96.1 Å²	96.1	51%	0.513	50%	0.501	S	S	.	.	H	α-helix	trans	-65.2	-35.5	178.6	-77.6	-66.5	0	0	0	112.2	N221 F229	N221-N225 WeakPolarHBondContact O-CB 3.24Å; N221-N225 PolarHBondContact O-N 3.47Å; N221-N225 PolarHBondContact O-ND2 3.34Å; N225-F229 WeakPolarHBondContact O-CB 3.26Å; N225-F229 PolarHBondContact O-N 2.67Å
226	S	79.9	Confident	75.1	Confident	60 Å²	60	91.3 Å²	91.3	42%	0.42	47%	0.474	S	S	.	.	H	α-helix	trans	-65.9	-45.2	173.8	-173.6	0	0	0	0	111.5	L222 E223 E224 F229 W230	L222-S226 VanDerWaalsContact O-CB 3.24Å; L222-S226 WeakPolarHBondContact O-CB 3.49Å; L222-S226 PolarHBondContact O-N 2.81Å; L222-S226 VanDerWaalsContact O-N 3.09Å; E223-S226 PolarHBondContact O-N 3.04Å; E224-S226 VanDerWaalsContact C-N 3.32Å; E224-S226 PolarHBondContact O-N 3.41Å; S226-F229 PolarHBondContact O-N 3.12Å; S226-W230 PolarHBondContact O-N 2.86Å
227	F	84.8	Confident	77.3	Confident	152 Å²	152	90 Å²	90	67%	0.667	46%	0.459	S	S	*	.	H	α-helix	trans	-63.5	-44.2	177.8	-179.2	-98.9	0	0	0	112.2	E223 E224 W230 R231	E223-F227 WeakPolarHBondContact O-CB 3.14Å; E223-F227 PolarHBondContact O-N 3.03Å; E224-F227 PolarHBondContact O-N 2.97Å; F227-W230 PolarHBondContact O-N 3.43Å; F227-R231 VanDerWaalsContact O-CB 3.31Å; F227-R231 WeakPolarHBondContact O-CB 3.16Å; F227-R231 PolarHBondContact O-N 2.83Å
228	I	86.5	Confident	79.5	Confident	70 Å²	70	86.1 Å²	86.1	36%	0.359	44%	0.437	S	S	.	.	H	α-helix	trans	-59.8	-47.4	174.7	-71	165.3	0	0	0	110.6	E224 W230 R231 D232	E224-I228 WeakPolarHBondContact O-CB 3.11Å; E224-I228 VanDerWaalsContact O-CG1 3.29Å; E224-I228 WeakPolarHBondContact O-CG1 3.47Å; E224-I228 PolarHBondContact O-N 3.31Å; I228-W230 PolarHBondContact O-N 3.37Å; I228-R231 WeakPolarHBondContact O-CB 3.22Å; I228-R231 PolarHBondContact O-N 3.33Å; I228-D232 PolarHBondContact O-N 3.37Å
229	F	87.1	Confident	81.8	Confident	38 Å²	38	85.8 Å²	85.8	17%	0.167	43%	0.43	C	S	.	.	H	α-helix	trans	-59.1	-47.2	176.7	174.5	-92.8	0	0	0	112.5	T208 N225 S226 D232 V233	T208-F229 HydrophobicContact CG2-CE2 4.17Å; T208-F229 WeakPolarHBondContact O-CE2 3.5Å; N225-F229 WeakPolarHBondContact O-CB 3.26Å; N225-F229 PolarHBondContact O-N 2.67Å; S226-F229 PolarHBondContact O-N 3.12Å; F229-D232 PolarHBondContact O-N 2.97Å; F229-V233 HydrophobicContact CD1-CG2 4.35Å; F229-V233 HydrophobicContact CE1-CG2 3.88Å; F229-V233 HydrophobicContact CE2-CG2 4.16Å; F229-V233 HydrophobicContact CZ-CG2 3.79Å; F229-V233 WeakPolarHBondContact O-CG2 3.49Å; F229-V233 PolarHBondContact O-N 2.93Å
230	W	88.2	Confident	83.8	Confident	114 Å²	114	81.7 Å²	81.7	43%	0.432	40%	0.402	S	S	.	.	H	α-helix	trans	-67.8	-36.9	179.2	-80.8	113	0	0	0	112.8	S226 F227 I228 D232 V234	S226-W230 PolarHBondContact O-N 2.86Å; F227-W230 PolarHBondContact O-N 3.43Å; I228-W230 PolarHBondContact O-N 3.37Å; W230-D232 VanDerWaalsContact C-N 3.34Å; W230-V234 WeakPolarHBondContact O-CB 3.24Å; W230-V234 VanDerWaalsContact O-CG2 3.24Å; W230-V234 WeakPolarHBondContact O-CG2 3.27Å; W230-V234 PolarHBondContact O-N 3.09Å
231	R	90.5	Very high	85.7	Confident	120 Å²	120	77.1 Å²	77.1	45%	0.453	38%	0.376	S	S	.	.	H	α-helix	trans	-56.5	-49.2	171.2	178.9	-159.1	70.7	-166.8	-0.8	110.7	F227 I228 V234 L235	F227-R231 VanDerWaalsContact O-CB 3.31Å; F227-R231 WeakPolarHBondContact O-CB 3.16Å; F227-R231 PolarHBondContact O-N 2.83Å; I228-R231 WeakPolarHBondContact O-CB 3.22Å; I228-R231 PolarHBondContact O-N 3.33Å; R231-V234 PolarHBondContact O-N 3.15Å; R231-L235 HydrophobicContact CG-CD1 4.04Å; R231-L235 WeakPolarHBondContact O-CG 3.37Å; R231-L235 PolarHBondContact O-N 3.26Å
232	D	90.5	Very high	87.6	Confident	57 Å²	57	79.9 Å²	79.9	31%	0.305	39%	0.385	S	S	.	.	H	α-helix	trans	-67.9	-42.1	-175.5	-64.1	-14.3	0	0	0	111.3	I228 F229 W230 V234 L235 Q236	I228-D232 PolarHBondContact O-N 3.37Å; F229-D232 PolarHBondContact O-N 2.97Å; W230-D232 VanDerWaalsContact C-N 3.34Å; D232-V234 PolarHBondContact O-N 3.06Å; D232-L235 PolarHBondContact O-N 2.81Å; D232-Q236 WeakPolarHBondContact O-CG 3.31Å; D232-Q236 PolarHBondContact O-N 3.01Å
233	V	91.5	Very high	89.3	Confident	5 Å²	5	77.9 Å²	77.9	3%	0.03	38%	0.375	C	S	.	.	H	α-helix	trans	-60.7	-40.6	171.9	170.6	0	0	0	0	112	L205 T208 I209 F229 Y237	L205-V233 HydrophobicContact CD1-CG1 4.29Å; T208-V233 HydrophobicContact CG2-CG2 3.69Å; I209-V233 HydrophobicContact CG1-CG1 4.38Å; F229-V233 HydrophobicContact CD1-CG2 4.35Å; F229-V233 HydrophobicContact CE1-CG2 3.88Å; F229-V233 HydrophobicContact CE2-CG2 4.16Å; F229-V233 HydrophobicContact CZ-CG2 3.79Å; F229-V233 WeakPolarHBondContact O-CG2 3.49Å; F229-V233 PolarHBondContact O-N 2.93Å; V233-Y237 WeakPolarHBondContact O-CB 3.35Å; V233-Y237 PolarHBondContact O-N 3.47Å
234	V	93.7	Very high	90.6	Very high	82 Å²	82	70 Å²	70	50%	0.497	34%	0.338	S	S	.	.	H	α-helix	trans	-68.1	-40.8	177.7	167	0	0	0	0	111.5	W230 R231 D232 Y237 C238	W230-V234 WeakPolarHBondContact O-CB 3.24Å; W230-V234 VanDerWaalsContact O-CG2 3.24Å; W230-V234 WeakPolarHBondContact O-CG2 3.27Å; W230-V234 PolarHBondContact O-N 3.09Å; R231-V234 PolarHBondContact O-N 3.15Å; D232-V234 PolarHBondContact O-N 3.06Å; V234-Y237 PolarHBondContact O-N 2.83Å; V234-C238 WeakPolarHBondContact O-CB 3.25Å; V234-C238 PolarHBondContact O-N 2.83Å; V234-C238 PolarHBondContact O-SG 3.18Å; V234-C238 VanDerWaalsContact O-SG 3.38Å
235	L	94.8	Very high	91.7	Very high	109 Å²	109	64.7 Å²	64.7	57%	0.571	31%	0.314	S	S	*	.	H	α-helix	trans	-63.9	-45.7	176.2	-71	170.9	0	0	0	111.7	R231 D232 C238 F239	R231-L235 HydrophobicContact CG-CD1 4.04Å; R231-L235 WeakPolarHBondContact O-CG 3.37Å; R231-L235 PolarHBondContact O-N 3.26Å; D232-L235 PolarHBondContact O-N 2.81Å; L235-C238 PolarHBondContact O-N 2.69Å; L235-F239 PolarHBondContact O-N 3.27Å
236	Q	94.3	Very high	92.7	Very high	34 Å²	34	62.3 Å²	62.3	16%	0.159	31%	0.307	C	S	.	.	H	α-helix	trans	-63	-40.7	173.7	-73.7	174.6	-35.2	0	0	112	D204 L205 T208 D232 F239 A240	D204-Q236 PolarHBondContact OD1-NE2 3.31Å; D204-Q236 PolarHBondContact OD2-NE2 2.86Å; L205-Q236 HydrophobicContact CB-CB 4.22Å; L205-Q236 HydrophobicContact CD1-CB 3.89Å; T208-Q236 VanDerWaalsContact OG1-CD 3.29Å; T208-Q236 PolarHBondContact OG1-NE2 3.07Å; T208-Q236 PolarHBondContact OG1-OE1 3.4Å; D232-Q236 WeakPolarHBondContact O-CG 3.31Å; D232-Q236 PolarHBondContact O-N 3.01Å; Q236-F239 PolarHBondContact O-N 3.14Å; Q236-A240 WeakPolarHBondContact O-CB 3.42Å; Q236-A240 PolarHBondContact O-N 2.9Å
237	Y	96.3	Very high	93.5	Very high	45 Å²	45	59.5 Å²	59.5	18%	0.176	29%	0.288	C	S	.	.	H	α-helix	trans	-61.2	-45.4	175.9	-178	-78.6	0	0	0	111.3	I148 S151 L152 I155 L205 V233 V234 F241	I148-Y237 HydrophobicContact CG2-CD2 3.97Å; I148-Y237 HydrophobicContact CG2-CE2 4.11Å; S151-Y237 PolarHBondContact OG-OH 3.22Å; L152-Y237 HydrophobicContact CD1-CE2 4.39Å; L152-Y237 HydrophobicContact CD2-CD1 4.47Å; L152-Y237 HydrophobicContact CD2-CD2 4.23Å; L152-Y237 HydrophobicContact CD2-CE1 3.95Å; L152-Y237 HydrophobicContact CD2-CE2 3.72Å; L152-Y237 HydrophobicContact CG-CD2 4.36Å; L152-Y237 HydrophobicContact CG-CE2 3.72Å; I155-Y237 WeakPolarHBondContact CD1-OH 3.26Å; L205-Y237 HydrophobicContact CD2-CD2 4.29Å; V233-Y237 WeakPolarHBondContact O-CB 3.35Å; V233-Y237 PolarHBondContact O-N 3.47Å; V234-Y237 PolarHBondContact O-N 2.83Å; Y237-F241 WeakPolarHBondContact O-CB 3.5Å; Y237-F241 PolarHBondContact O-N 3.46Å
238	C	96.7	Very high	94	Very high	56 Å²	56	52.3 Å²	52.3	38%	0.378	26%	0.256	S	S	.	.	H	α-helix	trans	-62.4	-42.7	175.5	-73.4	0	0	0	0	112.1	V234 L235 F241 F242	V234-C238 WeakPolarHBondContact O-CB 3.25Å; V234-C238 PolarHBondContact O-N 2.83Å; V234-C238 PolarHBondContact O-SG 3.18Å; V234-C238 VanDerWaalsContact O-SG 3.38Å; L235-C238 PolarHBondContact O-N 2.69Å; C238-F241 PolarHBondContact O-N 2.9Å; C238-F242 WeakPolarHBondContact O-CD2 3.34Å; C238-F242 PolarHBondContact O-N 3.14Å
239	F	96.8	Very high	94.4	Very high	115 Å²	115	52.3 Å²	52.3	50%	0.504	25%	0.253	S	S	.	.	H	α-helix	trans	-63.3	-51.7	176.7	178.8	-112	0	0	0	112.1	A201 L235 Q236 F241 F242 C243	A201-F239 HydrophobicContact CB-CD1 3.82Å; A201-F239 HydrophobicContact CB-CE1 3.61Å; L235-F239 PolarHBondContact O-N 3.27Å; Q236-F239 PolarHBondContact O-N 3.14Å; F239-F241 VanDerWaalsContact C-N 3.27Å; F239-F241 PolarHBondContact O-N 3.48Å; F239-F242 PolarHBondContact O-N 3.27Å; F239-F242 VanDerWaalsContact O-N 3.13Å; F239-C243 PolarHBondContact O-N 3.01Å; F239-C243 PolarHBondContact O-SG 3.24Å
240	A	96.6	Very high	94.7	Very high	2 Å²	2	51.3 Å²	51.3	2%	0.017	25%	0.25	C	C	.	.	H	α-helix	trans	-58.9	-38.6	176.5	0	0	0	0	0	112	A201 L202 L205 Q236 L244	A201-A240 HydrophobicContact CB-CB 4.33Å; L202-A240 HydrophobicContact CD2-CB 4.38Å; L205-A240 HydrophobicContact CD2-CB 3.99Å; Q236-A240 WeakPolarHBondContact O-CB 3.42Å; Q236-A240 PolarHBondContact O-N 2.9Å; A240-L244 WeakPolarHBondContact O-CB 3.12Å; A240-L244 PolarHBondContact O-N 2.83Å
241	F	97.3	Very high	95	Very high	36 Å²	36	46 Å²	46	16%	0.158	23%	0.23	C	C	.	.	H	α-helix	trans	-62.5	-45.9	173.3	170.3	-105.2	0	0	0	112.6	L152 I155 I159 Y237 C238 F239 L244 I245	L152-F241 HydrophobicContact CD2-CB 3.78Å; L152-F241 HydrophobicContact CD2-CD2 4.27Å; I155-F241 HydrophobicContact CB-CE2 4.38Å; I155-F241 HydrophobicContact CG2-CD2 4.45Å; I155-F241 HydrophobicContact CG2-CE2 3.62Å; I155-F241 HydrophobicContact CG2-CZ 4.12Å; I159-F241 HydrophobicContact CD1-CE2 3.97Å; I159-F241 HydrophobicContact CD1-CZ 3.58Å; Y237-F241 WeakPolarHBondContact O-CB 3.5Å; Y237-F241 PolarHBondContact O-N 3.46Å; C238-F241 PolarHBondContact O-N 2.9Å; F239-F241 VanDerWaalsContact C-N 3.27Å; F239-F241 PolarHBondContact O-N 3.48Å; F241-L244 PolarHBondContact O-N 3.39Å; F241-I245 HydrophobicContact CE2-CB 4.47Å; F241-I245 WeakPolarHBondContact O-CB 3.48Å; F241-I245 WeakPolarHBondContact O-CG2 3.48Å; F241-I245 PolarHBondContact O-N 3.11Å
242	F	96.9	Very high	95.2	Very high	134 Å²	134	40.5 Å²	40.5	59%	0.588	21%	0.209	S	C	*	.	H	α-helix	trans	-65.1	-40	177.9	-77.2	-57.4	0	0	0	112.7	C238 F239 I245 A246	C238-F242 WeakPolarHBondContact O-CD2 3.34Å; C238-F242 PolarHBondContact O-N 3.14Å; F239-F242 PolarHBondContact O-N 3.27Å; F239-F242 VanDerWaalsContact O-N 3.13Å; F242-I245 WeakPolarHBondContact O-CG2 3.43Å; F242-A246 WeakPolarHBondContact O-CB 3.36Å; F242-A246 PolarHBondContact O-N 2.87Å
243	C	96.4	Very high	95.2	Very high	15 Å²	15	39.4 Å²	39.4	10%	0.101	21%	0.206	C	C	.	.	H	α-helix	trans	-63.3	-48.8	172.5	-65.7	0	0	0	0	111.1	C198 F239 I245 A246 H247	C198-C243 PolarHBondContact SG-O 2.99Å; C198-C243 VanDerWaalsContact SG-O 3.36Å; F239-C243 PolarHBondContact O-N 3.01Å; F239-C243 PolarHBondContact O-SG 3.24Å; C243-I245 PolarHBondContact O-N 3.21Å; C243-A246 PolarHBondContact O-N 3.18Å; C243-H247 PolarHBondContact O-N 2.92Å
244	L	96.4	Very high	95.3	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-62.9	-44.6	-177.8	179.9	65	0	0	0	112.4	L152 A240 F241 A246 H247 C248 I402 P403	L152-L244 HydrophobicContact CB-CD2 3.81Å; A240-L244 WeakPolarHBondContact O-CB 3.12Å; A240-L244 PolarHBondContact O-N 2.83Å; F241-L244 PolarHBondContact O-N 3.39Å; L244-A246 VanDerWaalsContact C-N 3.35Å; L244-H247 PolarHBondContact O-N 3.38Å; L244-C248 PolarHBondContact O-N 2.98Å; L244-C248 PolarHBondContact O-SG 2.93Å; L244-I402 HydrophobicContact CD1-CB 4.33Å; L244-I402 HydrophobicContact CD1-CG2 4.01Å; L244-I402 HydrophobicContact CD2-CG2 3.88Å; L244-P403 HydrophobicContact CD1-CB 3.73Å; L244-P403 HydrophobicContact CD1-CG 3.85Å
245	I	96.1	Very high	95.2	Very high	18 Å²	18	35.5 Å²	35.5	9%	0.092	18%	0.182	C	C	.	.	H	α-helix	trans	-68.2	-36.2	179.7	-164.2	66.6	0	0	0	111.5	C156 I159 L160 F241 F242 C243 H247 C248 F249	C156-I245 HydrophobicContact CB-CD1 3.98Å; I159-I245 HydrophobicContact CB-CD1 3.94Å; I159-I245 HydrophobicContact CD1-CD1 4.25Å; I159-I245 HydrophobicContact CG2-CD1 3.81Å; I159-I245 HydrophobicContact CG2-CG1 4.31Å; L160-I245 HydrophobicContact CD1-CD1 3.64Å; F241-I245 HydrophobicContact CE2-CB 4.47Å; F241-I245 WeakPolarHBondContact O-CB 3.48Å; F241-I245 WeakPolarHBondContact O-CG2 3.48Å; F241-I245 PolarHBondContact O-N 3.11Å; F242-I245 WeakPolarHBondContact O-CG2 3.43Å; C243-I245 PolarHBondContact O-N 3.21Å; I245-H247 VanDerWaalsContact C-N 3.32Å; I245-H247 PolarHBondContact O-N 3.34Å; I245-C248 HydrophobicContact CD1-CB 4.48Å; I245-C248 PolarHBondContact O-N 3.08Å; I245-F249 HydrophobicContact CD1-CE2 4.24Å; I245-F249 HydrophobicContact CG1-CD2 3.99Å; I245-F249 HydrophobicContact CG1-CE2 3.69Å; I245-F249 VanDerWaalsContact O-CD2 3.23Å; I245-F249 WeakPolarHBondContact O-CD2 3.27Å; I245-F249 PolarHBondContact O-N 3.4Å
246	A	95.9	Very high	95	Very high	45 Å²	45	30.4 Å²	30.4	37%	0.372	16%	0.155	S	C	.	.	H	α-helix	trans	-61.5	-40.4	171.3	0	0	0	0	0	111.5	L194 F242 C243 L244 F249 L250	L194-A246 HydrophobicContact CD2-CB 3.95Å; F242-A246 WeakPolarHBondContact O-CB 3.36Å; F242-A246 PolarHBondContact O-N 2.87Å; C243-A246 PolarHBondContact O-N 3.18Å; L244-A246 VanDerWaalsContact C-N 3.35Å; A246-F249 PolarHBondContact O-N 3.14Å; A246-L250 WeakPolarHBondContact O-CB 3.45Å; A246-L250 PolarHBondContact O-N 3.28Å
247	H	96.9	Very high	94.8	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.009	15%	0.148	C	C	.	.	H	α-helix	trans	-66.3	-42	175.6	-162.3	-170.5	0	0	0	111.8	D191 L194 S195 C243 L244 I245 F249 L250 L251 P403	D191-H247 IonicContact OD1-CD2 3.78Å; D191-H247 IonicContact OD1-CE1 3.7Å; D191-H247 IonicContact OD1-NE2 2.78Å; D191-H247 PolarHBondContact OD1-NE2 3.1Å; L194-H247 HydrophobicContact CD2-CB 3.95Å; L194-H247 HydrophobicContact CG-CB 3.92Å; S195-H247 PolarHBondContact OG-CE1 3.27Å; S195-H247 PolarHBondContact OG-NE2 3.22Å; C243-H247 PolarHBondContact O-N 2.92Å; L244-H247 PolarHBondContact O-N 3.38Å; I245-H247 VanDerWaalsContact C-N 3.32Å; I245-H247 PolarHBondContact O-N 3.34Å; H247-F249 VanDerWaalsContact C-N 3.34Å; H247-F249 PolarHBondContact O-N 3.36Å; H247-L250 WeakPolarHBondContact O-CB 3.3Å; H247-L250 PolarHBondContact O-N 3.05Å; H247-L251 WeakPolarHBondContact O-CG 3.38Å; H247-L251 PolarHBondContact O-N 3.41Å; H247-P403 HydrophobicContact CB-CB 4.2Å; H247-P403 HydrophobicContact CB-CG 4.48Å; H247-P403 VanDerWaalsContact ND1-CG 3.28Å; H247-P403 WeakPolarHBondContact ND1-CG 3.47Å
248	C	95.8	Very high	94.5	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.4	-42.4	175.4	-64.5	0	0	0	0	112.1	L160 L244 I245 L252 C406	L160-C248 HydrophobicContact CD1-CB 3.53Å; L160-C248 HydrophobicContact CD2-CB 3.75Å; L160-C248 HydrophobicContact CG-CB 4.28Å; L244-C248 PolarHBondContact O-N 2.98Å; L244-C248 PolarHBondContact O-SG 2.93Å; I245-C248 HydrophobicContact CD1-CB 4.48Å; I245-C248 PolarHBondContact O-N 3.08Å; C248-L252 WeakPolarHBondContact O-CB 3.42Å; C248-L252 PolarHBondContact O-N 3.05Å; C248-L252 VanDerWaalsContact O-N 3.08Å; C248-C406 VanDerWaalsContact SG-CB 3.53Å
249	F	93.8	Very high	94.3	Very high	70 Å²	70	24.7 Å²	24.7	31%	0.307	13%	0.125	S	C	.	.	H	α-helix	trans	-67.9	-37.9	174.4	-79.5	-59.7	0	0	0	112.9	I159 L160 Y163 I245 A246 H247 L252 C253	I159-F249 HydrophobicContact CG2-CE2 4.41Å; I159-F249 HydrophobicContact CG2-CZ 4.06Å; L160-F249 HydrophobicContact CD1-CE1 4.43Å; Y163-F249 AromaticContact CD2-CE1 3.9Å; Y163-F249 HydrophobicContact CD2-CE1 3.9Å; Y163-F249 HydrophobicContact CE2-CE1 4.46Å; Y163-F249 HydrophobicContact CG-CE1 4.01Å; I245-F249 HydrophobicContact CD1-CE2 4.24Å; I245-F249 HydrophobicContact CG1-CD2 3.99Å; I245-F249 HydrophobicContact CG1-CE2 3.69Å; I245-F249 VanDerWaalsContact O-CD2 3.23Å; I245-F249 WeakPolarHBondContact O-CD2 3.27Å; I245-F249 PolarHBondContact O-N 3.4Å; A246-F249 PolarHBondContact O-N 3.14Å; H247-F249 VanDerWaalsContact C-N 3.34Å; H247-F249 PolarHBondContact O-N 3.36Å; F249-L252 WeakPolarHBondContact O-CB 3.46Å; F249-L252 PolarHBondContact O-N 2.95Å; F249-C253 PolarHBondContact O-N 2.87Å; F249-C253 PolarHBondContact O-SG 3.23Å
250	L	94.3	Very high	93.9	Very high	18 Å²	18	19.7 Å²	19.7	9%	0.094	10%	0.104	C	C	.	.	H	α-helix	trans	-62.2	-49.1	176.5	-168.8	172.3	0	0	0	111.4	L187 A190 D191 L194 A246 H247 L252 C253 Q254	L187-L250 HydrophobicContact CD2-CD2 4.16Å; L187-L250 HydrophobicContact CD2-CG 4.1Å; A190-L250 VanDerWaalsContact C-CD1 3.5Å; A190-L250 HydrophobicContact CB-CD1 3.63Å; A190-L250 HydrophobicContact CB-CG 4.46Å; D191-L250 HydrophobicContact CB-CD2 3.98Å; L194-L250 HydrophobicContact CB-CD1 4.3Å; L194-L250 HydrophobicContact CD2-CD1 3.87Å; A246-L250 WeakPolarHBondContact O-CB 3.45Å; A246-L250 PolarHBondContact O-N 3.28Å; H247-L250 WeakPolarHBondContact O-CB 3.3Å; H247-L250 PolarHBondContact O-N 3.05Å; L250-L252 VanDerWaalsContact C-N 3.27Å; L250-L252 PolarHBondContact O-N 3.07Å; L250-C253 WeakPolarHBondContact O-CB 3.46Å; L250-C253 PolarHBondContact O-N 2.84Å; L250-C253 VanDerWaalsContact O-N 3.12Å; L250-Q254 HydrophobicContact CD2-CG 4.11Å; L250-Q254 PolarHBondContact O-N 2.92Å
251	L	94.3	Very high	93.5	Very high	2 Å²	2	19.8 Å²	19.8	1%	0.01	11%	0.105	C	C	.	.	H	α-helix	trans	-60.1	-37.2	174.8	-68.1	-179.3	0	0	0	111.9	H247 Q254 V255 W311 P403 L407	H247-L251 WeakPolarHBondContact O-CG 3.38Å; H247-L251 PolarHBondContact O-N 3.41Å; L251-Q254 PolarHBondContact O-N 3.29Å; L251-V255 PolarHBondContact O-N 2.9Å; L251-W311 HydrophobicContact CD2-CZ2 4.19Å; L251-P403 HydrophobicContact CD1-CB 3.97Å; L251-L407 HydrophobicContact CB-CD1 4.3Å; L251-L407 HydrophobicContact CB-CD2 4.08Å
252	L	93.3	Very high	93.1	Very high	4 Å²	4	19.7 Å²	19.7	2%	0.021	10%	0.104	C	C	.	.	H	α-helix	trans	-65.6	-41.6	174.7	-177.3	57.7	0	0	0	111.5	L160 Y163 C248 F249 L250 Q254 V255 T256 L407 M411	L160-L252 HydrophobicContact CG-CD2 4.46Å; Y163-L252 HydrophobicContact CD1-CD2 3.52Å; Y163-L252 HydrophobicContact CE1-CD2 3.85Å; Y163-L252 HydrophobicContact CG-CD2 4.39Å; C248-L252 WeakPolarHBondContact O-CB 3.42Å; C248-L252 PolarHBondContact O-N 3.05Å; C248-L252 VanDerWaalsContact O-N 3.08Å; F249-L252 WeakPolarHBondContact O-CB 3.46Å; F249-L252 PolarHBondContact O-N 2.95Å; L250-L252 VanDerWaalsContact C-N 3.27Å; L250-L252 PolarHBondContact O-N 3.07Å; L252-Q254 VanDerWaalsContact C-N 3.34Å; L252-Q254 PolarHBondContact O-N 2.97Å; L252-V255 PolarHBondContact O-N 2.86Å; L252-T256 HydrophobicContact CD1-CG2 4.26Å; L252-T256 WeakPolarHBondContact O-CG2 3.44Å; L252-T256 PolarHBondContact O-N 2.97Å; L252-T256 PolarHBondContact O-OG1 3.26Å; L252-L407 HydrophobicContact CB-CD1 4.12Å; L252-L407 HydrophobicContact CD1-CD1 4.21Å; L252-M411 HydrophobicContact CD1-SD 3.81Å
253	C	91.8	Very high	92.6	Very high	35 Å²	35	16 Å²	16	24%	0.236	9%	0.091	C	C	.	.	H	α-helix	trans	-62.5	-36.6	173	-71.3	0	0	0	0	112.8	F183 L187 F249 L250 T256 T257	F183-C253 HydrophobicContact CZ-CB 4.47Å; L187-C253 HydrophobicContact CD1-CB 4.1Å; L187-C253 HydrophobicContact CD2-CB 3.87Å; F249-C253 PolarHBondContact O-N 2.87Å; F249-C253 PolarHBondContact O-SG 3.23Å; L250-C253 WeakPolarHBondContact O-CB 3.46Å; L250-C253 PolarHBondContact O-N 2.84Å; L250-C253 VanDerWaalsContact O-N 3.12Å; C253-T256 WeakPolarHBondContact CA-OG1 3.25Å; C253-T256 PolarHBondContact O-OG1 3.24Å; C253-T257 WeakPolarHBondContact O-CB 3.16Å; C253-T257 PolarHBondContact O-N 3.3Å; C253-T257 PolarHBondContact O-OG1 3.26Å
254	Q	92.4	Very high	92.1	Very high	4 Å²	4	17.2 Å²	17.2	2%	0.019	10%	0.099	C	C	.	.	H	α-helix	trans	-64	-50.4	173.7	-74.7	172.4	-33.5	0	0	111.3	L187 L250 L251 L252 T257 L258 W311	L187-Q254 HydrophobicContact CB-CG 3.77Å; L187-Q254 HydrophobicContact CD1-CG 3.98Å; L187-Q254 HydrophobicContact CG-CG 4.34Å; L187-Q254 PolarHBondContact O-NE2 3.38Å; L250-Q254 HydrophobicContact CD2-CG 4.11Å; L250-Q254 PolarHBondContact O-N 2.92Å; L251-Q254 PolarHBondContact O-N 3.29Å; L252-Q254 VanDerWaalsContact C-N 3.34Å; L252-Q254 PolarHBondContact O-N 2.97Å; Q254-T257 PolarHBondContact O-N 3.12Å; Q254-L258 WeakPolarHBondContact O-CB 3.34Å; Q254-L258 PolarHBondContact O-N 2.7Å; Q254-W311 HydrophobicContact CB-CZ2 4.35Å
255	V	92.7	Very high	91.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.3	-41.7	179.5	171.6	0	0	0	0	112.2	L251 L252 L258 N259 W311 I314 L407	L251-V255 PolarHBondContact O-N 2.9Å; L252-V255 PolarHBondContact O-N 2.86Å; V255-L258 PolarHBondContact O-N 2.89Å; V255-N259 VanDerWaalsContact O-CB 3.3Å; V255-N259 WeakPolarHBondContact O-CB 3.47Å; V255-N259 PolarHBondContact O-N 2.71Å; V255-W311 HydrophobicContact CG2-CB 4.15Å; V255-W311 HydrophobicContact CG2-CG 3.76Å; V255-I314 HydrophobicContact CG1-CB 4.44Å; V255-I314 HydrophobicContact CG1-CG2 3.74Å; V255-L407 HydrophobicContact CG2-CD1 4.42Å; V255-L407 HydrophobicContact CG2-CD2 3.96Å
256	T	91.1	Very high	89.9	Confident	2 Å²	2	31.8 Å²	31.8	1%	0.012	17%	0.171	C	C	.	.	H	α-helix	trans	-66.7	-40.2	176.4	52.8	0	0	0	0	111.7	A168 I172 L252 C253 N259 V260	A168-T256 HydrophobicContact CB-CG2 4.25Å; I172-T256 VanDerWaalsContact CD1-OG1 3.25Å; I172-T256 WeakPolarHBondContact CD1-OG1 3.17Å; L252-T256 HydrophobicContact CD1-CG2 4.26Å; L252-T256 WeakPolarHBondContact O-CG2 3.44Å; L252-T256 PolarHBondContact O-N 2.97Å; L252-T256 PolarHBondContact O-OG1 3.26Å; C253-T256 WeakPolarHBondContact CA-OG1 3.25Å; C253-T256 PolarHBondContact O-OG1 3.24Å; T256-N259 PolarHBondContact O-N 2.74Å; T256-V260 WeakPolarHBondContact O-CG2 3.31Å; T256-V260 PolarHBondContact O-N 2.77Å
257	T	89.9	Confident	89	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.006	19%	0.185	C	C	.	.	H	α-helix	trans	-62.1	-45	175.4	-58.6	0	0	0	0	111.6	I180 F183 F184 C253 Q254 V260 A261	I180-T257 HydrophobicContact CG2-CG2 3.86Å; F183-T257 HydrophobicContact CD1-CG2 4.31Å; F183-T257 WeakPolarHBondContact CE1-OG1 3.32Å; F184-T257 HydrophobicContact CD2-CG2 4.31Å; C253-T257 WeakPolarHBondContact O-CB 3.16Å; C253-T257 PolarHBondContact O-N 3.3Å; C253-T257 PolarHBondContact O-OG1 3.26Å; Q254-T257 PolarHBondContact O-N 3.12Å; T257-V260 PolarHBondContact O-N 3.08Å; T257-A261 WeakPolarHBondContact O-CB 3.01Å; T257-A261 PolarHBondContact O-N 3.19Å
258	L	90.2	Very high	88.3	Confident	12 Å²	12	37 Å²	37	6%	0.063	19%	0.186	C	C	.	.	H	α-helix	trans	-67.8	-36	178.2	-170.7	61.1	0	0	0	111.9	Q254 V255 A261 F262 L269 W311 F312 I315	Q254-L258 WeakPolarHBondContact O-CB 3.34Å; Q254-L258 PolarHBondContact O-N 2.7Å; V255-L258 PolarHBondContact O-N 2.89Å; L258-A261 PolarHBondContact O-N 2.79Å; L258-F262 WeakPolarHBondContact O-CB 3.35Å; L258-F262 PolarHBondContact O-N 2.89Å; L258-L269 HydrophobicContact CD1-CD1 4.3Å; L258-L269 HydrophobicContact CD1-CG 4.46Å; L258-W311 HydrophobicContact CD2-CB 4.25Å; L258-W311 HydrophobicContact CD2-CE3 4.46Å; L258-F312 HydrophobicContact CD2-CD1 4.38Å; L258-F312 HydrophobicContact CD2-CE1 3.88Å; L258-F312 HydrophobicContact CD2-CZ 4.35Å; L258-F312 HydrophobicContact CG-CE1 4.45Å; L258-I315 HydrophobicContact CB-CD1 3.93Å; L258-I315 HydrophobicContact CD2-CD1 3.68Å; L258-I315 HydrophobicContact CG-CD1 3.55Å
259	N	90.6	Very high	87.8	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.016	19%	0.189	C	C	.	.	H	α-helix	trans	-67	-38.4	173.4	-159.9	102.4	0	0	0	112.6	V255 T256 A261 N263 I315 R318	V255-N259 VanDerWaalsContact O-CB 3.3Å; V255-N259 WeakPolarHBondContact O-CB 3.47Å; V255-N259 PolarHBondContact O-N 2.71Å; T256-N259 PolarHBondContact O-N 2.74Å; N259-A261 VanDerWaalsContact C-N 3.34Å; N259-N263 PolarHBondContact ND2-ND2 3.08Å; N259-N263 WeakPolarHBondContact O-CB 3.41Å; N259-N263 PolarHBondContact O-N 2.97Å; N259-I315 HydrophobicContact CB-CG1 4.19Å; N259-R318 VanDerWaalsContact OD1-CD 3.26Å; N259-R318 WeakPolarHBondContact OD1-CD 3.44Å; N259-R318 PolarHBondContact OD1-NE 3.25Å
260	V	89.6	Confident	87.4	Confident	9 Å²	9	38.7 Å²	38.7	6%	0.055	20%	0.197	C	C	.	.	H	α-helix	trans	-64.1	-40.3	171.3	169.5	0	0	0	0	110.8	Y169 I172 R173 I180 T256 T257 S264	Y169-V260 HydrophobicContact CD2-CG2 3.36Å; Y169-V260 HydrophobicContact CE2-CB 4.36Å; Y169-V260 HydrophobicContact CE2-CG2 3.57Å; Y169-V260 HydrophobicContact CG-CG2 4.23Å; I172-V260 HydrophobicContact CB-CG2 4.14Å; I172-V260 HydrophobicContact CG2-CB 4.18Å; I172-V260 HydrophobicContact CG2-CG1 4.23Å; I172-V260 HydrophobicContact CG2-CG2 4.01Å; R173-V260 HydrophobicContact CB-CG1 4.16Å; R173-V260 HydrophobicContact CB-CG2 4.28Å; R173-V260 HydrophobicContact CG-CG1 4.49Å; I180-V260 HydrophobicContact CD1-CG1 4.29Å; T256-V260 WeakPolarHBondContact O-CG2 3.31Å; T256-V260 PolarHBondContact O-N 2.77Å; T257-V260 PolarHBondContact O-N 3.08Å; V260-S264 WeakPolarHBondContact O-CB 3.4Å
261	A	88.7	Confident	87	Confident	4 Å²	4	41.5 Å²	41.5	3%	0.033	22%	0.215	C	C	.	.	H	α-helix	trans	-67.2	-39.7	177.8	0	0	0	0	0	112.4	T257 L258 N259 S264 L269	T257-A261 WeakPolarHBondContact O-CB 3.01Å; T257-A261 PolarHBondContact O-N 3.19Å; L258-A261 PolarHBondContact O-N 2.79Å; N259-A261 VanDerWaalsContact C-N 3.34Å; A261-S264 PolarHBondContact O-OG 3.31Å; A261-L269 HydrophobicContact CB-CB 4.24Å; A261-L269 PolarHBondContact O-N 2.85Å
262	F	87.6	Confident	86.5	Confident	35 Å²	35	41.6 Å²	41.6	15%	0.154	22%	0.216	C	C	.	.	H	α-helix	trans	-63	-52.3	175.4	-163.5	-73.7	0	0	0	111	L258 S264 L269 I315 I333 D336 V337 I340	L258-F262 WeakPolarHBondContact O-CB 3.35Å; L258-F262 PolarHBondContact O-N 2.89Å; F262-S264 PolarHBondContact O-N 3.02Å; F262-L269 HydrophobicContact CB-CD1 3.85Å; F262-L269 HydrophobicContact CD2-CD1 3.51Å; F262-L269 HydrophobicContact CE2-CD1 4.42Å; F262-L269 HydrophobicContact CG-CD1 4.06Å; F262-I315 HydrophobicContact CB-CG2 4.39Å; F262-I315 HydrophobicContact CD2-CG2 4.25Å; F262-I315 HydrophobicContact CG-CG2 4.19Å; F262-I333 HydrophobicContact CE1-CG1 4.41Å; F262-I333 HydrophobicContact CE1-CG2 4.27Å; F262-I333 HydrophobicContact CZ-CB 4.46Å; F262-I333 HydrophobicContact CZ-CG2 3.85Å; F262-D336 HydrophobicContact CE2-CB 4.18Å; F262-D336 HydrophobicContact CZ-CB 3.91Å; F262-V337 HydrophobicContact CE2-CG2 4Å; F262-I340 HydrophobicContact CE2-CD1 4.36Å
263	N	86.6	Confident	86.2	Confident	56 Å²	56	42.8 Å²	42.8	30%	0.299	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.2	25.9	-175.5	-61.1	10	0	0	0	112.8	N259 N319	N259-N263 PolarHBondContact ND2-ND2 3.08Å; N259-N263 WeakPolarHBondContact O-CB 3.41Å; N259-N263 PolarHBondContact O-N 2.97Å; N263-N319 PolarHBondContact ND2-OD1 2.62Å; N263-N319 PolarHBondContact OD1-ND2 3.49Å; N263-N319 PolarHBondContact OD1-OD1 3.38Å
264	S	85.6	Confident	85.9	Confident	40 Å²	40	46.2 Å²	46.2	28%	0.28	24%	0.236	S	C	.	.			trans	-110.6	131.1	-178	76.1	0	0	0	0	112.9	V260 A261 F262 N266 S268	V260-S264 WeakPolarHBondContact O-CB 3.4Å; A261-S264 PolarHBondContact O-OG 3.31Å; F262-S264 PolarHBondContact O-N 3.02Å; S264-N266 PolarHBondContact O-N 3.01Å; S264-S268 WeakPolarHBondContact OG-CB 3.45Å
265	Q	76.7	Confident	85.6	Confident	193 Å²	193	47.3 Å²	47.3	90%	0.902	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-24.2	-173.3	-64.5	173.4	-11.1	0	0	114.2	K267	Q265-K267 PolarHBondContact O-N 3.11Å
266	N	70.4	Confident	85.3	Confident	132 Å²	132	47.4 Å²	47.4	71%	0.706	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.7	25.9	-166.7	-68.4	-28.3	0	0	0	114.4	S264 S268	S264-N266 PolarHBondContact O-N 3.01Å; N266-S268 PolarHBondContact O-N 3.41Å
267	K	76.7	Confident	85.2	Confident	153 Å²	153	47.8 Å²	47.8	67%	0.665	25%	0.246	S	C	*	.			trans	54.1	32.4	-173.4	-53.9	-178.2	179.6	-175.7	0	113	Q265 L269 I270 T271	Q265-K267 PolarHBondContact O-N 3.11Å; K267-L269 VanDerWaalsContact C-N 3.25Å; K267-L269 PolarHBondContact O-N 3.46Å; K267-I270 HydrophobicContact CB-CB 4.47Å; K267-I270 HydrophobicContact CB-CD1 4.34Å; K267-I270 HydrophobicContact CD-CD1 4.5Å; K267-I270 PolarHBondContact O-N 3.24Å; K267-I270 VanDerWaalsContact O-N 3.14Å; K267-T271 PolarHBondContact O-N 3.01Å; K267-T271 PolarHBondContact O-OG1 3.41Å
268	S	83.2	Confident	85.1	Confident	3 Å²	3	54.1 Å²	54.1	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-62.8	-34.2	-172.7	-163.2	0	0	0	0	112.1	V177 S264 N266 T271 V272	V177-S268 WeakPolarHBondContact CG1-OG 3.46Å; S264-S268 WeakPolarHBondContact OG-CB 3.45Å; N266-S268 PolarHBondContact O-N 3.41Å; S268-T271 PolarHBondContact O-N 3.19Å; S268-V272 WeakPolarHBondContact O-CG2 3.44Å; S268-V272 PolarHBondContact O-N 3Å
269	L	85.3	Confident	84.9	Confident	15 Å²	15	56.7 Å²	56.7	8%	0.079	29%	0.29	C	S	.	.	H	α-helix	trans	-57.2	-51.5	173.8	-172.3	155.3	0	0	0	111.6	L258 A261 F262 K267 T271 V272 F273 I340	L258-L269 HydrophobicContact CD1-CD1 4.3Å; L258-L269 HydrophobicContact CD1-CG 4.46Å; A261-L269 HydrophobicContact CB-CB 4.24Å; A261-L269 PolarHBondContact O-N 2.85Å; F262-L269 HydrophobicContact CB-CD1 3.85Å; F262-L269 HydrophobicContact CD2-CD1 3.51Å; F262-L269 HydrophobicContact CE2-CD1 4.42Å; F262-L269 HydrophobicContact CG-CD1 4.06Å; K267-L269 VanDerWaalsContact C-N 3.25Å; K267-L269 PolarHBondContact O-N 3.46Å; L269-T271 PolarHBondContact O-N 3.35Å; L269-V272 PolarHBondContact O-N 2.85Å; L269-F273 HydrophobicContact CD2-CB 4.44Å; L269-F273 VanDerWaalsContact O-CB 3.24Å; L269-F273 WeakPolarHBondContact O-CB 3.4Å; L269-F273 PolarHBondContact O-N 2.97Å; L269-I340 HydrophobicContact CD1-CD1 3.79Å; L269-I340 HydrophobicContact CD2-CD1 3.4Å; L269-I340 HydrophobicContact CD2-CG1 3.65Å; L269-I340 HydrophobicContact CD2-CG2 4.35Å; L269-I340 HydrophobicContact CG-CD1 4.28Å
270	I	84.4	Confident	84.8	Confident	92 Å²	92	57.3 Å²	57.3	47%	0.472	29%	0.293	S	S	.	.	H	α-helix	trans	-59	-38.5	179.6	-61	177.2	0	0	0	110.5	K267 I274	K267-I270 HydrophobicContact CB-CB 4.47Å; K267-I270 HydrophobicContact CB-CD1 4.34Å; K267-I270 HydrophobicContact CD-CD1 4.5Å; K267-I270 PolarHBondContact O-N 3.24Å; K267-I270 VanDerWaalsContact O-N 3.14Å; I270-I274 HydrophobicContact CG2-CD1 3.63Å; I270-I274 HydrophobicContact CG2-CG1 4.3Å; I270-I274 WeakPolarHBondContact O-CB 3.41Å; I270-I274 VanDerWaalsContact O-CG1 3.27Å; I270-I274 WeakPolarHBondContact O-CG1 3.48Å; I270-I274 PolarHBondContact O-N 3.37Å
271	T	85.3	Confident	84.7	Confident	77 Å²	77	59.1 Å²	59.1	47%	0.472	30%	0.302	S	S	.	.	H	α-helix	trans	-65.4	-50	177.3	-53	0	0	0	0	111.7	K267 S268 L269 S275	K267-T271 PolarHBondContact O-N 3.01Å; K267-T271 PolarHBondContact O-OG1 3.41Å; S268-T271 PolarHBondContact O-N 3.19Å; L269-T271 PolarHBondContact O-N 3.35Å; T271-S275 VanDerWaalsContact O-CB 3.31Å; T271-S275 WeakPolarHBondContact O-CB 3.45Å; T271-S275 PolarHBondContact O-N 3.26Å; T271-S275 VanDerWaalsContact O-N 3.11Å; T271-S275 PolarHBondContact O-OG 3.43Å
272	V	85.2	Confident	84.6	Confident	4 Å²	4	65.1 Å²	65.1	2%	0.024	33%	0.327	C	S	.	.	H	α-helix	trans	-60.3	-48.7	177.8	170.9	0	0	0	0	110.3	I180 F184 S268 L269 S275 N276	I180-V272 HydrophobicContact CG2-CG2 4.35Å; F184-V272 HydrophobicContact CB-CG1 4.05Å; F184-V272 HydrophobicContact CD1-CG1 3.88Å; F184-V272 HydrophobicContact CD2-CG1 4.13Å; F184-V272 HydrophobicContact CE1-CG1 4.39Å; F184-V272 HydrophobicContact CG-CG1 3.74Å; S268-V272 WeakPolarHBondContact O-CG2 3.44Å; S268-V272 PolarHBondContact O-N 3Å; L269-V272 PolarHBondContact O-N 2.85Å; V272-S275 WeakPolarHBondContact CA-OG 3.39Å; V272-S275 PolarHBondContact O-N 3.24Å; V272-S275 PolarHBondContact O-OG 2.67Å; V272-N276 PolarHBondContact O-N 2.67Å
273	F	85.4	Confident	84.5	Confident	29 Å²	29	65.7 Å²	65.7	13%	0.127	34%	0.343	C	S	.	.	H	α-helix	trans	-59	-57.1	-179.5	-173.4	-96	0	0	0	112.2	L269 S275 N276 N277 I340 A343 E344	L269-F273 HydrophobicContact CD2-CB 4.44Å; L269-F273 VanDerWaalsContact O-CB 3.24Å; L269-F273 WeakPolarHBondContact O-CB 3.4Å; L269-F273 PolarHBondContact O-N 2.97Å; F273-S275 PolarHBondContact O-N 3.33Å; F273-S275 VanDerWaalsContact O-N 3.14Å; F273-N276 PolarHBondContact O-N 2.79Å; F273-N277 WeakPolarHBondContact CZ-ND2 3.42Å; F273-N277 PolarHBondContact O-N 2.85Å; F273-N277 PolarHBondContact O-OD1 3.47Å; F273-I340 HydrophobicContact CD2-CG2 3.87Å; F273-I340 HydrophobicContact CE2-CG2 3.84Å; F273-I340 HydrophobicContact CG-CG2 4.34Å; F273-I340 HydrophobicContact CZ-CG2 4.28Å; F273-A343 HydrophobicContact CD1-CB 4.45Å; F273-A343 HydrophobicContact CE1-CB 3.57Å; F273-A343 HydrophobicContact CZ-CB 4.16Å; F273-E344 HydrophobicContact CE2-CB 4.36Å; F273-E344 VanDerWaalsContact CE2-OE2 3.28Å; F273-E344 WeakPolarHBondContact CE2-OE2 3.42Å; F273-E344 HydrophobicContact CZ-CB 3.89Å; F273-E344 WeakPolarHBondContact CZ-OE2 3.33Å
274	I	87	Confident	84.5	Confident	107 Å²	107	64.4 Å²	64.4	55%	0.549	34%	0.336	S	S	.	.	H	α-helix	trans	-55.1	-39.4	178	-69.9	173.1	0	0	0	111.5	I270 F278	I270-I274 HydrophobicContact CG2-CD1 3.63Å; I270-I274 HydrophobicContact CG2-CG1 4.3Å; I270-I274 WeakPolarHBondContact O-CB 3.41Å; I270-I274 VanDerWaalsContact O-CG1 3.27Å; I270-I274 WeakPolarHBondContact O-CG1 3.48Å; I270-I274 PolarHBondContact O-N 3.37Å; I274-F278 VanDerWaalsContact O-CB 3.25Å; I274-F278 WeakPolarHBondContact O-CB 3.37Å; I274-F278 PolarHBondContact O-N 3.06Å
275	S	85.5	Confident	84.5	Confident	26 Å²	26	63.1 Å²	63.1	18%	0.182	33%	0.327	C	S	.	.	H	α-helix	trans	-70.8	-33.3	-179.7	67.6	0	0	0	0	113.7	Y181 T271 V272 F273 V279	Y181-S275 WeakPolarHBondContact CD2-OG 3.48Å; Y181-S275 VanDerWaalsContact CE2-CB 3.42Å; Y181-S275 WeakPolarHBondContact CE2-OG 3.24Å; T271-S275 VanDerWaalsContact O-CB 3.31Å; T271-S275 WeakPolarHBondContact O-CB 3.45Å; T271-S275 PolarHBondContact O-N 3.26Å; T271-S275 VanDerWaalsContact O-N 3.11Å; T271-S275 PolarHBondContact O-OG 3.43Å; V272-S275 WeakPolarHBondContact CA-OG 3.39Å; V272-S275 PolarHBondContact O-N 3.24Å; V272-S275 PolarHBondContact O-OG 2.67Å; F273-S275 PolarHBondContact O-N 3.33Å; F273-S275 VanDerWaalsContact O-N 3.14Å; S275-V279 WeakPolarHBondContact O-CG2 3.19Å; S275-V279 PolarHBondContact O-N 3.22Å
276	N	86	Confident	84.8	Confident	3 Å²	3	61.9 Å²	61.9	2%	0.016	32%	0.319	C	S	.	.	H	α-helix	trans	-70	-54.4	177.4	-150.4	72.7	0	0	0	110.5	F184 E188 V272 F273 F278 V279 E280	F184-N276 HydrophobicContact CD1-CB 4.43Å; F184-N276 WeakPolarHBondContact CD1-OD1 3.39Å; F184-N276 HydrophobicContact CE1-CB 4.28Å; E188-N276 PolarHBondContact OE2-ND2 2.83Å; E188-N276 PolarHBondContact OE2-OD1 3.32Å; V272-N276 PolarHBondContact O-N 2.67Å; F273-N276 PolarHBondContact O-N 2.79Å; N276-F278 PolarHBondContact O-N 3.47Å; N276-V279 WeakPolarHBondContact O-CB 3.36Å; N276-V279 PolarHBondContact O-N 3.05Å; N276-E280 PolarHBondContact O-N 3.19Å
277	N	88.7	Confident	85.5	Confident	9 Å²	9	62.9 Å²	62.9	5%	0.048	31%	0.312	C	S	.	.	H	α-helix	trans	-59.7	-29.4	178.5	-67.4	62.5	0	0	0	112.5	F273 L281 E344 V347	F273-N277 WeakPolarHBondContact CZ-ND2 3.42Å; F273-N277 PolarHBondContact O-N 2.85Å; F273-N277 PolarHBondContact O-OD1 3.47Å; N277-L281 WeakPolarHBondContact O-CB 3.32Å; N277-L281 PolarHBondContact O-N 3Å; N277-E344 PolarHBondContact ND2-OE2 2.65Å; N277-V347 HydrophobicContact CB-CB 4.47Å; N277-V347 HydrophobicContact CB-CG1 3.98Å; N277-V347 HydrophobicContact CB-CG2 3.95Å
278	F	88.5	Confident	86	Confident	134 Å²	134	64.6 Å²	64.6	59%	0.588	32%	0.32	S	S	*	.	H	α-helix	trans	-70.4	-40.7	171.8	179.1	-99.3	0	0	0	113.4	I274 N276 K282	I274-F278 VanDerWaalsContact O-CB 3.25Å; I274-F278 WeakPolarHBondContact O-CB 3.37Å; I274-F278 PolarHBondContact O-N 3.06Å; N276-F278 PolarHBondContact O-N 3.47Å; F278-K282 WeakPolarHBondContact O-CB 3.08Å; F278-K282 PolarHBondContact O-N 3Å
279	V	86.9	Confident	86	Confident	66 Å²	66	64.9 Å²	64.9	40%	0.4	32%	0.321	S	S	.	.	H	α-helix	trans	-65	-45.2	175.4	169.8	0	0	0	0	110.4	S275 N276 K282 G283	S275-V279 WeakPolarHBondContact O-CG2 3.19Å; S275-V279 PolarHBondContact O-N 3.22Å; N276-V279 WeakPolarHBondContact O-CB 3.36Å; N276-V279 PolarHBondContact O-N 3.05Å; V279-K282 PolarHBondContact O-N 3.15Å; V279-G283 PolarHBondContact O-N 2.71Å
280	E	86.7	Confident	86.1	Confident	16 Å²	16	65.2 Å²	65.2	8%	0.075	33%	0.328	C	S	.	.	H	α-helix	trans	-62.8	-52.9	-179.8	-162.9	-80.3	116.3	0	0	111.4	N276 K282 G283 N284 K351	N276-E280 PolarHBondContact O-N 3.19Å; E280-K282 VanDerWaalsContact C-N 3.32Å; E280-K282 PolarHBondContact O-N 2.79Å; E280-G283 PolarHBondContact O-N 2.97Å; E280-G283 VanDerWaalsContact O-N 3.13Å; E280-N284 PolarHBondContact O-N 2.81Å; E280-N284 VanDerWaalsContact O-N 3.13Å; E280-N284 PolarHBondContact OE1-ND2 3.47Å; E280-K351 WeakPolarHBondContact OE1-CD 3.48Å; E280-K351 IonicContact OE1-NZ 3.38Å; E280-K351 PolarHBondContact OE1-NZ 3.06Å; E280-K351 VanDerWaalsContact OE1-NZ 3.13Å; E280-K351 WeakPolarHBondContact OE2-CD 3.28Å; E280-K351 IonicContact OE2-NZ 3.97Å; E280-K351 PolarHBondContact OE2-NZ 3.49Å
281	L	87.9	Confident	86.3	Confident	47 Å²	47	64.4 Å²	64.4	25%	0.246	32%	0.321	C	S	.	.	H	α-helix	trans	-56.4	-43.5	174.7	-175	71.3	0	0	0	112	N277 V285 I350 K351	N277-L281 WeakPolarHBondContact O-CB 3.32Å; N277-L281 PolarHBondContact O-N 3Å; L281-V285 HydrophobicContact CD1-CG2 3.54Å; L281-V285 HydrophobicContact CG-CG2 4.09Å; L281-V285 VanDerWaalsContact O-CB 3.26Å; L281-V285 WeakPolarHBondContact O-CB 3.32Å; L281-V285 VanDerWaalsContact O-CG2 3.31Å; L281-V285 WeakPolarHBondContact O-CG2 3.45Å; L281-V285 PolarHBondContact O-N 2.86Å; L281-I350 HydrophobicContact CD1-CG2 4.05Å; L281-I350 HydrophobicContact CD2-CG2 4.3Å; L281-K351 HydrophobicContact CD1-CB 3.8Å
282	K	87.4	Confident	86.4	Confident	130 Å²	130	64 Å²	64	57%	0.565	32%	0.319	S	S	*	.	H	α-helix	trans	-65.5	-39.7	178.1	-176.1	-175	177.4	-172.6	0	112.1	F278 V279 E280 F286	F278-K282 WeakPolarHBondContact O-CB 3.08Å; F278-K282 PolarHBondContact O-N 3Å; V279-K282 PolarHBondContact O-N 3.15Å; E280-K282 VanDerWaalsContact C-N 3.32Å; E280-K282 PolarHBondContact O-N 2.79Å; K282-F286 HydrophobicContact CG-CD2 4.32Å; K282-F286 HydrophobicContact CG-CE2 4.3Å; K282-F286 WeakPolarHBondContact O-CD2 3.48Å
283	G	85.5	Confident	86.7	Confident	48 Å²	48	66.6 Å²	66.6	50%	0.495	33%	0.333	S	S	.	.	H	α-helix	trans	-64.5	-40.1	179.6	0	0	0	0	0	112.9	V279 E280	V279-G283 PolarHBondContact O-N 2.71Å; E280-G283 PolarHBondContact O-N 2.97Å; E280-G283 VanDerWaalsContact O-N 3.13Å
284	N	86.8	Confident	86.9	Confident	29 Å²	29	65.2 Å²	65.2	16%	0.155	33%	0.327	C	S	.	.	H	α-helix	trans	-93.1	-36.1	-171.8	-74.9	-34.4	0	0	0	114.5	E280 R287 K351 I355	E280-N284 PolarHBondContact O-N 2.81Å; E280-N284 VanDerWaalsContact O-N 3.13Å; E280-N284 PolarHBondContact OE1-ND2 3.47Å; N284-R287 PolarHBondContact O-N 3.05Å; N284-K351 HydrophobicContact CB-CD 4.4Å; N284-I355 HydrophobicContact CB-CD1 4.1Å
285	V	86.1	Confident	87.1	Confident	12 Å²	12	61.3 Å²	61.3	7%	0.073	31%	0.305	C	S	.	.	H	α-helix	trans	-70.7	-35.1	-172.5	166.1	0	0	0	0	114.2	L281 R287 F354 I355 F358	L281-V285 HydrophobicContact CD1-CG2 3.54Å; L281-V285 HydrophobicContact CG-CG2 4.09Å; L281-V285 VanDerWaalsContact O-CB 3.26Å; L281-V285 WeakPolarHBondContact O-CB 3.32Å; L281-V285 VanDerWaalsContact O-CG2 3.31Å; L281-V285 WeakPolarHBondContact O-CG2 3.45Å; L281-V285 PolarHBondContact O-N 2.86Å; V285-R287 VanDerWaalsContact C-N 3.32Å; V285-R287 PolarHBondContact O-N 3.23Å; V285-F354 HydrophobicContact CB-CB 4.49Å; V285-F354 HydrophobicContact CG1-CB 3.76Å; V285-F354 HydrophobicContact CG1-CG 4.29Å; V285-F354 HydrophobicContact CG2-CB 3.93Å; V285-I355 HydrophobicContact CG2-CG1 4.45Å; V285-F358 HydrophobicContact CG1-CD2 3.98Å; V285-F358 HydrophobicContact CG1-CE2 3.65Å
286	F	82.1	Confident	87.4	Confident	168 Å²	168	66.4 Å²	66.4	74%	0.737	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-2	-177.7	-64.1	-69.6	0	0	0	114	K282	K282-F286 HydrophobicContact CG-CD2 4.32Å; K282-F286 HydrophobicContact CG-CE2 4.3Å; K282-F286 WeakPolarHBondContact O-CD2 3.48Å
287	R	85.8	Confident	87.6	Confident	152 Å²	152	67.5 Å²	67.5	57%	0.574	33%	0.332	S	S	*	.	S	Bend	trans	-91.1	132.1	-177.2	-165.5	175.9	-177.4	-172.6	0.8	111	N284 V285 M289	N284-R287 PolarHBondContact O-N 3.05Å; V285-R287 VanDerWaalsContact C-N 3.32Å; V285-R287 PolarHBondContact O-N 3.23Å; R287-M289 HydrophobicContact CB-CG 4.12Å; R287-M289 HydrophobicContact CB-SD 4.3Å; R287-M289 HydrophobicContact CG-CG 3.92Å; R287-M289 HydrophobicContact CG-SD 4.31Å; R287-M289 PolarHBondContact O-N 3.21Å
288	K	86.1	Confident	87.6	Confident	190 Å²	190	67 Å²	67	83%	0.826	33%	0.33	S	S	*	.			trans	-71	126.6	166.9	-168.9	-177.6	179	-175.9	0	109.3	N359	K288-N359 VanDerWaalsContact CA-OD1 3.26Å; K288-N359 WeakPolarHBondContact CA-OD1 3.13Å; K288-N359 WeakPolarHBondContact CG-OD1 3.4Å
289	M	82.9	Confident	87.7	Confident	8 Å²	8	60.8 Å²	60.8	4%	0.039	30%	0.303	C	S	.	.			trans	-142.3	133.6	-173.3	-62.4	-164.6	-65.8	0	0	111.5	R287 N293 I297 I355 N359	R287-M289 HydrophobicContact CB-CG 4.12Å; R287-M289 HydrophobicContact CB-SD 4.3Å; R287-M289 HydrophobicContact CG-CG 3.92Å; R287-M289 HydrophobicContact CG-SD 4.31Å; R287-M289 PolarHBondContact O-N 3.21Å; M289-N293 HydrophobicContact CB-CB 4.17Å; M289-I297 HydrophobicContact CE-CD1 3.52Å; M289-I297 HydrophobicContact SD-CD1 3.36Å; M289-I297 WeakPolarHBondContact SD-CD1 3.46Å; M289-I355 HydrophobicContact CE-CD1 3.95Å; M289-I355 HydrophobicContact CE-CG1 4.05Å; M289-I355 HydrophobicContact CE-CG2 3.65Å; M289-N359 PolarHBondContact N-OD1 3.35Å; M289-N359 PolarHBondContact O-OD1 3.12Å
290	G	88.6	Confident	87.9	Confident	22 Å²	22	58.8 Å²	58.8	23%	0.227	29%	0.293	C	S	.	.			trans	-83.2	175.2	173.2	0	0	0	0	0	112.9	T292 N293 L294	G290-T292 PolarHBondContact O-N 3.41Å; G290-N293 PolarHBondContact O-N 2.94Å; G290-L294 PolarHBondContact O-N 2.89Å; G290-L294 VanDerWaalsContact O-N 3.14Å
291	K	88.1	Confident	88.1	Confident	75 Å²	75	58.2 Å²	58.2	33%	0.326	29%	0.29	S	S	.	.	H	α-helix	trans	-58.7	-32.2	-177	-64.9	-175.5	179.8	-173.2	0	113.6	F295 Y369	K291-F295 PolarHBondContact O-N 2.93Å; K291-Y369 PolarHBondContact O-OH 3.46Å
292	T	87.9	Confident	88.3	Confident	69 Å²	69	56 Å²	56	42%	0.423	28%	0.279	S	S	.	.	H	α-helix	trans	-66.8	-46	177.1	43.8	0	0	0	0	112.3	G290 F295 Q296 F523	G290-T292 PolarHBondContact O-N 3.41Å; T292-F295 WeakPolarHBondContact O-CB 3.2Å; T292-F295 PolarHBondContact O-N 3.31Å; T292-Q296 PolarHBondContact O-N 3.39Å; T292-F523 HydrophobicContact CG2-CE1 3.6Å; T292-F523 HydrophobicContact CG2-CZ 3.96Å
293	N	91.1	Very high	88.5	Confident	59 Å²	59	50.5 Å²	50.5	32%	0.316	25%	0.254	S	S	.	.	H	α-helix	trans	-69.2	-37.9	-179.5	-63.1	0.2	0	0	0	111.5	M289 G290 F295 Q296 I297	M289-N293 HydrophobicContact CB-CB 4.17Å; G290-N293 PolarHBondContact O-N 2.94Å; N293-F295 VanDerWaalsContact C-N 3.32Å; N293-F295 PolarHBondContact O-N 3.41Å; N293-Q296 PolarHBondContact O-N 3.27Å; N293-I297 PolarHBondContact O-N 3.2Å; N293-I297 VanDerWaalsContact O-N 3.1Å
294	L	89.9	Confident	88.7	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.8	-37.1	175	175.5	63	0	0	0	111.9	G290 I297 A298 I355 T356 I361 Y369	G290-L294 PolarHBondContact O-N 2.89Å; G290-L294 VanDerWaalsContact O-N 3.14Å; L294-I297 PolarHBondContact O-N 3.36Å; L294-A298 WeakPolarHBondContact O-CB 3.33Å; L294-A298 PolarHBondContact O-N 3.46Å; L294-I355 HydrophobicContact CD1-CG2 4Å; L294-T356 HydrophobicContact CD2-CG2 4.12Å; L294-I361 HydrophobicContact CD2-CD1 3.82Å; L294-I361 HydrophobicContact CD2-CG2 4.14Å; L294-Y369 WeakPolarHBondContact CB-OH 3.28Å; L294-Y369 HydrophobicContact CD2-CE2 4.4Å; L294-Y369 HydrophobicContact CG-CE2 4.12Å; L294-Y369 WeakPolarHBondContact CG-OH 3.33Å
295	F	91.1	Very high	89	Confident	24 Å²	24	48.6 Å²	48.6	11%	0.105	23%	0.231	C	C	.	.	H	α-helix	trans	-61.2	-46.3	173.7	177.2	-99.3	0	0	0	112	F77 K291 T292 N293 I297 A298 C299 Y369 I373 R396	F77-F295 HydrophobicContact CE2-CD2 4.46Å; F77-F295 HydrophobicContact CE2-CE2 4.14Å; K291-F295 PolarHBondContact O-N 2.93Å; T292-F295 WeakPolarHBondContact O-CB 3.2Å; T292-F295 PolarHBondContact O-N 3.31Å; N293-F295 VanDerWaalsContact C-N 3.32Å; N293-F295 PolarHBondContact O-N 3.41Å; F295-I297 VanDerWaalsContact C-N 3.33Å; F295-I297 PolarHBondContact O-N 3.08Å; F295-A298 PolarHBondContact O-N 3Å; F295-C299 WeakPolarHBondContact CZ-SG 3.19Å; F295-C299 PolarHBondContact O-N 3.32Å; F295-C299 PolarHBondContact O-SG 2.94Å; F295-Y369 HydrophobicContact CB-CD1 4.13Å; F295-Y369 HydrophobicContact CB-CE1 3.68Å; F295-Y369 HydrophobicContact CB-CE2 4.25Å; F295-Y369 AromaticContact CD2-CD1 3.58Å; F295-Y369 HydrophobicContact CD2-CD1 3.58Å; F295-Y369 HydrophobicContact CD2-CD2 4.07Å; F295-Y369 HydrophobicContact CD2-CE1 4.05Å; F295-Y369 AromaticContact CD2-CG 3.58Å; F295-Y369 HydrophobicContact CD2-CG 3.58Å; F295-Y369 HydrophobicContact CE2-CD1 4.49Å; F295-Y369 HydrophobicContact CE2-CG 4.33Å; F295-Y369 HydrophobicContact CG-CD1 4.27Å; F295-Y369 HydrophobicContact CG-CE1 4.31Å; F295-Y369 PolarHBondContact N-OH 3.24Å; F295-I373 HydrophobicContact CE2-CD1 3.96Å; F295-I373 HydrophobicContact CE2-CG1 4.03Å; F295-I373 HydrophobicContact CZ-CD1 4.18Å; F295-I373 HydrophobicContact CZ-CG1 4Å; F295-R396 HydrophobicContact CE1-CG 4.21Å; F295-R396 HydrophobicContact CZ-CG 4.41Å; F295-R396 VanDerWaalsContact CZ-NE 3.32Å
296	Q	90.9	Very high	89.3	Confident	133 Å²	133	48.6 Å²	48.6	62%	0.621	23%	0.23	S	C	*	.	H	α-helix	trans	-61.3	-40.9	179	-70	-179.7	-19	0	0	112.2	T292 N293 A300	T292-Q296 PolarHBondContact O-N 3.39Å; N293-Q296 PolarHBondContact O-N 3.27Å; Q296-A300 WeakPolarHBondContact O-CB 3.31Å; Q296-A300 PolarHBondContact O-N 3.07Å
297	I	89.8	Confident	89.9	Confident	26 Å²	26	40.9 Å²	40.9	13%	0.133	20%	0.196	C	C	.	.	H	α-helix	trans	-66.9	-47	176.7	-69.2	169.7	0	0	0	110.6	M289 N293 L294 F295 C299 A300 D301	M289-I297 HydrophobicContact CE-CD1 3.52Å; M289-I297 HydrophobicContact SD-CD1 3.36Å; M289-I297 WeakPolarHBondContact SD-CD1 3.46Å; N293-I297 PolarHBondContact O-N 3.2Å; N293-I297 VanDerWaalsContact O-N 3.1Å; L294-I297 PolarHBondContact O-N 3.36Å; F295-I297 VanDerWaalsContact C-N 3.33Å; F295-I297 PolarHBondContact O-N 3.08Å; I297-C299 VanDerWaalsContact C-N 3.3Å; I297-C299 PolarHBondContact O-N 3.34Å; I297-A300 CarbonylContact O-C 3.02Å; I297-A300 WeakPolarHBondContact O-CA 3.44Å; I297-A300 WeakPolarHBondContact O-CB 3.41Å; I297-A300 PolarHBondContact O-N 3.48Å; I297-D301 PolarHBondContact O-N 2.99Å
298	A	90.2	Very high	90.2	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60	-38.4	178.1	0	0	0	0	0	112.5	F77 L294 F295 V302 Y366	F77-A298 HydrophobicContact CD1-CB 4.32Å; F77-A298 HydrophobicContact CE1-CB 3.49Å; F77-A298 VanDerWaalsContact CE1-CB 3.49Å; F77-A298 HydrophobicContact CZ-CB 3.76Å; L294-A298 WeakPolarHBondContact O-CB 3.33Å; L294-A298 PolarHBondContact O-N 3.46Å; F295-A298 PolarHBondContact O-N 3Å; A298-V302 WeakPolarHBondContact O-CG2 3.48Å; A298-V302 PolarHBondContact O-N 2.94Å; A298-V302 VanDerWaalsContact O-N 3.12Å; A298-Y366 HydrophobicContact CB-CE1 4.49Å
299	C	90.9	Very high	90.5	Very high	3 Å²	3	27.1 Å²	27.1	2%	0.02	15%	0.145	C	C	.	.	H	α-helix	trans	-64.6	-39.8	170.8	-73.6	0	0	0	0	112.9	F295 I297 V302 R303 M397	F295-C299 WeakPolarHBondContact CZ-SG 3.19Å; F295-C299 PolarHBondContact O-N 3.32Å; F295-C299 PolarHBondContact O-SG 2.94Å; I297-C299 VanDerWaalsContact C-N 3.3Å; I297-C299 PolarHBondContact O-N 3.34Å; C299-V302 PolarHBondContact O-N 3.48Å; C299-R303 PolarHBondContact O-N 3.43Å; C299-R303 VanDerWaalsContact O-N 3.08Å; C299-M397 HydrophobicContact CB-SD 4.38Å
300	A	90.7	Very high	91.1	Very high	24 Å²	24	27.4 Å²	27.4	20%	0.198	15%	0.148	C	C	.	.	H	α-helix	trans	-65.3	-40.4	177.3	0	0	0	0	0	112.1	Q296 I297 R303 E304	Q296-A300 WeakPolarHBondContact O-CB 3.31Å; Q296-A300 PolarHBondContact O-N 3.07Å; I297-A300 CarbonylContact O-C 3.02Å; I297-A300 WeakPolarHBondContact O-CA 3.44Å; I297-A300 WeakPolarHBondContact O-CB 3.41Å; I297-A300 PolarHBondContact O-N 3.48Å; A300-R303 WeakPolarHBondContact O-CB 3.26Å; A300-R303 PolarHBondContact O-N 3.33Å; A300-E304 VanDerWaalsContact O-CB 3.28Å; A300-E304 WeakPolarHBondContact O-CB 3.39Å; A300-E304 PolarHBondContact O-N 3.17Å
301	D	90.4	Very high	91.3	Very high	3 Å²	3	27 Å²	27	2%	0.016	14%	0.139	C	C	.	.	H	α-helix	trans	-63.7	-41.1	176	-58.5	-29.5	0	0	0	111.4	M78 I297 E304 R305 K351 H352	M78-D301 HydrophobicContact CE-CB 4.02Å; I297-D301 PolarHBondContact O-N 2.99Å; D301-E304 PolarHBondContact O-N 3.13Å; D301-R305 WeakPolarHBondContact O-CG 3.28Å; D301-R305 PolarHBondContact O-N 3.14Å; D301-K351 VanDerWaalsContact CG-NZ 3.27Å; D301-K351 IonicContact OD1-NZ 2.79Å; D301-K351 PolarHBondContact OD1-NZ 3.41Å; D301-K351 WeakPolarHBondContact OD2-CE 3.42Å; D301-K351 IonicContact OD2-NZ 2.71Å; D301-H352 IonicContact OD2-CD2 3.46Å; D301-H352 IonicContact OD2-CE1 2.57Å; D301-H352 PolarHBondContact OD2-CE1 2.73Å; D301-H352 IonicContact OD2-NE2 3.8Å; D301-H352 PolarHBondContact OD2-NE2 2.82Å
302	V	91.9	Very high	91.5	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-58.8	-47.8	172.7	161.5	0	0	0	0	111.7	F77 M78 M82 A298 C299 E304 F306	F77-V302 HydrophobicContact CD1-CG2 4.26Å; F77-V302 HydrophobicContact CE1-CG2 3.8Å; M78-V302 HydrophobicContact CE-CG2 3.99Å; M78-V302 HydrophobicContact SD-CG2 3.71Å; M82-V302 VanDerWaalsContact SD-O 3.39Å; A298-V302 WeakPolarHBondContact O-CG2 3.48Å; A298-V302 PolarHBondContact O-N 2.94Å; A298-V302 VanDerWaalsContact O-N 3.12Å; C299-V302 PolarHBondContact O-N 3.48Å; V302-E304 VanDerWaalsContact C-N 3.35Å; V302-F306 PolarHBondContact O-N 2.88Å
303	R	91.2	Very high	91.8	Very high	15 Å²	15	23.9 Å²	23.9	6%	0.057	13%	0.129	C	C	.	.	H	α-helix	trans	-62.7	-42.2	177	178.1	-158.2	69.3	108.8	12.8	111.4	D191 C299 A300 F306 H307 G398 L399	D191-R303 IonicContact OD2-CZ 3.66Å; D191-R303 IonicContact OD2-NH1 2.79Å; D191-R303 PolarHBondContact OD2-NH1 3.34Å; D191-R303 IonicContact OD2-NH2 3.61Å; C299-R303 PolarHBondContact O-N 3.43Å; C299-R303 VanDerWaalsContact O-N 3.08Å; A300-R303 WeakPolarHBondContact O-CB 3.26Å; A300-R303 PolarHBondContact O-N 3.33Å; R303-F306 WeakPolarHBondContact O-CB 3.4Å; R303-F306 PolarHBondContact O-N 3.33Å; R303-H307 PolarHBondContact O-CD2 3.05Å; R303-H307 PolarHBondContact O-N 3.39Å; R303-G398 WeakPolarHBondContact CD-O 3.35Å; R303-L399 HydrophobicContact CG-CB 4.43Å; R303-L399 HydrophobicContact CG-CD1 4.23Å
304	E	91.3	Very high	91.9	Very high	12 Å²	12	21.8 Å²	21.8	6%	0.056	12%	0.117	C	C	.	.	H	α-helix	trans	-63.7	-47.2	179.7	175.6	155.6	-175.8	0	0	111.6	R192 A300 D301 V302 F306 H307 Y308	R192-E304 IonicContact CZ-OE2 3.75Å; R192-E304 IonicContact NH2-OE2 2.89Å; R192-E304 PolarHBondContact NH2-OE2 2.84Å; A300-E304 VanDerWaalsContact O-CB 3.28Å; A300-E304 WeakPolarHBondContact O-CB 3.39Å; A300-E304 PolarHBondContact O-N 3.17Å; D301-E304 PolarHBondContact O-N 3.13Å; V302-E304 VanDerWaalsContact C-N 3.35Å; E304-F306 VanDerWaalsContact C-N 3.31Å; E304-F306 PolarHBondContact O-N 3.07Å; E304-H307 WeakPolarHBondContact O-CB 3.43Å; E304-H307 PolarHBondContact O-N 3.32Å; E304-H307 VanDerWaalsContact O-N 3.14Å; E304-Y308 HydrophobicContact CG-CD2 3.98Å; E304-Y308 HydrophobicContact CG-CE2 3.34Å; E304-Y308 WeakPolarHBondContact O-CD2 3.28Å; E304-Y308 PolarHBondContact O-N 3.02Å; E304-Y308 PolarHBondContact OE1-OH 2.79Å
305	R	91.6	Very high	92	Very high	25 Å²	25	21.8 Å²	21.8	9%	0.094	12%	0.117	C	C	.	.	H	α-helix	trans	-57.4	-40.4	169.7	-72.5	173.5	174.7	-139.4	2	113.4	E69 M82 D301 H307 Y308 C309 D348	E69-R305 VanDerWaalsContact CD-NH1 3.33Å; E69-R305 IonicContact OE1-CZ 3.54Å; E69-R305 IonicContact OE1-NH1 3.12Å; E69-R305 PolarHBondContact OE1-NH1 2.69Å; E69-R305 IonicContact OE1-NH2 3.13Å; E69-R305 PolarHBondContact OE1-NH2 2.92Å; M82-R305 HydrophobicContact CE-CB 4.2Å; M82-R305 HydrophobicContact SD-CB 3.68Å; D301-R305 WeakPolarHBondContact O-CG 3.28Å; D301-R305 PolarHBondContact O-N 3.14Å; R305-H307 VanDerWaalsContact C-N 3.33Å; R305-Y308 PolarHBondContact O-N 3.13Å; R305-C309 PolarHBondContact O-N 3.33Å; R305-C309 PolarHBondContact O-SG 3.35Å; R305-C309 VanDerWaalsContact O-SG 3.42Å; R305-D348 IonicContact CZ-OD2 3.92Å; R305-D348 IonicContact NE-OD2 3.36Å; R305-D348 PolarHBondContact NE-OD2 2.93Å; R305-D348 IonicContact NH2-OD2 3.49Å; R305-D348 PolarHBondContact NH2-OD2 3.09Å
306	F	93.8	Very high	92.1	Very high	12 Å²	12	21.5 Å²	21.5	5%	0.053	12%	0.118	C	C	.	.	H	α-helix	trans	-63.6	-41.1	177	-174	-104.6	0	0	0	111.3	M82 C85 L86 L89 V302 R303 E304 C309 V310 L399 L404	M82-F306 HydrophobicContact CE-CB 4.38Å; M82-F306 HydrophobicContact CE-CD2 4.44Å; M82-F306 HydrophobicContact SD-CB 3.79Å; M82-F306 HydrophobicContact SD-CD2 4.46Å; M82-F306 PolarHBondContact SD-N 3.32Å; M82-F306 VanDerWaalsContact SD-N 3.42Å; C85-F306 HydrophobicContact CB-CB 4.05Å; C85-F306 HydrophobicContact CB-CD1 3.8Å; C85-F306 HydrophobicContact CB-CD2 3.65Å; C85-F306 HydrophobicContact CB-CE1 4.13Å; C85-F306 HydrophobicContact CB-CE2 4Å; C85-F306 HydrophobicContact CB-CG 3.54Å; C85-F306 HydrophobicContact CB-CZ 4.22Å; L86-F306 HydrophobicContact CB-CE2 3.91Å; L86-F306 HydrophobicContact CB-CZ 4.49Å; L86-F306 HydrophobicContact CD1-CE2 4.45Å; L89-F306 HydrophobicContact CB-CE1 4.36Å; L89-F306 HydrophobicContact CB-CZ 3.98Å; L89-F306 HydrophobicContact CD2-CE1 4.1Å; L89-F306 HydrophobicContact CD2-CZ 3.68Å; L89-F306 HydrophobicContact CG-CZ 4.48Å; V302-F306 PolarHBondContact O-N 2.88Å; R303-F306 WeakPolarHBondContact O-CB 3.4Å; R303-F306 PolarHBondContact O-N 3.33Å; E304-F306 VanDerWaalsContact C-N 3.31Å; E304-F306 PolarHBondContact O-N 3.07Å; F306-C309 PolarHBondContact O-N 2.89Å; F306-V310 HydrophobicContact CE1-CG2 4.34Å; F306-V310 HydrophobicContact CZ-CG2 4.46Å; F306-V310 WeakPolarHBondContact O-CG2 3.45Å; F306-V310 PolarHBondContact O-N 3.42Å; F306-V310 VanDerWaalsContact O-N 3.13Å; F306-L399 HydrophobicContact CD1-CD1 4.15Å; F306-L399 HydrophobicContact CE1-CD1 4.46Å; F306-L404 HydrophobicContact CD1-CD1 4.41Å; F306-L404 HydrophobicContact CE1-CD1 4.33Å; F306-L404 HydrophobicContact CE1-CD2 4.3Å
307	H	93.4	Very high	92.1	Very high	6 Å²	6	17.2 Å²	17.2	3%	0.028	10%	0.102	C	C	.	.	H	α-helix	trans	-63	-46.3	173.1	-72.3	-159.1	0	0	0	111.4	R303 E304 R305 C309 V310 W311	R303-H307 PolarHBondContact O-CD2 3.05Å; R303-H307 PolarHBondContact O-N 3.39Å; E304-H307 WeakPolarHBondContact O-CB 3.43Å; E304-H307 PolarHBondContact O-N 3.32Å; E304-H307 VanDerWaalsContact O-N 3.14Å; R305-H307 VanDerWaalsContact C-N 3.33Å; H307-C309 PolarHBondContact O-N 3.14Å; H307-V310 PolarHBondContact O-N 3.05Å; H307-V310 VanDerWaalsContact O-N 3.14Å; H307-W311 HydrophobicContact CB-CD2 4.43Å; H307-W311 HydrophobicContact CB-CH2 4.14Å; H307-W311 HydrophobicContact CB-CZ2 3.88Å; H307-W311 PolarHBondContact O-N 3.23Å
308	Y	92.2	Very high	92.1	Very high	8 Å²	8	17.9 Å²	17.9	3%	0.031	10%	0.103	C	C	.	.	H	α-helix	trans	-58.1	-45.9	175.6	-71.9	-49.3	0	0	0	112.5	E304 R305 V310 W311 F312 E344	E304-Y308 HydrophobicContact CG-CD2 3.98Å; E304-Y308 HydrophobicContact CG-CE2 3.34Å; E304-Y308 WeakPolarHBondContact O-CD2 3.28Å; E304-Y308 PolarHBondContact O-N 3.02Å; E304-Y308 PolarHBondContact OE1-OH 2.79Å; R305-Y308 PolarHBondContact O-N 3.13Å; Y308-V310 VanDerWaalsContact C-N 3.29Å; Y308-V310 PolarHBondContact O-N 3.13Å; Y308-W311 AromaticContact CD1-CE3 3.65Å; Y308-W311 HydrophobicContact CD1-CE3 3.65Å; Y308-W311 AromaticContact CD1-CZ3 3.79Å; Y308-W311 HydrophobicContact CD1-CZ3 3.79Å; Y308-W311 AromaticContact CE1-CE3 3.95Å; Y308-W311 HydrophobicContact CE1-CE3 3.95Å; Y308-W311 AromaticContact CE1-CZ3 3.64Å; Y308-W311 HydrophobicContact CE1-CZ3 3.64Å; Y308-W311 PolarHBondContact O-N 2.92Å; Y308-F312 HydrophobicContact CD1-CE2 4.42Å; Y308-F312 HydrophobicContact CG-CE2 4.44Å; Y308-F312 WeakPolarHBondContact O-CD2 3.35Å; Y308-F312 WeakPolarHBondContact O-CG 3.32Å; Y308-F312 PolarHBondContact O-N 2.86Å; Y308-E344 HydrophobicContact CD2-CG 4.14Å; Y308-E344 HydrophobicContact CE2-CG 4.32Å; Y308-E344 WeakPolarHBondContact CE2-OE1 3.17Å
309	C	92.9	Very high	92.1	Very high	45 Å²	45	18.5 Å²	18.5	30%	0.304	11%	0.106	S	C	.	.	H	α-helix	trans	-57.9	-40.6	175.4	-74.5	0	0	0	0	112.5	M82 R305 F306 H307 S313	M82-C309 HydrophobicContact CE-CB 4.47Å; R305-C309 PolarHBondContact O-N 3.33Å; R305-C309 PolarHBondContact O-SG 3.35Å; R305-C309 VanDerWaalsContact O-SG 3.42Å; F306-C309 PolarHBondContact O-N 2.89Å; H307-C309 PolarHBondContact O-N 3.14Å; C309-S313 WeakPolarHBondContact O-CB 3.44Å; C309-S313 PolarHBondContact O-N 3.49Å; C309-S313 VanDerWaalsContact O-N 3.07Å; C309-S313 PolarHBondContact O-OG 2.94Å
310	V	94.4	Very high	92.1	Very high	15 Å²	15	18.5 Å²	18.5	9%	0.091	11%	0.106	C	C	.	.	H	α-helix	trans	-68	-45.4	175.7	169	0	0	0	0	111.4	F306 H307 Y308 S313 I314 L404 I408	F306-V310 HydrophobicContact CE1-CG2 4.34Å; F306-V310 HydrophobicContact CZ-CG2 4.46Å; F306-V310 WeakPolarHBondContact O-CG2 3.45Å; F306-V310 PolarHBondContact O-N 3.42Å; F306-V310 VanDerWaalsContact O-N 3.13Å; H307-V310 PolarHBondContact O-N 3.05Å; H307-V310 VanDerWaalsContact O-N 3.14Å; Y308-V310 VanDerWaalsContact C-N 3.29Å; Y308-V310 PolarHBondContact O-N 3.13Å; V310-S313 WeakPolarHBondContact O-CB 3.32Å; V310-S313 PolarHBondContact O-N 3.02Å; V310-I314 HydrophobicContact CG1-CD1 3.95Å; V310-I314 WeakPolarHBondContact O-CG1 3.41Å; V310-I314 PolarHBondContact O-N 2.93Å; V310-L404 HydrophobicContact CG1-CD2 4.4Å; V310-L404 HydrophobicContact CG1-CG 4.39Å; V310-L404 HydrophobicContact CG2-CD1 4.5Å; V310-L404 HydrophobicContact CG2-CD2 4.3Å; V310-I408 HydrophobicContact CG1-CD1 3.78Å; V310-I408 HydrophobicContact CG1-CG1 3.8Å; V310-I408 HydrophobicContact CG2-CD1 4.43Å
311	W	93	Very high	92	Very high	13 Å²	13	20.5 Å²	20.5	5%	0.049	11%	0.113	C	C	.	.	H	α-helix	trans	-65.2	-44.3	-179.6	-62.1	-19.6	0	0	0	112.4	L251 Q254 V255 L258 H307 Y308 I314 I315	L251-W311 HydrophobicContact CD2-CZ2 4.19Å; Q254-W311 HydrophobicContact CB-CZ2 4.35Å; V255-W311 HydrophobicContact CG2-CB 4.15Å; V255-W311 HydrophobicContact CG2-CG 3.76Å; L258-W311 HydrophobicContact CD2-CB 4.25Å; L258-W311 HydrophobicContact CD2-CE3 4.46Å; H307-W311 HydrophobicContact CB-CD2 4.43Å; H307-W311 HydrophobicContact CB-CH2 4.14Å; H307-W311 HydrophobicContact CB-CZ2 3.88Å; H307-W311 PolarHBondContact O-N 3.23Å; Y308-W311 AromaticContact CD1-CE3 3.65Å; Y308-W311 HydrophobicContact CD1-CE3 3.65Å; Y308-W311 AromaticContact CD1-CZ3 3.79Å; Y308-W311 HydrophobicContact CD1-CZ3 3.79Å; Y308-W311 AromaticContact CE1-CE3 3.95Å; Y308-W311 HydrophobicContact CE1-CE3 3.95Å; Y308-W311 AromaticContact CE1-CZ3 3.64Å; Y308-W311 HydrophobicContact CE1-CZ3 3.64Å; Y308-W311 PolarHBondContact O-N 2.92Å; W311-I314 PolarHBondContact O-N 3.45Å; W311-I315 WeakPolarHBondContact O-CG1 3.45Å; W311-I315 PolarHBondContact O-N 2.87Å
312	F	93.5	Very high	91.8	Very high	6 Å²	6	27.3 Å²	27.3	3%	0.026	15%	0.145	C	C	.	.	H	α-helix	trans	-65.4	-38	174.4	-66.2	-52.6	0	0	0	112.1	L258 Y308 I314 I315 V316 V337 I340 L341	L258-F312 HydrophobicContact CD2-CD1 4.38Å; L258-F312 HydrophobicContact CD2-CE1 3.88Å; L258-F312 HydrophobicContact CD2-CZ 4.35Å; L258-F312 HydrophobicContact CG-CE1 4.45Å; Y308-F312 HydrophobicContact CD1-CE2 4.42Å; Y308-F312 HydrophobicContact CG-CE2 4.44Å; Y308-F312 WeakPolarHBondContact O-CD2 3.35Å; Y308-F312 WeakPolarHBondContact O-CG 3.32Å; Y308-F312 PolarHBondContact O-N 2.86Å; F312-I314 VanDerWaalsContact C-N 3.28Å; F312-I314 PolarHBondContact O-N 3.31Å; F312-I315 HydrophobicContact CD1-CD1 4.38Å; F312-I315 PolarHBondContact O-N 2.69Å; F312-V316 VanDerWaalsContact O-CG2 3.32Å; F312-V316 WeakPolarHBondContact O-CG2 3.03Å; F312-V316 PolarHBondContact O-N 3.3Å; F312-V337 HydrophobicContact CB-CG1 3.75Å; F312-V337 HydrophobicContact CB-CG2 4.34Å; F312-V337 HydrophobicContact CD1-CG2 4.27Å; F312-V337 HydrophobicContact CD2-CG1 4.4Å; F312-V337 HydrophobicContact CG-CG1 4Å; F312-V337 HydrophobicContact CG-CG2 4.48Å; F312-I340 HydrophobicContact CE1-CD1 4.28Å; F312-I340 HydrophobicContact CE1-CG2 4.22Å; F312-I340 HydrophobicContact CE2-CG2 4.08Å; F312-I340 HydrophobicContact CZ-CB 4.24Å; F312-I340 HydrophobicContact CZ-CG2 3.48Å; F312-I340 VanDerWaalsContact CZ-CG2 3.48Å; F312-L341 HydrophobicContact CD2-CD2 3.85Å; F312-L341 HydrophobicContact CD2-CG 4.07Å; F312-L341 HydrophobicContact CE2-CD2 3.94Å; F312-L341 HydrophobicContact CE2-CG 4.24Å
313	S	93.3	Very high	91.6	Very high	73 Å²	73	29.4 Å²	29.4	51%	0.51	16%	0.16	S	C	.	.	H	α-helix	trans	-59.2	-40.5	172.7	-60.8	0	0	0	0	111.8	C309 V310 C317	C309-S313 WeakPolarHBondContact O-CB 3.44Å; C309-S313 PolarHBondContact O-N 3.49Å; C309-S313 VanDerWaalsContact O-N 3.07Å; C309-S313 PolarHBondContact O-OG 2.94Å; V310-S313 WeakPolarHBondContact O-CB 3.32Å; V310-S313 PolarHBondContact O-N 3.02Å; S313-C317 PolarHBondContact O-N 3.08Å; S313-C317 VanDerWaalsContact O-N 3.1Å; S313-C317 PolarHBondContact O-SG 3.24Å; S313-C317 VanDerWaalsContact O-SG 3.34Å
314	I	93.3	Very high	91.4	Very high	14 Å²	14	31.3 Å²	31.3	7%	0.072	18%	0.184	C	C	.	.	H	α-helix	trans	-66.9	-42.6	175	-67.5	164.2	0	0	0	111.2	V255 V310 W311 F312 C317 R318 L407 I408 M411	V255-I314 HydrophobicContact CG1-CB 4.44Å; V255-I314 HydrophobicContact CG1-CG2 3.74Å; V310-I314 HydrophobicContact CG1-CD1 3.95Å; V310-I314 WeakPolarHBondContact O-CG1 3.41Å; V310-I314 PolarHBondContact O-N 2.93Å; W311-I314 PolarHBondContact O-N 3.45Å; F312-I314 VanDerWaalsContact C-N 3.28Å; F312-I314 PolarHBondContact O-N 3.31Å; I314-C317 PolarHBondContact O-N 3.07Å; I314-R318 HydrophobicContact CG2-CG 4.33Å; I314-R318 WeakPolarHBondContact O-CG 3.13Å; I314-R318 PolarHBondContact O-N 3.46Å; I314-L407 HydrophobicContact CD1-CD2 4Å; I314-L407 HydrophobicContact CD1-CG 4.14Å; I314-I408 HydrophobicContact CD1-CG1 4.33Å; I314-M411 HydrophobicContact CD1-CG 4.37Å; I314-M411 HydrophobicContact CG1-CB 4.48Å; I314-M411 HydrophobicContact CG2-CB 3.95Å; I314-M411 HydrophobicContact CG2-CE 3.73Å; I314-M411 HydrophobicContact CG2-CG 3.88Å
315	I	92.4	Very high	91.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64.5	-42.5	179.1	-69.8	164.9	0	0	0	111.4	L258 N259 F262 W311 F312 C317 R318 N319	L258-I315 HydrophobicContact CB-CD1 3.93Å; L258-I315 HydrophobicContact CD2-CD1 3.68Å; L258-I315 HydrophobicContact CG-CD1 3.55Å; N259-I315 HydrophobicContact CB-CG1 4.19Å; F262-I315 HydrophobicContact CB-CG2 4.39Å; F262-I315 HydrophobicContact CD2-CG2 4.25Å; F262-I315 HydrophobicContact CG-CG2 4.19Å; W311-I315 WeakPolarHBondContact O-CG1 3.45Å; W311-I315 PolarHBondContact O-N 2.87Å; F312-I315 HydrophobicContact CD1-CD1 4.38Å; F312-I315 PolarHBondContact O-N 2.69Å; I315-C317 PolarHBondContact O-N 2.86Å; I315-R318 PolarHBondContact O-N 2.87Å; I315-N319 WeakPolarHBondContact O-CB 3.4Å; I315-N319 PolarHBondContact O-N 3.32Å
316	V	92.8	Very high	91.2	Very high	18 Å²	18	40.5 Å²	40.5	11%	0.109	22%	0.224	C	C	.	.	H	α-helix	trans	-56.8	-50.3	172	172.7	0	0	0	0	109.9	F312 R318 N319 M320 L330 I333 L334 V337	F312-V316 VanDerWaalsContact O-CG2 3.32Å; F312-V316 WeakPolarHBondContact O-CG2 3.03Å; F312-V316 PolarHBondContact O-N 3.3Å; V316-R318 PolarHBondContact O-N 3.34Å; V316-N319 PolarHBondContact O-N 3.16Å; V316-M320 HydrophobicContact CG1-CG 4.16Å; V316-M320 VanDerWaalsContact O-CB 3.22Å; V316-M320 WeakPolarHBondContact O-CB 3.47Å; V316-M320 WeakPolarHBondContact O-CG 3.41Å; V316-M320 PolarHBondContact O-N 3.02Å; V316-L330 HydrophobicContact CG1-CD1 3.76Å; V316-I333 HydrophobicContact CG2-CG2 3.92Å; V316-L334 HydrophobicContact CG2-CD2 4.25Å; V316-V337 HydrophobicContact CG2-CG2 4.18Å
317	C	91.1	Very high	91.2	Very high	43 Å²	43	45.8 Å²	45.8	29%	0.291	25%	0.252	S	S	.	.	H	α-helix	trans	-61	-38.3	177.2	-72.9	0	0	0	0	113.5	S313 I314 I315 N321	S313-C317 PolarHBondContact O-N 3.08Å; S313-C317 VanDerWaalsContact O-N 3.1Å; S313-C317 PolarHBondContact O-SG 3.24Å; S313-C317 VanDerWaalsContact O-SG 3.34Å; I314-C317 PolarHBondContact O-N 3.07Å; I315-C317 PolarHBondContact O-N 2.86Å; C317-N321 VanDerWaalsContact O-CB 3.31Å; C317-N321 WeakPolarHBondContact O-CB 3.45Å; C317-N321 PolarHBondContact O-N 2.91Å
318	R	90.4	Very high	91.1	Very high	41 Å²	41	51.4 Å²	51.4	16%	0.155	28%	0.282	C	S	.	.	H	α-helix	trans	-64	-53.9	176.1	-74.7	-179.3	76	128	13.8	111.4	S165 N259 I314 I315 V316 M320 N321 E322 M411	S165-R318 PolarHBondContact OG-NH1 3.46Å; S165-R318 PolarHBondContact OG-NH2 3.29Å; N259-R318 VanDerWaalsContact OD1-CD 3.26Å; N259-R318 WeakPolarHBondContact OD1-CD 3.44Å; N259-R318 PolarHBondContact OD1-NE 3.25Å; I314-R318 HydrophobicContact CG2-CG 4.33Å; I314-R318 WeakPolarHBondContact O-CG 3.13Å; I314-R318 PolarHBondContact O-N 3.46Å; I315-R318 PolarHBondContact O-N 2.87Å; V316-R318 PolarHBondContact O-N 3.34Å; R318-M320 PolarHBondContact O-N 3.39Å; R318-N321 WeakPolarHBondContact O-CB 3.5Å; R318-N321 PolarHBondContact O-N 3.41Å; R318-E322 PolarHBondContact O-N 3.47Å; R318-E322 VanDerWaalsContact O-N 3.15Å; R318-M411 HydrophobicContact CG-CE 3.86Å
319	N	89.7	Confident	91.1	Very high	12 Å²	12	53.7 Å²	53.7	6%	0.064	30%	0.295	C	S	.	.	H	α-helix	trans	-67.5	-37.6	-176.4	-74	-4.5	0	0	0	111.5	N263 I315 V316 N321 E322 S323 I333	N263-N319 PolarHBondContact ND2-OD1 2.62Å; N263-N319 PolarHBondContact OD1-ND2 3.49Å; N263-N319 PolarHBondContact OD1-OD1 3.38Å; I315-N319 WeakPolarHBondContact O-CB 3.4Å; I315-N319 PolarHBondContact O-N 3.32Å; V316-N319 PolarHBondContact O-N 3.16Å; N319-N321 VanDerWaalsContact C-N 3.28Å; N319-N321 PolarHBondContact O-N 3.39Å; N319-E322 PolarHBondContact O-N 3.01Å; N319-E322 VanDerWaalsContact O-N 3.1Å; N319-S323 WeakPolarHBondContact O-CB 3.38Å; N319-S323 PolarHBondContact O-N 3.08Å; N319-I333 HydrophobicContact CB-CD1 3.78Å
320	M	90.1	Very high	91.1	Very high	4 Å²	4	53.6 Å²	53.6	2%	0.02	29%	0.291	C	S	.	.	H	α-helix	trans	-61.8	-34.8	173.1	-74.8	-64.3	-75.3	0	0	113.1	V316 R318 E322 G324 W325 L330	V316-M320 HydrophobicContact CG1-CG 4.16Å; V316-M320 VanDerWaalsContact O-CB 3.22Å; V316-M320 WeakPolarHBondContact O-CB 3.47Å; V316-M320 WeakPolarHBondContact O-CG 3.41Å; V316-M320 PolarHBondContact O-N 3.02Å; R318-M320 PolarHBondContact O-N 3.39Å; M320-E322 VanDerWaalsContact C-N 3.34Å; M320-G324 PolarHBondContact O-N 3.19Å; M320-G324 VanDerWaalsContact O-N 3.09Å; M320-W325 HydrophobicContact CB-CD2 4.08Å; M320-W325 HydrophobicContact CB-CE3 4.11Å; M320-W325 HydrophobicContact CB-CH2 4.42Å; M320-W325 HydrophobicContact CB-CZ2 4.4Å; M320-W325 HydrophobicContact CB-CZ3 4.28Å; M320-W325 HydrophobicContact CE-CB 4.13Å; M320-W325 HydrophobicContact CE-CD2 4.21Å; M320-W325 HydrophobicContact CE-CE3 3.69Å; M320-W325 HydrophobicContact CE-CG 4.43Å; M320-W325 HydrophobicContact CE-CZ3 4.43Å; M320-W325 PolarHBondContact O-N 2.95Å; M320-L330 HydrophobicContact CE-CB 3.65Å; M320-L330 HydrophobicContact CE-CD1 4.01Å; M320-L330 HydrophobicContact CE-CD2 4.11Å; M320-L330 HydrophobicContact CE-CG 4.12Å; M320-L330 HydrophobicContact CG-CD1 3.97Å; M320-L330 HydrophobicContact SD-CB 3.59Å; M320-L330 VanDerWaalsContact SD-CB 3.59Å; M320-L330 HydrophobicContact SD-CD1 3.83Å; M320-L330 HydrophobicContact SD-CG 4.23Å
321	N	88.4	Confident	91.1	Very high	66 Å²	66	58.6 Å²	58.6	35%	0.353	31%	0.314	S	S	.	.	H	α-helix	trans	-73.5	-23.7	175.4	-164.9	48.8	0	0	0	113.1	C317 R318 N319 T415	C317-N321 VanDerWaalsContact O-CB 3.31Å; C317-N321 WeakPolarHBondContact O-CB 3.45Å; C317-N321 PolarHBondContact O-N 2.91Å; R318-N321 WeakPolarHBondContact O-CB 3.5Å; R318-N321 PolarHBondContact O-N 3.41Å; N319-N321 VanDerWaalsContact C-N 3.28Å; N319-N321 PolarHBondContact O-N 3.39Å; N321-T415 HydrophobicContact CB-CG2 4.06Å; N321-T415 PolarHBondContact ND2-O 3.1Å
322	E	87	Confident	91	Very high	145 Å²	145	62 Å²	62	68%	0.678	34%	0.336	S	S	*	.	H	α-helix	trans	-81.4	-42	172	-169.2	168.7	-176.5	0	0	111.5	R318 N319 M320 G324	R318-E322 PolarHBondContact O-N 3.47Å; R318-E322 VanDerWaalsContact O-N 3.15Å; N319-E322 PolarHBondContact O-N 3.01Å; N319-E322 VanDerWaalsContact O-N 3.1Å; M320-E322 VanDerWaalsContact C-N 3.34Å; E322-G324 VanDerWaalsContact C-N 3.29Å; E322-G324 PolarHBondContact O-N 3.22Å
323	S	87	Confident	90.9	Very high	45 Å²	45	62.4 Å²	62.4	32%	0.315	34%	0.338	S	S	.	.	H	α-helix	trans	-68	-18.2	174.8	-89.9	0	0	0	0	115.1	N319 N326 D329	N319-S323 WeakPolarHBondContact O-CB 3.38Å; N319-S323 PolarHBondContact O-N 3.08Å; S323-N326 PolarHBondContact O-ND2 2.95Å; S323-D329 WeakPolarHBondContact CB-OD2 3.42Å; S323-D329 VanDerWaalsContact OG-CG 3.32Å; S323-D329 PolarHBondContact OG-OD2 3.38Å
324	G	87	Confident	90.9	Very high	54 Å²	54	62.5 Å²	62.5	56%	0.557	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	25.3	-174	0	0	0	0	0	114.3	M320 E322	M320-G324 PolarHBondContact O-N 3.19Å; M320-G324 VanDerWaalsContact O-N 3.09Å; E322-G324 VanDerWaalsContact C-N 3.29Å; E322-G324 PolarHBondContact O-N 3.22Å
325	W	87.5	Confident	90.8	Very high	151 Å²	151	65.5 Å²	65.5	57%	0.572	35%	0.348	S	S	*	.	S	Bend	trans	67.6	35	175.4	-60.9	79.1	0	0	0	117.1	M320	M320-W325 HydrophobicContact CB-CD2 4.08Å; M320-W325 HydrophobicContact CB-CE3 4.11Å; M320-W325 HydrophobicContact CB-CH2 4.42Å; M320-W325 HydrophobicContact CB-CZ2 4.4Å; M320-W325 HydrophobicContact CB-CZ3 4.28Å; M320-W325 HydrophobicContact CE-CB 4.13Å; M320-W325 HydrophobicContact CE-CD2 4.21Å; M320-W325 HydrophobicContact CE-CE3 3.69Å; M320-W325 HydrophobicContact CE-CG 4.43Å; M320-W325 HydrophobicContact CE-CZ3 4.43Å; M320-W325 PolarHBondContact O-N 2.95Å
326	N	92.2	Very high	90.7	Very high	79 Å²	79	69.1 Å²	69.1	42%	0.422	37%	0.368	S	S	.	.			trans	-66	142.6	171	-51	-47.3	0	0	0	112	S323 D329 L330	S323-N326 PolarHBondContact O-ND2 2.95Å; N326-D329 HydrophobicContact CB-CB 4.22Å; N326-D329 WeakPolarHBondContact CB-OD2 3.37Å; N326-D329 PolarHBondContact ND2-OD2 3.13Å; N326-L330 PolarHBondContact O-N 3.46Å
327	L	93	Very high	90.7	Very high	124 Å²	124	68.8 Å²	68.8	65%	0.649	37%	0.365	S	S	*	.	H	α-helix	trans	-73.7	-34.2	180	-174.1	62.2	0	0	0	112.9	L330 Q331	L327-L330 HydrophobicContact CD1-CD2 4.23Å; L327-L330 WeakPolarHBondContact O-CB 3.46Å; L327-L330 PolarHBondContact O-N 3.49Å; L327-Q331 PolarHBondContact O-N 3.39Å
328	D	92.7	Very high	90.6	Very high	123 Å²	123	70.2 Å²	70.2	66%	0.658	37%	0.373	S	S	*	.	H	α-helix	trans	-68.9	-39.3	-179.6	-52.8	-62.3	0	0	0	111.7	Q331 T332	D328-Q331 PolarHBondContact O-N 2.9Å; D328-T332 WeakPolarHBondContact O-CB 3.27Å; D328-T332 PolarHBondContact O-N 3.09Å; D328-T332 PolarHBondContact O-OG1 2.98Å
329	D	90.8	Very high	90.6	Very high	56 Å²	56	76.1 Å²	76.1	30%	0.299	40%	0.396	S	S	.	.	H	α-helix	trans	-62.4	-45.7	171.4	-66.5	-23.5	0	0	0	110.5	S323 N326 Q331 T332 I333	S323-D329 WeakPolarHBondContact CB-OD2 3.42Å; S323-D329 VanDerWaalsContact OG-CG 3.32Å; S323-D329 PolarHBondContact OG-OD2 3.38Å; N326-D329 HydrophobicContact CB-CB 4.22Å; N326-D329 WeakPolarHBondContact CB-OD2 3.37Å; N326-D329 PolarHBondContact ND2-OD2 3.13Å; D329-Q331 PolarHBondContact O-N 3.34Å; D329-T332 PolarHBondContact O-N 2.73Å; D329-I333 WeakPolarHBondContact O-CD1 3.43Å; D329-I333 VanDerWaalsContact O-CG1 3.26Å; D329-I333 WeakPolarHBondContact O-CG1 3.47Å; D329-I333 PolarHBondContact O-N 3.38Å
330	L	93.5	Very high	90.6	Very high	44 Å²	44	76.3 Å²	76.3	23%	0.23	40%	0.397	C	S	.	.	H	α-helix	trans	-57.4	-49.6	176.7	-176.8	59.7	0	0	0	111.6	V316 M320 N326 L327 T332 I333 L334	V316-L330 HydrophobicContact CG1-CD1 3.76Å; M320-L330 HydrophobicContact CE-CB 3.65Å; M320-L330 HydrophobicContact CE-CD1 4.01Å; M320-L330 HydrophobicContact CE-CD2 4.11Å; M320-L330 HydrophobicContact CE-CG 4.12Å; M320-L330 HydrophobicContact CG-CD1 3.97Å; M320-L330 HydrophobicContact SD-CB 3.59Å; M320-L330 VanDerWaalsContact SD-CB 3.59Å; M320-L330 HydrophobicContact SD-CD1 3.83Å; M320-L330 HydrophobicContact SD-CG 4.23Å; N326-L330 PolarHBondContact O-N 3.46Å; L327-L330 HydrophobicContact CD1-CD2 4.23Å; L327-L330 WeakPolarHBondContact O-CB 3.46Å; L327-L330 PolarHBondContact O-N 3.49Å; L330-T332 VanDerWaalsContact C-N 3.29Å; L330-T332 PolarHBondContact O-N 3.14Å; L330-I333 PolarHBondContact O-N 3.38Å; L330-L334 HydrophobicContact CD1-CD1 3.87Å; L330-L334 HydrophobicContact CD1-CG 3.93Å; L330-L334 HydrophobicContact CD2-CD1 4.41Å; L330-L334 HydrophobicContact CG-CD1 3.77Å; L330-L334 HydrophobicContact CG-CG 4.23Å; L330-L334 VanDerWaalsContact O-CB 3.32Å; L330-L334 WeakPolarHBondContact O-CB 3.44Å; L330-L334 VanDerWaalsContact O-CG 3.24Å; L330-L334 WeakPolarHBondContact O-CG 3.22Å; L330-L334 PolarHBondContact O-N 2.95Å
331	Q	93.6	Very high	90.5	Very high	119 Å²	119	78.7 Å²	78.7	56%	0.556	41%	0.41	S	S	*	.	H	α-helix	trans	-61.8	-40.6	-179.3	-179.2	171.8	-31.8	0	0	111.2	L327 D328 D329 I335	L327-Q331 PolarHBondContact O-N 3.39Å; D328-Q331 PolarHBondContact O-N 2.9Å; D329-Q331 PolarHBondContact O-N 3.34Å; Q331-I335 HydrophobicContact CG-CD1 4Å; Q331-I335 WeakPolarHBondContact O-CD1 3.3Å; Q331-I335 VanDerWaalsContact O-CG1 3.25Å; Q331-I335 WeakPolarHBondContact O-CG1 3.25Å; Q331-I335 PolarHBondContact O-N 3.05Å; Q331-I335 VanDerWaalsContact O-N 3.07Å
332	T	91.4	Very high	90.6	Very high	84 Å²	84	80.1 Å²	80.1	52%	0.515	42%	0.417	S	S	.	.	H	α-helix	trans	-62.4	-51.7	177.1	-55.2	0	0	0	0	111.3	D328 D329 L330 L334 I335 D336	D328-T332 WeakPolarHBondContact O-CB 3.27Å; D328-T332 PolarHBondContact O-N 3.09Å; D328-T332 PolarHBondContact O-OG1 2.98Å; D329-T332 PolarHBondContact O-N 2.73Å; L330-T332 VanDerWaalsContact C-N 3.29Å; L330-T332 PolarHBondContact O-N 3.14Å; T332-L334 VanDerWaalsContact C-N 3.35Å; T332-L334 PolarHBondContact O-N 3.07Å; T332-I335 PolarHBondContact O-N 3.28Å; T332-D336 PolarHBondContact O-N 3.39Å
333	I	91.8	Very high	90.7	Very high	16 Å²	16	75 Å²	75	8%	0.082	40%	0.4	C	S	.	.	H	α-helix	trans	-62.9	-40.4	180	-63.9	162.5	0	0	0	111.2	F262 V316 N319 D329 L330 I335 D336 V337	F262-I333 HydrophobicContact CE1-CG1 4.41Å; F262-I333 HydrophobicContact CE1-CG2 4.27Å; F262-I333 HydrophobicContact CZ-CB 4.46Å; F262-I333 HydrophobicContact CZ-CG2 3.85Å; V316-I333 HydrophobicContact CG2-CG2 3.92Å; N319-I333 HydrophobicContact CB-CD1 3.78Å; D329-I333 WeakPolarHBondContact O-CD1 3.43Å; D329-I333 VanDerWaalsContact O-CG1 3.26Å; D329-I333 WeakPolarHBondContact O-CG1 3.47Å; D329-I333 PolarHBondContact O-N 3.38Å; L330-I333 PolarHBondContact O-N 3.38Å; I333-I335 VanDerWaalsContact C-N 3.34Å; I333-I335 PolarHBondContact O-N 3.24Å; I333-D336 PolarHBondContact O-N 3.4Å; I333-V337 HydrophobicContact CG2-CG2 4.36Å; I333-V337 WeakPolarHBondContact O-CB 3.49Å; I333-V337 WeakPolarHBondContact O-CG2 3.48Å; I333-V337 PolarHBondContact O-N 2.86Å
334	L	92.5	Very high	90.8	Very high	75 Å²	75	73.2 Å²	73.2	39%	0.393	39%	0.386	S	S	.	.	H	α-helix	trans	-65.9	-34.1	178	-74.1	177.3	0	0	0	112.8	V316 L330 T332 T338	V316-L334 HydrophobicContact CG2-CD2 4.25Å; L330-L334 HydrophobicContact CD1-CD1 3.87Å; L330-L334 HydrophobicContact CD1-CG 3.93Å; L330-L334 HydrophobicContact CD2-CD1 4.41Å; L330-L334 HydrophobicContact CG-CD1 3.77Å; L330-L334 HydrophobicContact CG-CG 4.23Å; L330-L334 VanDerWaalsContact O-CB 3.32Å; L330-L334 WeakPolarHBondContact O-CB 3.44Å; L330-L334 VanDerWaalsContact O-CG 3.24Å; L330-L334 WeakPolarHBondContact O-CG 3.22Å; L330-L334 PolarHBondContact O-N 2.95Å; T332-L334 VanDerWaalsContact C-N 3.35Å; T332-L334 PolarHBondContact O-N 3.07Å; L334-T338 VanDerWaalsContact O-CB 3.26Å; L334-T338 WeakPolarHBondContact O-CB 3.45Å; L334-T338 PolarHBondContact O-N 3.4Å; L334-T338 PolarHBondContact O-OG1 3.16Å
335	I	92.4	Very high	90.8	Very high	77 Å²	77	71.7 Å²	71.7	40%	0.395	37%	0.366	S	S	.	.	H	α-helix	trans	-64.3	-47.8	173.9	-72.9	164.4	0	0	0	110.1	Q331 T332 I333 T338 Y339	Q331-I335 HydrophobicContact CG-CD1 4Å; Q331-I335 WeakPolarHBondContact O-CD1 3.3Å; Q331-I335 VanDerWaalsContact O-CG1 3.25Å; Q331-I335 WeakPolarHBondContact O-CG1 3.25Å; Q331-I335 PolarHBondContact O-N 3.05Å; Q331-I335 VanDerWaalsContact O-N 3.07Å; T332-I335 PolarHBondContact O-N 3.28Å; I333-I335 VanDerWaalsContact C-N 3.34Å; I333-I335 PolarHBondContact O-N 3.24Å; I335-T338 PolarHBondContact O-N 3.22Å; I335-Y339 HydrophobicContact CG2-CD2 3.81Å; I335-Y339 HydrophobicContact CG2-CE2 3.49Å; I335-Y339 VanDerWaalsContact CG2-CE2 3.49Å; I335-Y339 VanDerWaalsContact O-CD2 3.3Å; I335-Y339 WeakPolarHBondContact O-CD2 3.39Å; I335-Y339 PolarHBondContact O-N 2.78Å
336	D	90.2	Very high	90.8	Very high	76 Å²	76	66.4 Å²	66.4	41%	0.406	35%	0.354	S	S	.	.	H	α-helix	trans	-61.8	-47.6	178.1	-75.9	-27.3	0	0	0	112	F262 T332 I333 T338 Y339 I340	F262-D336 HydrophobicContact CE2-CB 4.18Å; F262-D336 HydrophobicContact CZ-CB 3.91Å; T332-D336 PolarHBondContact O-N 3.39Å; I333-D336 PolarHBondContact O-N 3.4Å; D336-T338 VanDerWaalsContact C-N 3.28Å; D336-T338 PolarHBondContact O-N 3.41Å; D336-Y339 PolarHBondContact O-N 3.11Å; D336-I340 WeakPolarHBondContact O-CD1 3.28Å; D336-I340 VanDerWaalsContact O-CG1 3.28Å; D336-I340 WeakPolarHBondContact O-CG1 3.26Å; D336-I340 PolarHBondContact O-N 3.25Å; D336-I340 VanDerWaalsContact O-N 3.08Å
337	V	91.5	Very high	90.6	Very high	10 Å²	10	63.9 Å²	63.9	6%	0.061	34%	0.342	C	S	.	.	H	α-helix	trans	-57.6	-40.6	174.1	167.9	0	0	0	0	111.7	F262 F312 V316 I333 I340 L341	F262-V337 HydrophobicContact CE2-CG2 4Å; F312-V337 HydrophobicContact CB-CG1 3.75Å; F312-V337 HydrophobicContact CB-CG2 4.34Å; F312-V337 HydrophobicContact CD1-CG2 4.27Å; F312-V337 HydrophobicContact CD2-CG1 4.4Å; F312-V337 HydrophobicContact CG-CG1 4Å; F312-V337 HydrophobicContact CG-CG2 4.48Å; V316-V337 HydrophobicContact CG2-CG2 4.18Å; I333-V337 HydrophobicContact CG2-CG2 4.36Å; I333-V337 WeakPolarHBondContact O-CB 3.49Å; I333-V337 WeakPolarHBondContact O-CG2 3.48Å; I333-V337 PolarHBondContact O-N 2.86Å; V337-I340 PolarHBondContact O-N 3.01Å; V337-L341 HydrophobicContact CG1-CD1 3.94Å; V337-L341 WeakPolarHBondContact O-CG 3.47Å; V337-L341 PolarHBondContact O-N 3.3Å
338	T	90.2	Very high	90.4	Very high	74 Å²	74	58.1 Å²	58.1	45%	0.454	31%	0.312	S	S	.	.	H	α-helix	trans	-65.1	-41.6	177.7	-60	0	0	0	0	111.6	L334 I335 D336 I340 L341 L342	L334-T338 VanDerWaalsContact O-CB 3.26Å; L334-T338 WeakPolarHBondContact O-CB 3.45Å; L334-T338 PolarHBondContact O-N 3.4Å; L334-T338 PolarHBondContact O-OG1 3.16Å; I335-T338 PolarHBondContact O-N 3.22Å; D336-T338 VanDerWaalsContact C-N 3.28Å; D336-T338 PolarHBondContact O-N 3.41Å; T338-I340 VanDerWaalsContact C-N 3.34Å; T338-I340 PolarHBondContact O-N 2.78Å; T338-L341 PolarHBondContact O-N 3.18Å; T338-L342 HydrophobicContact CG2-CD1 3.97Å; T338-L342 HydrophobicContact CG2-CG 4.39Å; T338-L342 WeakPolarHBondContact O-CB 3.26Å; T338-L342 VanDerWaalsContact O-CG 3.26Å; T338-L342 WeakPolarHBondContact O-CG 3.4Å; T338-L342 PolarHBondContact O-N 3.21Å
339	Y	90	Very high	90.2	Very high	164 Å²	164	56.3 Å²	56.3	64%	0.643	30%	0.296	S	S	*	.	H	α-helix	trans	-64	-36.8	175.4	-78.6	-57.9	0	0	0	113	I335 D336 A343	I335-Y339 HydrophobicContact CG2-CD2 3.81Å; I335-Y339 HydrophobicContact CG2-CE2 3.49Å; I335-Y339 VanDerWaalsContact CG2-CE2 3.49Å; I335-Y339 VanDerWaalsContact O-CD2 3.3Å; I335-Y339 WeakPolarHBondContact O-CD2 3.39Å; I335-Y339 PolarHBondContact O-N 2.78Å; D336-Y339 PolarHBondContact O-N 3.11Å; Y339-A343 WeakPolarHBondContact O-CB 3.4Å; Y339-A343 PolarHBondContact O-N 3.36Å
340	I	89.5	Confident	90	Very high	16 Å²	16	57.1 Å²	57.1	8%	0.082	30%	0.299	C	S	.	.	H	α-helix	trans	-67.8	-46.5	177.3	-58.9	154.1	0	0	0	110.4	F262 L269 F273 F312 D336 V337 T338 L342 A343 E344	F262-I340 HydrophobicContact CE2-CD1 4.36Å; L269-I340 HydrophobicContact CD1-CD1 3.79Å; L269-I340 HydrophobicContact CD2-CD1 3.4Å; L269-I340 HydrophobicContact CD2-CG1 3.65Å; L269-I340 HydrophobicContact CD2-CG2 4.35Å; L269-I340 HydrophobicContact CG-CD1 4.28Å; F273-I340 HydrophobicContact CD2-CG2 3.87Å; F273-I340 HydrophobicContact CE2-CG2 3.84Å; F273-I340 HydrophobicContact CG-CG2 4.34Å; F273-I340 HydrophobicContact CZ-CG2 4.28Å; F312-I340 HydrophobicContact CE1-CD1 4.28Å; F312-I340 HydrophobicContact CE1-CG2 4.22Å; F312-I340 HydrophobicContact CE2-CG2 4.08Å; F312-I340 HydrophobicContact CZ-CB 4.24Å; F312-I340 HydrophobicContact CZ-CG2 3.48Å; F312-I340 VanDerWaalsContact CZ-CG2 3.48Å; D336-I340 WeakPolarHBondContact O-CD1 3.28Å; D336-I340 VanDerWaalsContact O-CG1 3.28Å; D336-I340 WeakPolarHBondContact O-CG1 3.26Å; D336-I340 PolarHBondContact O-N 3.25Å; D336-I340 VanDerWaalsContact O-N 3.08Å; V337-I340 PolarHBondContact O-N 3.01Å; T338-I340 VanDerWaalsContact C-N 3.34Å; T338-I340 PolarHBondContact O-N 2.78Å; I340-L342 VanDerWaalsContact C-N 3.33Å; I340-L342 PolarHBondContact O-N 2.78Å; I340-A343 WeakPolarHBondContact O-CB 3.37Å; I340-A343 PolarHBondContact O-N 2.95Å; I340-A343 VanDerWaalsContact O-N 3.12Å; I340-E344 PolarHBondContact O-N 3.16Å
341	L	89.2	Confident	89.8	Confident	54 Å²	54	55.1 Å²	55.1	28%	0.283	29%	0.289	S	S	.	.	H	α-helix	trans	-62.2	-37.7	176.2	-73.1	170.1	0	0	0	112.7	F312 V337 T338 A343 E344 V345	F312-L341 HydrophobicContact CD2-CD2 3.85Å; F312-L341 HydrophobicContact CD2-CG 4.07Å; F312-L341 HydrophobicContact CE2-CD2 3.94Å; F312-L341 HydrophobicContact CE2-CG 4.24Å; V337-L341 HydrophobicContact CG1-CD1 3.94Å; V337-L341 WeakPolarHBondContact O-CG 3.47Å; V337-L341 PolarHBondContact O-N 3.3Å; T338-L341 PolarHBondContact O-N 3.18Å; L341-A343 VanDerWaalsContact C-N 3.32Å; L341-E344 PolarHBondContact O-N 2.98Å; L341-V345 WeakPolarHBondContact O-CB 3.4Å; L341-V345 VanDerWaalsContact O-CG2 3.28Å; L341-V345 WeakPolarHBondContact O-CG2 3.39Å; L341-V345 PolarHBondContact O-N 2.92Å
342	L	89	Confident	89.6	Confident	97 Å²	97	49.4 Å²	49.4	51%	0.508	26%	0.262	S	S	.	.	H	α-helix	trans	-68.2	-30	174.2	-73.5	171.8	0	0	0	113	T338 I340 A346	T338-L342 HydrophobicContact CG2-CD1 3.97Å; T338-L342 HydrophobicContact CG2-CG 4.39Å; T338-L342 WeakPolarHBondContact O-CB 3.26Å; T338-L342 VanDerWaalsContact O-CG 3.26Å; T338-L342 WeakPolarHBondContact O-CG 3.4Å; T338-L342 PolarHBondContact O-N 3.21Å; I340-L342 VanDerWaalsContact C-N 3.33Å; I340-L342 PolarHBondContact O-N 2.78Å; L342-A346 WeakPolarHBondContact O-CB 2.94Å; L342-A346 PolarHBondContact O-N 3.07Å; L342-A346 VanDerWaalsContact O-N 3.1Å
343	A	89	Confident	89.4	Confident	38 Å²	38	45.6 Å²	45.6	31%	0.314	24%	0.239	S	C	.	.	H	α-helix	trans	-72.9	-37.9	174.5	0	0	0	0	0	111.9	F273 Y339 I340 L341 A346 V347	F273-A343 HydrophobicContact CD1-CB 4.45Å; F273-A343 HydrophobicContact CE1-CB 3.57Å; F273-A343 HydrophobicContact CZ-CB 4.16Å; Y339-A343 WeakPolarHBondContact O-CB 3.4Å; Y339-A343 PolarHBondContact O-N 3.36Å; I340-A343 WeakPolarHBondContact O-CB 3.37Å; I340-A343 PolarHBondContact O-N 2.95Å; I340-A343 VanDerWaalsContact O-N 3.12Å; L341-A343 VanDerWaalsContact C-N 3.32Å; A343-A346 PolarHBondContact O-N 3.41Å; A343-V347 WeakPolarHBondContact O-CG2 3.41Å; A343-V347 PolarHBondContact O-N 3.1Å
344	E	89.6	Confident	89.2	Confident	6 Å²	6	47.8 Å²	47.8	3%	0.028	25%	0.248	C	C	.	.	H	α-helix	trans	-60.4	-51.7	173.3	-173.5	62.1	-165	0	0	111.1	F273 N277 Y308 I340 L341 A346 V347 D348	F273-E344 HydrophobicContact CE2-CB 4.36Å; F273-E344 VanDerWaalsContact CE2-OE2 3.28Å; F273-E344 WeakPolarHBondContact CE2-OE2 3.42Å; F273-E344 HydrophobicContact CZ-CB 3.89Å; F273-E344 WeakPolarHBondContact CZ-OE2 3.33Å; N277-E344 PolarHBondContact ND2-OE2 2.65Å; Y308-E344 HydrophobicContact CD2-CG 4.14Å; Y308-E344 HydrophobicContact CE2-CG 4.32Å; Y308-E344 WeakPolarHBondContact CE2-OE1 3.17Å; I340-E344 PolarHBondContact O-N 3.16Å; L341-E344 PolarHBondContact O-N 2.98Å; E344-A346 VanDerWaalsContact C-N 3.29Å; E344-A346 PolarHBondContact O-N 2.67Å; E344-V347 PolarHBondContact O-N 3.42Å; E344-V347 VanDerWaalsContact O-N 3.09Å; E344-D348 PolarHBondContact O-N 3.21Å
345	V	87.7	Confident	89	Confident	23 Å²	23	44.2 Å²	44.2	14%	0.139	23%	0.229	C	C	.	.	H	α-helix	trans	-46.5	-51.1	170.8	154.7	0	0	0	0	111.9	E69 L341 V347 D348 W349	E69-V345 WeakPolarHBondContact OE2-CG1 3.29Å; E69-V345 WeakPolarHBondContact OE2-CG2 3.27Å; L341-V345 WeakPolarHBondContact O-CB 3.4Å; L341-V345 VanDerWaalsContact O-CG2 3.28Å; L341-V345 WeakPolarHBondContact O-CG2 3.39Å; L341-V345 PolarHBondContact O-N 2.92Å; V345-V347 PolarHBondContact O-N 2.94Å; V345-D348 PolarHBondContact O-N 3.01Å; V345-W349 HydrophobicContact CG1-CD2 4.29Å; V345-W349 HydrophobicContact CG1-CH2 4.11Å; V345-W349 HydrophobicContact CG1-CZ2 3.46Å; V345-W349 VanDerWaalsContact CG1-CZ2 3.46Å; V345-W349 VanDerWaalsContact O-CG 3.27Å; V345-W349 PolarHBondContact O-N 3.2Å; V345-W349 VanDerWaalsContact O-N 3.12Å; V345-W349 PolarHBondContact O-NE1 3.12Å
346	A	86.8	Confident	88.7	Confident	39 Å²	39	40.6 Å²	40.6	32%	0.322	21%	0.21	S	C	.	.	H	α-helix	trans	-68	-34.4	-178.6	0	0	0	0	0	113.3	L342 A343 E344 I350	L342-A346 WeakPolarHBondContact O-CB 2.94Å; L342-A346 PolarHBondContact O-N 3.07Å; L342-A346 VanDerWaalsContact O-N 3.1Å; A343-A346 PolarHBondContact O-N 3.41Å; E344-A346 VanDerWaalsContact C-N 3.29Å; E344-A346 PolarHBondContact O-N 2.67Å; A346-I350 WeakPolarHBondContact O-CD1 3.29Å; A346-I350 VanDerWaalsContact O-CG1 3.24Å; A346-I350 WeakPolarHBondContact O-CG1 3.35Å; A346-I350 PolarHBondContact O-N 3.05Å; A346-I350 VanDerWaalsContact O-N 3.15Å
347	V	89.1	Confident	88.4	Confident	27 Å²	27	40.4 Å²	40.4	16%	0.164	21%	0.206	C	C	.	.	H	α-helix	trans	-66.6	-45.3	176.3	167.2	0	0	0	0	110.8	N277 A343 E344 V345 W349 I350 K351	N277-V347 HydrophobicContact CB-CB 4.47Å; N277-V347 HydrophobicContact CB-CG1 3.98Å; N277-V347 HydrophobicContact CB-CG2 3.95Å; A343-V347 WeakPolarHBondContact O-CG2 3.41Å; A343-V347 PolarHBondContact O-N 3.1Å; E344-V347 PolarHBondContact O-N 3.42Å; E344-V347 VanDerWaalsContact O-N 3.09Å; V345-V347 PolarHBondContact O-N 2.94Å; V347-W349 VanDerWaalsContact C-N 3.34Å; V347-W349 PolarHBondContact O-N 3.44Å; V347-I350 WeakPolarHBondContact O-CB 3.41Å; V347-I350 PolarHBondContact O-N 3.03Å; V347-I350 VanDerWaalsContact O-N 3.15Å; V347-K351 WeakPolarHBondContact O-CB 3.43Å; V347-K351 PolarHBondContact O-N 3.04Å
348	D	88.8	Confident	88.2	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.011	23%	0.227	C	C	.	.	H	α-helix	trans	-61	-41.8	176.1	-84	-30.3	0	0	0	112.6	R305 E344 V345 I350 K351 H352	R305-D348 IonicContact CZ-OD2 3.92Å; R305-D348 IonicContact NE-OD2 3.36Å; R305-D348 PolarHBondContact NE-OD2 2.93Å; R305-D348 IonicContact NH2-OD2 3.49Å; R305-D348 PolarHBondContact NH2-OD2 3.09Å; E344-D348 PolarHBondContact O-N 3.21Å; V345-D348 PolarHBondContact O-N 3.01Å; D348-I350 VanDerWaalsContact C-N 3.27Å; D348-I350 PolarHBondContact O-N 3.3Å; D348-K351 PolarHBondContact O-N 3.3Å; D348-K351 WeakPolarHBondContact OD1-CE 3.26Å; D348-K351 IonicContact OD1-NZ 3.83Å; D348-K351 PolarHBondContact OD1-NZ 3.42Å; D348-H352 WeakPolarHBondContact O-CB 3.4Å; D348-H352 PolarHBondContact O-CD2 3.19Å; D348-H352 PolarHBondContact O-N 3.46Å
349	W	86.9	Confident	88	Confident	86 Å²	86	43.4 Å²	43.4	33%	0.326	21%	0.214	S	C	.	.	H	α-helix	trans	-56.9	-45.1	174.7	-68.4	5	0	0	0	110.8	P65 E69 V345 V347 S353	P65-W349 HydrophobicContact CB-CB 4.35Å; P65-W349 HydrophobicContact CB-CD2 3.78Å; P65-W349 HydrophobicContact CB-CE3 3.89Å; P65-W349 HydrophobicContact CB-CG 3.98Å; P65-W349 HydrophobicContact CG-CB 4.16Å; P65-W349 HydrophobicContact CG-CD2 4.44Å; P65-W349 HydrophobicContact CG-CE3 4.45Å; P65-W349 HydrophobicContact CG-CG 4.33Å; E69-W349 HydrophobicContact CB-CZ2 4.39Å; E69-W349 PolarHBondContact OE1-NE1 3.49Å; E69-W349 WeakPolarHBondContact OE2-CZ2 3.2Å; V345-W349 HydrophobicContact CG1-CD2 4.29Å; V345-W349 HydrophobicContact CG1-CH2 4.11Å; V345-W349 HydrophobicContact CG1-CZ2 3.46Å; V345-W349 VanDerWaalsContact CG1-CZ2 3.46Å; V345-W349 VanDerWaalsContact O-CG 3.27Å; V345-W349 PolarHBondContact O-N 3.2Å; V345-W349 VanDerWaalsContact O-N 3.12Å; V345-W349 PolarHBondContact O-NE1 3.12Å; V347-W349 VanDerWaalsContact C-N 3.34Å; V347-W349 PolarHBondContact O-N 3.44Å; W349-S353 WeakPolarHBondContact O-CB 3.45Å; W349-S353 PolarHBondContact O-N 2.7Å; W349-S353 PolarHBondContact O-OG 3Å
350	I	87.7	Confident	87.8	Confident	73 Å²	73	40.2 Å²	40.2	37%	0.374	21%	0.211	S	C	.	.	H	α-helix	trans	-65.3	-48.3	178.1	-68.1	165.6	0	0	0	110.4	L281 A346 V347 D348 S353 F354	L281-I350 HydrophobicContact CD1-CG2 4.05Å; L281-I350 HydrophobicContact CD2-CG2 4.3Å; A346-I350 WeakPolarHBondContact O-CD1 3.29Å; A346-I350 VanDerWaalsContact O-CG1 3.24Å; A346-I350 WeakPolarHBondContact O-CG1 3.35Å; A346-I350 PolarHBondContact O-N 3.05Å; A346-I350 VanDerWaalsContact O-N 3.15Å; V347-I350 WeakPolarHBondContact O-CB 3.41Å; V347-I350 PolarHBondContact O-N 3.03Å; V347-I350 VanDerWaalsContact O-N 3.15Å; D348-I350 VanDerWaalsContact C-N 3.27Å; D348-I350 PolarHBondContact O-N 3.3Å; I350-S353 PolarHBondContact O-N 2.76Å; I350-F354 HydrophobicContact CG2-CD2 3.72Å; I350-F354 HydrophobicContact CG2-CE2 3.79Å; I350-F354 VanDerWaalsContact O-CD2 3.29Å; I350-F354 WeakPolarHBondContact O-CD2 3.47Å; I350-F354 PolarHBondContact O-N 3.15Å
351	K	89.6	Confident	87.5	Confident	1 Å²	1	40.1 Å²	40.1	0%	0.004	21%	0.21	C	C	.	.	H	α-helix	trans	-52.9	-60.8	177.7	175.4	171.4	63.8	-168	0	111.6	E280 L281 N284 D301 V347 D348 S353 F354 I355	E280-K351 WeakPolarHBondContact OE1-CD 3.48Å; E280-K351 IonicContact OE1-NZ 3.38Å; E280-K351 PolarHBondContact OE1-NZ 3.06Å; E280-K351 VanDerWaalsContact OE1-NZ 3.13Å; E280-K351 WeakPolarHBondContact OE2-CD 3.28Å; E280-K351 IonicContact OE2-NZ 3.97Å; E280-K351 PolarHBondContact OE2-NZ 3.49Å; L281-K351 HydrophobicContact CD1-CB 3.8Å; N284-K351 HydrophobicContact CB-CD 4.4Å; D301-K351 VanDerWaalsContact CG-NZ 3.27Å; D301-K351 IonicContact OD1-NZ 2.79Å; D301-K351 PolarHBondContact OD1-NZ 3.41Å; D301-K351 WeakPolarHBondContact OD2-CE 3.42Å; D301-K351 IonicContact OD2-NZ 2.71Å; V347-K351 WeakPolarHBondContact O-CB 3.43Å; V347-K351 PolarHBondContact O-N 3.04Å; D348-K351 PolarHBondContact O-N 3.3Å; D348-K351 WeakPolarHBondContact OD1-CE 3.26Å; D348-K351 IonicContact OD1-NZ 3.83Å; D348-K351 PolarHBondContact OD1-NZ 3.42Å; K351-S353 PolarHBondContact O-N 3.13Å; K351-F354 PolarHBondContact O-N 2.69Å; K351-I355 HydrophobicContact CD-CD1 4.49Å; K351-I355 HydrophobicContact CG-CD1 3.59Å; K351-I355 VanDerWaalsContact O-CG1 3.27Å; K351-I355 WeakPolarHBondContact O-CG1 3.15Å; K351-I355 PolarHBondContact O-N 3.41Å
352	H	89.1	Confident	87.1	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.5	-37	-178.9	-78.8	-69.1	0	0	0	112.8	I64 L68 D301 D348 F354 I355 T356 Y366	I64-H352 HydrophobicContact CG2-CB 4.27Å; L68-H352 HydrophobicContact CD1-CB 3.63Å; L68-H352 HydrophobicContact CD2-CB 4.17Å; L68-H352 HydrophobicContact CG-CB 4.49Å; D301-H352 IonicContact OD2-CD2 3.46Å; D301-H352 IonicContact OD2-CE1 2.57Å; D301-H352 PolarHBondContact OD2-CE1 2.73Å; D301-H352 IonicContact OD2-NE2 3.8Å; D301-H352 PolarHBondContact OD2-NE2 2.82Å; D348-H352 WeakPolarHBondContact O-CB 3.4Å; D348-H352 PolarHBondContact O-CD2 3.19Å; D348-H352 PolarHBondContact O-N 3.46Å; H352-F354 VanDerWaalsContact C-N 3.31Å; H352-F354 PolarHBondContact O-N 2.75Å; H352-I355 PolarHBondContact O-N 3.3Å; H352-T356 WeakPolarHBondContact O-CB 3.36Å; H352-T356 WeakPolarHBondContact O-CG2 3.4Å; H352-T356 PolarHBondContact O-N 2.88Å; H352-T356 VanDerWaalsContact O-N 3.14Å; H352-T356 PolarHBondContact O-OG1 3.29Å; H352-Y366 WeakPolarHBondContact CB-OH 3.48Å; H352-Y366 AromaticContact ND1-CE1 3.88Å; H352-Y366 AromaticContact ND1-CZ 3.77Å; H352-Y366 PolarHBondContact ND1-OH 3.42Å
353	S	86.2	Confident	86.5	Confident	3 Å²	3	36.9 Å²	36.9	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-67.8	-27.7	177	-58.8	0	0	0	0	113.3	F61 I64 W349 I350 K351 T356 K357	F61-S353 WeakPolarHBondContact CD2-O 3.32Å; I64-S353 WeakPolarHBondContact CG2-OG 3.39Å; W349-S353 WeakPolarHBondContact O-CB 3.45Å; W349-S353 PolarHBondContact O-N 2.7Å; W349-S353 PolarHBondContact O-OG 3Å; I350-S353 PolarHBondContact O-N 2.76Å; K351-S353 PolarHBondContact O-N 3.13Å; S353-T356 PolarHBondContact O-OG1 3.44Å; S353-K357 WeakPolarHBondContact O-CB 3.49Å
354	F	88.7	Confident	86	Confident	63 Å²	63	38.2 Å²	38.2	28%	0.276	20%	0.201	S	C	.	.	H	α-helix	trans	-83.7	-44.1	172	-83.2	-65.1	0	0	0	113	F61 V285 I350 K351 H352 T356 K357 F358	F61-F354 HydrophobicContact CE2-CD1 4.33Å; F61-F354 HydrophobicContact CE2-CD2 4.36Å; F61-F354 HydrophobicContact CE2-CE1 4.19Å; F61-F354 HydrophobicContact CE2-CE2 4.23Å; F61-F354 HydrophobicContact CE2-CG 4.4Å; F61-F354 HydrophobicContact CE2-CZ 4.14Å; F61-F354 HydrophobicContact CZ-CE2 4.44Å; F61-F354 HydrophobicContact CZ-CZ 4.38Å; V285-F354 HydrophobicContact CB-CB 4.49Å; V285-F354 HydrophobicContact CG1-CB 3.76Å; V285-F354 HydrophobicContact CG1-CG 4.29Å; V285-F354 HydrophobicContact CG2-CB 3.93Å; I350-F354 HydrophobicContact CG2-CD2 3.72Å; I350-F354 HydrophobicContact CG2-CE2 3.79Å; I350-F354 VanDerWaalsContact O-CD2 3.29Å; I350-F354 WeakPolarHBondContact O-CD2 3.47Å; I350-F354 PolarHBondContact O-N 3.15Å; K351-F354 PolarHBondContact O-N 2.69Å; H352-F354 VanDerWaalsContact C-N 3.31Å; H352-F354 PolarHBondContact O-N 2.75Å; F354-T356 PolarHBondContact O-N 3.24Å; F354-K357 PolarHBondContact O-N 2.92Å; F354-F358 HydrophobicContact CB-CD2 4.26Å; F354-F358 HydrophobicContact CB-CE2 4.09Å; F354-F358 HydrophobicContact CD1-CD2 4.36Å; F354-F358 HydrophobicContact CD1-CE1 4.47Å; F354-F358 AromaticContact CD1-CE2 3.58Å; F354-F358 HydrophobicContact CD1-CE2 3.58Å; F354-F358 AromaticContact CD1-CZ 3.65Å; F354-F358 HydrophobicContact CD1-CZ 3.65Å; F354-F358 HydrophobicContact CE1-CE2 4.4Å; F354-F358 HydrophobicContact CE1-CZ 4.09Å; F354-F358 HydrophobicContact CG-CE2 4.18Å; F354-F358 WeakPolarHBondContact O-CB 3.44Å; F354-F358 WeakPolarHBondContact O-CD2 3.43Å; F354-F358 WeakPolarHBondContact O-CG 3.5Å; F354-F358 PolarHBondContact O-N 2.88Å
355	I	87.9	Confident	85.6	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-57.2	-50.9	-179.2	-68.2	162.9	0	0	0	110.9	N284 V285 M289 L294 K351 H352 N359	N284-I355 HydrophobicContact CB-CD1 4.1Å; V285-I355 HydrophobicContact CG2-CG1 4.45Å; M289-I355 HydrophobicContact CE-CD1 3.95Å; M289-I355 HydrophobicContact CE-CG1 4.05Å; M289-I355 HydrophobicContact CE-CG2 3.65Å; L294-I355 HydrophobicContact CD1-CG2 4Å; K351-I355 HydrophobicContact CD-CD1 4.49Å; K351-I355 HydrophobicContact CG-CD1 3.59Å; K351-I355 VanDerWaalsContact O-CG1 3.27Å; K351-I355 WeakPolarHBondContact O-CG1 3.15Å; K351-I355 PolarHBondContact O-N 3.41Å; H352-I355 PolarHBondContact O-N 3.3Å; I355-N359 VanDerWaalsContact O-CB 3.3Å; I355-N359 WeakPolarHBondContact O-CB 3.44Å; I355-N359 PolarHBondContact O-N 3.5Å; I355-N359 PolarHBondContact O-ND2 2.69Å
356	T	85.3	Confident	85.6	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.2	-43.6	177.6	51	0	0	0	0	112.4	I64 L294 H352 S353 F354 N359 V360 I361 Y366	I64-T356 HydrophobicContact CD1-CG2 4.15Å; I64-T356 WeakPolarHBondContact CD1-OG1 3.46Å; L294-T356 HydrophobicContact CD2-CG2 4.12Å; H352-T356 WeakPolarHBondContact O-CB 3.36Å; H352-T356 WeakPolarHBondContact O-CG2 3.4Å; H352-T356 PolarHBondContact O-N 2.88Å; H352-T356 VanDerWaalsContact O-N 3.14Å; H352-T356 PolarHBondContact O-OG1 3.29Å; S353-T356 PolarHBondContact O-OG1 3.44Å; F354-T356 PolarHBondContact O-N 3.24Å; T356-N359 PolarHBondContact O-N 3.49Å; T356-V360 CarbonylContact O-C 3.6Å; T356-V360 VanDerWaalsContact O-CA 3.31Å; T356-V360 WeakPolarHBondContact O-CA 3.24Å; T356-V360 PolarHBondContact O-N 3.42Å; T356-I361 HydrophobicContact CG2-CB 4.4Å; T356-I361 PolarHBondContact O-N 3.31Å; T356-Y366 HydrophobicContact CG2-CE2 4.14Å
357	K	85.2	Confident	85.4	Confident	73 Å²	73	39.8 Å²	39.8	32%	0.317	20%	0.2	S	C	.	.	H	α-helix	trans	-66.3	-37.4	-179.2	179.5	178	-179.7	179.6	0	113.3	F61 S353 F354	F61-K357 HydrophobicContact CB-CD 4.29Å; F61-K357 HydrophobicContact CD2-CD 3.67Å; F61-K357 HydrophobicContact CE2-CD 4.45Å; F61-K357 HydrophobicContact CG-CD 4.31Å; S353-K357 WeakPolarHBondContact O-CB 3.49Å; F354-K357 PolarHBondContact O-N 2.92Å
358	F	87.1	Confident	85.2	Confident	114 Å²	114	41.5 Å²	41.5	50%	0.5	21%	0.206	S	C	.	.	H	α-helix	trans	-80.5	-34.4	177	-67.4	-38.7	0	0	0	112.8	V285 F354 V360	V285-F358 HydrophobicContact CG1-CD2 3.98Å; V285-F358 HydrophobicContact CG1-CE2 3.65Å; F354-F358 HydrophobicContact CB-CD2 4.26Å; F354-F358 HydrophobicContact CB-CE2 4.09Å; F354-F358 HydrophobicContact CD1-CD2 4.36Å; F354-F358 HydrophobicContact CD1-CE1 4.47Å; F354-F358 AromaticContact CD1-CE2 3.58Å; F354-F358 HydrophobicContact CD1-CE2 3.58Å; F354-F358 AromaticContact CD1-CZ 3.65Å; F354-F358 HydrophobicContact CD1-CZ 3.65Å; F354-F358 HydrophobicContact CE1-CE2 4.4Å; F354-F358 HydrophobicContact CE1-CZ 4.09Å; F354-F358 HydrophobicContact CG-CE2 4.18Å; F354-F358 WeakPolarHBondContact O-CB 3.44Å; F354-F358 WeakPolarHBondContact O-CD2 3.43Å; F354-F358 WeakPolarHBondContact O-CG 3.5Å; F354-F358 PolarHBondContact O-N 2.88Å; F358-V360 VanDerWaalsContact C-N 3.33Å
359	N	86	Confident	85.2	Confident	32 Å²	32	42.2 Å²	42.2	17%	0.171	21%	0.209	C	C	.	.	H	α-helix	trans	-86.3	-2.8	175.8	-67.8	-74.7	0	0	0	113.8	K288 M289 I355 T356 I361	K288-N359 VanDerWaalsContact CA-OD1 3.26Å; K288-N359 WeakPolarHBondContact CA-OD1 3.13Å; K288-N359 WeakPolarHBondContact CG-OD1 3.4Å; M289-N359 PolarHBondContact N-OD1 3.35Å; M289-N359 PolarHBondContact O-OD1 3.12Å; I355-N359 VanDerWaalsContact O-CB 3.3Å; I355-N359 WeakPolarHBondContact O-CB 3.44Å; I355-N359 PolarHBondContact O-N 3.5Å; I355-N359 PolarHBondContact O-ND2 2.69Å; T356-N359 PolarHBondContact O-N 3.49Å; N359-I361 VanDerWaalsContact C-N 3.28Å; N359-I361 HydrophobicContact CB-CD1 3.81Å; N359-I361 HydrophobicContact CB-CG1 3.87Å; N359-I361 PolarHBondContact O-N 2.97Å
360	V	85.4	Confident	85.3	Confident	98 Å²	98	38.3 Å²	38.3	59%	0.594	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.3	40.1	-177.7	-158.8	0	0	0	0	112.3	T356 F358	T356-V360 CarbonylContact O-C 3.6Å; T356-V360 VanDerWaalsContact O-CA 3.31Å; T356-V360 WeakPolarHBondContact O-CA 3.24Å; T356-V360 PolarHBondContact O-N 3.42Å; F358-V360 VanDerWaalsContact C-N 3.33Å
361	I	82.6	Confident	85.3	Confident	13 Å²	13	35.5 Å²	35.5	7%	0.067	18%	0.181	C	C	.	.			trans	-88.5	127.1	176.8	-58.4	173	0	0	0	108.7	L294 T356 N359 V365	L294-I361 HydrophobicContact CD2-CD1 3.82Å; L294-I361 HydrophobicContact CD2-CG2 4.14Å; T356-I361 HydrophobicContact CG2-CB 4.4Å; T356-I361 PolarHBondContact O-N 3.31Å; N359-I361 VanDerWaalsContact C-N 3.28Å; N359-I361 HydrophobicContact CB-CD1 3.81Å; N359-I361 HydrophobicContact CB-CG1 3.87Å; N359-I361 PolarHBondContact O-N 2.97Å; I361-V365 HydrophobicContact CG2-CB 4.18Å; I361-V365 HydrophobicContact CG2-CG1 4.35Å; I361-V365 HydrophobicContact CG2-CG2 3.93Å
362	P	81.3	Confident	85.2	Confident	65 Å²	65	37.6 Å²	37.6	42%	0.422	20%	0.196	S	C	.	.			trans	-72.1	148.7	178.4	30.3	-34.5	0	0	0	111.8	N364 V365	P362-N364 VanDerWaalsContact C-N 3.27Å; P362-N364 WeakPolarHBondContact CB-OD1 3.48Å; P362-N364 WeakPolarHBondContact CG-OD1 3.29Å; P362-N364 PolarHBondContact O-N 3.34Å; P362-V365 HydrophobicContact CG-CG2 4.12Å; P362-V365 WeakPolarHBondContact O-CB 3.08Å; P362-V365 WeakPolarHBondContact O-CG2 3.42Å; P362-V365 PolarHBondContact O-N 2.87Å
363	S	76.3	Confident	85.2	Confident	19 Å²	19	37.7 Å²	37.7	13%	0.133	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-10.4	-170.9	58.5	0	0	0	0	115.1	Y67 V365	Y67-S363 WeakPolarHBondContact CD2-OG 3.1Å; Y67-S363 WeakPolarHBondContact CE2-OG 3.49Å; S363-V365 PolarHBondContact O-N 2.99Å
364	N	78.2	Confident	85.3	Confident	65 Å²	65	37.5 Å²	37.5	35%	0.348	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-17	174	75.3	-61.3	0	0	0	112.5	P362 Y366 E367 E368	P362-N364 VanDerWaalsContact C-N 3.27Å; P362-N364 WeakPolarHBondContact CB-OD1 3.48Å; P362-N364 WeakPolarHBondContact CG-OD1 3.29Å; P362-N364 PolarHBondContact O-N 3.34Å; N364-Y366 PolarHBondContact O-N 2.9Å; N364-E367 WeakPolarHBondContact O-CA 3.49Å; N364-E367 WeakPolarHBondContact O-CB 3.11Å; N364-E367 PolarHBondContact O-N 3.23Å; N364-E368 PolarHBondContact ND2-OE1 3.43Å; N364-E368 PolarHBondContact O-N 3.31Å
365	V	82.3	Confident	85.2	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60.8	-26.6	-177.6	170.1	0	0	0	0	112.8	I361 P362 S363 E367 E368 Y369	I361-V365 HydrophobicContact CG2-CB 4.18Å; I361-V365 HydrophobicContact CG2-CG1 4.35Å; I361-V365 HydrophobicContact CG2-CG2 3.93Å; P362-V365 HydrophobicContact CG-CG2 4.12Å; P362-V365 WeakPolarHBondContact O-CB 3.08Å; P362-V365 WeakPolarHBondContact O-CG2 3.42Å; P362-V365 PolarHBondContact O-N 2.87Å; S363-V365 PolarHBondContact O-N 2.99Å; V365-E367 VanDerWaalsContact C-N 3.28Å; V365-E367 PolarHBondContact O-N 2.95Å; V365-E368 WeakPolarHBondContact O-CB 3.46Å; V365-E368 PolarHBondContact O-N 3.14Å; V365-Y369 HydrophobicContact CG1-CD1 4.03Å; V365-Y369 HydrophobicContact CG1-CD2 4.39Å; V365-Y369 HydrophobicContact CG1-CE1 3.4Å; V365-Y369 HydrophobicContact CG1-CE2 3.8Å; V365-Y369 HydrophobicContact CG1-CG 4.49Å; V365-Y369 WeakPolarHBondContact CG1-OH 3.47Å; V365-Y369 WeakPolarHBondContact O-CD1 3.46Å; V365-Y369 PolarHBondContact O-N 3.43Å
366	Y	86.6	Confident	85.1	Confident	4 Å²	4	39.4 Å²	39.4	2%	0.016	20%	0.204	C	C	.	.	H	α-helix	trans	-68.9	-24.6	172.2	-61.3	-79.3	0	0	0	113.4	L68 A298 H352 T356 N364 Y369 T370	L68-Y366 HydrophobicContact CD2-CD1 3.93Å; L68-Y366 HydrophobicContact CD2-CD2 4.47Å; L68-Y366 HydrophobicContact CD2-CE1 3.62Å; L68-Y366 HydrophobicContact CD2-CE2 4.22Å; L68-Y366 HydrophobicContact CD2-CG 4.35Å; A298-Y366 HydrophobicContact CB-CE1 4.49Å; H352-Y366 WeakPolarHBondContact CB-OH 3.48Å; H352-Y366 AromaticContact ND1-CE1 3.88Å; H352-Y366 AromaticContact ND1-CZ 3.77Å; H352-Y366 PolarHBondContact ND1-OH 3.42Å; T356-Y366 HydrophobicContact CG2-CE2 4.14Å; N364-Y366 PolarHBondContact O-N 2.9Å; Y366-Y369 AromaticContact CD1-CD2 3.91Å; Y366-Y369 HydrophobicContact CD1-CD2 3.91Å; Y366-Y369 HydrophobicContact CD1-CE2 4.15Å; Y366-Y369 HydrophobicContact CE1-CD2 4.47Å; Y366-Y369 HydrophobicContact CE1-CE2 4.3Å; Y366-T370 WeakPolarHBondContact O-CB 3.38Å; Y366-T370 PolarHBondContact O-N 3.39Å; Y366-T370 PolarHBondContact O-OG1 3.42Å
367	E	83.9	Confident	85.1	Confident	98 Å²	98	39.7 Å²	39.7	46%	0.458	21%	0.205	S	C	.	.	H	α-helix	trans	-73.4	-45.2	171.5	-165.6	178.3	162.4	0	0	110.2	N364 V365 Y369 T370 V371	N364-E367 WeakPolarHBondContact O-CA 3.49Å; N364-E367 WeakPolarHBondContact O-CB 3.11Å; N364-E367 PolarHBondContact O-N 3.23Å; V365-E367 VanDerWaalsContact C-N 3.28Å; V365-E367 PolarHBondContact O-N 2.95Å; E367-Y369 VanDerWaalsContact C-N 3.28Å; E367-Y369 PolarHBondContact O-N 3.47Å; E367-T370 PolarHBondContact O-N 3.28Å; E367-T370 VanDerWaalsContact O-N 3.09Å; E367-V371 WeakPolarHBondContact O-CG2 3.38Å; E367-V371 PolarHBondContact O-N 3.42Å
368	E	84.6	Confident	85.1	Confident	63 Å²	63	37.6 Å²	37.6	29%	0.294	20%	0.197	S	C	.	.	H	α-helix	trans	-54.7	-43.9	171.8	-59.3	171.1	-161.8	0	0	111.1	N364 V365 S372	N364-E368 PolarHBondContact ND2-OE1 3.43Å; N364-E368 PolarHBondContact O-N 3.31Å; V365-E368 WeakPolarHBondContact O-CB 3.46Å; V365-E368 PolarHBondContact O-N 3.14Å; E368-S372 WeakPolarHBondContact O-CB 3.43Å; E368-S372 PolarHBondContact O-N 3.1Å
369	Y	89.3	Confident	84.9	Confident	16 Å²	16	34.9 Å²	34.9	6%	0.063	19%	0.188	C	C	.	.	H	α-helix	trans	-63.3	-42.4	174.9	-62.9	-18.5	0	0	0	113.1	F77 K291 L294 F295 V365 Y366 E367 S372 I373	F77-Y369 HydrophobicContact CE2-CD2 4.35Å; F77-Y369 HydrophobicContact CE2-CG 4.43Å; K291-Y369 PolarHBondContact O-OH 3.46Å; L294-Y369 WeakPolarHBondContact CB-OH 3.28Å; L294-Y369 HydrophobicContact CD2-CE2 4.4Å; L294-Y369 HydrophobicContact CG-CE2 4.12Å; L294-Y369 WeakPolarHBondContact CG-OH 3.33Å; F295-Y369 HydrophobicContact CB-CD1 4.13Å; F295-Y369 HydrophobicContact CB-CE1 3.68Å; F295-Y369 HydrophobicContact CB-CE2 4.25Å; F295-Y369 AromaticContact CD2-CD1 3.58Å; F295-Y369 HydrophobicContact CD2-CD1 3.58Å; F295-Y369 HydrophobicContact CD2-CD2 4.07Å; F295-Y369 HydrophobicContact CD2-CE1 4.05Å; F295-Y369 AromaticContact CD2-CG 3.58Å; F295-Y369 HydrophobicContact CD2-CG 3.58Å; F295-Y369 HydrophobicContact CE2-CD1 4.49Å; F295-Y369 HydrophobicContact CE2-CG 4.33Å; F295-Y369 HydrophobicContact CG-CD1 4.27Å; F295-Y369 HydrophobicContact CG-CE1 4.31Å; F295-Y369 PolarHBondContact N-OH 3.24Å; V365-Y369 HydrophobicContact CG1-CD1 4.03Å; V365-Y369 HydrophobicContact CG1-CD2 4.39Å; V365-Y369 HydrophobicContact CG1-CE1 3.4Å; V365-Y369 HydrophobicContact CG1-CE2 3.8Å; V365-Y369 HydrophobicContact CG1-CG 4.49Å; V365-Y369 WeakPolarHBondContact CG1-OH 3.47Å; V365-Y369 WeakPolarHBondContact O-CD1 3.46Å; V365-Y369 PolarHBondContact O-N 3.43Å; Y366-Y369 AromaticContact CD1-CD2 3.91Å; Y366-Y369 HydrophobicContact CD1-CD2 3.91Å; Y366-Y369 HydrophobicContact CD1-CE2 4.15Å; Y366-Y369 HydrophobicContact CE1-CD2 4.47Å; Y366-Y369 HydrophobicContact CE1-CE2 4.3Å; E367-Y369 VanDerWaalsContact C-N 3.28Å; E367-Y369 PolarHBondContact O-N 3.47Å; Y369-S372 WeakPolarHBondContact O-CB 3.46Å; Y369-S372 PolarHBondContact O-N 2.94Å; Y369-I373 WeakPolarHBondContact O-CG1 3.45Å; Y369-I373 PolarHBondContact O-N 2.79Å; Y369-I373 VanDerWaalsContact O-N 3.09Å
370	T	88.6	Confident	84.4	Confident	4 Å²	4	33.7 Å²	33.7	3%	0.025	18%	0.182	C	C	.	.	H	α-helix	trans	-64.6	-45	178.6	-56.1	0	0	0	0	110.7	F77 Y80 Y366 E367 S372 I373 A374	F77-T370 WeakPolarHBondContact CA-OG1 3.46Å; F77-T370 WeakPolarHBondContact CB-OG1 3.38Å; Y80-T370 HydrophobicContact CD1-CG2 4.12Å; Y80-T370 HydrophobicContact CG-CG2 4.36Å; Y366-T370 WeakPolarHBondContact O-CB 3.38Å; Y366-T370 PolarHBondContact O-N 3.39Å; Y366-T370 PolarHBondContact O-OG1 3.42Å; E367-T370 PolarHBondContact O-N 3.28Å; E367-T370 VanDerWaalsContact O-N 3.09Å; T370-S372 VanDerWaalsContact C-N 3.29Å; T370-S372 PolarHBondContact O-N 3.13Å; T370-I373 PolarHBondContact O-N 3.19Å; T370-A374 VanDerWaalsContact O-CB 3.31Å; T370-A374 WeakPolarHBondContact O-CB 3.42Å; T370-A374 PolarHBondContact O-N 2.97Å
371	V	88.1	Confident	83.9	Confident	15 Å²	15	33.1 Å²	33.1	9%	0.091	17%	0.173	C	C	.	.	H	α-helix	trans	-60.1	-38.9	173.4	173.4	0	0	0	0	111.1	E367 A374 Y375 H451 I452 Y455	E367-V371 WeakPolarHBondContact O-CG2 3.38Å; E367-V371 PolarHBondContact O-N 3.42Å; V371-A374 PolarHBondContact O-N 3.33Å; V371-Y375 VanDerWaalsContact O-CB 3.29Å; V371-Y375 WeakPolarHBondContact O-CB 3.38Å; V371-Y375 PolarHBondContact O-N 3.5Å; V371-H451 HydrophobicContact CG2-CB 4.23Å; V371-I452 HydrophobicContact CG1-CG1 4.4Å; V371-Y455 HydrophobicContact CG1-CD1 4.13Å; V371-Y455 HydrophobicContact CG1-CD2 4.33Å; V371-Y455 HydrophobicContact CG1-CG 3.93Å; V371-Y455 HydrophobicContact CG2-CD2 4.39Å; V371-Y455 HydrophobicContact CG2-CG 4.37Å
372	S	86.8	Confident	83.6	Confident	45 Å²	45	39.8 Å²	39.8	32%	0.315	20%	0.204	S	C	.	.	H	α-helix	trans	-65.6	-39.7	178.9	-167.3	0	0	0	0	113.4	E368 Y369 T370 D376 R396	E368-S372 WeakPolarHBondContact O-CB 3.43Å; E368-S372 PolarHBondContact O-N 3.1Å; Y369-S372 WeakPolarHBondContact O-CB 3.46Å; Y369-S372 PolarHBondContact O-N 2.94Å; T370-S372 VanDerWaalsContact C-N 3.29Å; T370-S372 PolarHBondContact O-N 3.13Å; S372-D376 PolarHBondContact O-N 3.42Å; S372-R396 PolarHBondContact O-NH1 3.27Å; S372-R396 PolarHBondContact OG-NH1 3.14Å; S372-R396 PolarHBondContact OG-NH2 3.47Å
373	I	88.7	Confident	82.8	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-73.6	-40.9	175.8	-61.7	163.5	0	0	0	110.6	F77 Y80 F295 Y369 T370 Y375 D376 L377 L393 M397	F77-I373 HydrophobicContact CD2-CD1 4.13Å; F77-I373 HydrophobicContact CE2-CD1 3.41Å; F77-I373 VanDerWaalsContact CE2-CD1 3.41Å; F77-I373 HydrophobicContact CZ-CD1 4.07Å; Y80-I373 HydrophobicContact CD1-CG2 4.31Å; Y80-I373 HydrophobicContact CE1-CB 4.11Å; Y80-I373 HydrophobicContact CE1-CG2 3.74Å; F295-I373 HydrophobicContact CE2-CD1 3.96Å; F295-I373 HydrophobicContact CE2-CG1 4.03Å; F295-I373 HydrophobicContact CZ-CD1 4.18Å; F295-I373 HydrophobicContact CZ-CG1 4Å; Y369-I373 WeakPolarHBondContact O-CG1 3.45Å; Y369-I373 PolarHBondContact O-N 2.79Å; Y369-I373 VanDerWaalsContact O-N 3.09Å; T370-I373 PolarHBondContact O-N 3.19Å; I373-Y375 PolarHBondContact O-N 2.68Å; I373-D376 PolarHBondContact O-N 2.77Å; I373-L377 PolarHBondContact O-N 2.84Å; I373-L393 HydrophobicContact CG2-CD1 4.27Å; I373-M397 HydrophobicContact CD1-CE 3.88Å; I373-M397 HydrophobicContact CG1-CE 4.46Å; I373-M397 HydrophobicContact CG2-CE 3.74Å
374	A	88.6	Confident	81.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-57.9	-38.2	173.9	0	0	0	0	0	112.4	Y80 T370 V371 L377 L378 A448 I452	Y80-A374 HydrophobicContact CE1-CB 4.35Å; Y80-A374 WeakPolarHBondContact OH-CA 3.35Å; T370-A374 VanDerWaalsContact O-CB 3.31Å; T370-A374 WeakPolarHBondContact O-CB 3.42Å; T370-A374 PolarHBondContact O-N 2.97Å; V371-A374 PolarHBondContact O-N 3.33Å; A374-L377 PolarHBondContact O-N 3.34Å; A374-L378 PolarHBondContact O-N 3.29Å; A374-L378 VanDerWaalsContact O-N 3.1Å; A374-A448 HydrophobicContact CB-CB 3.73Å; A374-I452 HydrophobicContact CB-CD1 4.12Å; A374-I452 HydrophobicContact CB-CG1 4.29Å
375	Y	86	Confident	81.1	Confident	59 Å²	59	47.6 Å²	47.6	23%	0.231	24%	0.235	C	C	.	.	H	α-helix	trans	-66.4	-45.1	178.8	-176.4	-99.6	0	0	0	111.8	V371 I373 L377 L378 L379 I452 P525	V371-Y375 VanDerWaalsContact O-CB 3.29Å; V371-Y375 WeakPolarHBondContact O-CB 3.38Å; V371-Y375 PolarHBondContact O-N 3.5Å; I373-Y375 PolarHBondContact O-N 2.68Å; Y375-L377 VanDerWaalsContact C-N 3.32Å; Y375-L377 PolarHBondContact O-N 3.23Å; Y375-L378 PolarHBondContact O-N 2.99Å; Y375-L379 HydrophobicContact CD1-CD1 3.96Å; Y375-L379 HydrophobicContact CD1-CG 4.26Å; Y375-L379 HydrophobicContact CE1-CD1 3.41Å; Y375-L379 VanDerWaalsContact CE1-CD1 3.41Å; Y375-L379 HydrophobicContact CE1-CD2 4.32Å; Y375-L379 HydrophobicContact CE1-CG 3.84Å; Y375-L379 PolarHBondContact O-N 3.49Å; Y375-I452 HydrophobicContact CD2-CD1 4.42Å; Y375-P525 HydrophobicContact CD1-CG 3.93Å; Y375-P525 HydrophobicContact CE1-CB 3.52Å; Y375-P525 HydrophobicContact CE1-CG 3.17Å; Y375-P525 HydrophobicContact CE2-CG 4.45Å; Y375-P525 VanDerWaalsContact CZ-CG 3.5Å; Y375-P525 VanDerWaalsContact OH-CB 3.28Å; Y375-P525 WeakPolarHBondContact OH-CB 3.2Å
376	D	85.8	Confident	80	Confident	44 Å²	44	51 Å²	51	24%	0.235	26%	0.256	C	S	.	.	H	α-helix	trans	-57.4	-44.6	172.8	-73.6	9.6	0	0	0	111.3	S372 I373 L378 L379 C380 L393 R396	S372-D376 PolarHBondContact O-N 3.42Å; I373-D376 PolarHBondContact O-N 2.77Å; D376-L378 VanDerWaalsContact C-N 3.33Å; D376-L378 PolarHBondContact O-N 3.5Å; D376-L379 WeakPolarHBondContact O-CB 3.5Å; D376-L379 PolarHBondContact O-N 3.1Å; D376-L379 VanDerWaalsContact O-N 3.15Å; D376-C380 PolarHBondContact O-N 3.02Å; D376-C380 PolarHBondContact O-SG 2.88Å; D376-L393 HydrophobicContact CB-CD1 3.88Å; D376-L393 HydrophobicContact CB-CD2 4.45Å; D376-R396 IonicContact OD1-NH1 3.22Å; D376-R396 PolarHBondContact OD1-NH1 3.5Å; D376-R396 WeakPolarHBondContact OD2-CD 3.49Å; D376-R396 IonicContact OD2-CZ 2.69Å; D376-R396 IonicContact OD2-NE 2.76Å; D376-R396 IonicContact OD2-NH1 2.75Å; D376-R396 PolarHBondContact OD2-NH1 2.93Å
377	L	86.2	Confident	79	Confident	5 Å²	5	51.9 Å²	51.9	3%	0.026	26%	0.262	C	S	.	.	H	α-helix	trans	-60.7	-39	178.3	-178.8	65.5	0	0	0	112.9	Y80 I373 A374 Y375 C380 H381 L393 L444 M445 A448	Y80-L377 WeakPolarHBondContact OH-CD2 3.32Å; I373-L377 PolarHBondContact O-N 2.84Å; A374-L377 PolarHBondContact O-N 3.34Å; Y375-L377 VanDerWaalsContact C-N 3.32Å; Y375-L377 PolarHBondContact O-N 3.23Å; L377-C380 WeakPolarHBondContact O-CB 3.22Å; L377-C380 PolarHBondContact O-N 3.26Å; L377-H381 PolarHBondContact O-N 3.14Å; L377-H381 PolarHBondContact O-ND1 3.2Å; L377-L393 HydrophobicContact CB-CD2 4.06Å; L377-L393 HydrophobicContact CD1-CD2 4.12Å; L377-L444 HydrophobicContact CD2-CB 3.79Å; L377-M445 HydrophobicContact CD2-SD 4.03Å; L377-M445 HydrophobicContact CG-SD 3.92Å; L377-A448 HydrophobicContact CD2-CB 4.29Å
378	L	85.1	Confident	78	Confident	29 Å²	29	49.9 Å²	49.9	15%	0.152	26%	0.255	C	S	.	.	H	α-helix	trans	-70.9	-36.6	174.7	-66.1	-160.8	0	0	0	112	A374 Y375 D376 C380 H381 Q382 M445 A448 I452	A374-L378 PolarHBondContact O-N 3.29Å; A374-L378 VanDerWaalsContact O-N 3.1Å; Y375-L378 PolarHBondContact O-N 2.99Å; D376-L378 VanDerWaalsContact C-N 3.33Å; D376-L378 PolarHBondContact O-N 3.5Å; L378-C380 VanDerWaalsContact C-N 3.31Å; L378-C380 PolarHBondContact O-N 3.03Å; L378-H381 PolarHBondContact O-N 3.24Å; L378-Q382 WeakPolarHBondContact O-CG 3.49Å; L378-Q382 PolarHBondContact O-N 3.12Å; L378-Q382 VanDerWaalsContact O-N 3.09Å; L378-M445 HydrophobicContact CD2-CE 3.55Å; L378-M445 HydrophobicContact CD2-SD 3.79Å; L378-A448 HydrophobicContact CD2-CB 3.98Å; L378-A448 HydrophobicContact CG-CB 4.19Å; L378-I452 HydrophobicContact CD1-CD1 3.51Å; L378-I452 HydrophobicContact CG-CD1 3.88Å
379	L	82.3	Confident	77.3	Confident	58 Å²	58	51.8 Å²	51.8	30%	0.304	26%	0.26	S	S	.	.	H	α-helix	trans	-61.5	-38.7	171.9	-72.7	-175.7	0	0	0	111.9	Y375 D376 H381 Q382 G383	Y375-L379 HydrophobicContact CD1-CD1 3.96Å; Y375-L379 HydrophobicContact CD1-CG 4.26Å; Y375-L379 HydrophobicContact CE1-CD1 3.41Å; Y375-L379 VanDerWaalsContact CE1-CD1 3.41Å; Y375-L379 HydrophobicContact CE1-CD2 4.32Å; Y375-L379 HydrophobicContact CE1-CG 3.84Å; Y375-L379 PolarHBondContact O-N 3.49Å; D376-L379 WeakPolarHBondContact O-CB 3.5Å; D376-L379 PolarHBondContact O-N 3.1Å; D376-L379 VanDerWaalsContact O-N 3.15Å; L379-H381 PolarHBondContact O-N 3.03Å; L379-Q382 PolarHBondContact O-N 3.21Å; L379-G383 PolarHBondContact O-N 3.26Å
380	C	76.8	Confident	76.7	Confident	7 Å²	7	52.4 Å²	52.4	5%	0.047	27%	0.267	C	S	.	.	H	α-helix	trans	-53.5	-40.9	174.9	-60.8	0	0	0	0	112.1	D376 L377 L378 T386 Y389	D376-C380 PolarHBondContact O-N 3.02Å; D376-C380 PolarHBondContact O-SG 2.88Å; L377-C380 WeakPolarHBondContact O-CB 3.22Å; L377-C380 PolarHBondContact O-N 3.26Å; L378-C380 VanDerWaalsContact C-N 3.31Å; L378-C380 PolarHBondContact O-N 3.03Å; C380-T386 WeakPolarHBondContact O-CA 3.23Å; C380-T386 WeakPolarHBondContact O-CG2 3.36Å; C380-Y389 PolarHBondContact SG-O 3.42Å
381	H	74.5	Confident	76.3	Confident	86 Å²	86	54.3 Å²	54.3	40%	0.398	28%	0.277	S	S	.	.	H	α-helix	trans	-85.1	-22	-177.1	-71.6	86.2	0	0	0	114.1	L377 L378 L379 M445	L377-H381 PolarHBondContact O-N 3.14Å; L377-H381 PolarHBondContact O-ND1 3.2Å; L378-H381 PolarHBondContact O-N 3.24Å; L379-H381 PolarHBondContact O-N 3.03Å; H381-M445 HydrophobicContact CB-CE 3.94Å; H381-M445 VanDerWaalsContact CE1-SD 3.54Å; H381-M445 PolarHBondContact ND1-SD 3.15Å; H381-M445 VanDerWaalsContact ND1-SD 3.4Å
382	Q	75.7	Confident	75.9	Confident	153 Å²	153	56.9 Å²	56.9	72%	0.715	29%	0.29	S	S	*	.	H	α-helix	trans	-86.1	-21.8	173.8	-67.3	-179.7	22	0	0	112.9	L378 L379	L378-Q382 WeakPolarHBondContact O-CG 3.49Å; L378-Q382 PolarHBondContact O-N 3.12Å; L378-Q382 VanDerWaalsContact O-N 3.09Å; L379-Q382 PolarHBondContact O-N 3.21Å
383	G	65.2	Low	75.8	Confident	18 Å²	18	54.9 Å²	54.9	19%	0.186	28%	0.276	C	S	.	.	S	Bend	trans	-68.8	146.4	178.4	0	0	0	0	0	113.4	L379 N385	L379-G383 PolarHBondContact O-N 3.26Å; G383-N385 PolarHBondContact O-N 3.45Å
384	K	57.5	Low	75.7	Confident	208 Å²	208	55.5 Å²	55.5	90%	0.904	28%	0.28	S	S	*	.	S	Bend	trans	-63.2	-24.5	175.2	-67.6	-175.7	178.9	-179.1	0	113.5
385	N	60.4	Low	75.6	Confident	86 Å²	86	58.9 Å²	58.9	46%	0.46	29%	0.293	S	S	.	.			trans	-117.2	73.1	-177.1	-60.6	18.8	0	0	0	109.8	G383 S387 D388 Y389	G383-N385 PolarHBondContact O-N 3.45Å; N385-S387 PolarHBondContact O-N 3.49Å; N385-D388 HydrophobicContact CB-CB 4.12Å; N385-D388 VanDerWaalsContact CB-CG 3.47Å; N385-D388 VanDerWaalsContact CB-OD2 3.22Å; N385-D388 WeakPolarHBondContact CB-OD2 3.3Å; N385-D388 PolarHBondContact ND2-OD2 2.99Å; N385-D388 PolarHBondContact O-N 2.89Å; N385-Y389 WeakPolarHBondContact O-CD2 3.28Å
386	T	60.1	Low	75.6	Confident	72 Å²	72	59.7 Å²	59.7	44%	0.442	30%	0.295	S	S	.	.	H	α-helix	trans	-58.8	-21	-173.2	58.1	0	0	0	0	115	C380 S390	C380-T386 WeakPolarHBondContact O-CA 3.23Å; C380-T386 WeakPolarHBondContact O-CG2 3.36Å; T386-S390 PolarHBondContact O-N 3.21Å
387	S	64.2	Low	75.5	Confident	22 Å²	22	57.8 Å²	57.8	15%	0.154	29%	0.285	C	S	.	.	H	α-helix	trans	-81.3	-45.1	179	36.3	0	0	0	0	112.7	R145 N385 Y389 S390 D391	R145-S387 VanDerWaalsContact NH2-CB 3.29Å; R145-S387 PolarHBondContact NH2-OG 2.83Å; N385-S387 PolarHBondContact O-N 3.49Å; S387-Y389 VanDerWaalsContact C-N 3.26Å; S387-Y389 PolarHBondContact O-N 2.85Å; S387-S390 WeakPolarHBondContact O-CB 3.39Å; S387-S390 PolarHBondContact O-N 2.91Å; S387-D391 PolarHBondContact O-N 3Å
388	D	64.3	Low	75.5	Confident	57 Å²	57	58.8 Å²	58.8	31%	0.305	30%	0.296	S	S	.	.	H	α-helix	trans	-56.6	-42.7	179.3	-48.1	9.7	0	0	0	110.9	R145 N385 D391 L392	R145-D388 IonicContact CZ-OD1 3.7Å; R145-D388 IonicContact NH1-OD1 2.79Å; R145-D388 PolarHBondContact NH1-OD1 3.16Å; N385-D388 HydrophobicContact CB-CB 4.12Å; N385-D388 VanDerWaalsContact CB-CG 3.47Å; N385-D388 VanDerWaalsContact CB-OD2 3.22Å; N385-D388 WeakPolarHBondContact CB-OD2 3.3Å; N385-D388 PolarHBondContact ND2-OD2 2.99Å; N385-D388 PolarHBondContact O-N 2.89Å; D388-D391 PolarHBondContact O-N 3.42Å; D388-L392 WeakPolarHBondContact O-CG 3.34Å; D388-L392 PolarHBondContact O-N 2.61Å; D388-L392 VanDerWaalsContact O-N 3.11Å
389	Y	69.2	Low	75.7	Confident	102 Å²	102	57.4 Å²	57.4	40%	0.4	29%	0.289	S	S	.	.	H	α-helix	trans	-69.9	-32.3	176.4	-75.2	-78.6	0	0	0	113.4	C380 N385 S387 L392 L393	C380-Y389 PolarHBondContact SG-O 3.42Å; N385-Y389 WeakPolarHBondContact O-CD2 3.28Å; S387-Y389 VanDerWaalsContact C-N 3.26Å; S387-Y389 PolarHBondContact O-N 2.85Å; Y389-L392 HydrophobicContact CD1-CD1 4.3Å; Y389-L392 PolarHBondContact O-N 3.33Å; Y389-L393 WeakPolarHBondContact O-CB 3.32Å; Y389-L393 PolarHBondContact O-N 2.9Å
390	S	76.6	Confident	76.1	Confident	30 Å²	30	55 Å²	55	21%	0.21	28%	0.276	C	S	.	.	H	α-helix	trans	-68.8	-36.2	173.8	-171.3	0	0	0	0	111.8	H88 T386 S387 L393 S394	H88-S390 PolarHBondContact NE2-O 2.88Å; H88-S390 VanDerWaalsContact NE2-O 3.13Å; T386-S390 PolarHBondContact O-N 3.21Å; S387-S390 WeakPolarHBondContact O-CB 3.39Å; S387-S390 PolarHBondContact O-N 2.91Å; S390-L393 PolarHBondContact O-N 3.39Å; S390-S394 PolarHBondContact O-N 2.78Å
391	D	80.2	Confident	76.8	Confident	43 Å²	43	55.7 Å²	55.7	23%	0.23	28%	0.281	C	S	.	.	H	α-helix	trans	-62.5	-48.1	172.8	-67.2	-39	0	0	0	109.9	K149 S387 D388 L393 S394 R395	K149-D391 IonicContact NZ-OD1 2.67Å; K149-D391 PolarHBondContact NZ-OD1 3.17Å; K149-D391 IonicContact NZ-OD2 2.67Å; K149-D391 PolarHBondContact NZ-OD2 2.91Å; S387-D391 PolarHBondContact O-N 3Å; D388-D391 PolarHBondContact O-N 3.42Å; D391-L393 VanDerWaalsContact C-N 3.29Å; D391-L393 PolarHBondContact O-N 3.38Å; D391-S394 PolarHBondContact O-N 2.74Å; D391-S394 VanDerWaalsContact O-N 3.14Å; D391-S394 PolarHBondContact O-OG 3.49Å; D391-R395 PolarHBondContact O-N 3.04Å
392	L	80.1	Confident	77.7	Confident	70 Å²	70	52.1 Å²	52.1	37%	0.366	27%	0.265	S	S	.	.	H	α-helix	trans	-56.8	-38.2	175.5	-71.7	172.7	0	0	0	113.3	D388 Y389 R395 R396 Y513	D388-L392 WeakPolarHBondContact O-CG 3.34Å; D388-L392 PolarHBondContact O-N 2.61Å; D388-L392 VanDerWaalsContact O-N 3.11Å; Y389-L392 HydrophobicContact CD1-CD1 4.3Å; Y389-L392 PolarHBondContact O-N 3.33Å; L392-R395 PolarHBondContact O-N 3.39Å; L392-R396 PolarHBondContact O-N 2.89Å; L392-Y513 HydrophobicContact CD2-CE2 4.21Å
393	L	85	Confident	78.6	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.016	23%	0.231	C	C	.	.	H	α-helix	trans	-73.5	-32.2	179.1	-171.7	50.7	0	0	0	112.5	I373 D376 L377 Y389 S390 D391 R396 M397	I373-L393 HydrophobicContact CG2-CD1 4.27Å; D376-L393 HydrophobicContact CB-CD1 3.88Å; D376-L393 HydrophobicContact CB-CD2 4.45Å; L377-L393 HydrophobicContact CB-CD2 4.06Å; L377-L393 HydrophobicContact CD1-CD2 4.12Å; Y389-L393 WeakPolarHBondContact O-CB 3.32Å; Y389-L393 PolarHBondContact O-N 2.9Å; S390-L393 PolarHBondContact O-N 3.39Å; D391-L393 VanDerWaalsContact C-N 3.29Å; D391-L393 PolarHBondContact O-N 3.38Å; L393-R396 PolarHBondContact O-N 3.25Å; L393-M397 PolarHBondContact O-N 2.69Å
394	S	86.6	Confident	80	Confident	14 Å²	14	44.1 Å²	44.1	10%	0.098	22%	0.223	C	C	.	.	H	α-helix	trans	-65.5	-40.6	169.5	74.5	0	0	0	0	111.8	H88 S390 D391 R396 M397 G398 L399	H88-S394 PolarHBondContact NE2-N 2.91Å; S390-S394 PolarHBondContact O-N 2.78Å; D391-S394 PolarHBondContact O-N 2.74Å; D391-S394 VanDerWaalsContact O-N 3.14Å; D391-S394 PolarHBondContact O-OG 3.49Å; S394-R396 PolarHBondContact O-N 3.43Å; S394-M397 CarbonylContact O-C 3.44Å; S394-M397 WeakPolarHBondContact O-CB 3.46Å; S394-M397 PolarHBondContact O-N 2.87Å; S394-M397 VanDerWaalsContact O-N 3.13Å; S394-G398 PolarHBondContact O-N 3.05Å; S394-L399 PolarHBondContact O-N 3.13Å; S394-L399 VanDerWaalsContact O-N 3.08Å
395	R	85.8	Confident	81.8	Confident	71 Å²	71	34.2 Å²	34.2	27%	0.268	18%	0.179	S	C	.	.	H	α-helix	trans	-64.6	-36.4	175.3	-157.3	-177.7	67.5	90.8	7.4	112.5	D203 D391 L392 M397 G398 Y513	D203-R395 WeakPolarHBondContact OD2-CD 3.45Å; D391-R395 PolarHBondContact O-N 3.04Å; L392-R395 PolarHBondContact O-N 3.39Å; R395-M397 PolarHBondContact O-N 3.45Å; R395-G398 PolarHBondContact O-N 2.93Å; R395-Y513 VanDerWaalsContact CZ-CE1 3.5Å; R395-Y513 VanDerWaalsContact CZ-CZ 3.47Å; R395-Y513 VanDerWaalsContact CZ-OH 3.31Å; R395-Y513 PolarHBondContact NE-OH 2.86Å; R395-Y513 PolarHBondContact NH2-OH 2.92Å
396	R	85.3	Confident	83.5	Confident	76 Å²	76	30.1 Å²	30.1	29%	0.287	16%	0.158	S	C	.	.	H	α-helix	trans	-64.7	-25.1	173.2	-171.6	172.8	-179.8	-168.3	-6.5	113.4	F295 S372 D376 L392 L393 S394	F295-R396 HydrophobicContact CE1-CG 4.21Å; F295-R396 HydrophobicContact CZ-CG 4.41Å; F295-R396 VanDerWaalsContact CZ-NE 3.32Å; S372-R396 PolarHBondContact O-NH1 3.27Å; S372-R396 PolarHBondContact OG-NH1 3.14Å; S372-R396 PolarHBondContact OG-NH2 3.47Å; D376-R396 IonicContact OD1-NH1 3.22Å; D376-R396 PolarHBondContact OD1-NH1 3.5Å; D376-R396 WeakPolarHBondContact OD2-CD 3.49Å; D376-R396 IonicContact OD2-CZ 2.69Å; D376-R396 IonicContact OD2-NE 2.76Å; D376-R396 IonicContact OD2-NH1 2.75Å; D376-R396 PolarHBondContact OD2-NH1 2.93Å; L392-R396 PolarHBondContact O-N 2.89Å; L393-R396 PolarHBondContact O-N 3.25Å; S394-R396 PolarHBondContact O-N 3.43Å
397	M	84.9	Confident	85.2	Confident	4 Å²	4	26.7 Å²	26.7	2%	0.02	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-5.5	170.3	-64.9	-65.9	-161.4	0	0	113.2	Q84 C299 I373 L393 S394 R395 L399	Q84-M397 HydrophobicContact CB-CE 4.06Å; Q84-M397 HydrophobicContact CG-CE 4.02Å; C299-M397 HydrophobicContact CB-SD 4.38Å; I373-M397 HydrophobicContact CD1-CE 3.88Å; I373-M397 HydrophobicContact CG1-CE 4.46Å; I373-M397 HydrophobicContact CG2-CE 3.74Å; L393-M397 PolarHBondContact O-N 2.69Å; S394-M397 CarbonylContact O-C 3.44Å; S394-M397 WeakPolarHBondContact O-CB 3.46Å; S394-M397 PolarHBondContact O-N 2.87Å; S394-M397 VanDerWaalsContact O-N 3.13Å; R395-M397 PolarHBondContact O-N 3.45Å; M397-L399 HydrophobicContact CB-CB 4.32Å; M397-L399 PolarHBondContact O-N 2.89Å
398	G	84.9	Confident	86.7	Confident	25 Å²	25	27 Å²	27	26%	0.258	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.5	13.1	-171.1	0	0	0	0	0	114.4	Q199 R303 S394 R395	Q199-G398 VanDerWaalsContact NE2-C 3.29Å; Q199-G398 PolarHBondContact NE2-O 3.49Å; R303-G398 WeakPolarHBondContact CD-O 3.35Å; S394-G398 PolarHBondContact O-N 3.05Å; R395-G398 PolarHBondContact O-N 2.93Å
399	L	89.1	Confident	88	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.005	13%	0.128	C	C	.	.			trans	-82.4	122.6	-176.8	178.5	68.1	0	0	0	110.3	C85 H88 R303 F306 S394 M397 P401	C85-L399 HydrophobicContact CB-CD2 3.92Å; H88-L399 HydrophobicContact CB-CD2 4.22Å; R303-L399 HydrophobicContact CG-CB 4.43Å; R303-L399 HydrophobicContact CG-CD1 4.23Å; F306-L399 HydrophobicContact CD1-CD1 4.15Å; F306-L399 HydrophobicContact CE1-CD1 4.46Å; S394-L399 PolarHBondContact O-N 3.13Å; S394-L399 VanDerWaalsContact O-N 3.08Å; M397-L399 HydrophobicContact CB-CB 4.32Å; M397-L399 PolarHBondContact O-N 2.89Å; L399-P401 WeakPolarHBondContact O-CD 3.4Å
400	T	90.6	Very high	89.1	Confident	6 Å²	6	20.8 Å²	20.8	4%	0.037	11%	0.11	C	C	.	.			trans	-100.4	93.2	170	-40.3	0	0	0	0	109.3	S195 C198 Q199 I402 P403	S195-T400 PolarHBondContact O-OG1 2.99Å; C198-T400 HydrophobicContact CB-CG2 4.2Å; Q199-T400 HydrophobicContact CG-CG2 4.26Å; Q199-T400 PolarHBondContact NE2-OG1 3.06Å; T400-I402 PolarHBondContact O-N 3.42Å; T400-P403 HydrophobicContact CG2-CG 3.76Å; T400-P403 WeakPolarHBondContact O-CD 3.33Å
401	P	91.9	Very high	89.8	Confident	22 Å²	22	19.6 Å²	19.6	14%	0.143	10%	0.102	C	C	.	.	H	α-helix	trans	-77.8	-21.2	-167.4	30.6	-38	0	0	0	114.7	I92 L399 S405	I92-P401 VanDerWaalsContact CD1-C 3.46Å; I92-P401 HydrophobicContact CD1-CB 3.66Å; I92-P401 HydrophobicContact CD1-CG 3.93Å; I92-P401 WeakPolarHBondContact CD1-O 3.36Å; L399-P401 WeakPolarHBondContact O-CD 3.4Å; P401-S405 WeakPolarHBondContact O-CB 3.46Å; P401-S405 PolarHBondContact O-N 3.02Å; P401-S405 PolarHBondContact O-OG 3.08Å
402	I	93.6	Very high	90.2	Very high	12 Å²	12	21.3 Å²	21.3	6%	0.062	11%	0.11	C	C	.	.	H	α-helix	trans	-63.8	-55.7	179.6	-59.2	178.3	0	0	0	112.4	I92 K149 L153 L202 L244 T400 L404 S405 C406	I92-I402 HydrophobicContact CD1-CB 4.5Å; I92-I402 HydrophobicContact CD1-CG1 3.91Å; K149-I402 HydrophobicContact CB-CD1 4.34Å; K149-I402 HydrophobicContact CG-CD1 4.3Å; L153-I402 HydrophobicContact CB-CG2 4.22Å; L153-I402 HydrophobicContact CD1-CG2 4.31Å; L202-I402 HydrophobicContact CD1-CD1 4.15Å; L244-I402 HydrophobicContact CD1-CB 4.33Å; L244-I402 HydrophobicContact CD1-CG2 4.01Å; L244-I402 HydrophobicContact CD2-CG2 3.88Å; T400-I402 PolarHBondContact O-N 3.42Å; I402-L404 VanDerWaalsContact C-N 3.29Å; I402-L404 PolarHBondContact O-N 3.4Å; I402-S405 WeakPolarHBondContact O-CB 3.19Å; I402-S405 PolarHBondContact O-N 2.93Å; I402-S405 VanDerWaalsContact O-N 3.12Å; I402-C406 PolarHBondContact O-N 3.35Å; I402-C406 PolarHBondContact O-SG 2.76Å
403	P	95.2	Very high	90.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-65	-32.4	-179.9	22.3	-29.5	0	0	0	112.8	L244 H247 L251 T400 C406 L407	L244-P403 HydrophobicContact CD1-CB 3.73Å; L244-P403 HydrophobicContact CD1-CG 3.85Å; H247-P403 HydrophobicContact CB-CB 4.2Å; H247-P403 HydrophobicContact CB-CG 4.48Å; H247-P403 VanDerWaalsContact ND1-CG 3.28Å; H247-P403 WeakPolarHBondContact ND1-CG 3.47Å; L251-P403 HydrophobicContact CD1-CB 3.97Å; T400-P403 HydrophobicContact CG2-CG 3.76Å; T400-P403 WeakPolarHBondContact O-CD 3.33Å; P403-C406 WeakPolarHBondContact O-CB 3.33Å; P403-C406 PolarHBondContact O-N 3.09Å; P403-L407 PolarHBondContact O-N 3.43Å
404	L	94.9	Very high	90.7	Very high	2 Å²	2	26 Å²	26	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-65.9	-38	173	-174.2	146.2	0	0	0	111.7	L89 F306 V310 I402 I408	L89-L404 HydrophobicContact CD1-CD2 3.53Å; L89-L404 HydrophobicContact CD2-CD2 3.73Å; L89-L404 HydrophobicContact CG-CD2 4.23Å; F306-L404 HydrophobicContact CD1-CD1 4.41Å; F306-L404 HydrophobicContact CE1-CD1 4.33Å; F306-L404 HydrophobicContact CE1-CD2 4.3Å; V310-L404 HydrophobicContact CG1-CD2 4.4Å; V310-L404 HydrophobicContact CG1-CG 4.39Å; V310-L404 HydrophobicContact CG2-CD1 4.5Å; V310-L404 HydrophobicContact CG2-CD2 4.3Å; I402-L404 VanDerWaalsContact C-N 3.29Å; I402-L404 PolarHBondContact O-N 3.4Å; L404-I408 HydrophobicContact CD2-CD1 3.62Å; L404-I408 WeakPolarHBondContact O-CG1 3.35Å; L404-I408 PolarHBondContact O-N 2.8Å
405	S	95.6	Very high	90.6	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.9	-41	169.2	-59.6	0	0	0	0	112.8	L89 I92 Y93 P401 I402 L407 I408 N409	L89-S405 VanDerWaalsContact CD1-OG 3.3Å; L89-S405 WeakPolarHBondContact CD1-OG 3.49Å; I92-S405 WeakPolarHBondContact CG2-OG 3.45Å; Y93-S405 PolarHBondContact OH-O 3.47Å; P401-S405 WeakPolarHBondContact O-CB 3.46Å; P401-S405 PolarHBondContact O-N 3.02Å; P401-S405 PolarHBondContact O-OG 3.08Å; I402-S405 WeakPolarHBondContact O-CB 3.19Å; I402-S405 PolarHBondContact O-N 2.93Å; I402-S405 VanDerWaalsContact O-N 3.12Å; S405-L407 VanDerWaalsContact C-N 3.3Å; S405-L407 PolarHBondContact O-N 3.49Å; S405-I408 PolarHBondContact O-N 3.08Å; S405-N409 WeakPolarHBondContact O-CB 3.14Å; S405-N409 PolarHBondContact O-N 2.99Å; S405-N409 PolarHBondContact O-ND2 3.09Å; S405-N409 PolarHBondContact O-OD1 3.31Å
406	C	95.6	Very high	90.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-57.8	-43.6	175.5	-64.8	0	0	0	0	111.7	C156 C248 I402 P403 A410	C156-C406 HydrophobicContact CB-CB 4.43Å; C248-C406 VanDerWaalsContact SG-CB 3.53Å; I402-C406 PolarHBondContact O-N 3.35Å; I402-C406 PolarHBondContact O-SG 2.76Å; P403-C406 WeakPolarHBondContact O-CB 3.33Å; P403-C406 PolarHBondContact O-N 3.09Å; C406-A410 WeakPolarHBondContact O-CB 3.47Å; C406-A410 PolarHBondContact O-N 3.44Å
407	L	95.2	Very high	89.8	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-60.4	-56	174.6	-179.6	75.7	0	0	0	111.2	L251 L252 V255 I314 P403 S405 N409 A410 M411	L251-L407 HydrophobicContact CB-CD1 4.3Å; L251-L407 HydrophobicContact CB-CD2 4.08Å; L252-L407 HydrophobicContact CB-CD1 4.12Å; L252-L407 HydrophobicContact CD1-CD1 4.21Å; V255-L407 HydrophobicContact CG2-CD1 4.42Å; V255-L407 HydrophobicContact CG2-CD2 3.96Å; I314-L407 HydrophobicContact CD1-CD2 4Å; I314-L407 HydrophobicContact CD1-CG 4.14Å; P403-L407 PolarHBondContact O-N 3.43Å; S405-L407 VanDerWaalsContact C-N 3.3Å; S405-L407 PolarHBondContact O-N 3.49Å; L407-N409 VanDerWaalsContact C-N 3.3Å; L407-N409 PolarHBondContact O-N 2.92Å; L407-A410 PolarHBondContact O-N 2.96Å; L407-M411 HydrophobicContact CD1-CG 4.36Å; L407-M411 HydrophobicContact CG-CG 4.5Å; L407-M411 WeakPolarHBondContact O-CB 3.35Å; L407-M411 VanDerWaalsContact O-CG 3.24Å; L407-M411 WeakPolarHBondContact O-CG 3.1Å; L407-M411 PolarHBondContact O-N 2.97Å
408	I	94.9	Very high	89.5	Confident	29 Å²	29	34.4 Å²	34.4	15%	0.149	17%	0.17	C	C	.	.	H	α-helix	trans	-55.8	-46.8	180	-70	169.6	0	0	0	110.6	L89 Y93 V310 I314 L404 S405 A410 M411 L412	L89-I408 HydrophobicContact CD1-CD1 4.36Å; L89-I408 HydrophobicContact CD2-CD1 3.87Å; Y93-I408 WeakPolarHBondContact OH-CG2 3.49Å; V310-I408 HydrophobicContact CG1-CD1 3.78Å; V310-I408 HydrophobicContact CG1-CG1 3.8Å; V310-I408 HydrophobicContact CG2-CD1 4.43Å; I314-I408 HydrophobicContact CD1-CG1 4.33Å; L404-I408 HydrophobicContact CD2-CD1 3.62Å; L404-I408 WeakPolarHBondContact O-CG1 3.35Å; L404-I408 PolarHBondContact O-N 2.8Å; S405-I408 PolarHBondContact O-N 3.08Å; I408-A410 PolarHBondContact O-N 3.37Å; I408-M411 PolarHBondContact O-N 3.5Å; I408-L412 HydrophobicContact CG2-CD1 3.69Å; I408-L412 HydrophobicContact CG2-CG 4.25Å; I408-L412 WeakPolarHBondContact O-CB 3.28Å; I408-L412 VanDerWaalsContact O-CG 3.28Å; I408-L412 WeakPolarHBondContact O-CG 3.37Å; I408-L412 PolarHBondContact O-N 3.34Å
409	N	93.3	Very high	89.2	Confident	26 Å²	26	38.2 Å²	38.2	14%	0.139	19%	0.19	C	C	.	.	H	α-helix	trans	-57.3	-51.7	177.9	-68.2	-14.6	0	0	0	111.8	Y93 T157 S405 L407 M411 L412 F413	Y93-N409 WeakPolarHBondContact CE1-OD1 3.41Å; Y93-N409 PolarHBondContact OH-OD1 2.83Å; T157-N409 HydrophobicContact CG2-CB 3.48Å; T157-N409 VanDerWaalsContact CG2-CB 3.48Å; T157-N409 PolarHBondContact OG1-ND2 3.15Å; S405-N409 WeakPolarHBondContact O-CB 3.14Å; S405-N409 PolarHBondContact O-N 2.99Å; S405-N409 PolarHBondContact O-ND2 3.09Å; S405-N409 PolarHBondContact O-OD1 3.31Å; L407-N409 VanDerWaalsContact C-N 3.3Å; L407-N409 PolarHBondContact O-N 2.92Å; N409-M411 VanDerWaalsContact C-N 3.32Å; N409-M411 PolarHBondContact O-N 2.99Å; N409-L412 PolarHBondContact O-N 3.22Å; N409-F413 HydrophobicContact CB-CD2 4.37Å; N409-F413 HydrophobicContact CB-CE2 4.2Å; N409-F413 WeakPolarHBondContact O-CB 3.49Å; N409-F413 WeakPolarHBondContact O-CD2 2.98Å; N409-F413 WeakPolarHBondContact O-CG 3.31Å; N409-F413 PolarHBondContact O-N 3.09Å
410	A	92.1	Very high	89	Confident	2 Å²	2	42 Å²	42	2%	0.017	22%	0.217	C	C	.	.	H	α-helix	trans	-61.6	-42.4	-177.8	0	0	0	0	0	112	L160 T161 C406 L407 I408 F413 Q414	L160-A410 HydrophobicContact CB-CB 3.61Å; L160-A410 HydrophobicContact CD2-CB 4.25Å; T161-A410 HydrophobicContact CG2-CB 4.13Å; C406-A410 WeakPolarHBondContact O-CB 3.47Å; C406-A410 PolarHBondContact O-N 3.44Å; L407-A410 PolarHBondContact O-N 2.96Å; I408-A410 PolarHBondContact O-N 3.37Å; A410-F413 PolarHBondContact O-N 2.86Å; A410-Q414 WeakPolarHBondContact O-CB 3.39Å; A410-Q414 VanDerWaalsContact O-CG 3.27Å; A410-Q414 WeakPolarHBondContact O-CG 3.31Å; A410-Q414 PolarHBondContact O-N 3.35Å
411	M	90	Very high	88.5	Confident	6 Å²	6	44.8 Å²	44.8	3%	0.03	23%	0.234	C	C	.	.	H	α-helix	trans	-69.3	-37.6	179.4	-62.7	-54.4	-60	0	0	112.3	L252 I314 R318 L407 I408 N409 T415	L252-M411 HydrophobicContact CD1-SD 3.81Å; I314-M411 HydrophobicContact CD1-CG 4.37Å; I314-M411 HydrophobicContact CG1-CB 4.48Å; I314-M411 HydrophobicContact CG2-CB 3.95Å; I314-M411 HydrophobicContact CG2-CE 3.73Å; I314-M411 HydrophobicContact CG2-CG 3.88Å; R318-M411 HydrophobicContact CG-CE 3.86Å; L407-M411 HydrophobicContact CD1-CG 4.36Å; L407-M411 HydrophobicContact CG-CG 4.5Å; L407-M411 WeakPolarHBondContact O-CB 3.35Å; L407-M411 VanDerWaalsContact O-CG 3.24Å; L407-M411 WeakPolarHBondContact O-CG 3.1Å; L407-M411 PolarHBondContact O-N 2.97Å; I408-M411 PolarHBondContact O-N 3.5Å; N409-M411 VanDerWaalsContact C-N 3.32Å; N409-M411 PolarHBondContact O-N 2.99Å; M411-T415 WeakPolarHBondContact O-CB 3.48Å; M411-T415 PolarHBondContact O-N 3.31Å; M411-T415 PolarHBondContact O-OG1 3.06Å
412	L	88.4	Confident	88	Confident	78 Å²	78	45.9 Å²	45.9	41%	0.408	24%	0.238	S	C	.	.	H	α-helix	trans	-65.5	-45.1	172.7	-72.3	173.7	0	0	0	111.9	I408 N409 Q414 T415 I416	I408-L412 HydrophobicContact CG2-CD1 3.69Å; I408-L412 HydrophobicContact CG2-CG 4.25Å; I408-L412 WeakPolarHBondContact O-CB 3.28Å; I408-L412 VanDerWaalsContact O-CG 3.28Å; I408-L412 WeakPolarHBondContact O-CG 3.37Å; I408-L412 PolarHBondContact O-N 3.34Å; N409-L412 PolarHBondContact O-N 3.22Å; L412-Q414 VanDerWaalsContact C-N 3.34Å; L412-Q414 PolarHBondContact O-N 2.65Å; L412-T415 PolarHBondContact O-N 3.32Å; L412-I416 WeakPolarHBondContact O-CG1 3.43Å; L412-I416 PolarHBondContact O-N 2.84Å
413	F	88.6	Confident	87.5	Confident	112 Å²	112	49.9 Å²	49.9	49%	0.491	27%	0.267	S	S	.	.	H	α-helix	trans	-65.6	-33.8	177.1	-71.1	-51.3	0	0	0	113	T157 T161 N409 A410 L422	T157-F413 HydrophobicContact CG2-CD2 4.21Å; T157-F413 HydrophobicContact CG2-CE2 3.99Å; T161-F413 HydrophobicContact CG2-CB 3.91Å; T161-F413 HydrophobicContact CG2-CD2 3.88Å; T161-F413 HydrophobicContact CG2-CG 4.32Å; N409-F413 HydrophobicContact CB-CD2 4.37Å; N409-F413 HydrophobicContact CB-CE2 4.2Å; N409-F413 WeakPolarHBondContact O-CB 3.49Å; N409-F413 WeakPolarHBondContact O-CD2 2.98Å; N409-F413 WeakPolarHBondContact O-CG 3.31Å; N409-F413 PolarHBondContact O-N 3.09Å; A410-F413 PolarHBondContact O-N 2.86Å; F413-L422 HydrophobicContact CD1-CD1 4.35Å
414	Q	87	Confident	87.1	Confident	59 Å²	59	56.8 Å²	56.8	28%	0.276	30%	0.303	S	S	.	.	H	α-helix	trans	-71.4	-32	172.7	-74.1	175	3.8	0	0	112.6	Y163 S165 A410 L412	Y163-Q414 PolarHBondContact O-NE2 2.99Å; S165-Q414 PolarHBondContact OG-OE1 3.49Å; A410-Q414 WeakPolarHBondContact O-CB 3.39Å; A410-Q414 VanDerWaalsContact O-CG 3.27Å; A410-Q414 WeakPolarHBondContact O-CG 3.31Å; A410-Q414 PolarHBondContact O-N 3.35Å; L412-Q414 VanDerWaalsContact C-N 3.34Å; L412-Q414 PolarHBondContact O-N 2.65Å
415	T	85.2	Confident	86.6	Confident	18 Å²	18	59.4 Å²	59.4	11%	0.11	32%	0.319	C	S	.	.	H	α-helix	trans	-73.1	-45.2	179	-58.2	0	0	0	0	111.5	N321 M411 L412 R417	N321-T415 HydrophobicContact CB-CG2 4.06Å; N321-T415 PolarHBondContact ND2-O 3.1Å; M411-T415 WeakPolarHBondContact O-CB 3.48Å; M411-T415 PolarHBondContact O-N 3.31Å; M411-T415 PolarHBondContact O-OG1 3.06Å; L412-T415 PolarHBondContact O-N 3.32Å; T415-R417 PolarHBondContact O-N 3.23Å; T415-R417 VanDerWaalsContact O-N 3.11Å
416	I	82.9	Confident	86.2	Confident	61 Å²	61	64.3 Å²	64.3	31%	0.313	35%	0.345	S	S	.	.			trans	-85.9	93.9	-169	-56.6	166.1	0	0	0	111	L412 S418 L422	L412-I416 WeakPolarHBondContact O-CG1 3.43Å; L412-I416 PolarHBondContact O-N 2.84Å; I416-S418 VanDerWaalsContact C-N 3.27Å; I416-S418 PolarHBondContact O-N 3.37Å; I416-L422 HydrophobicContact CB-CD2 3.95Å; I416-L422 HydrophobicContact CB-CG 4.26Å; I416-L422 HydrophobicContact CD1-CD2 3.58Å; I416-L422 HydrophobicContact CG1-CD2 4.35Å; I416-L422 HydrophobicContact CG2-CD1 4.31Å; I416-L422 HydrophobicContact CG2-CD2 3.65Å; I416-L422 HydrophobicContact CG2-CG 3.63Å
417	R	72.2	Confident	85.9	Confident	222 Å²	222	68.4 Å²	68.4	84%	0.838	37%	0.371	S	S	*	.			trans	-59.2	-25.4	-174.8	-173	62.7	66.8	120.5	4.4	115.5	T415	T415-R417 PolarHBondContact O-N 3.23Å; T415-R417 VanDerWaalsContact O-N 3.11Å
418	S	77.9	Confident	85.7	Confident	42 Å²	42	76 Å²	76	29%	0.294	41%	0.405	S	S	.	.			trans	-114.9	113.2	-168.4	45.3	0	0	0	0	113.7	I416 S420 T421 L422	I416-S418 VanDerWaalsContact C-N 3.27Å; I416-S418 PolarHBondContact O-N 3.37Å; S418-S420 VanDerWaalsContact C-N 3.33Å; S418-S420 PolarHBondContact O-N 3.42Å; S418-T421 WeakPolarHBondContact CB-OG1 3.49Å; S418-T421 PolarHBondContact O-N 3.34Å; S418-T421 VanDerWaalsContact OG-CB 3.27Å; S418-T421 WeakPolarHBondContact OG-CB 3.36Å; S418-T421 PolarHBondContact OG-OG1 3.49Å; S418-L422 PolarHBondContact O-N 2.95Å
419	P	79.6	Confident	85.5	Confident	104 Å²	104	77.8 Å²	77.8	68%	0.675	42%	0.417	S	S	*	.	H	α-helix	trans	-70.9	-25.9	-177.9	28.2	-34.9	0	0	0	113.7	L422 C423	P419-L422 PolarHBondContact O-N 3.4Å; P419-C423 PolarHBondContact O-N 3.3Å
420	S	83.9	Confident	85.4	Confident	82 Å²	82	79.7 Å²	79.7	57%	0.573	43%	0.429	S	S	*	.	H	α-helix	trans	-65.1	-43.1	172.4	48.2	0	0	0	0	111.8	S418 C423 L424	S418-S420 VanDerWaalsContact C-N 3.33Å; S418-S420 PolarHBondContact O-N 3.42Å; S420-C423 PolarHBondContact O-N 3.38Å; S420-L424 PolarHBondContact O-N 3.1Å
421	T	81.1	Confident	85.4	Confident	64 Å²	64	83.4 Å²	83.4	39%	0.393	46%	0.455	S	S	.	.	H	α-helix	trans	-62.9	-44.7	175.6	-48.6	0	0	0	0	110.9	S418 C423 L424 T425	S418-T421 WeakPolarHBondContact CB-OG1 3.49Å; S418-T421 PolarHBondContact O-N 3.34Å; S418-T421 VanDerWaalsContact OG-CB 3.27Å; S418-T421 WeakPolarHBondContact OG-CB 3.36Å; S418-T421 PolarHBondContact OG-OG1 3.49Å; T421-C423 VanDerWaalsContact C-N 3.33Å; T421-C423 PolarHBondContact O-N 3.24Å; T421-L424 PolarHBondContact O-N 3.42Å; T421-L424 VanDerWaalsContact O-N 3.14Å; T421-T425 HydrophobicContact CG2-CG2 4.09Å; T421-T425 PolarHBondContact O-N 3.25Å; T421-T425 PolarHBondContact O-OG1 3.29Å; T421-T425 VanDerWaalsContact O-OG1 3.08Å
422	L	79.9	Confident	85.6	Confident	44 Å²	44	85.1 Å²	85.1	23%	0.23	47%	0.47	C	S	.	.	H	α-helix	trans	-52.8	-48.1	174.7	-77.3	173.1	0	0	0	112.2	F413 I416 S418 P419 L424 T425 L426	F413-L422 HydrophobicContact CD1-CD1 4.35Å; I416-L422 HydrophobicContact CB-CD2 3.95Å; I416-L422 HydrophobicContact CB-CG 4.26Å; I416-L422 HydrophobicContact CD1-CD2 3.58Å; I416-L422 HydrophobicContact CG1-CD2 4.35Å; I416-L422 HydrophobicContact CG2-CD1 4.31Å; I416-L422 HydrophobicContact CG2-CD2 3.65Å; I416-L422 HydrophobicContact CG2-CG 3.63Å; S418-L422 PolarHBondContact O-N 2.95Å; P419-L422 PolarHBondContact O-N 3.4Å; L422-L424 VanDerWaalsContact C-N 3.25Å; L422-L424 PolarHBondContact O-N 3.22Å; L422-T425 PolarHBondContact O-N 2.7Å; L422-L426 WeakPolarHBondContact O-CB 3.44Å; L422-L426 PolarHBondContact O-N 2.89Å
423	C	83.7	Confident	85.9	Confident	97 Å²	97	83.9 Å²	83.9	66%	0.655	46%	0.464	S	S	*	.	H	α-helix	trans	-62.5	-32.3	-178.3	-167.6	0	0	0	0	113.1	P419 S420 T421 P427	P419-C423 PolarHBondContact O-N 3.3Å; S420-C423 PolarHBondContact O-N 3.38Å; T421-C423 VanDerWaalsContact C-N 3.33Å; T421-C423 PolarHBondContact O-N 3.24Å; C423-P427 WeakPolarHBondContact O-CD 3.38Å
424	L	86	Confident	86.1	Confident	144 Å²	144	82.9 Å²	82.9	75%	0.754	46%	0.459	S	S	*	.	H	α-helix	trans	-83.9	-35.1	179.9	-64.8	174.5	0	0	0	112.9	S420 T421 L422	S420-L424 PolarHBondContact O-N 3.1Å; T421-L424 PolarHBondContact O-N 3.42Å; T421-L424 VanDerWaalsContact O-N 3.14Å; L422-L424 VanDerWaalsContact C-N 3.25Å; L422-L424 PolarHBondContact O-N 3.22Å
425	T	86.3	Confident	86.5	Confident	58 Å²	58	82.9 Å²	82.9	36%	0.356	47%	0.47	S	S	.	.	H	α-helix	trans	-86.2	-28.8	-178.7	59.2	0	0	0	0	113.4	T421 L422 F428 V429	T421-T425 HydrophobicContact CG2-CG2 4.09Å; T421-T425 PolarHBondContact O-N 3.25Å; T421-T425 PolarHBondContact O-OG1 3.29Å; T421-T425 VanDerWaalsContact O-OG1 3.08Å; L422-T425 PolarHBondContact O-N 2.7Å; T425-F428 WeakPolarHBondContact O-CB 3.43Å; T425-F428 PolarHBondContact O-N 3.47Å; T425-F428 VanDerWaalsContact O-N 3.07Å; T425-V429 WeakPolarHBondContact O-CG2 3.22Å; T425-V429 PolarHBondContact O-N 3.15Å
426	L	87.2	Confident	86.9	Confident	103 Å²	103	85.4 Å²	85.4	54%	0.539	48%	0.484	S	S	.	.	H	α-helix	trans	-54.2	-44.2	-176.1	-179.8	66.8	0	0	0	114	L422 F428 V429 V430	L422-L426 WeakPolarHBondContact O-CB 3.44Å; L422-L426 PolarHBondContact O-N 2.89Å; L426-F428 VanDerWaalsContact C-N 3.32Å; L426-F428 PolarHBondContact O-N 2.94Å; L426-V429 PolarHBondContact O-N 2.96Å; L426-V430 HydrophobicContact CD1-CG2 3.89Å; L426-V430 HydrophobicContact CG-CG2 4.28Å; L426-V430 WeakPolarHBondContact O-CB 3.24Å; L426-V430 VanDerWaalsContact O-CG2 3.32Å; L426-V430 WeakPolarHBondContact O-CG2 3.27Å; L426-V430 PolarHBondContact O-N 3.13Å
427	P	88.3	Confident	87.4	Confident	86 Å²	86	82.8 Å²	82.8	56%	0.558	47%	0.471	S	S	*	.	H	α-helix	trans	-62.9	-37.1	177.7	-22.4	34.6	0	0	0	113	C423 S431	C423-P427 WeakPolarHBondContact O-CD 3.38Å; P427-S431 VanDerWaalsContact O-CB 3.32Å; P427-S431 WeakPolarHBondContact O-CB 3.33Å; P427-S431 PolarHBondContact O-N 3.49Å
428	F	91	Very high	88.4	Confident	159 Å²	159	75.7 Å²	75.7	70%	0.697	45%	0.452	S	S	*	.	H	α-helix	trans	-69.4	-43.9	176.5	-179.6	-98.8	0	0	0	111.4	T425 L426 S431 A432	T425-F428 WeakPolarHBondContact O-CB 3.43Å; T425-F428 PolarHBondContact O-N 3.47Å; T425-F428 VanDerWaalsContact O-N 3.07Å; L426-F428 VanDerWaalsContact C-N 3.32Å; L426-F428 PolarHBondContact O-N 2.94Å; F428-S431 PolarHBondContact O-N 3.21Å; F428-A432 WeakPolarHBondContact O-CB 3.47Å; F428-A432 PolarHBondContact O-N 3.24Å
429	V	91.2	Very high	89.2	Confident	67 Å²	67	76.2 Å²	76.2	41%	0.406	46%	0.459	S	S	.	.	H	α-helix	trans	-62.5	-44.9	176.3	173.2	0	0	0	0	111.3	T425 L426 S431 A432 L433	T425-V429 WeakPolarHBondContact O-CG2 3.22Å; T425-V429 PolarHBondContact O-N 3.15Å; L426-V429 PolarHBondContact O-N 2.96Å; V429-S431 PolarHBondContact O-N 3.09Å; V429-A432 PolarHBondContact O-N 3.23Å; V429-L433 HydrophobicContact CG1-CD1 3.88Å; V429-L433 HydrophobicContact CG1-CG 4.33Å; V429-L433 WeakPolarHBondContact O-CB 3.29Å; V429-L433 VanDerWaalsContact O-CG 3.28Å; V429-L433 WeakPolarHBondContact O-CG 3.39Å; V429-L433 PolarHBondContact O-N 3.26Å
430	V	91	Very high	89.7	Confident	66 Å²	66	71.7 Å²	71.7	40%	0.4	43%	0.429	S	S	.	.	H	α-helix	trans	-63.8	-41	176.9	170.9	0	0	0	0	111.3	L426 L433 F434	L426-V430 HydrophobicContact CD1-CG2 3.89Å; L426-V430 HydrophobicContact CG-CG2 4.28Å; L426-V430 WeakPolarHBondContact O-CB 3.24Å; L426-V430 VanDerWaalsContact O-CG2 3.32Å; L426-V430 WeakPolarHBondContact O-CG2 3.27Å; L426-V430 PolarHBondContact O-N 3.13Å; V430-L433 PolarHBondContact O-N 3.49Å; V430-F434 WeakPolarHBondContact O-CB 3.39Å; V430-F434 PolarHBondContact O-N 2.98Å
431	S	92	Very high	90.1	Very high	79 Å²	79	70 Å²	70	55%	0.552	41%	0.414	S	S	*	.	H	α-helix	trans	-62.2	-44.6	174.5	-172.4	0	0	0	0	112	P427 F428 V429 F434 A435	P427-S431 VanDerWaalsContact O-CB 3.32Å; P427-S431 WeakPolarHBondContact O-CB 3.33Å; P427-S431 PolarHBondContact O-N 3.49Å; F428-S431 PolarHBondContact O-N 3.21Å; V429-S431 PolarHBondContact O-N 3.09Å; S431-F434 PolarHBondContact O-N 3.14Å; S431-A435 PolarHBondContact O-N 3.18Å
432	A	94.1	Very high	90.6	Very high	42 Å²	42	72.6 Å²	72.6	35%	0.347	43%	0.425	S	S	.	.	H	α-helix	trans	-63.7	-44.9	176.3	0	0	0	0	0	112.2	F428 V429 F434 A435 V436	F428-A432 WeakPolarHBondContact O-CB 3.47Å; F428-A432 PolarHBondContact O-N 3.24Å; V429-A432 PolarHBondContact O-N 3.23Å; A432-F434 VanDerWaalsContact C-N 3.3Å; A432-F434 PolarHBondContact O-N 3.21Å; A432-A435 PolarHBondContact O-N 3.02Å; A432-V436 WeakPolarHBondContact O-CG2 3.43Å; A432-V436 PolarHBondContact O-N 3.3Å
433	L	93.7	Very high	91.1	Very high	53 Å²	53	73.6 Å²	73.6	28%	0.277	43%	0.433	S	S	.	.	H	α-helix	trans	-62.6	-35.5	175.5	-70.5	171.5	0	0	0	112.1	L90 Y93 T94 V429 V430 K437	L90-L433 HydrophobicContact CD2-CB 4.48Å; L90-L433 HydrophobicContact CD2-CD2 3.8Å; Y93-L433 HydrophobicContact CG-CD1 4.44Å; T94-L433 HydrophobicContact CG2-CB 4.26Å; V429-L433 HydrophobicContact CG1-CD1 3.88Å; V429-L433 HydrophobicContact CG1-CG 4.33Å; V429-L433 WeakPolarHBondContact O-CB 3.29Å; V429-L433 VanDerWaalsContact O-CG 3.28Å; V429-L433 WeakPolarHBondContact O-CG 3.39Å; V429-L433 PolarHBondContact O-N 3.26Å; V430-L433 PolarHBondContact O-N 3.49Å; L433-K437 VanDerWaalsContact O-CB 3.29Å; L433-K437 WeakPolarHBondContact O-CB 3.31Å; L433-K437 PolarHBondContact O-N 3.24Å
434	F	93.6	Very high	91.4	Very high	90 Å²	90	69 Å²	69	40%	0.395	40%	0.402	S	S	.	.	H	α-helix	trans	-67.7	-43.9	173.3	-171.8	-93.7	0	0	0	112.1	T94 F95 V430 S431 A432 V436 K437 V438	T94-F434 HydrophobicContact CG2-CB 4.3Å; T94-F434 HydrophobicContact CG2-CD2 4.42Å; F95-F434 HydrophobicContact CE1-CE2 4.14Å; F95-F434 HydrophobicContact CZ-CE2 4.16Å; V430-F434 WeakPolarHBondContact O-CB 3.39Å; V430-F434 PolarHBondContact O-N 2.98Å; S431-F434 PolarHBondContact O-N 3.14Å; A432-F434 VanDerWaalsContact C-N 3.3Å; A432-F434 PolarHBondContact O-N 3.21Å; F434-V436 PolarHBondContact O-N 3.21Å; F434-K437 PolarHBondContact O-N 2.85Å; F434-V438 HydrophobicContact CD1-CG2 4.17Å; F434-V438 HydrophobicContact CE1-CG2 3.77Å; F434-V438 HydrophobicContact CZ-CG2 4.09Å; F434-V438 WeakPolarHBondContact O-CG2 3.33Å; F434-V438 PolarHBondContact O-N 2.74Å
435	A	94.7	Very high	91.6	Very high	60 Å²	60	64.4 Å²	64.4	50%	0.496	38%	0.377	S	S	.	.	H	α-helix	trans	-61.4	-43.3	175.2	0	0	0	0	0	111.9	S431 A432 V438 A439	S431-A435 PolarHBondContact O-N 3.18Å; A432-A435 PolarHBondContact O-N 3.02Å; A435-V438 PolarHBondContact O-N 2.94Å; A435-A439 PolarHBondContact O-N 2.83Å
436	V	94.8	Very high	91.8	Very high	70 Å²	70	65.5 Å²	65.5	42%	0.424	39%	0.387	S	S	.	.	H	α-helix	trans	-62.1	-45.2	173.3	175.1	0	0	0	0	110.6	L90 A432 F434 V438 A439 T440	L90-V436 HydrophobicContact CD1-CG1 3.81Å; A432-V436 WeakPolarHBondContact O-CG2 3.43Å; A432-V436 PolarHBondContact O-N 3.3Å; F434-V436 PolarHBondContact O-N 3.21Å; V436-V438 VanDerWaalsContact C-N 3.33Å; V436-V438 PolarHBondContact O-N 3.23Å; V436-A439 CarbonylContact O-C 3.58Å; V436-A439 WeakPolarHBondContact O-CA 3.5Å; V436-A439 WeakPolarHBondContact O-CB 3.32Å; V436-A439 PolarHBondContact O-N 3.5Å; V436-A439 VanDerWaalsContact O-N 3.08Å; V436-T440 HydrophobicContact CG1-CG2 4.13Å; V436-T440 WeakPolarHBondContact O-CG2 3.3Å; V436-T440 PolarHBondContact O-N 2.92Å; V436-T440 PolarHBondContact O-OG1 3.41Å
437	K	93.6	Very high	91.9	Very high	7 Å²	7	62 Å²	62	3%	0.03	37%	0.368	C	S	.	.	H	α-helix	trans	-59	-40.1	177.1	174.3	59.4	-171	174	0	113.2	D87 L90 T94 F95 L433 F434 T440 N441	D87-K437 PolarHBondContact O-NZ 2.87Å; D87-K437 IonicContact OD1-NZ 3.52Å; D87-K437 PolarHBondContact OD1-NZ 3.29Å; D87-K437 IonicContact OD2-NZ 2.7Å; D87-K437 PolarHBondContact OD2-NZ 3.45Å; L90-K437 HydrophobicContact CB-CB 4.09Å; L90-K437 HydrophobicContact CB-CD 3.72Å; L90-K437 HydrophobicContact CB-CG 4.33Å; L90-K437 HydrophobicContact CD1-CB 4.36Å; T94-K437 HydrophobicContact CG2-CB 4.03Å; T94-K437 HydrophobicContact CG2-CG 4.43Å; F95-K437 HydrophobicContact CD2-CG 4.27Å; F95-K437 HydrophobicContact CE2-CD 4.32Å; F95-K437 HydrophobicContact CE2-CG 3.75Å; L433-K437 VanDerWaalsContact O-CB 3.29Å; L433-K437 WeakPolarHBondContact O-CB 3.31Å; L433-K437 PolarHBondContact O-N 3.24Å; F434-K437 PolarHBondContact O-N 2.85Å; K437-T440 PolarHBondContact O-OG1 2.89Å; K437-T440 VanDerWaalsContact O-OG1 3.09Å; K437-N441 VanDerWaalsContact O-CB 3.28Å; K437-N441 WeakPolarHBondContact O-CB 3.44Å; K437-N441 PolarHBondContact O-N 3.04Å; K437-N441 VanDerWaalsContact O-N 3.08Å
438	V	93.1	Very high	91.9	Very high	73 Å²	73	57.9 Å²	57.9	44%	0.442	34%	0.341	S	S	.	.	H	α-helix	trans	-67.1	-39.5	175.6	172.9	0	0	0	0	110.4	F434 A435 V436 L442	F434-V438 HydrophobicContact CD1-CG2 4.17Å; F434-V438 HydrophobicContact CE1-CG2 3.77Å; F434-V438 HydrophobicContact CZ-CG2 4.09Å; F434-V438 WeakPolarHBondContact O-CG2 3.33Å; F434-V438 PolarHBondContact O-N 2.74Å; A435-V438 PolarHBondContact O-N 2.94Å; V436-V438 VanDerWaalsContact C-N 3.33Å; V436-V438 PolarHBondContact O-N 3.23Å; V438-L442 VanDerWaalsContact O-CB 3.23Å; V438-L442 WeakPolarHBondContact O-CB 3.28Å; V438-L442 PolarHBondContact O-N 2.97Å
439	A	93.4	Very high	91.8	Very high	52 Å²	52	57 Å²	57	43%	0.43	33%	0.334	S	S	.	.	H	α-helix	trans	-67.4	-44.5	175.9	0	0	0	0	0	113.4	A435 V436 L442 T443	A435-A439 PolarHBondContact O-N 2.83Å; V436-A439 CarbonylContact O-C 3.58Å; V436-A439 WeakPolarHBondContact O-CA 3.5Å; V436-A439 WeakPolarHBondContact O-CB 3.32Å; V436-A439 PolarHBondContact O-N 3.5Å; V436-A439 VanDerWaalsContact O-N 3.08Å; A439-L442 PolarHBondContact O-N 3.45Å; A439-T443 WeakPolarHBondContact O-CB 3.27Å; A439-T443 WeakPolarHBondContact O-CG2 3.35Å; A439-T443 PolarHBondContact O-N 3.18Å; A439-T443 PolarHBondContact O-OG1 2.89Å
440	T	92.1	Very high	91.7	Very high	9 Å²	9	56.1 Å²	56.1	6%	0.055	33%	0.331	C	S	.	.	H	α-helix	trans	-62.2	-46.2	176.8	58	0	0	0	0	110.9	L83 L86 D87 L90 V436 K437 L442 T443 L444	L83-T440 HydrophobicContact CD1-CG2 3.74Å; L86-T440 HydrophobicContact CD2-CG2 3.91Å; L86-T440 HydrophobicContact CG-CG2 4.3Å; D87-T440 PolarHBondContact OD1-OG1 3.26Å; L90-T440 HydrophobicContact CD1-CG2 3.94Å; V436-T440 HydrophobicContact CG1-CG2 4.13Å; V436-T440 WeakPolarHBondContact O-CG2 3.3Å; V436-T440 PolarHBondContact O-N 2.92Å; V436-T440 PolarHBondContact O-OG1 3.41Å; K437-T440 PolarHBondContact O-OG1 2.89Å; K437-T440 VanDerWaalsContact O-OG1 3.09Å; T440-L442 PolarHBondContact O-N 3.4Å; T440-T443 WeakPolarHBondContact CA-OG1 3.45Å; T440-T443 PolarHBondContact O-N 2.83Å; T440-T443 PolarHBondContact O-OG1 3.35Å; T440-L444 WeakPolarHBondContact O-CB 3.46Å; T440-L444 WeakPolarHBondContact O-CD1 3.21Å; T440-L444 VanDerWaalsContact O-CG 3.22Å; T440-L444 WeakPolarHBondContact O-CG 3.36Å; T440-L444 PolarHBondContact O-N 3.32Å
441	N	90.6	Very high	91.4	Very high	47 Å²	47	53.5 Å²	53.5	25%	0.251	32%	0.315	S	S	.	.	H	α-helix	trans	-65.8	-41.2	179.9	-174	-103.7	0	0	0	112.1	D87 K437 L444 M445	D87-N441 PolarHBondContact OD1-N 2.72Å; K437-N441 VanDerWaalsContact O-CB 3.28Å; K437-N441 WeakPolarHBondContact O-CB 3.44Å; K437-N441 PolarHBondContact O-N 3.04Å; K437-N441 VanDerWaalsContact O-N 3.08Å; N441-L444 PolarHBondContact O-N 3.34Å; N441-M445 WeakPolarHBondContact O-CB 3.34Å; N441-M445 VanDerWaalsContact O-CG 3.24Å; N441-M445 WeakPolarHBondContact O-CG 3.35Å; N441-M445 PolarHBondContact O-N 2.87Å
442	L	91.6	Very high	91.1	Very high	119 Å²	119	50.8 Å²	50.8	62%	0.623	29%	0.294	S	S	*	.	H	α-helix	trans	-64.6	-43.6	176.8	-179.7	59.8	0	0	0	112.5	V438 A439 T440 S446	V438-L442 VanDerWaalsContact O-CB 3.23Å; V438-L442 WeakPolarHBondContact O-CB 3.28Å; V438-L442 PolarHBondContact O-N 2.97Å; A439-L442 PolarHBondContact O-N 3.45Å; T440-L442 PolarHBondContact O-N 3.4Å; L442-S446 VanDerWaalsContact O-CB 3.27Å; L442-S446 WeakPolarHBondContact O-CB 3.29Å; L442-S446 PolarHBondContact O-N 3.07Å
443	T	91	Very high	90.8	Very high	65 Å²	65	55.4 Å²	55.4	40%	0.399	30%	0.302	S	S	.	.	H	α-helix	trans	-66.2	-44.2	176.9	49.6	0	0	0	0	111.6	A439 T440 M445 S446 M447	A439-T443 WeakPolarHBondContact O-CB 3.27Å; A439-T443 WeakPolarHBondContact O-CG2 3.35Å; A439-T443 PolarHBondContact O-N 3.18Å; A439-T443 PolarHBondContact O-OG1 2.89Å; T440-T443 WeakPolarHBondContact CA-OG1 3.45Å; T440-T443 PolarHBondContact O-N 2.83Å; T440-T443 PolarHBondContact O-OG1 3.35Å; T443-M445 PolarHBondContact O-N 2.93Å; T443-S446 PolarHBondContact O-N 3.31Å; T443-M447 WeakPolarHBondContact O-CB 3.38Å; T443-M447 VanDerWaalsContact O-CG 3.28Å; T443-M447 WeakPolarHBondContact O-CG 3.35Å; T443-M447 PolarHBondContact O-N 3.09Å
444	L	91	Very high	90.3	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-58.4	-45	174.5	-76.1	166.5	0	0	0	112.9	Y80 L83 Q84 D87 L377 T440 N441 A448	Y80-L444 HydrophobicContact CD2-CD2 3.75Å; Y80-L444 HydrophobicContact CE2-CD2 3.41Å; Y80-L444 VanDerWaalsContact CE2-CD2 3.41Å; L83-L444 HydrophobicContact CB-CD2 4.03Å; L83-L444 HydrophobicContact CD2-CD2 3.7Å; L83-L444 HydrophobicContact CD2-CG 3.75Å; L83-L444 HydrophobicContact CG-CD1 4.15Å; L83-L444 HydrophobicContact CG-CD2 3.7Å; L83-L444 HydrophobicContact CG-CG 3.72Å; Q84-L444 HydrophobicContact CB-CD2 4.36Å; D87-L444 HydrophobicContact CB-CD1 3.38Å; D87-L444 VanDerWaalsContact CG-CD1 3.48Å; L377-L444 HydrophobicContact CD2-CB 3.79Å; T440-L444 WeakPolarHBondContact O-CB 3.46Å; T440-L444 WeakPolarHBondContact O-CD1 3.21Å; T440-L444 VanDerWaalsContact O-CG 3.22Å; T440-L444 WeakPolarHBondContact O-CG 3.36Å; T440-L444 PolarHBondContact O-N 3.32Å; N441-L444 PolarHBondContact O-N 3.34Å; L444-A448 WeakPolarHBondContact O-CB 3.42Å; L444-A448 PolarHBondContact O-N 3.41Å
445	M	90.1	Very high	89.8	Confident	48 Å²	48	55.9 Å²	55.9	24%	0.236	30%	0.301	C	S	.	.	H	α-helix	trans	-68.7	-37.7	178.3	-71	-64.2	-73.7	0	0	112.3	L377 L378 H381 N441 T443 Y449	L377-M445 HydrophobicContact CD2-SD 4.03Å; L377-M445 HydrophobicContact CG-SD 3.92Å; L378-M445 HydrophobicContact CD2-CE 3.55Å; L378-M445 HydrophobicContact CD2-SD 3.79Å; H381-M445 HydrophobicContact CB-CE 3.94Å; H381-M445 VanDerWaalsContact CE1-SD 3.54Å; H381-M445 PolarHBondContact ND1-SD 3.15Å; H381-M445 VanDerWaalsContact ND1-SD 3.4Å; N441-M445 WeakPolarHBondContact O-CB 3.34Å; N441-M445 VanDerWaalsContact O-CG 3.24Å; N441-M445 WeakPolarHBondContact O-CG 3.35Å; N441-M445 PolarHBondContact O-N 2.87Å; T443-M445 PolarHBondContact O-N 2.93Å; M445-Y449 WeakPolarHBondContact O-CB 3.5Å; M445-Y449 PolarHBondContact O-N 2.94Å
446	S	90.6	Very high	89.3	Confident	81 Å²	81	57.7 Å²	57.7	57%	0.566	30%	0.301	S	S	*	.	H	α-helix	trans	-63.9	-47.6	174.5	-177.2	0	0	0	0	111.7	L442 T443 S450	L442-S446 VanDerWaalsContact O-CB 3.27Å; L442-S446 WeakPolarHBondContact O-CB 3.29Å; L442-S446 PolarHBondContact O-N 3.07Å; T443-S446 PolarHBondContact O-N 3.31Å; S446-S450 PolarHBondContact O-N 3.45Å; S446-S450 VanDerWaalsContact O-N 3.07Å
447	M	88.6	Confident	88.9	Confident	28 Å²	28	58.3 Å²	58.3	14%	0.138	30%	0.302	C	S	.	.	H	α-helix	trans	-62.2	-46.9	175.5	-70.8	174.5	71.6	0	0	111.6	L74 Y80 L83 T443 Y449 S450 H451	L74-M447 HydrophobicContact CD2-SD 4.23Å; L74-M447 WeakPolarHBondContact O-CE 3.22Å; Y80-M447 HydrophobicContact CD2-CB 4.29Å; Y80-M447 HydrophobicContact CD2-CE 3.78Å; Y80-M447 HydrophobicContact CD2-SD 4.2Å; Y80-M447 HydrophobicContact CE2-CB 4.11Å; Y80-M447 HydrophobicContact CG-CE 4.49Å; L83-M447 HydrophobicContact CD2-SD 4.35Å; T443-M447 WeakPolarHBondContact O-CB 3.38Å; T443-M447 VanDerWaalsContact O-CG 3.28Å; T443-M447 WeakPolarHBondContact O-CG 3.35Å; T443-M447 PolarHBondContact O-N 3.09Å; M447-Y449 VanDerWaalsContact C-N 3.34Å; M447-Y449 PolarHBondContact O-N 2.96Å; M447-S450 WeakPolarHBondContact O-CB 3.46Å; M447-S450 PolarHBondContact O-N 2.95Å; M447-S450 VanDerWaalsContact O-N 3.09Å; M447-H451 PolarHBondContact O-CD2 3.22Å; M447-H451 PolarHBondContact O-N 2.83Å
448	A	88.7	Confident	88.4	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-59	-44.6	-179.4	0	0	0	0	0	112.2	A374 L377 L378 L444 S450 I452	A374-A448 HydrophobicContact CB-CB 3.73Å; L377-A448 HydrophobicContact CD2-CB 4.29Å; L378-A448 HydrophobicContact CD2-CB 3.98Å; L378-A448 HydrophobicContact CG-CB 4.19Å; L444-A448 WeakPolarHBondContact O-CB 3.42Å; L444-A448 PolarHBondContact O-N 3.41Å; A448-S450 VanDerWaalsContact C-N 3.35Å; A448-S450 PolarHBondContact O-N 2.95Å; A448-I452 WeakPolarHBondContact O-CB 3.34Å; A448-I452 WeakPolarHBondContact O-CD1 3.43Å; A448-I452 WeakPolarHBondContact O-CG1 3.4Å; A448-I452 PolarHBondContact O-N 2.87Å; A448-I452 VanDerWaalsContact O-N 3.08Å
449	Y	89.1	Confident	87.7	Confident	141 Å²	141	58.9 Å²	58.9	55%	0.553	32%	0.316	S	S	*	.	H	α-helix	trans	-63.2	-39.6	174.6	-177.3	-99.1	0	0	0	112.3	M445 M447 R453	M445-Y449 WeakPolarHBondContact O-CB 3.5Å; M445-Y449 PolarHBondContact O-N 2.94Å; M447-Y449 VanDerWaalsContact C-N 3.34Å; M447-Y449 PolarHBondContact O-N 2.96Å; Y449-R453 WeakPolarHBondContact O-CB 3.46Å; Y449-R453 PolarHBondContact O-N 2.89Å
450	S	88.2	Confident	87.1	Confident	48 Å²	48	58.5 Å²	58.5	34%	0.336	31%	0.31	S	S	.	.	H	α-helix	trans	-63.2	-54	176.8	-153.2	0	0	0	0	111.6	S446 M447 A448 I452 R453 E454	S446-S450 PolarHBondContact O-N 3.45Å; S446-S450 VanDerWaalsContact O-N 3.07Å; M447-S450 WeakPolarHBondContact O-CB 3.46Å; M447-S450 PolarHBondContact O-N 2.95Å; M447-S450 VanDerWaalsContact O-N 3.09Å; A448-S450 VanDerWaalsContact C-N 3.35Å; A448-S450 PolarHBondContact O-N 2.95Å; S450-I452 PolarHBondContact O-N 2.89Å; S450-R453 PolarHBondContact O-N 3.09Å; S450-R453 VanDerWaalsContact O-N 3.16Å; S450-E454 WeakPolarHBondContact CB-OE1 3.41Å; S450-E454 WeakPolarHBondContact O-CB 3.17Å; S450-E454 VanDerWaalsContact O-CG 3.27Å; S450-E454 WeakPolarHBondContact O-CG 3.11Å; S450-E454 PolarHBondContact O-N 3.18Å; S450-E454 PolarHBondContact OG-OE1 2.84Å
451	H	85	Confident	86.5	Confident	12 Å²	12	61.2 Å²	61.2	6%	0.056	33%	0.327	C	S	.	.	H	α-helix	trans	-58.5	-43.8	-179.5	-74.9	-69.9	0	0	0	112.6	V371 M447 E454 Y455	V371-H451 HydrophobicContact CG2-CB 4.23Å; M447-H451 PolarHBondContact O-CD2 3.22Å; M447-H451 PolarHBondContact O-N 2.83Å; H451-E454 PolarHBondContact O-N 2.93Å; H451-Y455 WeakPolarHBondContact O-CB 3.45Å; H451-Y455 PolarHBondContact O-N 3.08Å
452	I	86.1	Confident	85.8	Confident	22 Å²	22	62.8 Å²	62.8	11%	0.113	34%	0.338	C	S	.	.	H	α-helix	trans	-69.2	-36.2	179	-68.2	163.3	0	0	0	111.4	V371 A374 Y375 L378 A448 S450 I456	V371-I452 HydrophobicContact CG1-CG1 4.4Å; A374-I452 HydrophobicContact CB-CD1 4.12Å; A374-I452 HydrophobicContact CB-CG1 4.29Å; Y375-I452 HydrophobicContact CD2-CD1 4.42Å; L378-I452 HydrophobicContact CD1-CD1 3.51Å; L378-I452 HydrophobicContact CG-CD1 3.88Å; A448-I452 WeakPolarHBondContact O-CB 3.34Å; A448-I452 WeakPolarHBondContact O-CD1 3.43Å; A448-I452 WeakPolarHBondContact O-CG1 3.4Å; A448-I452 PolarHBondContact O-N 2.87Å; A448-I452 VanDerWaalsContact O-N 3.08Å; S450-I452 PolarHBondContact O-N 2.89Å; I452-I456 HydrophobicContact CG2-CD1 3.73Å; I452-I456 HydrophobicContact CG2-CG1 4.4Å; I452-I456 WeakPolarHBondContact O-CB 3.33Å; I452-I456 VanDerWaalsContact O-CG1 3.23Å; I452-I456 WeakPolarHBondContact O-CG1 3.23Å; I452-I456 PolarHBondContact O-N 2.86Å
453	R	87.3	Confident	84.9	Confident	139 Å²	139	62 Å²	62	53%	0.525	33%	0.331	S	S	.	.	H	α-helix	trans	-69.3	-41.4	175.4	-173.6	176.4	-178.2	-170.6	-0.2	112	Y449 S450 I456 N457	Y449-R453 WeakPolarHBondContact O-CB 3.46Å; Y449-R453 PolarHBondContact O-N 2.89Å; S450-R453 PolarHBondContact O-N 3.09Å; S450-R453 VanDerWaalsContact O-N 3.16Å; R453-I456 PolarHBondContact O-N 3.03Å; R453-N457 WeakPolarHBondContact O-CB 3.21Å; R453-N457 PolarHBondContact O-N 3.3Å; R453-N457 PolarHBondContact O-ND2 3.09Å; R453-N457 PolarHBondContact O-OD1 3.15Å
454	E	83.9	Confident	83.8	Confident	65 Å²	65	64.9 Å²	64.9	30%	0.304	34%	0.34	S	S	.	.	H	α-helix	trans	-59.6	-46.5	174.1	-72.5	165.2	-124.1	0	0	110.5	R75 S450 H451 N457 A458	R75-E454 IonicContact CZ-OE1 2.69Å; R75-E454 IonicContact CZ-OE2 3.35Å; R75-E454 IonicContact NE-OE2 2.77Å; R75-E454 IonicContact NH2-OE1 3.82Å; R75-E454 PolarHBondContact NH2-OE1 3.35Å; R75-E454 IonicContact NH2-OE2 2.68Å; R75-E454 PolarHBondContact NH2-OE2 2.86Å; S450-E454 WeakPolarHBondContact CB-OE1 3.41Å; S450-E454 WeakPolarHBondContact O-CB 3.17Å; S450-E454 VanDerWaalsContact O-CG 3.27Å; S450-E454 WeakPolarHBondContact O-CG 3.11Å; S450-E454 PolarHBondContact O-N 3.18Å; S450-E454 PolarHBondContact OG-OE1 2.84Å; H451-E454 PolarHBondContact O-N 2.93Å; E454-N457 PolarHBondContact O-N 2.65Å; E454-A458 PolarHBondContact O-N 3.2Å
455	Y	82.5	Confident	82.6	Confident	87 Å²	87	70 Å²	70	34%	0.341	37%	0.368	S	S	.	.	H	α-helix	trans	-63	-46.2	175.7	-177.7	-98.7	0	0	0	113.6	V371 H451 N457 A458 A459 F508	V371-Y455 HydrophobicContact CG1-CD1 4.13Å; V371-Y455 HydrophobicContact CG1-CD2 4.33Å; V371-Y455 HydrophobicContact CG1-CG 3.93Å; V371-Y455 HydrophobicContact CG2-CD2 4.39Å; V371-Y455 HydrophobicContact CG2-CG 4.37Å; H451-Y455 WeakPolarHBondContact O-CB 3.45Å; H451-Y455 PolarHBondContact O-N 3.08Å; Y455-N457 VanDerWaalsContact C-N 3.33Å; Y455-N457 PolarHBondContact O-N 3.49Å; Y455-A458 PolarHBondContact O-N 3.3Å; Y455-A459 WeakPolarHBondContact O-CB 3.2Å; Y455-A459 PolarHBondContact O-N 2.78Å; Y455-F508 WeakPolarHBondContact OH-CE2 3.16Å; Y455-F508 WeakPolarHBondContact OH-CZ 3.37Å
456	I	85.1	Confident	81.3	Confident	99 Å²	99	73.3 Å²	73.3	51%	0.508	38%	0.383	S	S	.	.	H	α-helix	trans	-62.9	-41	177.1	-72.6	168.1	0	0	0	111	I452 R453 A459 S460	I452-I456 HydrophobicContact CG2-CD1 3.73Å; I452-I456 HydrophobicContact CG2-CG1 4.4Å; I452-I456 WeakPolarHBondContact O-CB 3.33Å; I452-I456 VanDerWaalsContact O-CG1 3.23Å; I452-I456 WeakPolarHBondContact O-CG1 3.23Å; I452-I456 PolarHBondContact O-N 2.86Å; R453-I456 PolarHBondContact O-N 3.03Å; I456-A459 PolarHBondContact O-N 3.49Å; I456-S460 WeakPolarHBondContact O-CB 3.37Å; I456-S460 PolarHBondContact O-N 3.32Å; I456-S460 PolarHBondContact O-OG 3.3Å
457	N	86.3	Confident	80.1	Confident	82 Å²	82	73.9 Å²	73.9	44%	0.439	38%	0.379	S	S	.	.	H	α-helix	trans	-60.5	-49.9	175.7	-70.2	-11.1	0	0	0	110.5	R453 E454 Y455 A459 S460 T461	R453-N457 WeakPolarHBondContact O-CB 3.21Å; R453-N457 PolarHBondContact O-N 3.3Å; R453-N457 PolarHBondContact O-ND2 3.09Å; R453-N457 PolarHBondContact O-OD1 3.15Å; E454-N457 PolarHBondContact O-N 2.65Å; Y455-N457 VanDerWaalsContact C-N 3.33Å; Y455-N457 PolarHBondContact O-N 3.49Å; N457-A459 PolarHBondContact O-N 3.48Å; N457-S460 PolarHBondContact O-N 2.92Å; N457-S460 PolarHBondContact O-OG 3.15Å; N457-T461 PolarHBondContact O-N 2.9Å; N457-T461 PolarHBondContact O-OG1 3.5Å
458	A	81.4	Confident	78.6	Confident	51 Å²	51	76.1 Å²	76.1	42%	0.421	40%	0.397	S	S	.	.	H	α-helix	trans	-61.1	-41	179.3	0	0	0	0	0	112.9	E454 Y455 S460 T461 V462	E454-A458 PolarHBondContact O-N 3.2Å; Y455-A458 PolarHBondContact O-N 3.3Å; A458-S460 VanDerWaalsContact C-N 3.29Å; A458-S460 PolarHBondContact O-N 2.97Å; A458-T461 PolarHBondContact O-N 2.96Å; A458-T461 PolarHBondContact O-OG1 2.78Å; A458-V462 WeakPolarHBondContact O-CG2 3.42Å; A458-V462 PolarHBondContact O-N 2.91Å
459	A	80	Confident	77.1	Confident	42 Å²	42	79.2 Å²	79.2	35%	0.347	42%	0.418	S	S	.	.	H	α-helix	trans	-63.3	-36.2	173.3	0	0	0	0	0	112.1	Y455 I456 N457 Q463	Y455-A459 WeakPolarHBondContact O-CB 3.2Å; Y455-A459 PolarHBondContact O-N 2.78Å; I456-A459 PolarHBondContact O-N 3.49Å; N457-A459 PolarHBondContact O-N 3.48Å; A459-Q463 WeakPolarHBondContact O-CG 3.41Å; A459-Q463 PolarHBondContact O-N 3.2Å
460	S	80.3	Confident	75.5	Confident	43 Å²	43	76.9 Å²	76.9	30%	0.301	42%	0.415	S	S	.	.	H	α-helix	trans	-74	-32.1	178.4	75.7	0	0	0	0	113.7	I456 N457 A458 Q463 Q464	I456-S460 WeakPolarHBondContact O-CB 3.37Å; I456-S460 PolarHBondContact O-N 3.32Å; I456-S460 PolarHBondContact O-OG 3.3Å; N457-S460 PolarHBondContact O-N 2.92Å; N457-S460 PolarHBondContact O-OG 3.15Å; A458-S460 VanDerWaalsContact C-N 3.29Å; A458-S460 PolarHBondContact O-N 2.97Å; S460-Q463 PolarHBondContact O-N 2.8Å; S460-Q464 WeakPolarHBondContact O-CG 3.27Å; S460-Q464 PolarHBondContact O-N 3.32Å
461	T	78.8	Confident	73.8	Confident	67 Å²	67	78.2 Å²	78.2	41%	0.411	42%	0.418	S	S	.	.	H	α-helix	trans	-70.7	-42.7	175.6	49.5	0	0	0	0	111.2	N457 A458 Q463 Q464 D465	N457-T461 PolarHBondContact O-N 2.9Å; N457-T461 PolarHBondContact O-OG1 3.5Å; A458-T461 PolarHBondContact O-N 2.96Å; A458-T461 PolarHBondContact O-OG1 2.78Å; T461-Q463 VanDerWaalsContact C-N 3.27Å; T461-Q463 PolarHBondContact O-N 3.4Å; T461-Q464 WeakPolarHBondContact O-CA 3.36Å; T461-Q464 WeakPolarHBondContact O-CB 3.46Å; T461-Q464 PolarHBondContact O-N 3.09Å; T461-D465 PolarHBondContact O-N 3.07Å
462	V	77.2	Confident	72.1	Confident	80 Å²	80	82.9 Å²	82.9	49%	0.485	44%	0.443	S	S	.	.	H	α-helix	trans	-58	-41.8	174	174	0	0	0	0	111.1	A458 Q464 D465 E466	A458-V462 WeakPolarHBondContact O-CG2 3.42Å; A458-V462 PolarHBondContact O-N 2.91Å; V462-Q464 VanDerWaalsContact C-N 3.31Å; V462-Q464 PolarHBondContact O-N 3.08Å; V462-D465 PolarHBondContact O-N 3.36Å; V462-E466 WeakPolarHBondContact O-CG 3.08Å; V462-E466 PolarHBondContact O-N 3.46Å
463	Q	70.9	Confident	70.4	Confident	103 Å²	103	87.4 Å²	87.4	48%	0.481	47%	0.468	S	S	.	.	H	α-helix	trans	-65.7	-29.6	173.9	-72.9	178.1	0.3	0	0	113.4	A459 S460 T461 N467	A459-Q463 WeakPolarHBondContact O-CG 3.41Å; A459-Q463 PolarHBondContact O-N 3.2Å; S460-Q463 PolarHBondContact O-N 2.8Å; T461-Q463 VanDerWaalsContact C-N 3.27Å; T461-Q463 PolarHBondContact O-N 3.4Å; Q463-N467 WeakPolarHBondContact O-CB 3.39Å; Q463-N467 PolarHBondContact O-N 2.75Å; Q463-N467 PolarHBondContact O-ND2 2.94Å
464	Q	68.1	Low	68.5	Low	124 Å²	124	86 Å²	86	58%	0.579	47%	0.466	S	S	*	.	H	α-helix	trans	-74.2	-43	174.5	-74.3	173.5	10.4	0	0	111.3	S460 T461 V462 E466 N467 C468	S460-Q464 WeakPolarHBondContact O-CG 3.27Å; S460-Q464 PolarHBondContact O-N 3.32Å; T461-Q464 WeakPolarHBondContact O-CA 3.36Å; T461-Q464 WeakPolarHBondContact O-CB 3.46Å; T461-Q464 PolarHBondContact O-N 3.09Å; V462-Q464 VanDerWaalsContact C-N 3.31Å; V462-Q464 PolarHBondContact O-N 3.08Å; Q464-E466 PolarHBondContact O-N 3.34Å; Q464-N467 PolarHBondContact O-N 2.96Å; Q464-N467 VanDerWaalsContact O-N 3.14Å; Q464-C468 WeakPolarHBondContact O-CB 3.3Å; Q464-C468 PolarHBondContact O-N 3.02Å
465	D	67.1	Low	66.4	Low	109 Å²	109	86.8 Å²	86.8	58%	0.583	48%	0.475	S	S	*	.	H	α-helix	trans	-61.9	-43.9	177.8	-66	-37.5	0	0	0	111.7	T461 V462 N467 C468 S469	T461-D465 PolarHBondContact O-N 3.07Å; V462-D465 PolarHBondContact O-N 3.36Å; D465-N467 VanDerWaalsContact C-N 3.32Å; D465-N467 PolarHBondContact O-N 3.13Å; D465-C468 PolarHBondContact O-N 3.44Å; D465-S469 PolarHBondContact O-N 2.78Å; D465-S469 PolarHBondContact O-OG 2.77Å
466	E	62.4	Low	64.4	Low	117 Å²	117	86 Å²	86	55%	0.547	49%	0.486	S	S	.	.	H	α-helix	trans	-60.3	-36.8	172.5	-76.5	-173.1	179.2	0	0	113.1	V462 Q464 S469 L470	V462-E466 WeakPolarHBondContact O-CG 3.08Å; V462-E466 PolarHBondContact O-N 3.46Å; Q464-E466 PolarHBondContact O-N 3.34Å; E466-S469 PolarHBondContact O-OG 2.71Å; E466-S469 VanDerWaalsContact O-OG 3.1Å; E466-L470 VanDerWaalsContact O-CB 3.29Å; E466-L470 WeakPolarHBondContact O-CB 3.42Å; E466-L470 PolarHBondContact O-N 3.49Å
467	N	65.6	Low	62	Low	92 Å²	92	84.2 Å²	84.2	49%	0.492	49%	0.492	S	S	.	.	H	α-helix	trans	-75.6	-31.5	177	-82.8	-63.9	0	0	0	112.2	Q463 Q464 D465 N471	Q463-N467 WeakPolarHBondContact O-CB 3.39Å; Q463-N467 PolarHBondContact O-N 2.75Å; Q463-N467 PolarHBondContact O-ND2 2.94Å; Q464-N467 PolarHBondContact O-N 2.96Å; Q464-N467 VanDerWaalsContact O-N 3.14Å; D465-N467 VanDerWaalsContact C-N 3.32Å; D465-N467 PolarHBondContact O-N 3.13Å; N467-N471 WeakPolarHBondContact O-CB 3.31Å; N467-N471 PolarHBondContact O-N 2.75Å; N467-N471 VanDerWaalsContact O-N 3.17Å; N467-N471 PolarHBondContact O-ND2 3.18Å; N467-N471 VanDerWaalsContact O-ND2 3.12Å
468	C	57	Low	59.7	Low	76 Å²	76	86.7 Å²	86.7	51%	0.514	50%	0.504	S	S	.	.	H	α-helix	trans	-71.3	-43.4	176.1	-83.9	0	0	0	0	112.3	Q464 D465 N471 N472	Q464-C468 WeakPolarHBondContact O-CB 3.3Å; Q464-C468 PolarHBondContact O-N 3.02Å; D465-C468 PolarHBondContact O-N 3.44Å; C468-N471 PolarHBondContact O-N 2.92Å; C468-N472 VanDerWaalsContact O-CG 3.3Å; C468-N472 PolarHBondContact O-N 3.24Å
469	S	56.2	Low	57.2	Low	64 Å²	64	93 Å²	93	45%	0.448	52%	0.522	S	S	.	.	H	α-helix	trans	-62	-51.2	174.5	56.6	0	0	0	0	111.5	D465 E466 N471 N472 D473	D465-S469 PolarHBondContact O-N 2.78Å; D465-S469 PolarHBondContact O-OG 2.77Å; E466-S469 PolarHBondContact O-OG 2.71Å; E466-S469 VanDerWaalsContact O-OG 3.1Å; S469-N471 PolarHBondContact O-N 2.59Å; S469-N471 VanDerWaalsContact O-N 3.09Å; S469-N472 PolarHBondContact O-N 3.4Å; S469-D473 PolarHBondContact O-N 3.39Å
470	L	56.3	Low	54.9	Low	93 Å²	93	96 Å²	96	49%	0.487	54%	0.537	S	S	.	.	H	α-helix	trans	-60.2	-23.9	178.7	-164.6	91.5	0	0	0	113.6	E466 K474	E466-L470 VanDerWaalsContact O-CB 3.29Å; E466-L470 WeakPolarHBondContact O-CB 3.42Å; E466-L470 PolarHBondContact O-N 3.49Å; L470-K474 WeakPolarHBondContact O-CD 3.38Å; L470-K474 WeakPolarHBondContact O-CE 3.36Å; L470-K474 WeakPolarHBondContact O-CG 3.45Å
471	N	52	Low	52.4	Low	75 Å²	75	100.4 Å²	100.4	40%	0.401	56%	0.562	S	S	.	*	H	α-helix	trans	-88.4	-31.4	174.5	-74	-22.4	0	0	0	112.9	N467 C468 S469 K474 T475	N467-N471 WeakPolarHBondContact O-CB 3.31Å; N467-N471 PolarHBondContact O-N 2.75Å; N467-N471 VanDerWaalsContact O-N 3.17Å; N467-N471 PolarHBondContact O-ND2 3.18Å; N467-N471 VanDerWaalsContact O-ND2 3.12Å; C468-N471 PolarHBondContact O-N 2.92Å; S469-N471 PolarHBondContact O-N 2.59Å; S469-N471 VanDerWaalsContact O-N 3.09Å; N471-K474 PolarHBondContact O-N 3.46Å; N471-K474 PolarHBondContact OD1-NZ 3Å; N471-T475 WeakPolarHBondContact O-CB 3.5Å; N471-T475 PolarHBondContact O-N 3.46Å; N471-T475 PolarHBondContact O-OG1 3.47Å
472	N	49.8	Very low	49.7	Very low	110 Å²	110	103.9 Å²	103.9	59%	0.588	58%	0.583	S	S	*	*	H	α-helix	trans	-63.6	-42.4	172.1	-74.4	-16	0	0	0	111.4	C468 S469 K474 T475 A476	C468-N472 VanDerWaalsContact O-CG 3.3Å; C468-N472 PolarHBondContact O-N 3.24Å; S469-N472 PolarHBondContact O-N 3.4Å; N472-K474 VanDerWaalsContact C-N 3.35Å; N472-K474 PolarHBondContact O-N 3.16Å; N472-T475 PolarHBondContact O-N 2.84Å; N472-T475 VanDerWaalsContact O-N 3.08Å; N472-A476 WeakPolarHBondContact O-CB 3.08Å; N472-A476 PolarHBondContact O-N 3.45Å
473	D	50.4	Low	47.4	Very low	117 Å²	117	109 Å²	109	63%	0.626	60%	0.602	S	S	*	*	H	α-helix	trans	-59.2	-43.5	176.8	-65.2	-27.3	0	0	0	112.2	S469 T475 G477	S469-D473 PolarHBondContact O-N 3.39Å; D473-T475 VanDerWaalsContact C-N 3.32Å; D473-T475 PolarHBondContact O-N 3.33Å; D473-G477 PolarHBondContact O-N 2.93Å
474	K	47	Very low	45.1	Very low	111 Å²	111	113.8 Å²	113.8	48%	0.483	62%	0.621	S	S	.	*	H	α-helix	trans	-63.7	-37.1	174.6	-65.2	167.7	-159.8	156.7	0	112.3	L470 N471 N472 G477	L470-K474 WeakPolarHBondContact O-CD 3.38Å; L470-K474 WeakPolarHBondContact O-CE 3.36Å; L470-K474 WeakPolarHBondContact O-CG 3.45Å; N471-K474 PolarHBondContact O-N 3.46Å; N471-K474 PolarHBondContact OD1-NZ 3Å; N472-K474 VanDerWaalsContact C-N 3.35Å; N472-K474 PolarHBondContact O-N 3.16Å; K474-G477 PolarHBondContact O-N 3.05Å
475	T	40.9	Very low	43	Very low	81 Å²	81	111.5 Å²	111.5	50%	0.497	63%	0.631	S	S	.	*	H	α-helix	trans	-76.7	-38.1	-175.5	-52.7	0	0	0	0	111.1	N471 N472 D473 G477 I478	N471-T475 WeakPolarHBondContact O-CB 3.5Å; N471-T475 PolarHBondContact O-N 3.46Å; N471-T475 PolarHBondContact O-OG1 3.47Å; N472-T475 PolarHBondContact O-N 2.84Å; N472-T475 VanDerWaalsContact O-N 3.08Å; D473-T475 VanDerWaalsContact C-N 3.32Å; D473-T475 PolarHBondContact O-N 3.33Å; T475-G477 VanDerWaalsContact C-N 3.26Å; T475-G477 PolarHBondContact O-N 2.93Å; T475-I478 PolarHBondContact O-N 3.43Å
476	A	38.9	Very low	40.8	Very low	70 Å²	70	114.7 Å²	114.7	58%	0.579	65%	0.648	S	S	*	*	H	α-helix	trans	-58.3	-38.9	170.9	0	0	0	0	0	111.8	N472 I478	N472-A476 WeakPolarHBondContact O-CB 3.08Å; N472-A476 PolarHBondContact O-N 3.45Å; A476-I478 PolarHBondContact O-N 2.96Å
477	G	35.6	Very low	39.1	Very low	61 Å²	61	115.2 Å²	115.2	63%	0.629	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	-5.9	177.1	0	0	0	0	0	116.5	D473 K474 T475	D473-G477 PolarHBondContact O-N 2.93Å; K474-G477 PolarHBondContact O-N 3.05Å; T475-G477 VanDerWaalsContact C-N 3.26Å; T475-G477 PolarHBondContact O-N 2.93Å
478	I	38.8	Very low	37	Very low	134 Å²	134	120.9 Å²	120.9	69%	0.687	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	-19.5	-178.8	-68	171.5	0	0	0	112.2	T475 A476 T480	T475-I478 PolarHBondContact O-N 3.43Å; A476-I478 PolarHBondContact O-N 2.96Å; I478-T480 PolarHBondContact O-N 3.16Å
479	F	28.6	Very low	35.2	Very low	183 Å²	183	125.7 Å²	125.7	80%	0.803	69%	0.694	S	S	*	*			trans	-99.2	40.4	-174.4	-99.6	-85.2	0	0	0	115.1
480	T	30.1	Very low	33.7	Very low	107 Å²	107	128.3 Å²	128.3	66%	0.656	71%	0.709	S	S	*	*	S	Bend	trans	-120.1	97	169.8	56.2	0	0	0	0	112.9	I478	I478-T480 PolarHBondContact O-N 3.16Å
481	T	27.9	Very low	32.1	Very low	135 Å²	135	135.3 Å²	135.3	83%	0.828	73%	0.729	S	S	*	*			trans	50.5	111.3	152.8	49.9	0	0	0	0	119.4	E483	T481-E483 PolarHBondContact O-N 3.38Å
482	T	23.3	Very low	30.8	Very low	139 Å²	139	137.4 Å²	137.4	85%	0.853	75%	0.747	S	S	*	*			trans	-44.8	125.3	145.1	46.7	0	0	0	0	113
483	E	27.7	Very low	29.7	Very low	189 Å²	189	139.5 Å²	139.5	88%	0.883	76%	0.756	S	S	*	*			trans	-153.4	175.9	137.1	-126.4	-178.7	-176	0	0	112.7	T481	T481-E483 PolarHBondContact O-N 3.38Å
484	K	23.2	Very low	28.5	Very low	203 Å²	203	141.4 Å²	141.4	88%	0.883	77%	0.766	S	S	*	*			trans	-89	132.3	-159	-59.5	157.8	-174.6	160.3	0	112.3
485	G	24.5	Very low	27.6	Very low	76 Å²	76	139.9 Å²	139.9	78%	0.784	77%	0.769	S	S	*	*			trans	-170	109	171	0	0	0	0	0	114.9	V487	G485-V487 PolarHBondContact O-N 2.89Å
486	N	21.6	Very low	27.1	Very low	176 Å²	176	142 Å²	142	94%	0.941	77%	0.774	S	S	*	*			trans	-80.8	94.7	175.9	-112.4	-13.8	0	0	0	111.3
487	V	24.7	Very low	26.4	Very low	127 Å²	127	147.6 Å²	147.6	77%	0.77	79%	0.785	S	S	*	*			trans	-142.5	137.2	156.4	-177	0	0	0	0	109.6	G485 Q489	G485-V487 PolarHBondContact O-N 2.89Å; V487-Q489 PolarHBondContact O-N 3.32Å
488	K	21.7	Very low	25.9	Very low	211 Å²	211	151.7 Å²	151.7	92%	0.917	79%	0.787	S	S	*	*			trans	-67.5	119	176.4	-61.8	174.8	-179.6	178.8	0	110.4
489	Q	20.9	Very low	25.4	Very low	177 Å²	177	151.6 Å²	151.6	83%	0.827	79%	0.787	S	S	*	*			trans	-109.1	155.1	166	-71.4	-165.7	-1.2	0	0	111.4	V487	V487-Q489 PolarHBondContact O-N 3.32Å
490	P	24.2	Very low	25.2	Very low	119 Å²	119	151.1 Å²	151.1	77%	0.773	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-82	150.5	-173.6	-1.7	20.5	0	0	0	112	P492	P490-P492 WeakPolarHBondContact O-CD 3.48Å
491	R	21.4	Very low	25	Very low	241 Å²	241	152.6 Å²	152.6	91%	0.909	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-68.1	120.9	165.5	-63.6	-177.7	-175.6	178.7	1.8	109
492	P	25.8	Very low	25	Very low	119 Å²	119	152.2 Å²	152.2	77%	0.773	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-69.6	146.9	170.6	29.7	-33.5	0	0	0	110.3	P490 L494	P490-P492 WeakPolarHBondContact O-CD 3.48Å; P492-L494 PolarHBondContact O-N 2.75Å; P492-L494 VanDerWaalsContact O-N 3.14Å
493	I	26.5	Very low	25.1	Very low	153 Å²	153	149.7 Å²	149.7	79%	0.785	77%	0.773	S	S	*	*			trans	-76.3	104.4	-173.5	-61.2	171.5	0	0	0	110.1	S495	I493-S495 WeakPolarHBondContact CG2-OG 3.29Å; I493-S495 PolarHBondContact O-N 2.87Å; I493-S495 VanDerWaalsContact O-N 3.13Å
494	L	25.9	Very low	25	Very low	158 Å²	158	152 Å²	152	83%	0.827	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	79.3	174	-173.1	76.7	0	0	0	110.3	P492	P492-L494 PolarHBondContact O-N 2.75Å; P492-L494 VanDerWaalsContact O-N 3.14Å
495	S	27.1	Very low	25	Very low	79 Å²	79	150.7 Å²	150.7	55%	0.552	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.7	-11.8	175.2	68.6	0	0	0	0	118.2	I493	I493-S495 WeakPolarHBondContact CG2-OG 3.29Å; I493-S495 PolarHBondContact O-N 2.87Å; I493-S495 VanDerWaalsContact O-N 3.13Å
496	E	30.2	Very low	25.3	Very low	126 Å²	126	151 Å²	151	59%	0.589	76%	0.756	S	S	*	*	S	Bend	trans	-107.9	-16.3	-178.4	-144.6	-165.1	133.5	0	0	115.2	R500	E496-R500 IonicContact OE1-CZ 3.76Å; E496-R500 IonicContact OE1-NE 2.74Å; E496-R500 IonicContact OE1-NH2 2.78Å; E496-R500 PolarHBondContact OE1-NH2 3.24Å
497	K	25.8	Very low	25.7	Very low	186 Å²	186	147.1 Å²	147.1	81%	0.809	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-28.7	-171.8	-137	170.8	-173.3	177.1	0	114.5
498	E	25.1	Very low	26.3	Very low	147 Å²	147	145 Å²	145	69%	0.687	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-33	177.7	-70.9	-172.5	114.6	0	0	113.1	R500 I501	E498-R500 PolarHBondContact O-N 2.97Å; E498-I501 PolarHBondContact O-N 2.8Å
499	I	27.1	Very low	26.4	Very low	132 Å²	132	136.1 Å²	136.1	68%	0.677	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-26.8	-175.5	-63.3	177.1	0	0	0	112.2
500	R	23.8	Very low	26.9	Very low	173 Å²	173	133.6 Å²	133.6	65%	0.653	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-16.4	-179.3	-60.9	-164.7	-167.5	-158	6	114.8	E496 E498 S502 S503	E496-R500 IonicContact OE1-CZ 3.76Å; E496-R500 IonicContact OE1-NE 2.74Å; E496-R500 IonicContact OE1-NH2 2.78Å; E496-R500 PolarHBondContact OE1-NH2 3.24Å; E498-R500 PolarHBondContact O-N 2.97Å; R500-S502 PolarHBondContact O-N 3.23Å; R500-S503 PolarHBondContact O-N 3.11Å
501	I	27.6	Very low	27	Very low	139 Å²	139	133.4 Å²	133.4	71%	0.713	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-68.2	-25	-175.6	-61.6	178.1	0	0	0	111.6	E498 S503	E498-I501 PolarHBondContact O-N 2.8Å; I501-S503 PolarHBondContact O-N 3.28Å
502	S	27.2	Very low	27.3	Very low	127 Å²	127	124.9 Å²	124.9	89%	0.888	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-77.7	5.1	177.5	-153.4	0	0	0	0	114.8	R500	R500-S502 PolarHBondContact O-N 3.23Å
503	S	25.5	Very low	27.4	Very low	86 Å²	86	125.1 Å²	125.1	60%	0.601	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-119.3	-13.6	-165	-152.3	0	0	0	0	116.6	R500 I501 K505	R500-S503 PolarHBondContact O-N 3.11Å; I501-S503 PolarHBondContact O-N 3.28Å; S503-K505 VanDerWaalsContact C-N 3.29Å; S503-K505 PolarHBondContact O-N 2.9Å
504	R	26.3	Very low	27.4	Very low	236 Å²	236	124 Å²	124	89%	0.891	64%	0.643	S	S	*	*			trans	-74.1	84.8	172.4	-80.5	-168.3	174	-170.5	-1.5	110.2
505	K	23.2	Very low	27.4	Very low	177 Å²	177	124.6 Å²	124.6	77%	0.77	64%	0.641	S	S	*	*			trans	-55.9	145.2	169.2	-60.7	169.5	-174.3	171.3	0	109.2	S503	S503-K505 VanDerWaalsContact C-N 3.29Å; S503-K505 PolarHBondContact O-N 2.9Å
506	P	29.8	Very low	27.6	Very low	82 Å²	82	127.1 Å²	127.1	53%	0.532	66%	0.656	S	S	.	*			trans	-57.3	159.4	160.6	28.6	-34.6	0	0	0	109.7
507	P	30.5	Very low	27.4	Very low	95 Å²	95	125.5 Å²	125.5	62%	0.617	65%	0.654	S	S	*	*	S	Bend	trans	-64.2	-169.1	-176.8	25.1	-33.2	0	0	0	112.6
508	F	36	Very low	27.4	Very low	81 Å²	81	127.1 Å²	127.1	36%	0.355	66%	0.655	S	S	.	*			trans	79.8	160	-173.7	-55.1	-118.8	0	0	0	111.6	Y455 F523 L524	Y455-F508 WeakPolarHBondContact OH-CE2 3.16Å; Y455-F508 WeakPolarHBondContact OH-CZ 3.37Å; F508-F523 HydrophobicContact CB-CB 4.09Å; F508-F523 HydrophobicContact CD1-CB 3.4Å; F508-F523 WeakPolarHBondContact CD1-O 3.36Å; F508-F523 HydrophobicContact CE1-CB 4.14Å; F508-F523 HydrophobicContact CG-CB 4.06Å; F508-L524 VanDerWaalsContact CB-CA 3.49Å; F508-L524 HydrophobicContact CB-CB 3.93Å; F508-L524 HydrophobicContact CB-CD2 4Å; F508-L524 HydrophobicContact CB-CG 3.66Å; F508-L524 WeakPolarHBondContact O-CD1 3.36Å; F508-L524 WeakPolarHBondContact O-CG 3.29Å
509	G	25.4	Very low	27.5	Very low	26 Å²	26	126.1 Å²	126.1	27%	0.268	66%	0.655	S	S	.	*			trans	-170.9	94.4	-177	0	0	0	0	0	113.5	C522 F523 L524	G509-C522 CarbonylContact O-C 3.53Å; G509-C522 WeakPolarHBondContact O-CA 3.47Å; G509-C522 WeakPolarHBondContact O-CB 3.43Å; G509-F523 PolarHBondContact O-N 2.88Å; G509-F523 VanDerWaalsContact O-N 3.13Å; G509-L524 VanDerWaalsContact CA-CB 3.49Å; G509-L524 VanDerWaalsContact N-CB 3.25Å
510	F	30.2	Very low	27.6	Very low	124 Å²	124	126 Å²	126	54%	0.544	65%	0.652	S	S	.	*			trans	-159.4	153.2	-173.8	-168.3	-94.4	0	0	0	113.6	L524	F510-L524 CarbonylContact C-O 3.58Å; F510-L524 WeakPolarHBondContact CB-O 3.39Å
511	T	27.4	Very low	27.8	Very low	115 Å²	115	124.8 Å²	124.8	71%	0.706	66%	0.658	S	S	*	*			trans	-145.6	155.5	168	46	0	0	0	0	107.5
512	G	26.9	Very low	27.9	Very low	61 Å²	61	122 Å²	122	63%	0.629	65%	0.649	S	S	*	*	S	Bend	trans	-61.3	150.4	-168.2	0	0	0	0	0	116.3
513	Y	27.5	Very low	28	Very low	124 Å²	124	119.9 Å²	119.9	49%	0.486	63%	0.625	S	S	.	*	S	Bend	trans	72.9	126.6	176	-72.3	-105.9	0	0	0	118.2	L392 R395	L392-Y513 HydrophobicContact CD2-CE2 4.21Å; R395-Y513 VanDerWaalsContact CZ-CE1 3.5Å; R395-Y513 VanDerWaalsContact CZ-CZ 3.47Å; R395-Y513 VanDerWaalsContact CZ-OH 3.31Å; R395-Y513 PolarHBondContact NE-OH 2.86Å; R395-Y513 PolarHBondContact NH2-OH 2.92Å
514	D	28.1	Very low	28.5	Very low	131 Å²	131	118.2 Å²	118.2	70%	0.701	61%	0.609	S	S	*	*			trans	51.9	80.4	140.9	-49.8	-12.3	0	0	0	120.1
515	Q	24.8	Very low	29	Very low	169 Å²	169	109.3 Å²	109.3	79%	0.79	58%	0.582	S	S	*	*			trans	-152.1	102.7	150	-114.9	178.1	10.6	0	0	113	T517	Q515-T517 WeakPolarHBondContact CG-OG1 3.18Å; Q515-T517 PolarHBondContact O-N 3.36Å; Q515-T517 VanDerWaalsContact O-N 3.16Å
516	P	32.3	Very low	29.1	Very low	133 Å²	133	107 Å²	107	86%	0.864	58%	0.582	S	S	*	*			trans	-86.2	51.1	170.5	36.2	-34.7	0	0	0	111.2
517	T	25.2	Very low	29	Very low	92 Å²	92	105.6 Å²	105.6	56%	0.564	58%	0.583	S	S	*	*			trans	-133.5	97.1	-175.4	51.3	0	0	0	0	112.8	Q515	Q515-T517 WeakPolarHBondContact CG-OG1 3.18Å; Q515-T517 PolarHBondContact O-N 3.36Å; Q515-T517 VanDerWaalsContact O-N 3.16Å
518	R	26.3	Very low	28.8	Very low	219 Å²	219	108.7 Å²	108.7	83%	0.826	59%	0.593	S	S	*	*	S	Bend	trans	42.7	89	148.1	-157.5	-163.2	85	-175	6.4	116.9
519	D	26.6	Very low	28.2	Very low	127 Å²	127	116.2 Å²	116.2	68%	0.679	62%	0.619	S	S	*	*				-172.1	133.3	118.2	-77.9	-21.2	0	0	0	107	D521	D519-D521 PolarHBondContact O-N 2.95Å
520	E	29.9	Very low	28.1	Very low	130 Å²	130	125 Å²	125	61%	0.607	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-2	-160.1	-79.9	-89.8	145.2	0	0	116.2
521	D	28.1	Very low	27.7	Very low	147 Å²	147	129.5 Å²	129.5	79%	0.786	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.9	23.8	-163.5	-65	-61.9	0	0	0	116.2	D519	D519-D521 PolarHBondContact O-N 2.95Å
522	C	28.1	Very low	27.3	Very low	79 Å²	79	132.1 Å²	132.1	53%	0.534	66%	0.661	S	S	.	*			trans	-138.2	112.2	-166.6	-93.8	0	0	0	0	117	G509	G509-C522 CarbonylContact O-C 3.53Å; G509-C522 WeakPolarHBondContact O-CA 3.47Å; G509-C522 WeakPolarHBondContact O-CB 3.43Å
523	F	29	Very low	27.1	Very low	84 Å²	84	137.8 Å²	137.8	37%	0.368	67%	0.669	S	S	.	*			trans	-144.1	21.7	-177.9	-61.5	-95.7	0	0	0	121.4	T292 F508 G509	T292-F523 HydrophobicContact CG2-CE1 3.6Å; T292-F523 HydrophobicContact CG2-CZ 3.96Å; F508-F523 HydrophobicContact CB-CB 4.09Å; F508-F523 HydrophobicContact CD1-CB 3.4Å; F508-F523 WeakPolarHBondContact CD1-O 3.36Å; F508-F523 HydrophobicContact CE1-CB 4.14Å; F508-F523 HydrophobicContact CG-CB 4.06Å; G509-F523 PolarHBondContact O-N 2.88Å; G509-F523 VanDerWaalsContact O-N 3.13Å
524	L	37.9	Very low	26.8	Very low	50 Å²	50	140.5 Å²	140.5	26%	0.262	68%	0.683	S	S	.	*			trans	-81.4	167	-157.1	-112.9	-177.9	0	0	0	117.7	F508 G509 F510	F508-L524 VanDerWaalsContact CB-CA 3.49Å; F508-L524 HydrophobicContact CB-CB 3.93Å; F508-L524 HydrophobicContact CB-CD2 4Å; F508-L524 HydrophobicContact CB-CG 3.66Å; F508-L524 WeakPolarHBondContact O-CD1 3.36Å; F508-L524 WeakPolarHBondContact O-CG 3.29Å; G509-L524 VanDerWaalsContact CA-CB 3.49Å; G509-L524 VanDerWaalsContact N-CB 3.25Å; F510-L524 CarbonylContact C-O 3.58Å; F510-L524 WeakPolarHBondContact CB-O 3.39Å
525	P	34.8	Very low	26.6	Very low	50 Å²	50	138.6 Å²	138.6	33%	0.325	68%	0.68	S	S	.	*			trans	-104.5	117.5	144.8	-1.7	23.2	0	0	0	113.2	Y375 G527	Y375-P525 HydrophobicContact CD1-CG 3.93Å; Y375-P525 HydrophobicContact CE1-CB 3.52Å; Y375-P525 HydrophobicContact CE1-CG 3.17Å; Y375-P525 HydrophobicContact CE2-CG 4.45Å; Y375-P525 VanDerWaalsContact CZ-CG 3.5Å; Y375-P525 VanDerWaalsContact OH-CB 3.28Å; Y375-P525 WeakPolarHBondContact OH-CB 3.2Å; P525-G527 PolarHBondContact O-N 2.84Å
526	T	27.3	Very low	26.6	Very low	127 Å²	127	137.9 Å²	137.9	78%	0.779	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	59	170.5	-52.6	0	0	0	0	111.3
527	G	27.2	Very low	26.3	Very low	53 Å²	53	135.9 Å²	135.9	55%	0.546	67%	0.67	S	S	.	*	T	Hydrogen-bonded Turn	trans	-115.8	-33.3	-173	0	0	0	0	0	115.5	P525 R529	P525-G527 PolarHBondContact O-N 2.84Å; G527-R529 VanDerWaalsContact C-N 3.33Å; G527-R529 PolarHBondContact O-N 2.87Å
528	L	25.9	Very low	26.1	Very low	160 Å²	160	134.6 Å²	134.6	84%	0.838	68%	0.676	S	S	*	*			trans	-83.4	66.6	-170.9	-65.7	178.3	0	0	0	113.7	Y530	L528-Y530 PolarHBondContact O-N 3.33Å
529	R	23	Very low	25.9	Very low	240 Å²	240	130.5 Å²	130.5	91%	0.906	68%	0.677	S	S	*	*			trans	-69.7	123.1	150.1	-86.2	-156.1	-173.7	-151.2	6.1	108.1	G527 R531	G527-R529 VanDerWaalsContact C-N 3.33Å; G527-R529 PolarHBondContact O-N 2.87Å; R529-R531 VanDerWaalsContact C-N 3.29Å; R529-R531 PolarHBondContact O-N 3.01Å
530	Y	23	Very low	25.7	Very low	209 Å²	209	130.7 Å²	130.7	82%	0.82	68%	0.683	S	S	*	*			trans	-65.2	82.4	175.9	-137.4	-82.9	0	0	0	110.5	L528 K532	L528-Y530 PolarHBondContact O-N 3.33Å; Y530-K532 HydrophobicContact CD1-CB 4.1Å; Y530-K532 HydrophobicContact CD1-CD 4.48Å; Y530-K532 HydrophobicContact CD1-CG 4.19Å; Y530-K532 HydrophobicContact CE1-CG 4.26Å; Y530-K532 PolarHBondContact O-N 2.87Å
531	R	21.3	Very low	25.3	Very low	220 Å²	220	131.9 Å²	131.9	83%	0.83	69%	0.694	S	S	*	*			trans	-74.6	70.9	169.8	-168.4	175	-175.9	153.5	3.2	108.9	R529 F533	R529-R531 VanDerWaalsContact C-N 3.29Å; R529-R531 PolarHBondContact O-N 3.01Å; R531-F533 PolarHBondContact O-N 3.32Å
532	K	20.5	Very low	25	Very low	170 Å²	170	132.3 Å²	132.3	74%	0.739	69%	0.694	S	S	*	*			trans	-56.9	104.6	171.8	-146.5	173.6	-173.4	178.6	0	106.9	Y530 K534	Y530-K532 HydrophobicContact CD1-CB 4.1Å; Y530-K532 HydrophobicContact CD1-CD 4.48Å; Y530-K532 HydrophobicContact CD1-CG 4.19Å; Y530-K532 HydrophobicContact CE1-CG 4.26Å; Y530-K532 PolarHBondContact O-N 2.87Å; K532-K534 PolarHBondContact O-N 3.46Å; K532-K534 VanDerWaalsContact O-N 3.11Å
533	F	21.9	Very low	24.7	Very low	180 Å²	180	134.4 Å²	134.4	79%	0.789	71%	0.705	S	S	*	*			trans	-61.6	114.6	164.1	-90.2	-96.1	0	0	0	106.3	R531 S535	R531-F533 PolarHBondContact O-N 3.32Å; F533-S535 VanDerWaalsContact C-N 3.32Å; F533-S535 PolarHBondContact O-N 3.02Å
534	K	21.4	Very low	24.3	Very low	181 Å²	181	134.8 Å²	134.8	79%	0.787	72%	0.724	S	S	*	*			trans	-68.7	98.7	159.8	-88.2	-168.3	167.6	-164.7	0	106.7	K532	K532-K534 PolarHBondContact O-N 3.46Å; K532-K534 VanDerWaalsContact O-N 3.11Å
535	S	23.4	Very low	23.5	Very low	91 Å²	91	138.6 Å²	138.6	64%	0.636	74%	0.744	S	S	*	*			trans	-75.2	118.5	148.3	49.7	0	0	0	0	106.6	F533 S537	F533-S535 VanDerWaalsContact C-N 3.32Å; F533-S535 PolarHBondContact O-N 3.02Å; S535-S537 PolarHBondContact O-N 3.22Å
536	D	24.6	Very low	22.9	Very low	153 Å²	153	144.4 Å²	144.4	82%	0.818	77%	0.769	S	S	*	*	S	Bend	trans	-75.6	77.7	-178.6	-69.3	-47.9	0	0	0	110.8
537	S	26	Very low	22.5	Very low	91 Å²	91	144.1 Å²	144.1	64%	0.636	76%	0.763	S	S	*	*			trans	-153.7	82.2	174.9	61.8	0	0	0	0	109.2	S535	S535-S537 PolarHBondContact O-N 3.22Å
538	G	21.4	Very low	22.3	Very low	66 Å²	66	149 Å²	149	68%	0.68	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-76	139.4	171.9	0	0	0	0	0	111.1
539	P	23.3	Very low	22	Very low	132 Å²	132	147.6 Å²	147.6	86%	0.857	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-67.3	139.2	162	30.8	-32.4	0	0	0	109.1
540	V	22.7	Very low	21.9	Very low	132 Å²	132	144.3 Å²	144.3	80%	0.8	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-81.9	140.2	-178.9	174.4	0	0	0	0	110.2	I542	V540-I542 PolarHBondContact O-N 2.96Å
541	D	21.5	Very low	21.8	Very low	155 Å²	155	139.1 Å²	139.1	83%	0.829	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-62.7	121.2	176.5	-68.2	-60.7	0	0	0	112	T543	D541-T543 PolarHBondContact O-N 3.45Å
542	I	21.8	Very low	21.7	Very low	156 Å²	156	136.6 Å²	136.6	80%	0.8	76%	0.759	S	S	*	*			trans	-89.3	86.9	174.6	-61	-179.5	0	0	0	109.1	V540	V540-I542 PolarHBondContact O-N 2.96Å
543	T	20.1	Very low	21.7	Very low	122 Å²	122	134.5 Å²	134.5	75%	0.748	76%	0.761	S	S	*	*			trans	48.3	139.9	142.9	61.5	0	0	0	0	121.8	D541	D541-T543 PolarHBondContact O-N 3.45Å
544	A	21.6	Very low	21.6	Very low	93 Å²	93	130.3 Å²	130.3	77%	0.769	75%	0.754	S	S	*	*			trans	111.7	115.5	140.1	0	0	0	0	0	117.4
545	N	20.2	Very low	21.6	Very low	130 Å²	130	130.1 Å²	130.1	70%	0.695	76%	0.755	S	S	*	*			trans	-45.8	155.4	173.4	-49.4	14.2	0	0	0	115.3	D547	N545-D547 WeakPolarHBondContact CB-OD2 3.43Å; N545-D547 PolarHBondContact ND2-OD2 3.26Å
546	M	22	Very low	21.4	Very low	171 Å²	171	129.7 Å²	129.7	84%	0.842	75%	0.746	S	S	*	*			trans	-132.6	88.6	145.7	-172.6	72.7	79.5	0	0	109
547	D	19.2	Very low	21.3	Very low	122 Å²	122	127.7 Å²	127.7	65%	0.652	74%	0.739	S	S	*	*			trans	-74.9	121.2	174.7	-63.6	-73.3	0	0	0	110.8	N545	N545-D547 WeakPolarHBondContact CB-OD2 3.43Å; N545-D547 PolarHBondContact ND2-OD2 3.26Å
548	I	22.5	Very low	21.1	Very low	154 Å²	154	128.2 Å²	128.2	79%	0.79	74%	0.743	S	S	*	*			trans	-133.1	123.2	162.4	-61.2	-174.8	0	0	0	110.2
549	N	20.2	Very low	21.1	Very low	131 Å²	131	134.6 Å²	134.6	70%	0.701	76%	0.755	S	S	*	*			trans	-79.7	145.7	-176	-56.3	-77.6	0	0	0	112.9
550	H	21.5	Very low	21	Very low	172 Å²	172	138.1 Å²	138.1	80%	0.796	76%	0.757	S	S	*	*				173.5	152.5	104.2	-104.8	-82.3	0	0	0	113.3
551	S	20.8	Very low	21.1	Very low	99 Å²	99	136.8 Å²	136.8	69%	0.692	76%	0.76	S	S	*	*			trans	48.9	102.9	164.4	51.6	0	0	0	0	116.3
552	L	19.7	Very low	21	Very low	167 Å²	167	132.9 Å²	132.9	87%	0.874	76%	0.757	S	S	*	*			cis	61.6	91	34.6	-117	177.6	0	0	0	113.8
553	T	20.6	Very low	21	Very low	127 Å²	127	133.7 Å²	133.7	78%	0.779	76%	0.763	S	S	*	*			trans	-169.8	115.7	149.9	15.1	0	0	0	0	109.1
554	S	20.1	Very low	21.1	Very low	92 Å²	92	137.6 Å²	137.6	64%	0.643	77%	0.769	S	S	*	*			trans	29.6	121.1	157.6	55.6	0	0	0	0	120.2
555	E	20	Very low	21	Very low	176 Å²	176	141.1 Å²	141.1	82%	0.822	78%	0.775	S	S	*	*				64.1	142.2	65.9	-60.8	170.9	146.4	0	0	113.4
556	D	19.5	Very low	21	Very low	82 Å²	82	145.5 Å²	145.5	44%	0.439	78%	0.781	S	S	.	*			cis	-80.1	-171.6	-9.8	-87.4	-77.5	0	0	0	112.5
557	T	22.6	Very low	20.8	Very low	111 Å²	111	143.7 Å²	143.7	68%	0.681	78%	0.78	S	S	*	*			cis	76.1	168.5	11.6	37.7	0	0	0	0	118.8
558	S	21.9	Very low	20.9	Very low	103 Å²	103	145.3 Å²	145.3	72%	0.72	79%	0.788	S	S	*	*				-159.9	135.4	-73	52.4	0	0	0	0	111.8
559	E	22	Very low	20.8	Very low	199 Å²	199	142.7 Å²	142.7	93%	0.93	78%	0.783	S	S	*	*			trans	-159.2	164.9	156.4	-132.3	-179.1	-171.9	0	0	115.1
560	F	21.1	Very low	21	Very low	206 Å²	206	142.6 Å²	142.6	90%	0.904	79%	0.789	S	S	*	*			trans	-124.3	134	-170.5	-123.8	-104.3	0	0	0	110.2
561	A	23.2	Very low	21.1	Very low	104 Å²	104	142.5 Å²	142.5	86%	0.86	79%	0.793	S	S	*	*			trans	-148.2	123.2	164.4	0	0	0	0	0	110.6
562	G	20.6	Very low	21.2	Very low	73 Å²	73	142.9 Å²	142.9	75%	0.753	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-91.5	143.1	-170.1	0	0	0	0	0	114.7
563	N	21.8	Very low	21.4	Very low	174 Å²	174	141.9 Å²	141.9	93%	0.93	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-89.9	118.9	167.8	-89.1	-44.8	0	0	0	110.9	L565	N563-L565 PolarHBondContact O-N 3.42Å
564	K	21	Very low	21.7	Very low	203 Å²	203	138.8 Å²	138.8	88%	0.883	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-57.9	124.3	178	-72.6	173.8	174.4	173.3	0	111.3	R566	K564-R566 PolarHBondContact O-N 3.44Å
565	L	20.2	Very low	22	Very low	168 Å²	168	139.6 Å²	139.6	88%	0.88	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-64.8	118.2	164.8	-161.6	77	0	0	0	108.6	N563 V567	N563-L565 PolarHBondContact O-N 3.42Å; L565-V567 PolarHBondContact O-N 2.95Å; L565-V567 VanDerWaalsContact O-N 3.08Å
566	R	19.3	Very low	22.3	Very low	221 Å²	221	137.1 Å²	137.1	83%	0.834	79%	0.787	S	S	*	*			trans	-80.6	93.2	-171.1	-169.5	-175.5	-64.7	-173.2	0.6	110.5	K564 L568	K564-R566 PolarHBondContact O-N 3.44Å; R566-L568 PolarHBondContact O-N 2.7Å; R566-L568 VanDerWaalsContact O-N 3.14Å
567	V	18.7	Very low	22.5	Very low	134 Å²	134	143.1 Å²	143.1	81%	0.812	80%	0.803	S	S	*	*			trans	-60.8	113.3	170.4	179.5	0	0	0	0	109	L565	L565-V567 PolarHBondContact O-N 2.95Å; L565-V567 VanDerWaalsContact O-N 3.08Å
568	L	20.6	Very low	22.7	Very low	156 Å²	156	145 Å²	145	82%	0.817	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-84.7	121.4	169.7	-84.2	155.9	0	0	0	108.8	R566	R566-L568 PolarHBondContact O-N 2.7Å; R566-L568 VanDerWaalsContact O-N 3.14Å
569	S	20.7	Very low	23	Very low	98 Å²	98	148.2 Å²	148.2	69%	0.685	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-68.6	156.7	173.3	36.6	0	0	0	0	111.5
570	P	23.8	Very low	23.3	Very low	130 Å²	130	145.3 Å²	145.3	84%	0.844	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-72.2	136.3	-164.8	27.8	-35.5	0	0	0	113.2
571	I	23.9	Very low	23.6	Very low	169 Å²	169	141.1 Å²	141.1	87%	0.867	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-78.1	140.1	167.9	-65	176.9	0	0	0	108.9
572	S	23	Very low	23.9	Very low	108 Å²	108	145.1 Å²	145.1	76%	0.755	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-61.2	144.7	-170.1	-169.7	0	0	0	0	114.2	G574	S572-G574 PolarHBondContact O-N 3.05Å
573	T	24.5	Very low	24.3	Very low	146 Å²	146	145 Å²	145	90%	0.896	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	90.4	176.6	50	0	0	0	0	111.4
574	G	27.2	Very low	24.4	Very low	62 Å²	62	146.6 Å²	146.6	64%	0.639	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.6	-26.9	176.2	0	0	0	0	0	116.8	S572	S572-G574 PolarHBondContact O-N 3.05Å
575	S	26.3	Very low	24.9	Very low	108 Å²	108	145.3 Å²	145.3	76%	0.755	77%	0.767	S	S	*	*	S	Bend	trans	-100.9	-10.2	-165.5	-161.5	0	0	0	0	116.7
576	I	26.9	Very low	25.2	Very low	124 Å²	124	142 Å²	142	64%	0.636	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-89	-12	-171	-65.8	170.7	0	0	0	112.7	N578 E579 L580	I576-N578 PolarHBondContact O-N 3.48Å; I576-E579 PolarHBondContact O-N 3.05Å; I576-L580 HydrophobicContact CG2-CD1 4.35Å
577	W	22.9	Very low	25.6	Very low	208 Å²	208	138.6 Å²	138.6	79%	0.788	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-65.6	-20.6	-178.4	-94.2	97.5	0	0	0	115
578	N	26.4	Very low	25.9	Very low	150 Å²	150	140.1 Å²	140.1	80%	0.802	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-96.2	-8.2	-175.7	-69.1	7.4	0	0	0	114.1	I576	I576-N578 PolarHBondContact O-N 3.48Å
579	E	28.7	Very low	26.2	Very low	172 Å²	172	137.6 Å²	137.6	80%	0.804	76%	0.757	S	S	*	*	S	Bend	trans	-99	1.5	-173.5	-146.3	170.5	-150.3	0	0	113.4	I576	I576-E579 PolarHBondContact O-N 3.05Å
580	L	27.4	Very low	26.5	Very low	137 Å²	137	137.9 Å²	137.9	72%	0.717	76%	0.759	S	S	*	*	S	Bend	trans	-115.8	2.3	-172.8	-98.4	152.1	0	0	0	114.9	I576	I576-L580 HydrophobicContact CG2-CD1 4.35Å
581	I	28.7	Very low	26.8	Very low	119 Å²	119	137 Å²	137	61%	0.61	76%	0.763	S	S	*	*	S	Bend	trans	-106.8	-22.7	-172.2	-69.3	172.3	0	0	0	113.3	P583	I581-P583 VanDerWaalsContact C-CD 3.41Å
582	E	29.9	Very low	27	Very low	187 Å²	187	134.6 Å²	134.6	87%	0.874	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	63.6	179.3	-65.3	-158.5	152.7	0	0	115.7
583	P	28.8	Very low	27.1	Very low	71 Å²	71	133.3 Å²	133.3	46%	0.461	76%	0.76	S	S	.	*	T	Hydrogen-bonded Turn	trans	-121.8	-5.6	147.8	36.6	-30.6	0	0	0	113.7	I581	I581-P583 VanDerWaalsContact C-CD 3.41Å
584	Y	22.8	Very low	27.2	Very low	208 Å²	208	132.2 Å²	132.2	82%	0.816	75%	0.753	S	S	*	*	S	Bend	trans	-91.4	-6.8	-171.6	-93.6	-78.1	0	0	0	116.2
585	Q	31.3	Very low	27.1	Very low	176 Å²	176	135.6 Å²	135.6	82%	0.822	76%	0.764	S	S	*	*	S	Bend	trans	-111.1	-10.9	177.6	-70.9	-165.6	-18.6	0	0	115.1	I587	Q585-I587 VanDerWaalsContact C-N 3.31Å; Q585-I587 PolarHBondContact O-N 3.14Å
586	S	28.3	Very low	27	Very low	99 Å²	99	139.7 Å²	139.7	69%	0.692	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-9.8	179.6	56.6	0	0	0	0	114.8	M588	S586-M588 VanDerWaalsContact C-N 3.35Å
587	I	27.6	Very low	26.9	Very low	149 Å²	149	139.5 Å²	139.5	76%	0.764	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-15.3	179.4	-62.1	177.9	0	0	0	111.8	Q585	Q585-I587 VanDerWaalsContact C-N 3.31Å; Q585-I587 PolarHBondContact O-N 3.14Å
588	M	23.5	Very low	26.9	Very low	166 Å²	166	136.7 Å²	136.7	82%	0.818	78%	0.777	S	S	*	*	S	Bend	trans	-107.8	122.2	171.7	-63.3	-165.2	-168.6	0	0	111.1	S586	S586-M588 VanDerWaalsContact C-N 3.35Å
589	A	27.2	Very low	26.8	Very low	102 Å²	102	140.6 Å²	140.6	84%	0.843	78%	0.783	S	S	*	*			trans	65.7	98.7	171.2	0	0	0	0	0	118.5
590	S	26.9	Very low	26.4	Very low	105 Å²	105	141.6 Å²	141.6	73%	0.734	79%	0.787	S	S	*	*				-149.2	138.2	107.8	60	0	0	0	0	110.6
591	A	31.5	Very low	26.3	Very low	112 Å²	112	141.3 Å²	141.3	93%	0.926	79%	0.794	S	S	*	*			trans	-100.3	30.7	-170.9	0	0	0	0	0	113.3
592	T	26.4	Very low	25.8	Very low	117 Å²	117	141.1 Å²	141.1	72%	0.718	80%	0.803	S	S	*	*			trans	-130.1	99.5	-173.5	49.4	0	0	0	0	110.6	T594	T592-T594 PolarHBondContact O-N 3.07Å
593	G	26.3	Very low	25.3	Very low	81 Å²	81	141.5 Å²	141.5	84%	0.835	81%	0.805	S	S	*	*			trans	-81.3	106.2	-173.2	0	0	0	0	0	114.5
594	T	25.8	Very low	25.1	Very low	123 Å²	123	143.4 Å²	143.4	76%	0.755	82%	0.819	S	S	*	*			trans	-143.7	114	154.4	51.5	0	0	0	0	109.5	T592 K596	T592-T594 PolarHBondContact O-N 3.07Å; T594-K596 PolarHBondContact O-N 3.36Å
595	P	25.2	Very low	25.1	Very low	134 Å²	134	139.9 Å²	139.9	87%	0.87	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-74.9	124.6	177	29.8	-32.6	0	0	0	110.5
596	K	24.8	Very low	24.7	Very low	193 Å²	193	137 Å²	137	84%	0.839	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-82.3	123	169.1	-81.1	-173.5	174.2	-178.8	0	110.1	T594 L598	T594-K596 PolarHBondContact O-N 3.36Å; K596-L598 HydrophobicContact CB-CD1 4.39Å
597	S	24.5	Very low	24.6	Very low	121 Å²	121	140.8 Å²	140.8	85%	0.846	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-73	120.5	166.8	49.9	0	0	0	0	110.5
598	L	22.9	Very low	24.2	Very low	149 Å²	149	140 Å²	140	78%	0.78	83%	0.83	S	S	*	*			trans	-107.8	103.8	162	-81.9	79.9	0	0	0	108.3	K596	K596-L598 HydrophobicContact CB-CD1 4.39Å
599	Y	24.4	Very low	24.4	Very low	232 Å²	232	138 Å²	138	91%	0.91	83%	0.83	S	S	*	*			trans	-175	81.4	151.4	-102.5	-62.1	0	0	0	110.5
600	E	20.8	Very low	24.1	Very low	192 Å²	192	141.7 Å²	141.7	90%	0.897	83%	0.834	S	S	*	*			trans	-133.4	118.8	158.3	-81.4	-167.2	142.6	0	0	108.4
601	P	23.9	Very low	23.8	Very low	132 Å²	132	141.4 Å²	141.4	86%	0.857	83%	0.832	S	S	*	*			trans	-95.2	113.7	179	33.3	-29.6	0	0	0	111.8
602	S	19.9	Very low	23.1	Very low	115 Å²	115	147.1 Å²	147.1	80%	0.804	83%	0.83	S	S	*	*			trans	-99.7	122.8	-179.5	60.5	0	0	0	0	113.9
603	E	19.4	Very low	22.7	Very low	195 Å²	195	149.7 Å²	149.7	91%	0.911	84%	0.837	S	S	*	*			trans	-0.3	124.9	162.9	-55	-174.8	129.4	0	0	121.6
604	S	23.5	Very low	22.4	Very low	110 Å²	110	149.5 Å²	149.5	77%	0.769	84%	0.835	S	S	*	*			trans	177.8	145.3	144.4	34.4	0	0	0	0	108.5
605	T	22.1	Very low	22	Very low	134 Å²	134	149.4 Å²	149.4	82%	0.822	84%	0.84	S	S	*	*			cis	-151.3	165.4	-2.9	10.2	0	0	0	0	108.6
606	P	24.7	Very low	21.8	Very low	115 Å²	115	147.4 Å²	147.4	75%	0.747	84%	0.835	S	S	*	*			trans	-89.9	158.5	-165.7	35.6	-36.7	0	0	0	115.7
607	L	24.7	Very low	21.5	Very low	179 Å²	179	145.6 Å²	145.6	94%	0.937	83%	0.834	S	S	*	*			trans	-132.4	141.7	163.4	-82	170.3	0	0	0	110.9
608	T	20.8	Very low	21.3	Very low	133 Å²	133	150.9 Å²	150.9	82%	0.816	84%	0.835	S	S	*	*			trans	-102	160.1	-168.1	39.2	0	0	0	0	113.7
609	P	26.8	Very low	21.1	Very low	124 Å²	124	150 Å²	150	81%	0.805	83%	0.83	S	S	*	*			trans	-85.5	149.4	-169.6	33.8	-36.3	0	0	0	114.1
610	L	21.8	Very low	20.9	Very low	180 Å²	180	145.2 Å²	145.2	94%	0.942	81%	0.814	S	S	*	*			trans	-133.8	163	164.1	-99	170.3	0	0	0	110.8
611	S	18.7	Very low	20.9	Very low	98 Å²	98	143 Å²	143	69%	0.685	81%	0.809	S	S	*	*			trans	-136.5	171.8	-155.2	73.5	0	0	0	0	114.9
612	R	18.2	Very low	20.7	Very low	232 Å²	232	142.2 Å²	142.2	88%	0.875	81%	0.806	S	S	*	*			trans	84.4	114.3	155.9	-163.3	175.3	-61.4	-136.7	-0.8	117.5
613	I	18.1	Very low	20.7	Very low	172 Å²	172	140 Å²	140	88%	0.882	80%	0.802	S	S	*	*			trans	-66.8	138.4	164.4	-66.5	163.4	0	0	0	109.6
614	G	18.9	Very low	20.8	Very low	77 Å²	77	138.3 Å²	138.3	79%	0.794	80%	0.799	S	S	*	*			trans	-130.2	127.3	177.6	0	0	0	0	0	112.1
615	S	18.2	Very low	20.6	Very low	121 Å²	121	140.2 Å²	140.2	85%	0.846	80%	0.801	S	S	*	*			trans	-90.3	135.3	-169.1	52.4	0	0	0	0	115.7
616	A	20.5	Very low	20.5	Very low	92 Å²	92	143 Å²	143	76%	0.76	80%	0.801	S	S	*	*			trans	173.4	117.5	140.8	0	0	0	0	0	109.1
617	N	19.4	Very low	20.3	Very low	154 Å²	154	145.7 Å²	145.7	82%	0.824	81%	0.808	S	S	*	*				76.7	132.5	68.1	-85.8	-4.6	0	0	0	115.8
618	R	18.7	Very low	20	Very low	232 Å²	232	145.4 Å²	145.4	88%	0.875	80%	0.802	S	S	*	*			trans	92.1	147.5	168.5	-55	178.3	-170.2	-170.3	4.5	117
619	I	19.1	Very low	19.8	Very low	132 Å²	132	147.1 Å²	147.1	68%	0.677	81%	0.805	S	S	*	*			cis	-159.6	146.1	-14.9	-109.4	166.3	0	0	0	109.3
620	F	20.1	Very low	19.4	Very low	131 Å²	131	149.8 Å²	149.8	58%	0.575	81%	0.806	S	S	*	*			trans	0.8	140.3	159.4	-64.4	-95.7	0	0	0	121.2
621	N	20.9	Very low	19.3	Very low	145 Å²	145	147.1 Å²	147.1	78%	0.775	80%	0.801	S	S	*	*				-169.4	145.4	96.3	-107.3	-45.7	0	0	0	119
622	S	20.1	Very low	19.3	Very low	115 Å²	115	150.9 Å²	150.9	80%	0.804	81%	0.808	S	S	*	*			trans	-40.3	156.5	164.7	177.9	0	0	0	0	117.9
623	G	20.7	Very low	19.3	Very low	69 Å²	69	152 Å²	152	71%	0.711	81%	0.812	S	S	*	*			trans	166.6	78	149.2	0	0	0	0	0	122
624	N	21.4	Very low	19.4	Very low	160 Å²	160	148.4 Å²	148.4	86%	0.856	80%	0.803	S	S	*	*			trans	77.7	148.6	142.4	-154	15.7	0	0	0	121.3
625	N	19	Very low	19.5	Very low	150 Å²	150	154.6 Å²	154.6	80%	0.802	81%	0.808	S	S	*	*			trans	-97	132.6	177.4	-69.4	-55	0	0	0	111.8
626	K	20.2	Very low	19.6	Very low	192 Å²	192	160.2 Å²	160.2	84%	0.835	81%	0.811	S	S	*	*			trans	-156.8	139.6	147.3	-120.1	-178.5	179.9	-165.7	0	112
627	L	19	Very low	19.6	Very low	171 Å²	171	159.7 Å²	159.7	90%	0.895	81%	0.814	S	S	*	*			trans	-86.5	112.1	172.1	-74.9	144.2	0	0	0	108.9
628	E	18.4	Very low	19.6	Very low	173 Å²	173	157.6 Å²	157.6	81%	0.808	81%	0.811	S	S	*	*			trans	-149.7	129.7	160.9	-129.7	144.6	-154.1	0	0	109.1	E630	E628-E630 PolarHBondContact O-N 3.49Å
629	I	18.6	Very low	19.5	Very low	170 Å²	170	151.7 Å²	151.7	87%	0.872	80%	0.804	S	S	*	*			trans	-95.2	88.7	-170	-57.6	175	0	0	0	108.8
630	E	17.7	Very low	19.5	Very low	180 Å²	180	149.5 Å²	149.5	84%	0.841	80%	0.797	S	S	*	*			trans	-127.2	87.2	171.7	-159.5	158.2	-143.6	0	0	110.5	E628 E632	E628-E630 PolarHBondContact O-N 3.49Å; E630-E632 PolarHBondContact O-N 3.38Å; E630-E632 VanDerWaalsContact O-N 3.16Å
631	C	19.3	Very low	19.4	Very low	123 Å²	123	153.5 Å²	153.5	83%	0.831	82%	0.815	S	S	*	*			trans	-68.3	109.1	171.6	-82	0	0	0	0	109.7
632	E	18.4	Very low	19.3	Very low	178 Å²	178	152.5 Å²	152.5	83%	0.832	81%	0.805	S	S	*	*			trans	-56.9	140.5	-174.3	-69.1	-168.5	107.7	0	0	114	E630 S634	E630-E632 PolarHBondContact O-N 3.38Å; E630-E632 VanDerWaalsContact O-N 3.16Å; E632-S634 PolarHBondContact O-N 3.42Å
633	R	18.7	Very low	19.2	Very low	255 Å²	255	153.1 Å²	153.1	96%	0.962	81%	0.805	S	S	*	*			trans	-82.7	100.7	173.7	-68.3	168.8	168.7	152.6	-5.4	110.7
634	S	20.3	Very low	19.1	Very low	97 Å²	97	158.8 Å²	158.8	68%	0.678	81%	0.812	S	S	*	*			trans	-137.8	80.9	171.4	53.6	0	0	0	0	113.7	E632	E632-S634 PolarHBondContact O-N 3.42Å
635	F	21.8	Very low	19	Very low	207 Å²	207	158.9 Å²	158.9	91%	0.908	81%	0.813	S	S	*	*				-172.8	117.8	116.9	-119.1	-99.7	0	0	0	110.7
636	R	19.3	Very low	19	Very low	239 Å²	239	160.6 Å²	160.6	90%	0.902	81%	0.813	S	S	*	*			trans	-90.1	144.4	161.8	-79	-171.2	177.5	-143.2	4.5	108.7
637	G	21	Very low	19.3	Very low	81 Å²	81	156.5 Å²	156.5	84%	0.835	81%	0.806	S	S	*	*			trans	-152.6	54.8	177.1	0	0	0	0	0	111.3
638	S	18.1	Very low	19.4	Very low	109 Å²	109	156.4 Å²	156.4	76%	0.762	80%	0.801	S	S	*	*			trans	-75.3	150.9	174.3	-66	0	0	0	0	111.2
639	C	17.5	Very low	19.5	Very low	108 Å²	108	157 Å²	157	73%	0.73	80%	0.801	S	S	*	*			trans	-62.3	155.8	173.7	-46.3	0	0	0	0	112
640	V	19.2	Very low	19.5	Very low	86 Å²	86	153.7 Å²	153.7	52%	0.521	79%	0.789	S	S	.	*				-164.9	138.3	113.1	143.2	0	0	0	0	108.3	Q642 F688	V640-Q642 HydrophobicContact CG1-CB 4.18Å; V640-Q642 HydrophobicContact CG1-CG 4.09Å; V640-F688 HydrophobicContact CG2-CE2 3.95Å; V640-F688 HydrophobicContact CG2-CZ 4.48Å
641	F	17	Very low	19.5	Very low	216 Å²	216	150.3 Å²	150.3	95%	0.947	78%	0.781	S	S	*	*			trans	-101.5	131.2	158.9	-89.7	-98.5	0	0	0	106.7
642	Q	18.8	Very low	19.6	Very low	123 Å²	123	153.9 Å²	153.9	58%	0.575	78%	0.778	S	S	*	*			trans	-136.9	143.8	171.8	-108.2	169.5	-18.2	0	0	108.9	V640 E686	V640-Q642 HydrophobicContact CG1-CB 4.18Å; V640-Q642 HydrophobicContact CG1-CG 4.09Å; Q642-E686 PolarHBondContact NE2-OE1 3.27Å; Q642-E686 PolarHBondContact NE2-OE2 3.01Å
643	T	18.7	Very low	19.6	Very low	129 Å²	129	150.3 Å²	150.3	79%	0.791	77%	0.769	S	S	*	*			trans	-103	131.9	-174.7	45.1	0	0	0	0	110.7
644	E	18.1	Very low	19.7	Very low	187 Å²	187	144.4 Å²	144.4	87%	0.874	76%	0.757	S	S	*	*			trans	44.6	100.2	155.8	-54.4	-174.7	141	0	0	115.4
645	D	20.4	Very low	19.7	Very low	162 Å²	162	145.7 Å²	145.7	87%	0.866	76%	0.76	S	S	*	*				-160.1	-175.3	83.7	-133.6	-34.2	0	0	0	115.8
646	K	19	Very low	19.7	Very low	186 Å²	186	141.7 Å²	141.7	81%	0.809	76%	0.755	S	S	*	*			trans	-99.4	170.2	177.5	-65.2	171.3	-179	165	0	112.2
647	P	26.8	Very low	19.6	Very low	106 Å²	106	138.4 Å²	138.4	69%	0.688	75%	0.754	S	S	*	*			cis	-136.5	-173	-42.2	34.7	-15.2	0	0	0	113.3
648	Q	19.9	Very low	19.6	Very low	169 Å²	169	138.4 Å²	138.4	79%	0.79	75%	0.746	S	S	*	*			trans	95.5	132.2	158.7	-59.7	-179.6	8.1	0	0	121.3
649	F	19.9	Very low	19.6	Very low	186 Å²	186	139.3 Å²	139.3	82%	0.816	75%	0.747	S	S	*	*			trans	27.9	144.7	133.1	-71.9	-106	0	0	0	121.9
650	T	19.1	Very low	19.6	Very low	101 Å²	101	138.6 Å²	138.6	62%	0.62	74%	0.743	S	S	*	*			cis	-175	153.3	-17	22.4	0	0	0	0	109.8
651	T	18.3	Very low	19.5	Very low	108 Å²	108	142.4 Å²	142.4	66%	0.663	76%	0.755	S	S	*	*			trans	63.1	155.7	149.8	49.3	0	0	0	0	122.5
652	Y	21.2	Very low	19.6	Very low	198 Å²	198	138.9 Å²	138.9	78%	0.776	74%	0.741	S	S	*	*			trans	95	100.8	166.4	-58.8	-67.9	0	0	0	115.3
653	T	19.4	Very low	19.6	Very low	103 Å²	103	141.5 Å²	141.5	63%	0.632	75%	0.754	S	S	*	*			cis	105	136.9	44.3	51.4	0	0	0	0	111.9
654	N	20.3	Very low	19.7	Very low	132 Å²	132	139 Å²	139	71%	0.706	75%	0.753	S	S	*	*			trans	71.5	107	150.2	-62.6	0.6	0	0	0	117.6
655	T	19.7	Very low	19.7	Very low	123 Å²	123	137.7 Å²	137.7	76%	0.755	75%	0.751	S	S	*	*				84.9	161.2	89.4	65.3	0	0	0	0	114.7
656	P	21.8	Very low	19.7	Very low	124 Å²	124	137.8 Å²	137.8	81%	0.805	75%	0.746	S	S	*	*			cis	-127.4	-165.1	-22.4	28.5	-6	0	0	0	112.8
657	I	18.3	Very low	19.7	Very low	170 Å²	170	134 Å²	134	87%	0.872	74%	0.739	S	S	*	*			trans	-91.6	148.2	-176.8	-64.6	153.2	0	0	0	112.1
658	A	20.1	Very low	19.4	Very low	81 Å²	81	140.4 Å²	140.4	67%	0.669	75%	0.749	S	S	*	*			trans	-147.5	123.1	167.1	0	0	0	0	0	112.1
659	T	18	Very low	19.5	Very low	128 Å²	128	138.9 Å²	138.9	79%	0.785	75%	0.746	S	S	*	*				25.1	147.7	122.9	54.9	0	0	0	0	120.3
660	S	18.3	Very low	19.7	Very low	93 Å²	93	141.1 Å²	141.1	65%	0.65	75%	0.749	S	S	*	*			cis	-179	156	5.2	43.8	0	0	0	0	113.3
661	H	17.1	Very low	19.9	Very low	165 Å²	165	146 Å²	146	76%	0.764	76%	0.758	S	S	*	*			trans	64	157.6	139.8	-88.4	-115.3	0	0	0	124.6
662	H	19.3	Very low	20.1	Very low	143 Å²	143	150 Å²	150	66%	0.662	77%	0.769	S	S	*	*			trans	78.4	118.1	158.5	-76.1	-75.8	0	0	0	122.8
663	E	18.6	Very low	20.1	Very low	178 Å²	178	146.5 Å²	146.5	83%	0.832	76%	0.761	S	S	*	*			trans	63.8	154.6	134.9	-71.9	165.2	-145.9	0	0	122.9
664	G	19.1	Very low	20.3	Very low	75 Å²	75	148 Å²	148	77%	0.773	77%	0.771	S	S	*	*			trans	133.6	55.4	156.4	0	0	0	0	0	120.5
665	L	18.9	Very low	20.4	Very low	161 Å²	161	147 Å²	147	84%	0.843	77%	0.773	S	S	*	*			trans	39.1	106.5	143.8	-161.7	70.2	0	0	0	121.4
666	H	19.9	Very low	20.7	Very low	164 Å²	164	147.7 Å²	147.7	76%	0.759	77%	0.771	S	S	*	*			trans	38.9	119.5	139.7	-78.4	-108.6	0	0	0	123.4
667	V	19.9	Very low	20.9	Very low	107 Å²	107	149.4 Å²	149.4	65%	0.648	77%	0.773	S	S	*	*				64.6	101.9	129.3	-173.1	0	0	0	0	118.8
668	W	20.4	Very low	21.2	Very low	239 Å²	239	144.9 Å²	144.9	91%	0.905	77%	0.768	S	S	*	*				-152.9	162.5	98.7	-109.5	85.9	0	0	0	110.1
669	N	22.6	Very low	21.4	Very low	137 Å²	137	150.2 Å²	150.2	73%	0.733	78%	0.779	S	S	*	*			trans	-91.8	128.9	-165.2	-85.2	-60.8	0	0	0	114.9	Y671	N669-Y671 PolarHBondContact O-N 3.29Å
670	R	22.8	Very low	21.6	Very low	233 Å²	233	151.2 Å²	151.2	88%	0.879	78%	0.779	S	S	*	*			trans	43	71.1	149.1	-59	-171.2	-173	-167.6	1.8	117.3
671	Y	23	Very low	21.9	Very low	203 Å²	203	156.8 Å²	156.8	80%	0.796	79%	0.787	S	S	*	*			trans	6	125	135.2	-71.3	-84.7	0	0	0	118.3	N669	N669-Y671 PolarHBondContact O-N 3.29Å
672	E	22.5	Very low	22.1	Very low	193 Å²	193	153.1 Å²	153.1	90%	0.902	79%	0.794	S	S	*	*			trans	-55.5	128.1	136.2	-63	173.2	117.3	0	0	108.5
673	M	22.3	Very low	22.4	Very low	124 Å²	124	153 Å²	153	61%	0.611	80%	0.798	S	S	*	*			trans	-139.7	61	-175.8	-130.3	-66	174.7	0	0	110.6
674	T	23.5	Very low	22.6	Very low	136 Å²	136	152.9 Å²	152.9	83%	0.834	80%	0.795	S	S	*	*	S	Bend	trans	-136.5	44.7	-178.4	55	0	0	0	0	112.3
675	S	23.4	Very low	22.7	Very low	109 Å²	109	156.6 Å²	156.6	76%	0.762	80%	0.797	S	S	*	*	S	Bend	trans	-151.5	-11.2	171.6	67.7	0	0	0	0	117.8
676	I	24.7	Very low	22.8	Very low	139 Å²	139	155.3 Å²	155.3	71%	0.713	79%	0.786	S	S	*	*	S	Bend	trans	-124.8	53.2	-173.9	-37.2	-177.9	0	0	0	112.6
677	L	25.6	Very low	22.9	Very low	160 Å²	160	152 Å²	152	84%	0.838	78%	0.782	S	S	*	*	S	Bend	trans	-149.8	30.5	169.3	-122	158.6	0	0	0	112.6
678	G	24.4	Very low	22.9	Very low	75 Å²	75	153.3 Å²	153.3	77%	0.773	78%	0.779	S	S	*	*	S	Bend	trans	-109.3	-5.4	179	0	0	0	0	0	115.7
679	E	24.5	Very low	23	Very low	192 Å²	192	149.1 Å²	149.1	90%	0.897	78%	0.78	S	S	*	*	S	Bend	trans	-127.4	14.8	-169.4	-70.9	-160.5	136	0	0	115.9
680	L	23.8	Very low	23	Very low	150 Å²	150	146.3 Å²	146.3	79%	0.785	78%	0.776	S	S	*	*	S	Bend	trans	-121.2	124.4	160.7	-91.9	91.3	0	0	0	111.1
681	Y	23.8	Very low	23	Very low	210 Å²	210	143.5 Å²	143.5	82%	0.824	78%	0.775	S	S	*	*			trans	60.1	73.8	177	-71.5	-85.5	0	0	0	116.8	N683	Y681-N683 PolarHBondContact O-N 3.07Å
682	G	22	Very low	22.9	Very low	87 Å²	87	140.3 Å²	140.3	90%	0.897	78%	0.776	S	S	*	*			trans	-70.7	94.4	141.5	0	0	0	0	0	110.3
683	N	24.4	Very low	23	Very low	140 Å²	140	141.1 Å²	141.1	75%	0.749	77%	0.771	S	S	*	*			trans	-152	163.5	151.5	-141.9	-15.2	0	0	0	111.1	Y681	Y681-N683 PolarHBondContact O-N 3.07Å
684	K	22.5	Very low	23	Very low	177 Å²	177	140.8 Å²	140.8	77%	0.77	78%	0.778	S	S	*	*			trans	-66.1	133.2	-177.4	-52.8	170.7	-175.9	176.2	0	110.8
685	D	21.6	Very low	23	Very low	152 Å²	152	143.6 Å²	143.6	81%	0.813	78%	0.781	S	S	*	*				-173.4	179.4	104.8	-84.8	-13.4	0	0	0	109.6
686	E	20.8	Very low	23.1	Very low	134 Å²	134	143.5 Å²	143.5	63%	0.626	78%	0.78	S	S	*	*			trans	-89	154.9	-158	-68.3	163.5	77.1	0	0	116.5	Q642	Q642-E686 PolarHBondContact NE2-OE1 3.27Å; Q642-E686 PolarHBondContact NE2-OE2 3.01Å
687	S	21.6	Very low	23.1	Very low	94 Å²	94	141.5 Å²	141.5	66%	0.657	79%	0.785	S	S	*	*			trans	96.2	149.6	143.2	83.7	0	0	0	0	120.8
688	F	21	Very low	22.9	Very low	135 Å²	135	139.3 Å²	139.3	59%	0.592	78%	0.781	S	S	*	*			trans	58.8	95.3	166.6	-68.9	-76	0	0	0	121	V640 A690	V640-F688 HydrophobicContact CG2-CE2 3.95Å; V640-F688 HydrophobicContact CG2-CZ 4.48Å; F688-A690 HydrophobicContact CD1-CB 4.42Å
689	T	22.1	Very low	22.9	Very low	152 Å²	152	141.2 Å²	141.2	93%	0.933	78%	0.778	S	S	*	*				-136.1	74.7	117.5	21.3	0	0	0	0	111.1	M691	T689-M691 PolarHBondContact O-N 3.21Å
690	A	23.2	Very low	22.8	Very low	78 Å²	78	139.5 Å²	139.5	65%	0.645	77%	0.774	S	S	*	*			trans	-71.3	111.4	171.1	0	0	0	0	0	110.1	F688 V692	F688-A690 HydrophobicContact CD1-CB 4.42Å; A690-V692 PolarHBondContact O-N 3.16Å
691	M	22.4	Very low	22.9	Very low	174 Å²	174	139.5 Å²	139.5	86%	0.857	77%	0.774	S	S	*	*			trans	-71.6	113.3	-177.6	-164.8	-174.2	-157.7	0	0	111.2	T689 R693	T689-M691 PolarHBondContact O-N 3.21Å; M691-R693 PolarHBondContact O-N 3.29Å
692	V	21.2	Very low	22.7	Very low	135 Å²	135	140 Å²	140	82%	0.818	78%	0.775	S	S	*	*			trans	-65.3	122	-174.8	179.2	0	0	0	0	111.9	A690	A690-V692 PolarHBondContact O-N 3.16Å
693	R	24.6	Very low	22.8	Very low	210 Å²	210	140.9 Å²	140.9	79%	0.792	76%	0.764	S	S	*	*			trans	-125.3	142	158.4	-72.8	-174.9	177.5	173.7	1.1	109.1	M691 H695	M691-R693 PolarHBondContact O-N 3.29Å; R693-H695 PolarHBondContact O-N 2.89Å
694	P	22.3	Very low	22.7	Very low	117 Å²	117	145.1 Å²	145.1	76%	0.76	77%	0.77	S	S	*	*			trans	-75.3	128.6	-169.2	28.7	-34.7	0	0	0	112.5	S696	P694-S696 PolarHBondContact O-N 3.06Å
695	H	22.4	Very low	22.8	Very low	195 Å²	195	146.6 Å²	146.6	90%	0.903	77%	0.772	S	S	*	*			trans	-65.5	99.2	169.6	-75.2	-97.9	0	0	0	110.4	R693	R693-H695 PolarHBondContact O-N 2.89Å
696	S	26.3	Very low	23	Very low	107 Å²	107	149.7 Å²	149.7	75%	0.748	77%	0.774	S	S	*	*			trans	-73.9	123.4	159.2	-62.4	0	0	0	0	107.7	P694 C698	P694-S696 PolarHBondContact O-N 3.06Å; S696-C698 PolarHBondContact O-N 2.89Å
697	A	23.9	Very low	23.2	Very low	97 Å²	97	148.2 Å²	148.2	80%	0.802	78%	0.778	S	S	*	*			trans	-65.6	96.8	-172.9	0	0	0	0	0	111.6	V699	A697-V699 PolarHBondContact O-N 2.81Å
698	C	22	Very low	23.7	Very low	114 Å²	114	150.7 Å²	150.7	77%	0.77	78%	0.782	S	S	*	*			trans	-75.1	92.3	174.2	-162	0	0	0	0	108.8	S696 L700	S696-C698 PolarHBondContact O-N 2.89Å; C698-L700 PolarHBondContact O-N 3.47Å; C698-L700 VanDerWaalsContact O-N 3.16Å
699	V	23.6	Very low	24.1	Very low	115 Å²	115	149.2 Å²	149.2	70%	0.697	78%	0.781	S	S	*	*			trans	-63.4	115.9	171.5	178	0	0	0	0	107.6	A697 L701	A697-V699 PolarHBondContact O-N 2.81Å; V699-L701 HydrophobicContact CG1-CG 4.36Å; V699-L701 PolarHBondContact O-N 3.14Å
700	L	23.5	Very low	25	Very low	157 Å²	157	148.2 Å²	148.2	82%	0.822	77%	0.769	S	S	*	*			trans	-71.6	69.8	179.4	-80.7	164.5	0	0	0	111.4	C698 R702	C698-L700 PolarHBondContact O-N 3.47Å; C698-L700 VanDerWaalsContact O-N 3.16Å; L700-R702 PolarHBondContact O-N 3.45Å
701	L	24.9	Very low	25.8	Very low	149 Å²	149	146.1 Å²	146.1	78%	0.78	76%	0.755	S	S	*	*			trans	-65.1	82.3	160.5	-76.8	164.9	0	0	0	108.4	V699 P703	V699-L701 HydrophobicContact CG1-CG 4.36Å; V699-L701 PolarHBondContact O-N 3.14Å; L701-P703 WeakPolarHBondContact O-CD 3.38Å
702	R	20.1	Very low	26.9	Very low	222 Å²	222	143.3 Å²	143.3	84%	0.838	74%	0.742	S	S	*	*			trans	-62.4	114.2	161.8	-77.3	-176	173	-176.5	-1.7	107.3	L700 R704	L700-R702 PolarHBondContact O-N 3.45Å; R702-R704 PolarHBondContact O-N 3.15Å
703	P	24.5	Very low	27.6	Very low	104 Å²	104	141.4 Å²	141.4	68%	0.675	73%	0.727	S	S	*	*			trans	-62.4	139.4	168.3	-15.1	31.4	0	0	0	107.8	L701 Y705	L701-P703 WeakPolarHBondContact O-CD 3.38Å; P703-Y705 PolarHBondContact O-N 3.15Å
704	R	22.5	Very low	28.7	Very low	229 Å²	229	134 Å²	134	86%	0.864	71%	0.707	S	S	*	*			trans	-69.4	120.4	169.8	-81	-176.7	170.6	175	-3.2	107.8	R702 Y706	R702-R704 PolarHBondContact O-N 3.15Å; R704-Y706 PolarHBondContact O-N 3.34Å; R704-Y706 VanDerWaalsContact O-N 3.09Å
705	Y	24	Very low	29.8	Very low	208 Å²	208	132.6 Å²	132.6	82%	0.816	70%	0.697	S	S	*	*			trans	-64	109.4	174.6	-61.2	-86.7	0	0	0	109.6	P703 S707	P703-Y705 PolarHBondContact O-N 3.15Å; Y705-S707 PolarHBondContact O-N 3.29Å; Y705-S707 VanDerWaalsContact O-N 3.16Å
706	Y	26.3	Very low	30.8	Very low	218 Å²	218	129.6 Å²	129.6	86%	0.855	68%	0.682	S	S	*	*			trans	-78	83.7	151.1	-63.8	-65.5	0	0	0	107.2	R704 I708	R704-Y706 PolarHBondContact O-N 3.34Å; R704-Y706 VanDerWaalsContact O-N 3.09Å; Y706-I708 VanDerWaalsContact C-N 3.32Å; Y706-I708 PolarHBondContact O-N 3.01Å
707	S	25.7	Very low	32	Very low	103 Å²	103	129.5 Å²	129.5	72%	0.72	67%	0.672	S	S	*	*			trans	-65.1	98.2	164.5	51.6	0	0	0	0	107.6	Y705 D709	Y705-S707 PolarHBondContact O-N 3.29Å; Y705-S707 VanDerWaalsContact O-N 3.16Å; S707-D709 PolarHBondContact O-N 3.48Å
708	I	32.1	Very low	33.1	Very low	145 Å²	145	131.5 Å²	131.5	74%	0.744	66%	0.663	S	S	*	*			trans	-56.8	114.7	164.1	-63.5	174.8	0	0	0	105.6	Y706 L710	Y706-I708 VanDerWaalsContact C-N 3.32Å; Y706-I708 PolarHBondContact O-N 3.01Å; I708-L710 PolarHBondContact O-N 2.93Å
709	D	28.6	Very low	34.1	Very low	104 Å²	104	129.1 Å²	129.1	56%	0.556	65%	0.647	S	S	*	*			trans	-67.2	113.1	-170.9	-165	-24.1	0	0	0	109.2	S707 G711 I712	S707-D709 PolarHBondContact O-N 3.48Å; D709-G711 PolarHBondContact O-N 3.35Å; D709-G711 VanDerWaalsContact O-N 3.08Å; D709-G711 PolarHBondContact OD1-N 3.47Å; D709-I712 HydrophobicContact CB-CD1 4.37Å; D709-I712 HydrophobicContact CB-CG1 4.35Å; D709-I712 WeakPolarHBondContact O-CB 3.46Å; D709-I712 PolarHBondContact O-N 3.39Å
710	L	41.2	Very low	34.9	Very low	132 Å²	132	129 Å²	129	69%	0.691	64%	0.641	S	S	*	*	H	α-helix	trans	-62.9	-12.9	178.1	-78.8	129.4	0	0	0	111.8	I708 I712 S714	I708-L710 PolarHBondContact O-N 2.93Å; L710-I712 VanDerWaalsContact C-N 3.31Å; L710-S714 VanDerWaalsContact O-CB 3.23Å; L710-S714 WeakPolarHBondContact O-CB 3.32Å; L710-S714 PolarHBondContact O-N 3.45Å; L710-S714 PolarHBondContact O-OG 3.42Å
711	G	39.3	Very low	35.8	Very low	34 Å²	34	126 Å²	126	35%	0.351	62%	0.622	S	S	.	*	H	α-helix	trans	-56.9	-40.7	162.8	0	0	0	0	0	113.1	D709 S714 T715	D709-G711 PolarHBondContact O-N 3.35Å; D709-G711 VanDerWaalsContact O-N 3.08Å; D709-G711 PolarHBondContact OD1-N 3.47Å; G711-S714 WeakPolarHBondContact CA-OG 3.41Å; G711-S714 PolarHBondContact O-OG 2.61Å; G711-S714 VanDerWaalsContact O-OG 3.11Å; G711-T715 WeakPolarHBondContact O-CB 3.37Å; G711-T715 WeakPolarHBondContact O-CG2 3.4Å; G711-T715 PolarHBondContact O-N 2.91Å; G711-T715 PolarHBondContact O-OG1 2.95Å
712	I	45.2	Very low	36.3	Very low	115 Å²	115	122.8 Å²	122.8	59%	0.59	61%	0.611	S	S	*	*	H	α-helix	trans	-70.9	-45.4	178.8	-58.6	175.3	0	0	0	110.4	D709 L710 S714 T715 F716	D709-I712 HydrophobicContact CB-CD1 4.37Å; D709-I712 HydrophobicContact CB-CG1 4.35Å; D709-I712 WeakPolarHBondContact O-CB 3.46Å; D709-I712 PolarHBondContact O-N 3.39Å; L710-I712 VanDerWaalsContact C-N 3.31Å; I712-S714 PolarHBondContact O-N 3.44Å; I712-T715 WeakPolarHBondContact CA-OG1 3.45Å; I712-T715 PolarHBondContact O-N 3.27Å; I712-T715 PolarHBondContact O-OG1 3.07Å; I712-F716 WeakPolarHBondContact O-CB 3.45Å; I712-F716 PolarHBondContact O-N 2.84Å
713	L	37.1	Very low	37	Very low	94 Å²	94	117.6 Å²	117.6	49%	0.492	60%	0.6	S	S	.	*	H	α-helix	trans	-66.1	-39.9	177.6	-172.5	62.5	0	0	0	111.8	F716 L717	L713-F716 PolarHBondContact O-N 2.85Å; L713-L717 HydrophobicContact CG-CD1 4.12Å; L713-L717 WeakPolarHBondContact O-CB 3.29Å; L713-L717 VanDerWaalsContact O-CG 3.31Å; L713-L717 WeakPolarHBondContact O-CG 3.49Å; L713-L717 PolarHBondContact O-N 3.07Å
714	S	48.1	Very low	37.5	Very low	54 Å²	54	118.4 Å²	118.4	38%	0.378	60%	0.598	S	S	.	*	H	α-helix	trans	-70	-30.9	177.5	64.8	0	0	0	0	113.4	L710 G711 I712 K718	L710-S714 VanDerWaalsContact O-CB 3.23Å; L710-S714 WeakPolarHBondContact O-CB 3.32Å; L710-S714 PolarHBondContact O-N 3.45Å; L710-S714 PolarHBondContact O-OG 3.42Å; G711-S714 WeakPolarHBondContact CA-OG 3.41Å; G711-S714 PolarHBondContact O-OG 2.61Å; G711-S714 VanDerWaalsContact O-OG 3.11Å; I712-S714 PolarHBondContact O-N 3.44Å; S714-K718 VanDerWaalsContact O-CB 3.3Å; S714-K718 WeakPolarHBondContact O-CB 3.5Å; S714-K718 VanDerWaalsContact O-CG 3.29Å; S714-K718 WeakPolarHBondContact O-CG 3.36Å; S714-K718 PolarHBondContact O-N 3.12Å
715	T	45.5	Very low	37.7	Very low	89 Å²	89	116.1 Å²	116.1	55%	0.546	59%	0.589	S	S	.	*	H	α-helix	trans	-74.4	-34.6	171.5	46.6	0	0	0	0	112.2	G711 I712 S719	G711-T715 WeakPolarHBondContact O-CB 3.37Å; G711-T715 WeakPolarHBondContact O-CG2 3.4Å; G711-T715 PolarHBondContact O-N 2.91Å; G711-T715 PolarHBondContact O-OG1 2.95Å; I712-T715 WeakPolarHBondContact CA-OG1 3.45Å; I712-T715 PolarHBondContact O-N 3.27Å; I712-T715 PolarHBondContact O-OG1 3.07Å; T715-S719 WeakPolarHBondContact O-CB 3.46Å; T715-S719 PolarHBondContact O-N 3.33Å
716	F	43.5	Very low	38.2	Very low	132 Å²	132	112.7 Å²	112.7	58%	0.579	58%	0.583	S	S	*	*	H	α-helix	trans	-67	-42.9	172.9	-153.4	-90.3	0	0	0	112.1	I712 L713 S719 M720	I712-F716 WeakPolarHBondContact O-CB 3.45Å; I712-F716 PolarHBondContact O-N 2.84Å; L713-F716 PolarHBondContact O-N 2.85Å; F716-S719 WeakPolarHBondContact O-CB 3.43Å; F716-S719 PolarHBondContact O-N 2.93Å; F716-M720 HydrophobicContact CE1-CE 4.1Å; F716-M720 PolarHBondContact O-N 3.09Å
717	L	50.8	Low	38.4	Very low	105 Å²	105	107.5 Å²	107.5	55%	0.55	58%	0.575	S	S	.	*	H	α-helix	trans	-64.4	-44.6	174	-72.1	170.7	0	0	0	111.8	L713 S719 M720 E721	L713-L717 HydrophobicContact CG-CD1 4.12Å; L713-L717 WeakPolarHBondContact O-CB 3.29Å; L713-L717 VanDerWaalsContact O-CG 3.31Å; L713-L717 WeakPolarHBondContact O-CG 3.49Å; L713-L717 PolarHBondContact O-N 3.07Å; L717-S719 VanDerWaalsContact C-N 3.27Å; L717-S719 PolarHBondContact O-N 2.85Å; L717-M720 PolarHBondContact O-N 2.88Å; L717-E721 WeakPolarHBondContact O-CB 3.11Å; L717-E721 PolarHBondContact O-N 3.32Å
718	K	45.9	Very low	38.3	Very low	139 Å²	139	109.6 Å²	109.6	60%	0.604	58%	0.578	S	S	*	*	H	α-helix	trans	-62.6	-31.8	172.6	-79.1	177.9	175.1	-179.9	0	113.1	S714 E721 C722	S714-K718 VanDerWaalsContact O-CB 3.3Å; S714-K718 WeakPolarHBondContact O-CB 3.5Å; S714-K718 VanDerWaalsContact O-CG 3.29Å; S714-K718 WeakPolarHBondContact O-CG 3.36Å; S714-K718 PolarHBondContact O-N 3.12Å; K718-E721 PolarHBondContact O-N 3.1Å; K718-C722 WeakPolarHBondContact O-CB 3.36Å; K718-C722 PolarHBondContact O-N 3.27Å
719	S	43.7	Very low	38.1	Very low	63 Å²	63	112.3 Å²	112.3	44%	0.441	59%	0.587	S	S	.	*	H	α-helix	trans	-65.2	-43.9	173.8	-173.3	0	0	0	0	111.2	T715 F716 L717 N723	T715-S719 WeakPolarHBondContact O-CB 3.46Å; T715-S719 PolarHBondContact O-N 3.33Å; F716-S719 WeakPolarHBondContact O-CB 3.43Å; F716-S719 PolarHBondContact O-N 2.93Å; L717-S719 VanDerWaalsContact C-N 3.27Å; L717-S719 PolarHBondContact O-N 2.85Å; S719-N723 PolarHBondContact O-N 3.41Å; S719-N723 PolarHBondContact O-ND2 3.3Å
720	M	39.7	Very low	37.9	Very low	114 Å²	114	112.8 Å²	112.8	56%	0.562	59%	0.594	S	S	*	*	H	α-helix	trans	-65.7	-44.1	172.5	-72.6	-157.3	164.1	0	0	112.4	F716 L717 C722 N723 I724	F716-M720 HydrophobicContact CE1-CE 4.1Å; F716-M720 PolarHBondContact O-N 3.09Å; L717-M720 PolarHBondContact O-N 2.88Å; M720-C722 VanDerWaalsContact C-N 3.29Å; M720-C722 PolarHBondContact O-N 2.93Å; M720-N723 PolarHBondContact O-N 3.14Å; M720-I724 WeakPolarHBondContact O-CG1 3.33Å; M720-I724 PolarHBondContact O-N 3.26Å; M720-I724 VanDerWaalsContact O-N 3.13Å
721	E	42.9	Very low	37.2	Very low	93 Å²	93	112.7 Å²	112.7	44%	0.435	60%	0.601	S	S	.	*	H	α-helix	trans	-62.9	-35.2	179.2	-159.6	-171.4	163.3	0	0	112.5	L717 K718 I724 R725	L717-E721 WeakPolarHBondContact O-CB 3.11Å; L717-E721 PolarHBondContact O-N 3.32Å; K718-E721 PolarHBondContact O-N 3.1Å; E721-I724 PolarHBondContact O-N 3.49Å; E721-R725 WeakPolarHBondContact O-CG 3.36Å; E721-R725 PolarHBondContact O-N 3.23Å; E721-R725 IonicContact OE1-CZ 3.48Å; E721-R725 IonicContact OE1-NE 3.43Å; E721-R725 PolarHBondContact OE1-NE 2.74Å; E721-R725 IonicContact OE1-NH2 2.69Å; E721-R725 PolarHBondContact OE1-NH2 2.84Å
722	C	36.3	Very low	36.6	Very low	82 Å²	82	119.1 Å²	119.1	55%	0.554	63%	0.626	S	S	*	*	H	α-helix	trans	-68.5	-40.9	175.2	-167.7	0	0	0	0	112.1	K718 M720 I724 R725	K718-C722 WeakPolarHBondContact O-CB 3.36Å; K718-C722 PolarHBondContact O-N 3.27Å; M720-C722 VanDerWaalsContact C-N 3.29Å; M720-C722 PolarHBondContact O-N 2.93Å; C722-I724 VanDerWaalsContact C-N 3.29Å; C722-I724 PolarHBondContact O-N 2.98Å; C722-R725 PolarHBondContact O-N 2.86Å
723	N	34.1	Very low	35.6	Very low	112 Å²	112	122.2 Å²	122.2	60%	0.599	64%	0.635	S	S	*	*	H	α-helix	trans	-66.4	-28.5	176.7	-79.8	-72.7	0	0	0	113.1	S719 M720	S719-N723 PolarHBondContact O-N 3.41Å; S719-N723 PolarHBondContact O-ND2 3.3Å; M720-N723 PolarHBondContact O-N 3.14Å
724	I	34.6	Very low	34.8	Very low	122 Å²	122	125.5 Å²	125.5	63%	0.626	65%	0.653	S	S	*	*	H	α-helix	trans	-76.6	-28.5	178.9	-68.1	165.6	0	0	0	112	M720 E721 C722 I726	M720-I724 WeakPolarHBondContact O-CG1 3.33Å; M720-I724 PolarHBondContact O-N 3.26Å; M720-I724 VanDerWaalsContact O-N 3.13Å; E721-I724 PolarHBondContact O-N 3.49Å; C722-I724 VanDerWaalsContact C-N 3.29Å; C722-I724 PolarHBondContact O-N 2.98Å; I724-I726 VanDerWaalsContact C-N 3.31Å; I724-I726 PolarHBondContact O-N 3.13Å
725	R	28.3	Very low	33.7	Very low	180 Å²	180	126.8 Å²	126.8	68%	0.679	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	2.9	-176.8	-69.8	175.4	-174.6	-108.5	8.4	115.2	E721 C722 T727	E721-R725 WeakPolarHBondContact O-CG 3.36Å; E721-R725 PolarHBondContact O-N 3.23Å; E721-R725 IonicContact OE1-CZ 3.48Å; E721-R725 IonicContact OE1-NE 3.43Å; E721-R725 PolarHBondContact OE1-NE 2.74Å; E721-R725 IonicContact OE1-NH2 2.69Å; E721-R725 PolarHBondContact OE1-NH2 2.84Å; C722-R725 PolarHBondContact O-N 2.86Å; R725-T727 VanDerWaalsContact C-N 3.34Å
726	I	33	Very low	32.4	Very low	136 Å²	136	128.6 Å²	128.6	70%	0.697	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-8.8	176.5	-63.7	176.7	0	0	0	111.7	I724	I724-I726 VanDerWaalsContact C-N 3.31Å; I724-I726 PolarHBondContact O-N 3.13Å
727	T	30.5	Very low	31.5	Very low	110 Å²	110	126.5 Å²	126.5	68%	0.675	70%	0.698	S	S	*	*	S	Bend	trans	-122.7	60.8	177.9	54.8	0	0	0	0	112.2	R725	R725-T727 VanDerWaalsContact C-N 3.34Å
728	D	25	Very low	30.2	Very low	146 Å²	146	131.1 Å²	131.1	78%	0.781	72%	0.717	S	S	*	*			trans	-171.2	81.5	156.6	-99.6	-25.6	0	0	0	111.2
729	E	26	Very low	29.1	Very low	203 Å²	203	127.7 Å²	127.7	95%	0.949	72%	0.721	S	S	*	*			trans	-116.5	137	155.8	-77	-158.2	152.1	0	0	109.8
730	T	24.9	Very low	28.1	Very low	114 Å²	114	132.2 Å²	132.2	70%	0.699	74%	0.74	S	S	*	*			trans	-111.1	154.5	-162.3	43.4	0	0	0	0	112.3	I732	T730-I732 PolarHBondContact O-N 3.35Å
731	P	26	Very low	27.3	Very low	129 Å²	129	135.9 Å²	135.9	84%	0.838	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-75.8	124.3	-167.8	29	-35.2	0	0	0	113
732	I	28.2	Very low	26.6	Very low	170 Å²	170	137.4 Å²	137.4	87%	0.872	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-97.7	141.4	171	-62.7	179.5	0	0	0	109.7	T730	T730-I732 PolarHBondContact O-N 3.35Å
733	K	23.7	Very low	26	Very low	180 Å²	180	141.5 Å²	141.5	78%	0.783	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-88.3	150.8	-171.4	-65.1	176.6	176.5	177.6	0	113.7
734	D	20.5	Very low	26.1	Very low	163 Å²	163	141.4 Å²	141.4	87%	0.872	80%	0.799	S	S	*	*			trans	19	103	141.1	-48.2	-40.7	0	0	0	117.8
735	G	23.9	Very low	25.5	Very low	81 Å²	81	140.8 Å²	140.8	84%	0.835	81%	0.806	S	S	*	*			trans	-149.6	126.8	165.5	0	0	0	0	0	109.5
736	S	20	Very low	25.1	Very low	126 Å²	126	143.4 Å²	143.4	88%	0.881	82%	0.817	S	S	*	*			trans	-112.3	135.4	-169.6	59.1	0	0	0	0	113.3
737	A	24.5	Very low	24.7	Very low	88 Å²	88	143 Å²	143	73%	0.727	82%	0.821	S	S	*	*			trans	147.7	130.8	141.7	0	0	0	0	0	112.3
738	Q	23.3	Very low	24.2	Very low	202 Å²	202	147.4 Å²	147.4	94%	0.944	83%	0.832	S	S	*	*			trans	47.3	132.3	151.9	-59.1	175.1	-10.8	0	0	119.3
739	G	21.8	Very low	24.2	Very low	68 Å²	68	147.9 Å²	147.9	70%	0.701	83%	0.834	S	S	*	*			cis	167.6	179.3	2.4	0	0	0	0	0	110.8
740	N	23.9	Very low	24.1	Very low	157 Å²	157	149.1 Å²	149.1	84%	0.84	83%	0.83	S	S	*	*			trans	70.5	81.3	172	-59	3.7	0	0	0	118.3
741	E	22.3	Very low	24	Very low	192 Å²	192	150.4 Å²	150.4	90%	0.897	83%	0.831	S	S	*	*				37	115	122.5	-57	-174.7	143.7	0	0	121
742	S	28.9	Very low	24	Very low	125 Å²	125	153.5 Å²	153.5	87%	0.874	83%	0.834	S	S	*	*				-156.3	150.3	120	42.4	0	0	0	0	110.2
743	N	22.9	Very low	23.9	Very low	167 Å²	167	154.9 Å²	154.9	89%	0.893	83%	0.834	S	S	*	*			trans	-113.3	168	-162.6	-106.8	-22.4	0	0	0	113.6
744	P	36.4	Very low	23.9	Very low	110 Å²	110	158 Å²	158	71%	0.714	84%	0.841	S	S	*	*			trans	-110.3	173.7	-147.7	42	-39.8	0	0	0	115.9
745	S	21.9	Very low	24.1	Very low	110 Å²	110	161.3 Å²	161.3	77%	0.769	84%	0.841	S	S	*	*			trans	-160.4	126.9	142.5	58	0	0	0	0	112.7
746	Y	19	Very low	24.2	Very low	234 Å²	234	165.1 Å²	165.1	92%	0.918	84%	0.84	S	S	*	*			trans	-89.3	140.2	164.3	-85.4	-102.4	0	0	0	110.3
747	T	25.6	Very low	24.4	Very low	128 Å²	128	169.8 Å²	169.8	79%	0.785	84%	0.838	S	S	*	*			trans	-136.6	107.1	162	53.7	0	0	0	0	111.6
748	F	19.7	Very low	24.5	Very low	203 Å²	203	172.1 Å²	172.1	89%	0.89	84%	0.844	S	S	*	*			trans	-83.6	133.8	170.8	-165.2	-87.8	0	0	0	108.9
749	N	25.5	Very low	24.5	Very low	156 Å²	156	169.7 Å²	169.7	83%	0.834	84%	0.835	S	S	*	*			trans	-136.2	146.7	-176	-134.4	-25.6	0	0	0	113.7
750	R	24.1	Very low	24.7	Very low	228 Å²	228	173.3 Å²	173.3	86%	0.86	84%	0.843	S	S	*	*			trans	-100.3	160.1	-157.8	-110.5	-179	177.1	177.9	-0.5	115.2
751	I	22.5	Very low	24.8	Very low	142 Å²	142	173.3 Å²	173.3	73%	0.728	84%	0.838	S	S	*	*			trans	-55.8	132.9	178.5	-61.2	157	0	0	0	112.9
752	H	25.7	Very low	25	Very low	193 Å²	193	169.3 Å²	169.3	89%	0.894	83%	0.831	S	S	*	*			trans	-140.9	103	147.1	-93.8	-61.1	0	0	0	110.8	R754	H752-R754 PolarHBondContact O-N 2.57Å
753	K	26.6	Very low	24.8	Very low	199 Å²	199	169.1 Å²	169.1	87%	0.865	83%	0.83	S	S	*	*			trans	-75.5	119.1	167.6	-76.9	-171.8	175	-177.5	0	109.4
754	R	24	Very low	25	Very low	246 Å²	246	164.4 Å²	164.4	93%	0.928	82%	0.821	S	S	*	*			trans	-76.4	122.5	-179.3	-134.9	177.3	-166.4	174.5	4	110	H752	H752-R754 PolarHBondContact O-N 2.57Å
755	R	22.9	Very low	24.6	Very low	233 Å²	233	166 Å²	166	88%	0.879	83%	0.829	S	S	*	*			trans	-82	114.6	175.8	-168.3	-177.8	-141.9	161.8	4.6	109.5
756	I	26.2	Very low	24.8	Very low	160 Å²	160	165.3 Å²	165.3	82%	0.821	83%	0.83	S	S	*	*			trans	-74.8	137.1	172	-59.4	175	0	0	0	108.3
757	R	24.6	Very low	25.3	Very low	224 Å²	224	160 Å²	160	85%	0.845	82%	0.824	S	S	*	*			trans	-109.6	130.6	168.4	-80.1	178.2	165.4	149	-7.2	108.1
758	T	26	Very low	25.3	Very low	137 Å²	137	162 Å²	162	84%	0.84	83%	0.829	S	S	*	*			trans	-71.9	149.7	162.4	37.7	0	0	0	0	109.7
759	M	23.8	Very low	25.7	Very low	152 Å²	152	161.4 Å²	161.4	75%	0.749	83%	0.829	S	S	*	*			trans	-96	137.6	177.8	-69.4	178.4	64.4	0	0	110.4	E761	M759-E761 HydrophobicContact CE-CG 4.26Å; M759-E761 WeakPolarHBondContact CE-OE1 3.18Å
760	T	25.6	Very low	25.9	Very low	143 Å²	143	159.5 Å²	159.5	88%	0.877	83%	0.825	S	S	*	*			trans	-118.9	100.8	167.9	39.6	0	0	0	0	109.2
761	E	27.6	Very low	26.2	Very low	157 Å²	157	154.7 Å²	154.7	73%	0.734	83%	0.826	S	S	*	*			trans	-107.4	148	172.1	-73.3	-174.9	177.5	0	0	109.4	M759	M759-E761 HydrophobicContact CE-CG 4.26Å; M759-E761 WeakPolarHBondContact CE-OE1 3.18Å
762	S	26.5	Very low	26.5	Very low	108 Å²	108	159 Å²	159	76%	0.755	83%	0.833	S	S	*	*			cis	-158.2	-179.6	-14.7	55.5	0	0	0	0	110.2
763	S	23.6	Very low	26.8	Very low	121 Å²	121	156 Å²	156	85%	0.846	82%	0.824	S	S	*	*			trans	-69.6	140.8	-172.9	53.2	0	0	0	0	115.6
764	G	28.1	Very low	27.6	Very low	69 Å²	69	152.1 Å²	152.1	71%	0.711	82%	0.819	S	S	*	*			trans	-148.1	97.5	168.6	0	0	0	0	0	113.8
765	T	27.8	Very low	28.2	Very low	144 Å²	144	145.8 Å²	145.8	88%	0.883	81%	0.808	S	S	*	*			trans	24.3	112.9	161.7	44.7	0	0	0	0	120
766	A	25.4	Very low	28.8	Very low	95 Å²	95	141 Å²	141	79%	0.785	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-82.4	142	170.7	0	0	0	0	0	113.5
767	P	28.8	Very low	29.1	Very low	123 Å²	123	138 Å²	138	80%	0.799	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-72.1	160.5	168.7	-16.9	31.9	0	0	0	113.6
768	L	26.7	Very low	29.8	Very low	170 Å²	170	134.2 Å²	134.2	89%	0.89	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-75.2	147.8	-179.1	-79	76.5	0	0	0	113.2
769	H	27.9	Very low	30	Very low	189 Å²	189	135.1 Å²	135.1	88%	0.875	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-69	136.6	171.6	-93	-90.2	0	0	0	112.7
770	P	30.1	Very low	30.3	Very low	116 Å²	116	137.7 Å²	137.7	75%	0.753	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-75.4	164.6	160.6	32.6	-33.6	0	0	0	111.9
771	S	29.5	Very low	30.7	Very low	127 Å²	127	136.8 Å²	136.8	89%	0.888	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-74.2	156.6	-172.4	48.3	0	0	0	0	115.1
772	R	28.8	Very low	30.8	Very low	232 Å²	232	140.4 Å²	140.4	88%	0.875	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-93.8	124.1	-168.8	178.2	-173.2	-172.7	178.5	3.7	113
773	D	32.7	Very low	31.1	Very low	132 Å²	132	139.9 Å²	139.9	71%	0.706	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-83.7	138.3	169.4	-116.6	-35.6	0	0	0	111.5
774	P	43	Very low	31.6	Very low	116 Å²	116	137.4 Å²	137.4	75%	0.753	76%	0.756	S	S	*	*	S	Bend	trans	-92.8	0.7	-169.2	35.7	-36	0	0	0	115.6
775	T	36.4	Very low	31.7	Very low	113 Å²	113	142.7 Å²	142.7	69%	0.693	75%	0.754	S	S	*	*			trans	-89.5	-2.2	-167.8	40.5	0	0	0	0	116.1
776	I	36.1	Very low	31.8	Very low	133 Å²	133	143.3 Å²	143.3	68%	0.682	75%	0.753	S	S	*	*	S	Bend	trans	-105.4	119.7	-176.2	-58.9	179.2	0	0	0	111.3
777	P	31.2	Very low	31.9	Very low	96 Å²	96	143.1 Å²	143.1	62%	0.623	75%	0.745	S	S	*	*			trans	-68.3	137.9	178.5	-23.3	35.1	0	0	0	114.6	L779 W780	P777-L779 PolarHBondContact O-N 3.46Å; P777-W780 PolarHBondContact O-N 3.03Å
778	I	39.6	Very low	31.8	Very low	146 Å²	146	142.7 Å²	142.7	75%	0.749	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.3	-26.8	-172.1	-62.6	166	0	0	0	114.5	W780	I778-W780 PolarHBondContact O-N 3.06Å
779	L	30.9	Very low	31.9	Very low	156 Å²	156	139 Å²	139	82%	0.817	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-30.9	-172.7	-144.5	84.6	0	0	0	113.9	P777	P777-L779 PolarHBondContact O-N 3.46Å
780	W	29.8	Very low	31.9	Very low	206 Å²	206	136.1 Å²	136.1	78%	0.78	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-77.4	-25.5	-174.4	-87.9	66.9	0	0	0	113.6	P777 I778 R782 S783	P777-W780 PolarHBondContact O-N 3.03Å; I778-W780 PolarHBondContact O-N 3.06Å; W780-R782 PolarHBondContact O-N 3.19Å; W780-S783 WeakPolarHBondContact O-CB 3.42Å; W780-S783 PolarHBondContact O-N 2.97Å
781	E	34.4	Very low	31.7	Very low	123 Å²	123	139.2 Å²	139.2	58%	0.575	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-71.5	-11.9	-175.9	-161	177.4	-149.7	0	0	113.7
782	R	29.8	Very low	31.6	Very low	234 Å²	234	142.3 Å²	142.3	88%	0.883	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-77.8	-19.9	168.4	-83.5	-171	171.7	-169.3	-2.6	113.7	W780	W780-R782 PolarHBondContact O-N 3.19Å
783	S	31.9	Very low	31.5	Very low	97 Å²	97	136.5 Å²	136.5	68%	0.678	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-33.2	-177.6	-160	0	0	0	0	112.7	W780	W780-S783 WeakPolarHBondContact O-CB 3.42Å; W780-S783 PolarHBondContact O-N 2.97Å
784	S	35	Very low	31.3	Very low	68 Å²	68	136.7 Å²	136.7	48%	0.476	72%	0.718	S	S	.	*	G	3₁₀ helix	trans	-80.8	-12.6	-174.2	53.6	0	0	0	0	115.5	N786 S787	S784-N786 PolarHBondContact O-N 3.21Å; S784-S787 CarbonylContact O-C 3.59Å; S784-S787 PolarHBondContact O-N 3.44Å
785	R	29.9	Very low	30.6	Very low	180 Å²	180	138 Å²	138	68%	0.679	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-62.9	-24.5	-175.9	-74.5	-177	179.5	-149.1	-5.1	114.4	S787	R785-S787 VanDerWaalsContact C-N 3.31Å
786	N	30.1	Very low	30.2	Very low	158 Å²	158	141.6 Å²	141.6	85%	0.845	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-97	24.5	174.3	-66.6	19.5	0	0	0	111.9	S784	S784-N786 PolarHBondContact O-N 3.21Å
787	S	27	Very low	29.7	Very low	90 Å²	90	142.6 Å²	142.6	63%	0.629	73%	0.734	S	S	*	*			trans	-142.5	55.7	177.2	-68.1	0	0	0	0	110.8	S784 R785 A789	S784-S787 CarbonylContact O-C 3.59Å; S784-S787 PolarHBondContact O-N 3.44Å; R785-S787 VanDerWaalsContact C-N 3.31Å; S787-A789 PolarHBondContact O-N 3.14Å
788	T	27.6	Very low	29.5	Very low	114 Å²	114	146.7 Å²	146.7	70%	0.699	74%	0.742	S	S	*	*			trans	-64	83.8	160.3	49.6	0	0	0	0	109.2	N790	T788-N790 VanDerWaalsContact C-N 3.28Å; T788-N790 PolarHBondContact O-N 2.77Å
789	A	28.2	Very low	29	Very low	93 Å²	93	145.7 Å²	145.7	77%	0.769	75%	0.745	S	S	*	*			trans	-64.7	92.5	166.1	0	0	0	0	0	107.9	S787 Q791	S787-A789 PolarHBondContact O-N 3.14Å; A789-Q791 PolarHBondContact O-N 2.97Å
790	N	27.9	Very low	29	Very low	128 Å²	128	146.3 Å²	146.3	68%	0.684	75%	0.747	S	S	*	*			trans	-57.9	106	176	-77.4	-14.8	0	0	0	108.7	T788 F792	T788-N790 VanDerWaalsContact C-N 3.28Å; T788-N790 PolarHBondContact O-N 2.77Å; N790-F792 PolarHBondContact O-N 3.36Å
791	Q	26	Very low	29	Very low	182 Å²	182	142.2 Å²	142.2	85%	0.85	75%	0.745	S	S	*	*			trans	-60.9	103.8	167.6	-81.3	-178.2	-44.7	0	0	107.6	A789 V793	A789-Q791 PolarHBondContact O-N 2.97Å; Q791-V793 VanDerWaalsContact C-N 3.28Å; Q791-V793 PolarHBondContact O-N 3.02Å
792	F	27.6	Very low	28.7	Very low	192 Å²	192	142.8 Å²	142.8	84%	0.842	76%	0.759	S	S	*	*			trans	-66.6	90.1	171.9	-97.2	-96.2	0	0	0	108.7	N790 L794	N790-F792 PolarHBondContact O-N 3.36Å; F792-L794 PolarHBondContact O-N 3.07Å
793	V	26.8	Very low	28.6	Very low	109 Å²	109	135 Å²	135	66%	0.661	75%	0.753	S	S	*	*			trans	-60.4	119.1	169.7	177	0	0	0	0	107.7	Q791 D795	Q791-V793 VanDerWaalsContact C-N 3.28Å; Q791-V793 PolarHBondContact O-N 3.02Å; V793-D795 HydrophobicContact CG1-CB 4.46Å; V793-D795 PolarHBondContact O-N 2.79Å; V793-D795 VanDerWaalsContact O-N 3.15Å
794	L	28.9	Very low	28.3	Very low	136 Å²	136	142 Å²	142	71%	0.712	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-72.7	-10.8	-162.7	-150.3	70	0	0	0	113.9	F792 Q796	F792-L794 PolarHBondContact O-N 3.07Å; L794-Q796 PolarHBondContact O-N 3.09Å
795	D	28.3	Very low	28	Very low	145 Å²	145	145.5 Å²	145.5	78%	0.775	78%	0.782	S	S	*	*	G	3₁₀ helix	trans	-84.4	2.6	-162.5	-63.6	-42.8	0	0	0	116.3	V793	V793-D795 HydrophobicContact CG1-CB 4.46Å; V793-D795 PolarHBondContact O-N 2.79Å; V793-D795 VanDerWaalsContact O-N 3.15Å
796	Q	27.5	Very low	28	Very low	188 Å²	188	146.1 Å²	146.1	88%	0.879	79%	0.79	S	S	*	*	G	3₁₀ helix	trans	-97.1	12.1	173.2	-64.1	-142.1	22.1	0	0	114.5	L794 K798	L794-Q796 PolarHBondContact O-N 3.09Å; Q796-K798 PolarHBondContact O-N 3.17Å
797	L	25.6	Very low	28.1	Very low	154 Å²	154	146.6 Å²	146.6	81%	0.806	79%	0.787	S	S	*	*			trans	-79	64.1	167.5	-77.5	167.1	0	0	0	112.2
798	K	27.1	Very low	28.4	Very low	182 Å²	182	147.7 Å²	147.7	79%	0.791	79%	0.792	S	S	*	*	S	Bend	trans	-116.2	136.4	161.6	-114.2	179.7	177.1	174.2	0	109.7	Q796 I800	Q796-K798 PolarHBondContact O-N 3.17Å; K798-I800 PolarHBondContact O-N 3.12Å
799	P	29.4	Very low	28.7	Very low	125 Å²	125	148.2 Å²	148.2	81%	0.812	79%	0.79	S	S	*	*			trans	-74.7	115.7	-160.5	28.2	-34.6	0	0	0	112.1
800	I	31.4	Very low	29.4	Very low	168 Å²	168	146.6 Å²	146.6	86%	0.862	77%	0.773	S	S	*	*			trans	-77.4	129.2	169.7	-64.2	177.2	0	0	0	108.8	K798	K798-I800 PolarHBondContact O-N 3.12Å
801	T	28.5	Very low	30.1	Very low	120 Å²	120	145.3 Å²	145.3	74%	0.736	77%	0.766	S	S	*	*			trans	-59	139.9	-171.8	-39	0	0	0	0	112.6	G803	T801-G803 PolarHBondContact O-N 3.14Å
802	P	28.4	Very low	31.2	Very low	135 Å²	135	143 Å²	143	88%	0.877	76%	0.758	S	S	*	*	S	Bend	trans	-68	104	179.8	27.4	-35.2	0	0	0	111.3
803	G	27.3	Very low	32.1	Very low	72 Å²	72	137.4 Å²	137.4	74%	0.742	74%	0.737	S	S	*	*			trans	-167	-1.3	-177.6	0	0	0	0	0	117.6	T801	T801-G803 PolarHBondContact O-N 3.14Å
804	R	25.6	Very low	33	Very low	242 Å²	242	139.3 Å²	139.3	91%	0.913	73%	0.732	S	S	*	*			trans	-138.1	96.3	171.7	-78.7	-169.4	177.6	-177.4	-0.1	111.8	K806	R804-K806 PolarHBondContact O-N 3.36Å
805	V	29.2	Very low	33.6	Very low	142 Å²	142	141.4 Å²	141.4	86%	0.861	73%	0.732	S	S	*	*			trans	-65	111.2	153.4	178.4	0	0	0	0	106.5	Q807	V805-Q807 PolarHBondContact O-N 3.23Å
806	K	30.1	Very low	34.5	Very low	194 Å²	194	137.6 Å²	137.6	84%	0.843	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-65.8	116.4	163.5	-76.2	-174.2	175.9	-176.6	0	106.6	R804	R804-K806 PolarHBondContact O-N 3.36Å
807	Q	31.5	Very low	35.1	Very low	168 Å²	168	133.7 Å²	133.7	79%	0.785	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-56.9	140.6	168.7	-73.6	175.1	-42.5	0	0	108.7	V805 L809	V805-Q807 PolarHBondContact O-N 3.23Å; Q807-L809 PolarHBondContact O-N 3.23Å
808	P	34.3	Very low	36.4	Very low	113 Å²	113	129.8 Å²	129.8	73%	0.734	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-62.3	133.3	179.5	26.2	-33.6	0	0	0	109.7
809	L	33.7	Very low	37.2	Very low	125 Å²	125	128.2 Å²	128.2	65%	0.654	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-58.8	144.4	172.1	-99.7	64.8	0	0	0	110	Q807 D813	Q807-L809 PolarHBondContact O-N 3.23Å; L809-D813 HydrophobicContact CB-CB 4.31Å; L809-D813 HydrophobicContact CD2-CB 4.05Å; L809-D813 HydrophobicContact CG-CB 4.37Å
810	S	43.4	Very low	37.9	Very low	59 Å²	59	129.6 Å²	129.6	41%	0.413	67%	0.673	S	S	.	*	P	Polyproline II helix	trans	-68.3	154.7	-176.9	76.6	0	0	0	0	110.3	I812 D813	S810-I812 PolarHBondContact O-N 3.27Å; S810-I812 VanDerWaalsContact O-N 3.15Å; S810-D813 WeakPolarHBondContact CB-OD2 3.49Å; S810-D813 PolarHBondContact N-OD2 3.45Å; S810-D813 WeakPolarHBondContact O-CB 3.34Å; S810-D813 PolarHBondContact O-N 2.87Å; S810-D813 PolarHBondContact OG-OD2 3.26Å
811	D	41.4	Very low	38.5	Very low	100 Å²	100	128.5 Å²	128.5	54%	0.535	66%	0.664	S	S	.	*	H	α-helix	trans	-64.7	-22.3	-176.3	-64.1	-54.1	0	0	0	112.9	D813 R814 Y815	D811-D813 VanDerWaalsContact C-N 3.33Å; D811-D813 PolarHBondContact O-N 3.4Å; D811-R814 WeakPolarHBondContact O-CB 3.45Å; D811-R814 PolarHBondContact O-N 3.45Å; D811-R814 IonicContact OD1-CZ 3.84Å; D811-R814 IonicContact OD1-NE 3.79Å; D811-R814 PolarHBondContact OD1-NE 2.72Å; D811-R814 IonicContact OD1-NH2 2.9Å; D811-Y815 VanDerWaalsContact O-CD2 3.31Å; D811-Y815 WeakPolarHBondContact O-CD2 3.36Å; D811-Y815 PolarHBondContact O-N 3.05Å
812	I	50	Low	39.6	Very low	135 Å²	135	129.4 Å²	129.4	69%	0.692	66%	0.663	S	S	*	*	H	α-helix	trans	-59.4	-44.1	172.5	-62.3	173.3	0	0	0	110.7	S810 R814 Y815 S816	S810-I812 PolarHBondContact O-N 3.27Å; S810-I812 VanDerWaalsContact O-N 3.15Å; I812-R814 PolarHBondContact O-N 3.08Å; I812-Y815 PolarHBondContact O-N 3.47Å; I812-S816 PolarHBondContact O-N 3.33Å
813	D	46.1	Very low	40.3	Very low	73 Å²	73	130.7 Å²	130.7	39%	0.39	68%	0.675	S	S	.	*	H	α-helix	trans	-64.7	-32.1	-179.9	-51.4	-57.7	0	0	0	111.4	L809 S810 D811 M817	L809-D813 HydrophobicContact CB-CB 4.31Å; L809-D813 HydrophobicContact CD2-CB 4.05Å; L809-D813 HydrophobicContact CG-CB 4.37Å; S810-D813 WeakPolarHBondContact CB-OD2 3.49Å; S810-D813 PolarHBondContact N-OD2 3.45Å; S810-D813 WeakPolarHBondContact O-CB 3.34Å; S810-D813 PolarHBondContact O-N 2.87Å; S810-D813 PolarHBondContact OG-OD2 3.26Å; D811-D813 VanDerWaalsContact C-N 3.33Å; D811-D813 PolarHBondContact O-N 3.4Å; D813-M817 PolarHBondContact O-N 3.34Å; D813-M817 VanDerWaalsContact O-N 3.08Å
814	R	44.8	Very low	41	Very low	149 Å²	149	133.6 Å²	133.6	56%	0.562	67%	0.672	S	S	*	*	H	α-helix	trans	-68.6	-41.8	176.7	-56.9	-173.5	-168	-167.2	10.5	112.1	D811 I812 M817 V818	D811-R814 WeakPolarHBondContact O-CB 3.45Å; D811-R814 PolarHBondContact O-N 3.45Å; D811-R814 IonicContact OD1-CZ 3.84Å; D811-R814 IonicContact OD1-NE 3.79Å; D811-R814 PolarHBondContact OD1-NE 2.72Å; D811-R814 IonicContact OD1-NH2 2.9Å; I812-R814 PolarHBondContact O-N 3.08Å; R814-M817 PolarHBondContact O-N 3.16Å; R814-V818 WeakPolarHBondContact O-CG2 3.48Å; R814-V818 PolarHBondContact O-N 3.01Å
815	Y	42.8	Very low	41.8	Very low	181 Å²	181	127.9 Å²	127.9	71%	0.71	66%	0.659	S	S	*	*	H	α-helix	trans	-67.3	-41.6	176.2	-79.9	-76.2	0	0	0	111.4	D811 I812 M817 V818 E819	D811-Y815 VanDerWaalsContact O-CD2 3.31Å; D811-Y815 WeakPolarHBondContact O-CD2 3.36Å; D811-Y815 PolarHBondContact O-N 3.05Å; I812-Y815 PolarHBondContact O-N 3.47Å; Y815-M817 VanDerWaalsContact C-N 3.33Å; Y815-M817 PolarHBondContact O-N 2.57Å; Y815-V818 PolarHBondContact O-N 3.32Å; Y815-V818 VanDerWaalsContact O-N 3.11Å; Y815-E819 PolarHBondContact O-N 3.23Å
816	S	46.8	Very low	42.5	Very low	64 Å²	64	127.1 Å²	127.1	45%	0.448	65%	0.648	S	S	.	*	H	α-helix	trans	-57	-44.5	174.4	-169.7	0	0	0	0	112.4	I812 V818 E819 E820	I812-S816 PolarHBondContact O-N 3.33Å; S816-V818 VanDerWaalsContact C-N 3.28Å; S816-V818 PolarHBondContact O-N 3.26Å; S816-E819 PolarHBondContact O-N 3.18Å; S816-E820 PolarHBondContact O-N 3.39Å
817	M	40.6	Very low	43.2	Very low	106 Å²	106	123.2 Å²	123.2	52%	0.522	64%	0.636	S	S	.	*	H	α-helix	trans	-70.4	-24.2	179.5	-160.5	-171.4	75.7	0	0	112.9	D813 R814 Y815 Q821	D813-M817 PolarHBondContact O-N 3.34Å; D813-M817 VanDerWaalsContact O-N 3.08Å; R814-M817 PolarHBondContact O-N 3.16Å; Y815-M817 VanDerWaalsContact C-N 3.33Å; Y815-M817 PolarHBondContact O-N 2.57Å; M817-Q821 WeakPolarHBondContact O-CG 3.47Å; M817-Q821 PolarHBondContact O-N 3.44Å
818	V	51.4	Low	44	Very low	72 Å²	72	120.4 Å²	120.4	44%	0.436	63%	0.627	S	S	.	*	H	α-helix	trans	-76.6	-37	173	169.8	0	0	0	0	111.2	R814 Y815 S816 Q821 I822	R814-V818 WeakPolarHBondContact O-CG2 3.48Å; R814-V818 PolarHBondContact O-N 3.01Å; Y815-V818 PolarHBondContact O-N 3.32Å; Y815-V818 VanDerWaalsContact O-N 3.11Å; S816-V818 VanDerWaalsContact C-N 3.28Å; S816-V818 PolarHBondContact O-N 3.26Å; V818-Q821 PolarHBondContact O-N 3.22Å; V818-I822 HydrophobicContact CG1-CD1 3.73Å; V818-I822 WeakPolarHBondContact O-CD1 3.16Å; V818-I822 VanDerWaalsContact O-CG1 3.27Å; V818-I822 WeakPolarHBondContact O-CG1 3.38Å; V818-I822 PolarHBondContact O-N 3.42Å
819	E	45.4	Very low	44.6	Very low	149 Å²	149	120.9 Å²	120.9	70%	0.696	62%	0.62	S	S	*	*	H	α-helix	trans	-65.8	-42.2	171.6	-70.8	-167.7	126.6	0	0	111.9	Y815 S816 Q821 I822 S823	Y815-E819 PolarHBondContact O-N 3.23Å; S816-E819 PolarHBondContact O-N 3.18Å; E819-Q821 PolarHBondContact O-N 3.35Å; E819-I822 PolarHBondContact O-N 2.9Å; E819-I822 VanDerWaalsContact O-N 3.08Å; E819-S823 PolarHBondContact O-N 3.27Å; E819-S823 VanDerWaalsContact O-N 3.12Å
820	E	43	Very low	45.4	Very low	154 Å²	154	120.6 Å²	120.6	72%	0.72	62%	0.618	S	S	*	*	H	α-helix	trans	-65.6	-17.8	174.2	-76.5	-165.1	140.7	0	0	114.2	S816	S816-E820 PolarHBondContact O-N 3.39Å
821	Q	43.3	Very low	45.5	Very low	146 Å²	146	125.3 Å²	125.3	68%	0.682	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-4.4	172.9	-75.2	-173.9	-2.9	0	0	114.1	M817 V818 E819	M817-Q821 WeakPolarHBondContact O-CG 3.47Å; M817-Q821 PolarHBondContact O-N 3.44Å; V818-Q821 PolarHBondContact O-N 3.22Å; E819-Q821 PolarHBondContact O-N 3.35Å
822	I	52.5	Low	45.9	Very low	138 Å²	138	127.4 Å²	127.4	71%	0.708	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	-20.8	179.2	-70.5	171	0	0	0	111.9	V818 E819	V818-I822 HydrophobicContact CG1-CD1 3.73Å; V818-I822 WeakPolarHBondContact O-CD1 3.16Å; V818-I822 VanDerWaalsContact O-CG1 3.27Å; V818-I822 WeakPolarHBondContact O-CG1 3.38Å; V818-I822 PolarHBondContact O-N 3.42Å; E819-I822 PolarHBondContact O-N 2.9Å; E819-I822 VanDerWaalsContact O-N 3.08Å
823	S	44	Very low	45.5	Very low	162 Å²	162	126.7 Å²	126.7	100%	1.133	64%	0.637	S	S	*	*			trans	-84.3	0	174.5	-172	0	0	0	0	114.6	E819	E819-S823 PolarHBondContact O-N 3.27Å; E819-S823 VanDerWaalsContact O-N 3.12Å

Retrieved 823 of 823 residues in 979.7 ms (Link to these results)

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