A0A087YKE7_POEFO Loading...

LIM and calponin homology domains 1

AlphaFold DB , UniProt , Accession A0A087YKE7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,069 aa.

						>A0A087YKE7_POEFO|A0A087YKE7
MASPVADLGQSHQHHPGSESAADSAFLEAQKWIEAATGRCFGDKDFRGGLENGILLCELLSSIRPGLVKKINRLPTPIAGLDNLSVFLRGCEELGLKGSQLFDPGDLQDTSTRPAARGSDCSRRLKNVLITIYWLGRAANSCTSYNGPTLDLKEFEGLLSQMRKEAEAAESPQRSIRDSGYIDCWDSERSDSLSPPRHGREDSFDSLDSFGSRSQQTPSPDVLVPRGSSDGRGSDSESDGTPNRKMPDLHKDDMLARRTSVTELRTAMPFNQYLPNRSNQSGYVPAPLRKKKNEKEEGGHKSWSTATSPVGGGRPCRSLSMIDMRGENEAILQPHSHIRHELMHNQYNRIKEDENHWQEDLARWKSRRRSVSQDLIKKEEERKMMEQLMSGDSCISQRRKSIKTYREIVEDKERREEELREAYRKARTSEEASAILQRYAQRFSISEAILERLQLPKLLDRSVSADPSFPTSPFSLSLSSSPTTPDPFDEPSEGPLRYLRQQSAPAPRFTSTLEAQIEEFPKDSSSHQRPQIRSRSSEPPSTRALSPKPVPLLTPKPYFQPRLSADEKWNSKADSLLRVNGDIRNDPSSMKSESKERDSPPLFQASPDAPPSDASPARSPPASPERGRPVSTKTSGRQSSMEAASVSEGSPTPTRPTSLPEELKQPEDSFVETGGQKAAAQQEEKSTTAAHKAPPAEAKLEKTEQFTGNVLQILPSEVNTPNDPTSTESFQGVETAPSPAAPGSLGHNPLRETSSEFEISVRSPQSSSNPKSRWEFFAPPEAAEKDRHENEKYQREQEKLKEEWEKAQREVAEEERKYHEEERRILEETVMPLTPRSSALPSPSRGGLSSTSEPQDTIVRSLADWERKQELLERQSRGSTESAEWKRKENDRTSDISTADDSMKTGRSLVSQNSSQTERLAHSVHNGQKLPPTSPKCSTPPKKQTGPDSTRTSRPAGERRCSPTDNNVRSSSKPLAACSSAPDTFPPPPNRSVSGKKLCSSCSQPLGKGAAMIIETLSLYFHIHCFKCGVCKGQLGDTTTGTDVRIRNGLLNCNQCYIRSRSAGQPTTL
					

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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	46.3	Very low	34.8	Very low	241 Å²	241	134.8 Å²	134.8	100%	1.187	84%	0.835	S	S	*	*				0	150.7	0	-81.9	-58.1	-167.7	0	0	108.4
2	A	35.5	Very low	34.7	Very low	104 Å²	104	140.1 Å²	140.1	86%	0.86	84%	0.842	S	S	*	*			trans	67.6	141.5	-174.2	0	0	0	0	0	116.3
3	S	39.1	Very low	34.3	Very low	109 Å²	109	139.9 Å²	139.9	76%	0.762	83%	0.827	S	S	*	*			trans	-135.6	155.4	176.2	-48.3	0	0	0	0	108.7
4	P	46.9	Very low	34.3	Very low	120 Å²	120	143.4 Å²	143.4	78%	0.779	83%	0.83	S	S	*	*			trans	-95.9	123.8	145.8	32.4	-23.8	0	0	0	108.4
5	V	33.1	Very low	33.8	Very low	137 Å²	137	143.1 Å²	143.1	83%	0.83	82%	0.817	S	S	*	*				60	110.6	67.9	-177.6	0	0	0	0	110.8
6	A	36.3	Very low	34.1	Very low	94 Å²	94	140.7 Å²	140.7	78%	0.777	81%	0.809	S	S	*	*			trans	-89.3	148.1	175.6	0	0	0	0	0	110.8
7	D	27.1	Very low	34.2	Very low	159 Å²	159	135 Å²	135	85%	0.85	79%	0.788	S	S	*	*			trans	-124.6	128.2	162.2	-170	8.7	0	0	0	108.1
8	L	33.3	Very low	35	Very low	157 Å²	157	130.3 Å²	130.3	82%	0.822	76%	0.764	S	S	*	*			trans	-101	98.3	-172.9	-82.8	168.4	0	0	0	109.2	Q10	L8-Q10 PolarHBondContact O-N 2.77Å
9	G	30	Very low	36.1	Very low	73 Å²	73	130.9 Å²	130.9	75%	0.753	76%	0.759	S	S	*	*			trans	-52.4	125.7	-179	0	0	0	0	0	112.5	S11	G9-S11 PolarHBondContact O-N 3.41Å; G9-S11 VanDerWaalsContact O-N 3.1Å
10	Q	27.5	Very low	37.4	Very low	196 Å²	196	128 Å²	128	92%	0.916	75%	0.746	S	S	*	*			trans	-60.7	113.6	179.8	-73	178.7	-22.4	0	0	110.9	L8	L8-Q10 PolarHBondContact O-N 2.77Å
11	S	27.7	Very low	39	Very low	93 Å²	93	123.2 Å²	123.2	65%	0.65	72%	0.722	S	S	*	*			trans	-67.3	140.2	161.8	50.6	0	0	0	0	109.5	G9 Q13	G9-S11 PolarHBondContact O-N 3.41Å; G9-S11 VanDerWaalsContact O-N 3.1Å; S11-Q13 VanDerWaalsContact C-N 3.28Å; S11-Q13 PolarHBondContact O-N 3.49Å
12	H	33.6	Very low	40.6	Very low	198 Å²	198	112 Å²	112	92%	0.917	67%	0.667	S	S	*	*			trans	-67.1	92.7	165	-109.6	-68.6	0	0	0	108.2	H14	H12-H14 PolarHBondContact O-N 2.94Å
13	Q	29.1	Very low	43	Very low	138 Å²	138	110.9 Å²	110.9	65%	0.645	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-62.2	134.3	170.1	-62.7	-176.6	8.9	0	0	108.9	S11 H15	S11-Q13 VanDerWaalsContact C-N 3.28Å; S11-Q13 PolarHBondContact O-N 3.49Å; Q13-H15 PolarHBondContact O-N 2.79Å
14	H	34.2	Very low	45.4	Very low	188 Å²	188	107.8 Å²	107.8	87%	0.87	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-59.4	117.4	145.8	-87.5	-110	0	0	0	106.2	H12 P16	H12-H14 PolarHBondContact O-N 2.94Å; H14-P16 WeakPolarHBondContact O-CD 3.29Å
15	H	27.7	Very low	47.6	Very low	139 Å²	139	102 Å²	102	64%	0.644	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-62.8	116.8	176.9	-91.3	-68.4	0	0	0	109.4	Q13 G17 S18	Q13-H15 PolarHBondContact O-N 2.79Å; H15-G17 PolarHBondContact O-N 3.19Å; H15-S18 PolarHBondContact O-OG 3.48Å
16	P	38.2	Very low	50.5	Low	105 Å²	105	97.4 Å²	97.4	68%	0.682	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-8	175.5	30.7	-35.3	0	0	0	112.7	H14	H14-P16 WeakPolarHBondContact O-CD 3.29Å
17	G	36.8	Very low	53.2	Low	44 Å²	44	98.7 Å²	98.7	45%	0.454	55%	0.55	S	S	.	.	H	α-helix	trans	-80.1	-10.4	-178.1	0	0	0	0	0	116	H15 A21	H15-G17 PolarHBondContact O-N 3.19Å; G17-A21 WeakPolarHBondContact O-CB 3.45Å; G17-A21 PolarHBondContact O-N 3.33Å
18	S	48.5	Very low	56.4	Low	51 Å²	51	92 Å²	92	36%	0.357	51%	0.513	S	S	.	.	H	α-helix	trans	-81.3	-20.3	-176.4	56.2	0	0	0	0	114.7	H15	H15-S18 PolarHBondContact O-OG 3.48Å
19	E	55	Low	59.4	Low	141 Å²	141	84.5 Å²	84.5	66%	0.659	47%	0.474	S	S	*	.	H	α-helix	trans	-91.3	-48.3	175.4	-64.5	-175	140.9	0	0	109.9	A21 A22 D23	E19-A21 PolarHBondContact O-N 3.29Å; E19-A22 WeakPolarHBondContact O-CA 3.36Å; E19-A22 WeakPolarHBondContact O-CB 3.4Å; E19-A22 PolarHBondContact O-N 3.47Å; E19-D23 VanDerWaalsContact C-OD2 3.24Å; E19-D23 PolarHBondContact O-N 3.28Å
20	S	62.4	Low	62.5	Low	73 Å²	73	83.6 Å²	83.6	51%	0.51	45%	0.45	S	S	.	.	H	α-helix	trans	-49.8	-35.7	174	170.7	0	0	0	0	114.5	A22 D23 S24	S20-A22 VanDerWaalsContact C-N 3.32Å; S20-A22 PolarHBondContact O-N 3.3Å; S20-D23 WeakPolarHBondContact CA-OD2 3.47Å; S20-D23 PolarHBondContact N-OD2 3.28Å; S20-D23 PolarHBondContact O-N 3.04Å; S20-S24 PolarHBondContact O-N 2.95Å
21	A	70.8	Confident	65.7	Low	28 Å²	28	80.1 Å²	80.1	23%	0.231	43%	0.432	C	S	.	.	H	α-helix	trans	-75.2	-15.2	177	0	0	0	0	0	114.7	G17 E19 L158	G17-A21 WeakPolarHBondContact O-CB 3.45Å; G17-A21 PolarHBondContact O-N 3.33Å; E19-A21 PolarHBondContact O-N 3.29Å; A21-L158 PolarHBondContact O-N 3.01Å
22	A	79.8	Confident	68.9	Low	6 Å²	6	75.8 Å²	75.8	5%	0.05	40%	0.402	C	S	.	.	H	α-helix	trans	-92.3	-34.3	167.8	0	0	0	0	0	111.2	E19 S20 S24 A25 F26 L158	E19-A22 WeakPolarHBondContact O-CA 3.36Å; E19-A22 WeakPolarHBondContact O-CB 3.4Å; E19-A22 PolarHBondContact O-N 3.47Å; S20-A22 VanDerWaalsContact C-N 3.32Å; S20-A22 PolarHBondContact O-N 3.3Å; A22-S24 PolarHBondContact O-N 3.07Å; A22-A25 CarbonylContact O-C 3.53Å; A22-A25 WeakPolarHBondContact O-CA 3.47Å; A22-A25 WeakPolarHBondContact O-CB 3.21Å; A22-A25 PolarHBondContact O-N 3.09Å; A22-F26 HydrophobicContact CB-CD2 4.41Å; A22-F26 HydrophobicContact CB-CE2 4.19Å; A22-F26 WeakPolarHBondContact O-CD2 3.45Å; A22-F26 PolarHBondContact O-N 3.12Å; A22-L158 HydrophobicContact CB-CD1 4.45Å
23	D	86.8	Confident	71.9	Confident	79 Å²	79	66.4 Å²	66.4	42%	0.422	36%	0.358	S	S	.	.	H	α-helix	trans	-61.1	-42.3	-179.8	-58	-31.6	0	0	0	112.2	E19 S20 A25 F26 L27	E19-D23 VanDerWaalsContact C-OD2 3.24Å; E19-D23 PolarHBondContact O-N 3.28Å; S20-D23 WeakPolarHBondContact CA-OD2 3.47Å; S20-D23 PolarHBondContact N-OD2 3.28Å; S20-D23 PolarHBondContact O-N 3.04Å; D23-A25 VanDerWaalsContact C-N 3.33Å; D23-A25 PolarHBondContact O-N 2.98Å; D23-F26 PolarHBondContact O-N 3.34Å; D23-L27 WeakPolarHBondContact O-CG 3.25Å; D23-L27 PolarHBondContact O-N 3.47Å
24	S	89.7	Confident	75	Confident	44 Å²	44	62.3 Å²	62.3	31%	0.308	34%	0.339	S	S	.	.	H	α-helix	trans	-52.6	-48.5	168.8	-102.3	0	0	0	0	112.2	S20 A22 F26 L27 E28 E154	S20-S24 PolarHBondContact O-N 2.95Å; A22-S24 PolarHBondContact O-N 3.07Å; S24-F26 PolarHBondContact O-N 3.02Å; S24-L27 PolarHBondContact O-N 2.9Å; S24-E28 PolarHBondContact O-N 3.46Å; S24-E154 WeakPolarHBondContact CB-OE2 3.3Å; S24-E154 PolarHBondContact OG-OE2 3.34Å
25	A	92.9	Very high	77.8	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-68	-33.1	179.8	0	0	0	0	0	112.9	A22 D23 A29 L129 F155 L158	A22-A25 CarbonylContact O-C 3.53Å; A22-A25 WeakPolarHBondContact O-CA 3.47Å; A22-A25 WeakPolarHBondContact O-CB 3.21Å; A22-A25 PolarHBondContact O-N 3.09Å; D23-A25 VanDerWaalsContact C-N 3.33Å; D23-A25 PolarHBondContact O-N 2.98Å; A25-A29 WeakPolarHBondContact O-CB 3.27Å; A25-A29 PolarHBondContact O-N 2.82Å; A25-L129 HydrophobicContact CB-CD1 4.07Å; A25-F155 HydrophobicContact CB-CD1 3.75Å; A25-F155 HydrophobicContact CB-CE1 3.92Å; A25-F155 HydrophobicContact CB-CG 4.08Å; A25-F155 HydrophobicContact CB-CZ 4.36Å; A25-L158 HydrophobicContact CB-CB 4.41Å; A25-L158 HydrophobicContact CB-CD2 3.98Å
26	F	92.9	Very high	81	Confident	40 Å²	40	50.2 Å²	50.2	18%	0.175	30%	0.296	C	S	.	.	H	α-helix	trans	-65.1	-48.5	171.6	-79.4	-66.9	0	0	0	112.2	A22 D23 S24 A29 Q30 F46 L125 L129	A22-F26 HydrophobicContact CB-CD2 4.41Å; A22-F26 HydrophobicContact CB-CE2 4.19Å; A22-F26 WeakPolarHBondContact O-CD2 3.45Å; A22-F26 PolarHBondContact O-N 3.12Å; D23-F26 PolarHBondContact O-N 3.34Å; S24-F26 PolarHBondContact O-N 3.02Å; F26-A29 PolarHBondContact O-N 3.4Å; F26-Q30 WeakPolarHBondContact O-CB 3.47Å; F26-Q30 PolarHBondContact O-N 3.31Å; F26-F46 AromaticContact CD1-CD1 3.58Å; F26-F46 HydrophobicContact CD1-CD1 3.58Å; F26-F46 AromaticContact CD1-CE1 3.74Å; F26-F46 HydrophobicContact CD1-CE1 3.74Å; F26-F46 AromaticContact CD1-CG 3.99Å; F26-F46 HydrophobicContact CD1-CG 3.99Å; F26-F46 HydrophobicContact CD1-CZ 4.27Å; F26-F46 AromaticContact CE1-CD1 3.72Å; F26-F46 HydrophobicContact CE1-CD1 3.72Å; F26-F46 AromaticContact CE1-CE1 3.88Å; F26-F46 HydrophobicContact CE1-CE1 3.88Å; F26-F46 HydrophobicContact CE1-CG 4.5Å; F26-L125 HydrophobicContact CE1-CB 3.87Å; F26-L125 HydrophobicContact CE1-CD1 4.33Å; F26-L125 HydrophobicContact CZ-CB 3.65Å; F26-L125 HydrophobicContact CZ-CD1 4.19Å; F26-L129 HydrophobicContact CD1-CD1 3.76Å; F26-L129 HydrophobicContact CD1-CD2 3.81Å; F26-L129 HydrophobicContact CD1-CG 4.06Å; F26-L129 HydrophobicContact CD2-CD1 3.97Å; F26-L129 HydrophobicContact CE1-CD1 3.68Å; F26-L129 HydrophobicContact CE1-CD2 4.16Å; F26-L129 HydrophobicContact CE1-CG 3.94Å; F26-L129 HydrophobicContact CE2-CD1 3.9Å; F26-L129 HydrophobicContact CG-CD1 3.89Å; F26-L129 HydrophobicContact CG-CD2 4.37Å; F26-L129 HydrophobicContact CZ-CD1 3.75Å; F26-L129 HydrophobicContact CZ-CG 4.41Å
27	L	92.6	Very high	83.5	Confident	121 Å²	121	46.7 Å²	46.7	63%	0.634	27%	0.272	S	S	*	.	H	α-helix	trans	-64.3	-43.9	-178.5	-69.6	171.1	0	0	0	111.5	D23 S24 Q30 K31	D23-L27 WeakPolarHBondContact O-CG 3.25Å; D23-L27 PolarHBondContact O-N 3.47Å; S24-L27 PolarHBondContact O-N 2.9Å; L27-Q30 PolarHBondContact O-N 2.95Å; L27-K31 WeakPolarHBondContact O-CB 3.29Å; L27-K31 PolarHBondContact O-N 3.02Å
28	E	95.4	Very high	86.1	Confident	18 Å²	18	48.1 Å²	48.1	8%	0.084	29%	0.287	C	S	.	.	H	α-helix	trans	-69.9	-38.1	176.6	-177.5	55.3	-160.6	0	0	112.2	S24 K31 W32 L150 D151 E154 F155	S24-E28 PolarHBondContact O-N 3.46Å; E28-K31 IonicContact OE1-NZ 3.17Å; E28-K31 PolarHBondContact OE1-NZ 3.2Å; E28-K31 IonicContact OE2-NZ 3.28Å; E28-K31 PolarHBondContact OE2-NZ 3.14Å; E28-W32 VanDerWaalsContact O-CB 3.27Å; E28-W32 WeakPolarHBondContact O-CB 3.44Å; E28-W32 PolarHBondContact O-N 3.12Å; E28-L150 HydrophobicContact CG-CD1 3.93Å; E28-D151 HydrophobicContact CG-CB 4.18Å; E28-D151 PolarHBondContact OE1-N 3.42Å; E28-E154 HydrophobicContact CB-CB 3.94Å; E28-E154 HydrophobicContact CB-CG 4.09Å; E28-E154 HydrophobicContact CG-CB 4.26Å; E28-E154 HydrophobicContact CG-CG 4.27Å; E28-F155 HydrophobicContact CB-CE2 4.32Å; E28-F155 HydrophobicContact CG-CE2 4.14Å
29	A	95.8	Very high	88	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-59.2	-47.1	171.9	0	0	0	0	0	111.9	A25 F26 I33 F46 L129 I132 F155	A25-A29 WeakPolarHBondContact O-CB 3.27Å; A25-A29 PolarHBondContact O-N 2.82Å; F26-A29 PolarHBondContact O-N 3.4Å; A29-I33 WeakPolarHBondContact O-CB 3.25Å; A29-I33 WeakPolarHBondContact O-CD1 3.34Å; A29-I33 WeakPolarHBondContact O-CG1 3.33Å; A29-I33 PolarHBondContact O-N 3.21Å; A29-F46 HydrophobicContact CB-CE2 3.85Å; A29-F46 HydrophobicContact CB-CZ 3.85Å; A29-L129 HydrophobicContact CB-CD2 3.58Å; A29-I132 HydrophobicContact CB-CD1 4.34Å; A29-I132 HydrophobicContact CB-CG2 4.02Å; A29-F155 HydrophobicContact CB-CZ 4.04Å
30	Q	94.6	Very high	89.5	Confident	53 Å²	53	49 Å²	49	25%	0.248	29%	0.29	C	S	.	.	H	α-helix	trans	-61.8	-56.1	177.6	-177.1	172.2	-16	0	0	110.5	F26 L27 W32 I33 E34 F41 F46	F26-Q30 WeakPolarHBondContact O-CB 3.47Å; F26-Q30 PolarHBondContact O-N 3.31Å; L27-Q30 PolarHBondContact O-N 2.95Å; Q30-W32 VanDerWaalsContact C-N 3.28Å; Q30-W32 PolarHBondContact O-N 3.34Å; Q30-I33 PolarHBondContact O-N 2.79Å; Q30-E34 HydrophobicContact CG-CG 4.12Å; Q30-E34 PolarHBondContact NE2-OE1 3.16Å; Q30-E34 WeakPolarHBondContact O-CG 3.39Å; Q30-E34 PolarHBondContact O-N 3.22Å; Q30-F41 HydrophobicContact CG-CD1 4.44Å; Q30-F41 HydrophobicContact CG-CD2 3.84Å; Q30-F41 HydrophobicContact CG-CE1 4.43Å; Q30-F41 HydrophobicContact CG-CE2 3.84Å; Q30-F41 HydrophobicContact CG-CG 4.16Å; Q30-F41 HydrophobicContact CG-CZ 4.14Å; Q30-F46 HydrophobicContact CB-CD2 4.03Å; Q30-F46 HydrophobicContact CB-CE2 4.21Å
31	K	94.6	Very high	90.6	Very high	123 Å²	123	46.1 Å²	46.1	54%	0.535	27%	0.268	S	S	.	.	H	α-helix	trans	-52.9	-42.7	179.9	167.1	171.7	155.8	-77.1	0	112.6	L27 E28 A35	L27-K31 WeakPolarHBondContact O-CB 3.29Å; L27-K31 PolarHBondContact O-N 3.02Å; E28-K31 IonicContact OE1-NZ 3.17Å; E28-K31 PolarHBondContact OE1-NZ 3.2Å; E28-K31 IonicContact OE2-NZ 3.28Å; E28-K31 PolarHBondContact OE2-NZ 3.14Å; K31-A35 VanDerWaalsContact O-CB 3.26Å; K31-A35 WeakPolarHBondContact O-CB 3.47Å; K31-A35 PolarHBondContact O-N 2.88Å
32	W	95.8	Very high	91	Very high	3 Å²	3	47.1 Å²	47.1	1%	0.011	28%	0.282	C	S	.	.	H	α-helix	trans	-67.1	-45.8	176.2	179.4	60.3	0	0	0	112.4	E28 Q30 E34 A35 A36 L59 I63 I132 L135 G136 A139 Y145 P148 L150	E28-W32 VanDerWaalsContact O-CB 3.27Å; E28-W32 WeakPolarHBondContact O-CB 3.44Å; E28-W32 PolarHBondContact O-N 3.12Å; Q30-W32 VanDerWaalsContact C-N 3.28Å; Q30-W32 PolarHBondContact O-N 3.34Å; W32-E34 VanDerWaalsContact C-N 3.34Å; W32-E34 PolarHBondContact O-N 3.46Å; W32-A35 PolarHBondContact O-N 3.39Å; W32-A36 WeakPolarHBondContact O-CB 3.49Å; W32-A36 PolarHBondContact O-N 3.3Å; W32-L59 HydrophobicContact CE3-CD1 4.41Å; W32-L59 HydrophobicContact CH2-CD1 4Å; W32-L59 HydrophobicContact CH2-CD2 4.33Å; W32-L59 HydrophobicContact CH2-CG 4.49Å; W32-L59 HydrophobicContact CZ2-CD1 4.2Å; W32-L59 HydrophobicContact CZ3-CD1 4.11Å; W32-L59 HydrophobicContact CZ3-CD2 3.98Å; W32-I63 HydrophobicContact CH2-CD1 3.87Å; W32-I63 HydrophobicContact CZ2-CD1 4.19Å; W32-I132 HydrophobicContact CE3-CG2 4Å; W32-I132 HydrophobicContact CZ3-CG2 4.01Å; W32-L135 HydrophobicContact CH2-CG 4.19Å; W32-G136 VanDerWaalsContact CH2-CA 3.49Å; W32-A139 HydrophobicContact CH2-CB 4.47Å; W32-A139 HydrophobicContact CZ2-CB 4.1Å; W32-Y145 PolarHBondContact NE1-OH 3.19Å; W32-P148 PolarHBondContact NE1-O 3.08Å; W32-L150 HydrophobicContact CB-CB 4.48Å; W32-L150 HydrophobicContact CB-CD1 3.44Å; W32-L150 VanDerWaalsContact CB-CD1 3.44Å; W32-L150 HydrophobicContact CD2-CB 3.78Å; W32-L150 HydrophobicContact CD2-CD1 3.82Å; W32-L150 HydrophobicContact CD2-CG 4.29Å; W32-L150 HydrophobicContact CE3-CB 4.24Å; W32-L150 HydrophobicContact CE3-CD1 3.86Å; W32-L150 HydrophobicContact CE3-CD2 4.29Å; W32-L150 HydrophobicContact CE3-CG 4.37Å; W32-L150 HydrophobicContact CG-CB 3.85Å; W32-L150 HydrophobicContact CG-CD1 3.64Å; W32-L150 HydrophobicContact CG-CG 4.36Å
33	I	95.6	Very high	90.7	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-62.7	-42.7	178.7	-67.2	171.4	0	0	0	110.7	A29 Q30 A36 T37 F41 L50 L55 L56 L59 I132	A29-I33 WeakPolarHBondContact O-CB 3.25Å; A29-I33 WeakPolarHBondContact O-CD1 3.34Å; A29-I33 WeakPolarHBondContact O-CG1 3.33Å; A29-I33 PolarHBondContact O-N 3.21Å; Q30-I33 PolarHBondContact O-N 2.79Å; I33-A36 PolarHBondContact O-N 2.84Å; I33-T37 HydrophobicContact CG2-CG2 4.35Å; I33-T37 WeakPolarHBondContact O-CB 3.25Å; I33-T37 VanDerWaalsContact O-CG2 3.31Å; I33-T37 WeakPolarHBondContact O-CG2 3.27Å; I33-T37 PolarHBondContact O-N 3.23Å; I33-T37 PolarHBondContact O-OG1 3.49Å; I33-F41 HydrophobicContact CB-CE2 4.08Å; I33-F41 HydrophobicContact CB-CZ 4.32Å; I33-F41 HydrophobicContact CD1-CZ 4.34Å; I33-F41 HydrophobicContact CG2-CE2 3.78Å; I33-F41 HydrophobicContact CG2-CZ 4.09Å; I33-L50 HydrophobicContact CD1-CD2 4.22Å; I33-L55 HydrophobicContact CG2-CB 4.37Å; I33-L56 HydrophobicContact CD1-CD2 4.45Å; I33-L59 HydrophobicContact CG1-CD2 4.03Å; I33-I132 HydrophobicContact CD1-CD1 3.9Å; I33-I132 HydrophobicContact CD1-CG1 4.41Å
34	E	94.8	Very high	90.2	Very high	53 Å²	53	57.4 Å²	57.4	25%	0.248	33%	0.33	C	S	.	.	H	α-helix	trans	-63.6	-47.5	177.8	-65.7	-173.4	156.6	0	0	111.4	Q30 W32 A36 T37 G38 R39 C40 F41	Q30-E34 HydrophobicContact CG-CG 4.12Å; Q30-E34 PolarHBondContact NE2-OE1 3.16Å; Q30-E34 WeakPolarHBondContact O-CG 3.39Å; Q30-E34 PolarHBondContact O-N 3.22Å; W32-E34 VanDerWaalsContact C-N 3.34Å; W32-E34 PolarHBondContact O-N 3.46Å; E34-A36 PolarHBondContact O-N 3.2Å; E34-T37 PolarHBondContact O-N 3.13Å; E34-G38 WeakPolarHBondContact O-CA 3.39Å; E34-G38 PolarHBondContact O-N 2.84Å; E34-R39 VanDerWaalsContact CA-O 3.27Å; E34-R39 WeakPolarHBondContact CA-O 3.46Å; E34-R39 WeakPolarHBondContact CB-O 3.27Å; E34-R39 WeakPolarHBondContact CG-O 3.27Å; E34-C40 WeakPolarHBondContact OE1-CA 3.14Å; E34-F41 HydrophobicContact CG-CD2 3.58Å; E34-F41 HydrophobicContact CG-CE2 3.84Å; E34-F41 WeakPolarHBondContact OE1-CD2 3.44Å; E34-F41 PolarHBondContact OE1-N 3.49Å
35	A	94	Very high	90	Very high	63 Å²	63	62 Å²	62	52%	0.521	35%	0.351	S	S	.	.	H	α-helix	trans	-68.5	-31.2	178.6	0	0	0	0	0	113.5	K31 W32 P148	K31-A35 VanDerWaalsContact O-CB 3.26Å; K31-A35 WeakPolarHBondContact O-CB 3.47Å; K31-A35 PolarHBondContact O-N 2.88Å; W32-A35 PolarHBondContact O-N 3.39Å; A35-P148 HydrophobicContact CB-CB 4.3Å; A35-P148 HydrophobicContact CB-CG 3.74Å
36	A	93.5	Very high	89.8	Confident	10 Å²	10	63 Å²	63	8%	0.083	36%	0.355	C	S	.	.	H	α-helix	trans	-85.3	-14.9	179.3	0	0	0	0	0	114.2	W32 I33 E34 L59 S62 Y145 P148	W32-A36 WeakPolarHBondContact O-CB 3.49Å; W32-A36 PolarHBondContact O-N 3.3Å; I33-A36 PolarHBondContact O-N 2.84Å; E34-A36 PolarHBondContact O-N 3.2Å; A36-L59 HydrophobicContact CB-CD1 3.56Å; A36-S62 WeakPolarHBondContact O-CB 3.26Å; A36-S62 PolarHBondContact O-OG 3.04Å; A36-Y145 WeakPolarHBondContact CB-OH 3.4Å; A36-P148 HydrophobicContact CB-CG 4.12Å
37	T	92	Very high	89.7	Confident	31 Å²	31	63 Å²	63	19%	0.19	35%	0.354	C	S	.	.	H	α-helix	trans	-110.4	-20.6	177	60	0	0	0	0	114.1	I33 E34 R39 E58 L59	I33-T37 HydrophobicContact CG2-CG2 4.35Å; I33-T37 WeakPolarHBondContact O-CB 3.25Å; I33-T37 VanDerWaalsContact O-CG2 3.31Å; I33-T37 WeakPolarHBondContact O-CG2 3.27Å; I33-T37 PolarHBondContact O-N 3.23Å; I33-T37 PolarHBondContact O-OG1 3.49Å; E34-T37 PolarHBondContact O-N 3.13Å; T37-R39 VanDerWaalsContact C-N 3.27Å; T37-R39 PolarHBondContact OG1-N 3.48Å; T37-E58 HydrophobicContact CG2-CB 4.24Å; T37-L59 HydrophobicContact CG2-CB 3.79Å
38	G	90.2	Very high	89.4	Confident	74 Å²	74	58.6 Å²	58.6	76%	0.763	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	19.9	-171.4	0	0	0	0	0	113.7	E34	E34-G38 WeakPolarHBondContact O-CA 3.39Å; E34-G38 PolarHBondContact O-N 2.84Å
39	R	89.7	Confident	89.1	Confident	114 Å²	114	57.9 Å²	57.9	43%	0.43	34%	0.335	S	S	.	.			trans	-125	136.2	174.7	-61.6	-161.4	-164.4	-75.3	-5.2	111.1	E34 T37 L55 E58	E34-R39 VanDerWaalsContact CA-O 3.27Å; E34-R39 WeakPolarHBondContact CA-O 3.46Å; E34-R39 WeakPolarHBondContact CB-O 3.27Å; E34-R39 WeakPolarHBondContact CG-O 3.27Å; T37-R39 VanDerWaalsContact C-N 3.27Å; T37-R39 PolarHBondContact OG1-N 3.48Å; R39-L55 HydrophobicContact CB-CD2 3.81Å; R39-L55 HydrophobicContact CG-CD2 4.36Å; R39-E58 WeakPolarHBondContact CD-OE2 3.3Å; R39-E58 IonicContact CZ-OE1 2.62Å; R39-E58 IonicContact CZ-OE2 2.7Å; R39-E58 IonicContact NE-OE1 2.99Å; R39-E58 PolarHBondContact NE-OE1 3.4Å; R39-E58 IonicContact NE-OE2 2.59Å; R39-E58 PolarHBondContact NE-OE2 2.9Å; R39-E58 IonicContact NH2-OE1 3.18Å; R39-E58 PolarHBondContact NH2-OE1 2.97Å; R39-E58 IonicContact NH2-OE2 2.74Å
40	C	85.5	Confident	89	Confident	96 Å²	96	57.9 Å²	57.9	65%	0.649	34%	0.335	S	S	*	.			trans	-77.8	159.2	166.2	56.2	0	0	0	0	111.9	E34 G42	E34-C40 WeakPolarHBondContact OE1-CA 3.14Å; C40-G42 VanDerWaalsContact C-N 3.32Å
41	F	85	Confident	88.9	Confident	12 Å²	12	58.8 Å²	58.8	5%	0.053	34%	0.34	C	S	.	.			trans	-74.3	-25.8	172.7	-78	-133	0	0	0	111.8	Q30 I33 E34 F46 L50 L55	Q30-F41 HydrophobicContact CG-CD1 4.44Å; Q30-F41 HydrophobicContact CG-CD2 3.84Å; Q30-F41 HydrophobicContact CG-CE1 4.43Å; Q30-F41 HydrophobicContact CG-CE2 3.84Å; Q30-F41 HydrophobicContact CG-CG 4.16Å; Q30-F41 HydrophobicContact CG-CZ 4.14Å; I33-F41 HydrophobicContact CB-CE2 4.08Å; I33-F41 HydrophobicContact CB-CZ 4.32Å; I33-F41 HydrophobicContact CD1-CZ 4.34Å; I33-F41 HydrophobicContact CG2-CE2 3.78Å; I33-F41 HydrophobicContact CG2-CZ 4.09Å; E34-F41 HydrophobicContact CG-CD2 3.58Å; E34-F41 HydrophobicContact CG-CE2 3.84Å; E34-F41 WeakPolarHBondContact OE1-CD2 3.44Å; E34-F41 PolarHBondContact OE1-N 3.49Å; F41-F46 AromaticContact CE1-CD2 3.7Å; F41-F46 HydrophobicContact CE1-CD2 3.7Å; F41-F46 HydrophobicContact CE1-CE2 4.19Å; F41-F46 HydrophobicContact CE1-CG 4.3Å; F41-F46 HydrophobicContact CZ-CD2 4.12Å; F41-F46 HydrophobicContact CZ-CE2 4.21Å; F41-L50 HydrophobicContact CE1-CD2 3.88Å; F41-L50 HydrophobicContact CE1-CG 3.89Å; F41-L50 HydrophobicContact CZ-CD2 3.7Å; F41-L50 HydrophobicContact CZ-CG 4.17Å; F41-L55 HydrophobicContact CD2-CD1 3.88Å; F41-L55 HydrophobicContact CE2-CD1 3.91Å; F41-L55 HydrophobicContact CG-CD1 4.2Å; F41-L55 HydrophobicContact CZ-CD1 4.25Å
42	G	80.8	Confident	88.7	Confident	50 Å²	50	55.3 Å²	55.3	52%	0.515	33%	0.327	S	S	.	.			trans	73.9	-151.5	-176.9	0	0	0	0	0	112.4	C40 K44	C40-G42 VanDerWaalsContact C-N 3.32Å; G42-K44 PolarHBondContact O-N 3.46Å
43	D	72.5	Confident	88.6	Confident	181 Å²	181	55.1 Å²	55.1	97%	0.968	33%	0.326	S	S	*	.	S	Bend	trans	-72.5	27.4	-179.1	-40.3	-60.3	0	0	0	113.7
44	K	75.9	Confident	88.5	Confident	120 Å²	120	56.6 Å²	56.6	52%	0.522	33%	0.334	S	S	.	.	S	Bend	trans	-116	130.8	-173.7	-64	-176.7	178.9	-175.6	0	110.5	G42	G42-K44 PolarHBondContact O-N 3.46Å
45	D	85.3	Confident	88.5	Confident	139 Å²	139	54.8 Å²	54.8	74%	0.743	33%	0.326	S	S	*	.			trans	-47.7	145.8	165.7	-58.4	-39.3	0	0	0	110.9	R47 G48 G49	D45-R47 CarbonylContact O-C 3.59Å; D45-R47 PolarHBondContact O-N 2.91Å; D45-G48 PolarHBondContact O-N 3.25Å; D45-G49 PolarHBondContact O-N 2.96Å
46	F	89.3	Confident	88.6	Confident	21 Å²	21	51.8 Å²	51.8	9%	0.092	30%	0.301	C	S	.	.	H	α-helix	trans	-41.9	-42.6	177.6	-179.3	-98.2	0	0	0	113.2	F26 A29 Q30 F41 L50 L129 I132	F26-F46 AromaticContact CD1-CD1 3.58Å; F26-F46 HydrophobicContact CD1-CD1 3.58Å; F26-F46 AromaticContact CD1-CE1 3.74Å; F26-F46 HydrophobicContact CD1-CE1 3.74Å; F26-F46 AromaticContact CD1-CG 3.99Å; F26-F46 HydrophobicContact CD1-CG 3.99Å; F26-F46 HydrophobicContact CD1-CZ 4.27Å; F26-F46 AromaticContact CE1-CD1 3.72Å; F26-F46 HydrophobicContact CE1-CD1 3.72Å; F26-F46 AromaticContact CE1-CE1 3.88Å; F26-F46 HydrophobicContact CE1-CE1 3.88Å; F26-F46 HydrophobicContact CE1-CG 4.5Å; A29-F46 HydrophobicContact CB-CE2 3.85Å; A29-F46 HydrophobicContact CB-CZ 3.85Å; Q30-F46 HydrophobicContact CB-CD2 4.03Å; Q30-F46 HydrophobicContact CB-CE2 4.21Å; F41-F46 AromaticContact CE1-CD2 3.7Å; F41-F46 HydrophobicContact CE1-CD2 3.7Å; F41-F46 HydrophobicContact CE1-CE2 4.19Å; F41-F46 HydrophobicContact CE1-CG 4.3Å; F41-F46 HydrophobicContact CZ-CD2 4.12Å; F41-F46 HydrophobicContact CZ-CE2 4.21Å; F46-L50 HydrophobicContact CD1-CD1 4.24Å; F46-L50 HydrophobicContact CE1-CD1 3.7Å; F46-L50 HydrophobicContact CE2-CD1 4.16Å; F46-L50 HydrophobicContact CZ-CD1 3.67Å; F46-L50 WeakPolarHBondContact O-CG 3.31Å; F46-L50 PolarHBondContact O-N 3.39Å; F46-L129 HydrophobicContact CE1-CD2 3.99Å; F46-L129 HydrophobicContact CZ-CD2 3.75Å; F46-I132 HydrophobicContact CZ-CD1 3.85Å
47	R	90	Very high	88.7	Confident	41 Å²	41	51.3 Å²	51.3	16%	0.155	30%	0.297	C	S	.	.	H	α-helix	trans	-62.8	-51	175.6	-173.5	178.9	-176.7	-151.9	12.4	113.4	D45 G49 L50 E51 L107 Q108 D109 L125	D45-R47 CarbonylContact O-C 3.59Å; D45-R47 PolarHBondContact O-N 2.91Å; R47-G49 VanDerWaalsContact C-N 3.29Å; R47-G49 PolarHBondContact O-N 3.34Å; R47-L50 PolarHBondContact O-N 3.29Å; R47-L50 VanDerWaalsContact O-N 3.13Å; R47-E51 PolarHBondContact O-N 3.37Å; R47-L107 HydrophobicContact CG-CD2 4.38Å; R47-L107 PolarHBondContact NE-O 2.98Å; R47-Q108 PolarHBondContact NH2-O 3.39Å; R47-D109 IonicContact CZ-OD1 2.71Å; R47-D109 IonicContact NH1-OD1 3.23Å; R47-D109 PolarHBondContact NH1-OD1 2.83Å; R47-D109 IonicContact NH2-OD1 2.81Å; R47-D109 PolarHBondContact NH2-OD1 2.74Å; R47-L125 HydrophobicContact CB-CD2 3.95Å; R47-L125 HydrophobicContact CG-CD2 3.97Å
48	G	87.9	Confident	88.8	Confident	28 Å²	28	51.1 Å²	51.1	29%	0.289	29%	0.294	S	S	.	.	H	α-helix	trans	-71.1	-21.9	-178.5	0	0	0	0	0	113.8	D45	D45-G48 PolarHBondContact O-N 3.25Å
49	G	89.5	Confident	89	Confident	3 Å²	3	47.6 Å²	47.6	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-66.7	-40.4	166.4	0	0	0	0	0	112.7	D45 R47	D45-G49 PolarHBondContact O-N 2.96Å; R47-G49 VanDerWaalsContact C-N 3.29Å; R47-G49 PolarHBondContact O-N 3.34Å
50	L	93.1	Very high	89.3	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-91.6	-22.4	-175.4	-59.7	-177.2	0	0	0	115.1	I33 F41 F46 R47 N52 G53 L55 L56 L107 V128 I132	I33-L50 HydrophobicContact CD1-CD2 4.22Å; F41-L50 HydrophobicContact CE1-CD2 3.88Å; F41-L50 HydrophobicContact CE1-CG 3.89Å; F41-L50 HydrophobicContact CZ-CD2 3.7Å; F41-L50 HydrophobicContact CZ-CG 4.17Å; F46-L50 HydrophobicContact CD1-CD1 4.24Å; F46-L50 HydrophobicContact CE1-CD1 3.7Å; F46-L50 HydrophobicContact CE2-CD1 4.16Å; F46-L50 HydrophobicContact CZ-CD1 3.67Å; F46-L50 WeakPolarHBondContact O-CG 3.31Å; F46-L50 PolarHBondContact O-N 3.39Å; R47-L50 PolarHBondContact O-N 3.29Å; R47-L50 VanDerWaalsContact O-N 3.13Å; L50-N52 PolarHBondContact O-N 2.98Å; L50-N52 VanDerWaalsContact O-N 3.13Å; L50-G53 WeakPolarHBondContact O-CA 3.26Å; L50-G53 PolarHBondContact O-N 2.69Å; L50-L55 HydrophobicContact CD2-CB 4.24Å; L50-L56 HydrophobicContact CB-CD1 4.39Å; L50-L56 HydrophobicContact CD1-CD2 4.39Å; L50-L56 HydrophobicContact CD2-CD2 3.83Å; L50-L56 HydrophobicContact CD2-CG 3.95Å; L50-L107 HydrophobicContact CB-CD1 4.09Å; L50-L107 HydrophobicContact CB-CD2 3.95Å; L50-V128 HydrophobicContact CD1-CG1 4.16Å; L50-I132 HydrophobicContact CD1-CD1 4.25Å
51	E	91.4	Very high	89.7	Confident	72 Å²	72	39.5 Å²	39.5	34%	0.336	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-31.9	-173.7	-174.1	177.5	-152	0	0	114	R47 G53 Q108 D109	R47-E51 PolarHBondContact O-N 3.37Å; E51-G53 VanDerWaalsContact C-N 3.26Å; E51-G53 PolarHBondContact O-N 3.33Å; E51-Q108 VanDerWaalsContact OE1-CA 3.32Å; E51-Q108 WeakPolarHBondContact OE1-CA 3.46Å; E51-D109 PolarHBondContact OE1-N 3.34Å
52	N	90.9	Very high	90	Very high	50 Å²	50	41.2 Å²	41.2	27%	0.267	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-6.4	176.4	66.3	44.4	0	0	0	114.2	L50 I54 N83	L50-N52 PolarHBondContact O-N 2.98Å; L50-N52 VanDerWaalsContact O-N 3.13Å; N52-I54 HydrophobicContact CB-CD1 4.44Å; N52-I54 HydrophobicContact CB-CG1 4.4Å; N52-I54 PolarHBondContact O-N 2.82Å; N52-I54 VanDerWaalsContact OD1-CB 3.23Å; N52-I54 WeakPolarHBondContact OD1-CB 3.36Å; N52-I54 WeakPolarHBondContact OD1-CG1 3.25Å; N52-I54 PolarHBondContact OD1-N 3.47Å; N52-N83 WeakPolarHBondContact O-CB 3.25Å; N52-N83 PolarHBondContact O-ND2 2.89Å
53	G	92.9	Very high	90.6	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	65.9	-0.7	-179.7	0	0	0	0	0	116.5	L50 E51 C57	L50-G53 WeakPolarHBondContact O-CA 3.26Å; L50-G53 PolarHBondContact O-N 2.69Å; E51-G53 VanDerWaalsContact C-N 3.26Å; E51-G53 PolarHBondContact O-N 3.33Å; G53-C57 WeakPolarHBondContact O-CB 3.33Å; G53-C57 PolarHBondContact O-N 2.91Å; G53-C57 PolarHBondContact O-SG 3.43Å
54	I	94.2	Very high	91.5	Very high	31 Å²	31	34.1 Å²	34.1	16%	0.159	18%	0.177	C	C	.	.	H	α-helix	trans	-69.4	-50.9	-174.1	-62.3	174.4	0	0	0	110.6	N52 L56 C57 E58 I71 R73	N52-I54 HydrophobicContact CB-CD1 4.44Å; N52-I54 HydrophobicContact CB-CG1 4.4Å; N52-I54 PolarHBondContact O-N 2.82Å; N52-I54 VanDerWaalsContact OD1-CB 3.23Å; N52-I54 WeakPolarHBondContact OD1-CB 3.36Å; N52-I54 WeakPolarHBondContact OD1-CG1 3.25Å; N52-I54 PolarHBondContact OD1-N 3.47Å; I54-L56 VanDerWaalsContact C-N 3.29Å; I54-L56 PolarHBondContact O-N 2.98Å; I54-C57 PolarHBondContact O-N 3.2Å; I54-C57 VanDerWaalsContact O-N 3.16Å; I54-E58 PolarHBondContact O-N 3.33Å; I54-I71 HydrophobicContact CB-CG2 4.37Å; I54-I71 HydrophobicContact CG1-CG2 4Å; I54-I71 HydrophobicContact CG2-CG2 4.24Å; I54-R73 HydrophobicContact CD1-CG 4.38Å
55	L	94.5	Very high	92.2	Very high	14 Å²	14	33.2 Å²	33.2	7%	0.073	18%	0.184	C	C	.	.	H	α-helix	trans	-60.3	-40.2	178.6	-67.6	178.6	0	0	0	111.7	I33 R39 F41 L50 E58 L59	I33-L55 HydrophobicContact CG2-CB 4.37Å; R39-L55 HydrophobicContact CB-CD2 3.81Å; R39-L55 HydrophobicContact CG-CD2 4.36Å; F41-L55 HydrophobicContact CD2-CD1 3.88Å; F41-L55 HydrophobicContact CE2-CD1 3.91Å; F41-L55 HydrophobicContact CG-CD1 4.2Å; F41-L55 HydrophobicContact CZ-CD1 4.25Å; L50-L55 HydrophobicContact CD2-CB 4.24Å; L55-E58 PolarHBondContact O-N 3.49Å; L55-L59 VanDerWaalsContact O-CB 3.26Å; L55-L59 WeakPolarHBondContact O-CB 3.4Å; L55-L59 PolarHBondContact O-N 3.4Å
56	L	95.8	Very high	92.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64	-41	176	-64.7	178.8	0	0	0	112	I33 L50 I54 L60 L84 F87 F102 L107	I33-L56 HydrophobicContact CD1-CD2 4.45Å; L50-L56 HydrophobicContact CB-CD1 4.39Å; L50-L56 HydrophobicContact CD1-CD2 4.39Å; L50-L56 HydrophobicContact CD2-CD2 3.83Å; L50-L56 HydrophobicContact CD2-CG 3.95Å; I54-L56 VanDerWaalsContact C-N 3.29Å; I54-L56 PolarHBondContact O-N 2.98Å; L56-L60 VanDerWaalsContact O-CB 3.3Å; L56-L60 WeakPolarHBondContact O-CB 3.44Å; L56-L60 PolarHBondContact O-N 3.36Å; L56-L84 HydrophobicContact CD1-CD2 3.78Å; L56-F87 HydrophobicContact CB-CB 4.31Å; L56-F87 HydrophobicContact CB-CD1 4.08Å; L56-F87 HydrophobicContact CB-CD2 3.59Å; L56-F87 HydrophobicContact CB-CE1 4.3Å; L56-F87 HydrophobicContact CB-CE2 3.8Å; L56-F87 HydrophobicContact CB-CG 3.71Å; L56-F87 HydrophobicContact CB-CZ 4.15Å; L56-F87 HydrophobicContact CD1-CD1 4.03Å; L56-F87 HydrophobicContact CD1-CE1 4.03Å; L56-F87 HydrophobicContact CD1-CG 4.49Å; L56-F87 HydrophobicContact CD1-CZ 4.45Å; L56-F87 HydrophobicContact CD2-CE1 4.4Å; L56-F87 HydrophobicContact CD2-CE2 4.29Å; L56-F87 HydrophobicContact CD2-CZ 4.02Å; L56-F87 HydrophobicContact CG-CE1 4.48Å; L56-F87 HydrophobicContact CG-CZ 4.44Å; L56-F87 WeakPolarHBondContact O-CD2 3.5Å; L56-F87 WeakPolarHBondContact O-CE2 3.4Å; L56-F102 HydrophobicContact CD1-CE1 4.27Å; L56-F102 HydrophobicContact CD1-CZ 3.84Å; L56-L107 HydrophobicContact CD1-CD1 4.12Å
57	C	95.6	Very high	92.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-68	-37.7	174.4	-72.6	0	0	0	0	113.1	G53 I54 S61 V68 I71 N83	G53-C57 WeakPolarHBondContact O-CB 3.33Å; G53-C57 PolarHBondContact O-N 2.91Å; G53-C57 PolarHBondContact O-SG 3.43Å; I54-C57 PolarHBondContact O-N 3.2Å; I54-C57 VanDerWaalsContact O-N 3.16Å; C57-S61 WeakPolarHBondContact O-CB 3.46Å; C57-S61 PolarHBondContact O-N 2.86Å; C57-S61 PolarHBondContact O-OG 3.48Å; C57-V68 HydrophobicContact CB-CG1 4.1Å; C57-V68 HydrophobicContact CB-CG2 4.27Å; C57-V68 WeakPolarHBondContact O-CG2 3.45Å; C57-I71 HydrophobicContact CB-CD1 3.53Å; C57-I71 HydrophobicContact CB-CG1 3.73Å; C57-I71 HydrophobicContact CB-CG2 4.39Å; C57-N83 PolarHBondContact SG-O 3.37Å
58	E	94.6	Very high	92.3	Very high	28 Å²	28	28 Å²	28	13%	0.131	17%	0.173	C	C	.	.	H	α-helix	trans	-70.3	-38.7	176.7	-71.2	179.7	141.5	0	0	111.5	T37 R39 I54 L55 S61 S62 I71 R73	T37-E58 HydrophobicContact CG2-CB 4.24Å; R39-E58 WeakPolarHBondContact CD-OE2 3.3Å; R39-E58 IonicContact CZ-OE1 2.62Å; R39-E58 IonicContact CZ-OE2 2.7Å; R39-E58 IonicContact NE-OE1 2.99Å; R39-E58 PolarHBondContact NE-OE1 3.4Å; R39-E58 IonicContact NE-OE2 2.59Å; R39-E58 PolarHBondContact NE-OE2 2.9Å; R39-E58 IonicContact NH2-OE1 3.18Å; R39-E58 PolarHBondContact NH2-OE1 2.97Å; R39-E58 IonicContact NH2-OE2 2.74Å; I54-E58 PolarHBondContact O-N 3.33Å; L55-E58 PolarHBondContact O-N 3.49Å; E58-S61 WeakPolarHBondContact O-CB 3.44Å; E58-S61 PolarHBondContact O-N 3.07Å; E58-S62 PolarHBondContact O-N 2.61Å; E58-I71 HydrophobicContact CG-CD1 3.6Å; E58-R73 IonicContact OE1-CZ 3.6Å; E58-R73 IonicContact OE1-NH1 3.29Å; E58-R73 PolarHBondContact OE1-NH1 3.47Å; E58-R73 IonicContact OE1-NH2 3.93Å; E58-R73 PolarHBondContact OE1-NH2 3.49Å
59	L	95.5	Very high	92.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.8	-50	171.5	173	74.2	0	0	0	111.6	W32 I33 A36 T37 L55 S61 S62 I63 L135	W32-L59 HydrophobicContact CE3-CD1 4.41Å; W32-L59 HydrophobicContact CH2-CD1 4Å; W32-L59 HydrophobicContact CH2-CD2 4.33Å; W32-L59 HydrophobicContact CH2-CG 4.49Å; W32-L59 HydrophobicContact CZ2-CD1 4.2Å; W32-L59 HydrophobicContact CZ3-CD1 4.11Å; W32-L59 HydrophobicContact CZ3-CD2 3.98Å; I33-L59 HydrophobicContact CG1-CD2 4.03Å; A36-L59 HydrophobicContact CB-CD1 3.56Å; T37-L59 HydrophobicContact CG2-CB 3.79Å; L55-L59 VanDerWaalsContact O-CB 3.26Å; L55-L59 WeakPolarHBondContact O-CB 3.4Å; L55-L59 PolarHBondContact O-N 3.4Å; L59-S61 PolarHBondContact O-N 3.06Å; L59-S62 PolarHBondContact O-N 2.97Å; L59-S62 VanDerWaalsContact O-N 3.12Å; L59-S62 PolarHBondContact O-OG 2.8Å; L59-I63 HydrophobicContact CD1-CD1 4.15Å; L59-I63 HydrophobicContact CG-CD1 3.92Å; L59-I63 WeakPolarHBondContact O-CG1 3.34Å; L59-I63 PolarHBondContact O-N 2.91Å; L59-L135 HydrophobicContact CD2-CD2 3.65Å; L59-L135 HydrophobicContact CG-CD2 4.4Å
60	L	95.1	Very high	92.5	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.4	-35	176.9	-179.7	65	0	0	0	111.8	L56 R64 L67 V68 F87 L94	L56-L60 VanDerWaalsContact O-CB 3.3Å; L56-L60 WeakPolarHBondContact O-CB 3.44Å; L56-L60 PolarHBondContact O-N 3.36Å; L60-R64 PolarHBondContact O-N 2.91Å; L60-R64 VanDerWaalsContact O-N 3.13Å; L60-L67 HydrophobicContact CD1-CD1 3.61Å; L60-L67 HydrophobicContact CD2-CB 4.42Å; L60-L67 HydrophobicContact CG-CB 4.21Å; L60-L67 HydrophobicContact CG-CD1 4.13Å; L60-V68 HydrophobicContact CB-CG2 4.07Å; L60-V68 HydrophobicContact CD2-CG2 3.39Å; L60-V68 HydrophobicContact CG-CG2 3.85Å; L60-F87 HydrophobicContact CB-CD2 4.05Å; L60-F87 HydrophobicContact CB-CE2 4.38Å; L60-F87 HydrophobicContact CD2-CD2 4.09Å; L60-L94 HydrophobicContact CD1-CD1 3.44Å; L60-L94 VanDerWaalsContact CD1-CD1 3.44Å; L60-L94 HydrophobicContact CD1-CG 4.2Å
61	S	93.6	Very high	92.5	Very high	39 Å²	39	45.4 Å²	45.4	27%	0.273	24%	0.241	S	C	.	.	H	α-helix	trans	-69.8	-34	176.1	-55	0	0	0	0	113.2	C57 E58 L59 R64 V68	C57-S61 WeakPolarHBondContact O-CB 3.46Å; C57-S61 PolarHBondContact O-N 2.86Å; C57-S61 PolarHBondContact O-OG 3.48Å; E58-S61 WeakPolarHBondContact O-CB 3.44Å; E58-S61 PolarHBondContact O-N 3.07Å; L59-S61 PolarHBondContact O-N 3.06Å; S61-R64 CarbonylContact O-C 3.52Å; S61-V68 WeakPolarHBondContact OG-CB 3.41Å
62	S	92.4	Very high	92.6	Very high	49 Å²	49	44.1 Å²	44.1	34%	0.343	24%	0.237	S	C	.	.	H	α-helix	trans	-79.4	-28.9	176.6	69	0	0	0	0	112.8	A36 E58 L59 Y145	A36-S62 WeakPolarHBondContact O-CB 3.26Å; A36-S62 PolarHBondContact O-OG 3.04Å; E58-S62 PolarHBondContact O-N 2.61Å; L59-S62 PolarHBondContact O-N 2.97Å; L59-S62 VanDerWaalsContact O-N 3.12Å; L59-S62 PolarHBondContact O-OG 2.8Å; S62-Y145 WeakPolarHBondContact O-CD2 3.41Å
63	I	93	Very high	92.7	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-67.4	-48.8	172	-65.8	164	0	0	0	111.5	W32 L59 L94 L135 A139 S144 Y145	W32-I63 HydrophobicContact CH2-CD1 3.87Å; W32-I63 HydrophobicContact CZ2-CD1 4.19Å; L59-I63 HydrophobicContact CD1-CD1 4.15Å; L59-I63 HydrophobicContact CG-CD1 3.92Å; L59-I63 WeakPolarHBondContact O-CG1 3.34Å; L59-I63 PolarHBondContact O-N 2.91Å; I63-L94 HydrophobicContact CG2-CD1 4.19Å; I63-L94 HydrophobicContact CG2-CD2 4.02Å; I63-L135 HydrophobicContact CD1-CD1 3.81Å; I63-L135 HydrophobicContact CD1-CD2 4.14Å; I63-L135 HydrophobicContact CD1-CG 3.82Å; I63-A139 HydrophobicContact CB-CB 4.44Å; I63-A139 HydrophobicContact CD1-CB 3.95Å; I63-A139 HydrophobicContact CG1-CB 3.84Å; I63-A139 HydrophobicContact CG2-CB 3.74Å; I63-S144 PolarHBondContact O-OG 2.86Å; I63-S144 VanDerWaalsContact O-OG 3.07Å; I63-Y145 HydrophobicContact CB-CD2 4.39Å; I63-Y145 HydrophobicContact CG1-CD2 4.24Å; I63-Y145 HydrophobicContact CG1-CE2 4.02Å
64	R	91.3	Very high	92.6	Very high	81 Å²	81	53.9 Å²	53.9	31%	0.306	28%	0.278	S	S	.	.	S	Bend	trans	-147.3	110.1	175.7	-171.3	-172.2	-65.9	163.9	-1.5	110.8	L60 S61 L67 E93 L94 C142	L60-R64 PolarHBondContact O-N 2.91Å; L60-R64 VanDerWaalsContact O-N 3.13Å; S61-R64 CarbonylContact O-C 3.52Å; R64-L67 HydrophobicContact CB-CD1 3.77Å; R64-L67 HydrophobicContact CB-CG 4.13Å; R64-L67 HydrophobicContact CG-CD1 4.34Å; R64-L67 HydrophobicContact CG-CG 4.28Å; R64-E93 PolarHBondContact NH1-O 3.37Å; R64-L94 HydrophobicContact CB-CD2 4.25Å; R64-C142 PolarHBondContact NH2-SG 3.28Å; R64-C142 VanDerWaalsContact NH2-SG 3.36Å
65	P	89.9	Confident	92.3	Very high	102 Å²	102	58.7 Å²	58.7	66%	0.662	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	143	178.5	26	-34.1	0	0	0	111.2
66	G	87.1	Confident	92	Very high	55 Å²	55	61 Å²	61	57%	0.567	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.5	-16.5	177.2	0	0	0	0	0	116.1
67	L	88.6	Confident	91.7	Very high	19 Å²	19	66.3 Å²	66.3	10%	0.099	36%	0.36	C	S	.	.	S	Bend	trans	-63.5	-48	173.3	-65.9	-178.3	0	0	0	111.4	L60 R64 E93 L94	L60-L67 HydrophobicContact CD1-CD1 3.61Å; L60-L67 HydrophobicContact CD2-CB 4.42Å; L60-L67 HydrophobicContact CG-CB 4.21Å; L60-L67 HydrophobicContact CG-CD1 4.13Å; R64-L67 HydrophobicContact CB-CD1 3.77Å; R64-L67 HydrophobicContact CB-CG 4.13Å; R64-L67 HydrophobicContact CG-CD1 4.34Å; R64-L67 HydrophobicContact CG-CG 4.28Å; L67-E93 HydrophobicContact CD2-CB 3.73Å; L67-L94 HydrophobicContact CD1-CD1 4.25Å; L67-L94 HydrophobicContact CD1-CD2 3.95Å; L67-L94 HydrophobicContact CD1-CG 3.7Å
68	V	92.5	Very high	91.4	Very high	17 Å²	17	72 Å²	72	10%	0.103	39%	0.389	C	S	.	.			trans	-93.3	106.8	175.4	-178.9	0	0	0	0	109.6	C57 L60 S61 I71 V86	C57-V68 HydrophobicContact CB-CG1 4.1Å; C57-V68 HydrophobicContact CB-CG2 4.27Å; C57-V68 WeakPolarHBondContact O-CG2 3.45Å; L60-V68 HydrophobicContact CB-CG2 4.07Å; L60-V68 HydrophobicContact CD2-CG2 3.39Å; L60-V68 HydrophobicContact CG-CG2 3.85Å; S61-V68 WeakPolarHBondContact OG-CB 3.41Å; V68-I71 HydrophobicContact CG1-CD1 4.19Å; V68-I71 HydrophobicContact CG1-CG1 3.56Å; V68-V86 HydrophobicContact CB-CG1 4.45Å; V68-V86 HydrophobicContact CG1-CG1 4.03Å; V68-V86 HydrophobicContact CG2-CG1 4.22Å
69	K	87.8	Confident	91.3	Very high	193 Å²	193	70.7 Å²	70.7	84%	0.839	38%	0.383	S	S	*	.			trans	-81.4	-26.9	-178.8	-63.5	175.6	-175.8	171	0	113.5
70	K	91.8	Very high	91.1	Very high	175 Å²	175	71 Å²	71	76%	0.761	39%	0.386	S	S	*	.			trans	-162.8	143.5	178.9	-171.7	174.6	-179.2	-179.2	0	109.7
71	I	93.9	Very high	91	Very high	29 Å²	29	73.7 Å²	73.7	15%	0.149	40%	0.4	C	S	.	.			trans	-112	135.2	173.5	-55	177.7	0	0	0	108.6	I54 C57 E58 V68 R73	I54-I71 HydrophobicContact CB-CG2 4.37Å; I54-I71 HydrophobicContact CG1-CG2 4Å; I54-I71 HydrophobicContact CG2-CG2 4.24Å; C57-I71 HydrophobicContact CB-CD1 3.53Å; C57-I71 HydrophobicContact CB-CG1 3.73Å; C57-I71 HydrophobicContact CB-CG2 4.39Å; E58-I71 HydrophobicContact CG-CD1 3.6Å; V68-I71 HydrophobicContact CG1-CD1 4.19Å; V68-I71 HydrophobicContact CG1-CG1 3.56Å; I71-R73 HydrophobicContact CG2-CG 4.47Å; I71-R73 PolarHBondContact O-N 2.67Å
72	N	92.8	Very high	91	Very high	45 Å²	45	75.4 Å²	75.4	24%	0.241	41%	0.406	C	S	.	.			trans	-87.1	102.8	176.4	-166.8	-8.5	0	0	0	109.7	L74 A79 D82 N83	N72-L74 VanDerWaalsContact C-N 3.33Å; N72-L74 PolarHBondContact O-N 2.76Å; N72-L74 WeakPolarHBondContact OD1-CG 3.43Å; N72-L74 PolarHBondContact OD1-N 3.32Å; N72-A79 HydrophobicContact CB-CB 4.06Å; N72-A79 VanDerWaalsContact ND2-CB 3.34Å; N72-A79 WeakPolarHBondContact ND2-CB 3.46Å; N72-D82 PolarHBondContact ND2-OD2 3.14Å; N72-D82 VanDerWaalsContact ND2-OD2 3.08Å; N72-N83 WeakPolarHBondContact CB-OD1 3.4Å; N72-N83 PolarHBondContact N-OD1 3.14Å; N72-N83 PolarHBondContact O-ND2 3.08Å
73	R	94.1	Very high	91.2	Very high	145 Å²	145	73.2 Å²	73.2	55%	0.547	39%	0.391	S	S	.	.			trans	-90	14.3	-178.2	-60.5	-170.6	-172.3	-106.4	-6.9	114.2	I54 E58 I71	I54-R73 HydrophobicContact CD1-CG 4.38Å; E58-R73 IonicContact OE1-CZ 3.6Å; E58-R73 IonicContact OE1-NH1 3.29Å; E58-R73 PolarHBondContact OE1-NH1 3.47Å; E58-R73 IonicContact OE1-NH2 3.93Å; E58-R73 PolarHBondContact OE1-NH2 3.49Å; I71-R73 HydrophobicContact CG2-CG 4.47Å; I71-R73 PolarHBondContact O-N 2.67Å
74	L	90.8	Very high	91.3	Very high	110 Å²	110	73.3 Å²	73.3	58%	0.576	39%	0.391	S	S	*	.			trans	-71.8	138.7	176	-66.5	174	0	0	0	110.6	N72 T76 A79	N72-L74 VanDerWaalsContact C-N 3.33Å; N72-L74 PolarHBondContact O-N 2.76Å; N72-L74 WeakPolarHBondContact OD1-CG 3.43Å; N72-L74 PolarHBondContact OD1-N 3.32Å; L74-T76 PolarHBondContact O-N 3.25Å; L74-A79 HydrophobicContact CB-CB 3.97Å; L74-A79 VanDerWaalsContact O-CB 3.32Å; L74-A79 WeakPolarHBondContact O-CB 3.47Å
75	P	87.8	Confident	91.5	Very high	131 Å²	131	72 Å²	72	85%	0.851	39%	0.394	S	S	*	.	S	Bend	trans	-79.7	62.4	178.3	34.5	-36.5	0	0	0	111
76	T	89	Confident	91.7	Very high	64 Å²	64	68.4 Å²	68.4	39%	0.393	37%	0.371	S	S	.	.	S	Bend	trans	-131.7	146.2	176.7	71.2	0	0	0	0	111.2	L74 I78 A79 G80	L74-T76 PolarHBondContact O-N 3.25Å; T76-I78 PolarHBondContact O-N 3.17Å; T76-A79 WeakPolarHBondContact O-CB 3.46Å; T76-A79 PolarHBondContact O-N 3.2Å; T76-A79 VanDerWaalsContact O-N 3.08Å; T76-A79 WeakPolarHBondContact OG1-CB 3.14Å; T76-A79 PolarHBondContact OG1-N 3.18Å; T76-G80 PolarHBondContact O-N 2.91Å; T76-G80 VanDerWaalsContact O-N 3.09Å
77	P	88.2	Confident	92.2	Very high	110 Å²	110	65.8 Å²	65.8	71%	0.714	34%	0.344	S	S	*	.	H	α-helix	trans	-58.9	-29.9	176.9	-26.2	35.4	0	0	0	113.4	G80 L81	P77-G80 PolarHBondContact O-N 2.76Å; P77-L81 WeakPolarHBondContact O-CG 3.44Å; P77-L81 PolarHBondContact O-N 2.96Å
78	I	89.6	Confident	92.6	Very high	121 Å²	121	65.8 Å²	65.8	62%	0.621	34%	0.344	S	S	*	.	H	α-helix	trans	-66.2	-45	176	-56.9	173.3	0	0	0	110.3	T76 G80 L81 D82	T76-I78 PolarHBondContact O-N 3.17Å; I78-G80 VanDerWaalsContact C-N 3.3Å; I78-G80 PolarHBondContact O-N 3.13Å; I78-L81 PolarHBondContact O-N 3.25Å; I78-D82 PolarHBondContact O-N 3.22Å
79	A	92.3	Very high	92.7	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-63.4	-35.4	175	0	0	0	0	0	112.7	N72 L74 T76 D82 N83	N72-A79 HydrophobicContact CB-CB 4.06Å; N72-A79 VanDerWaalsContact ND2-CB 3.34Å; N72-A79 WeakPolarHBondContact ND2-CB 3.46Å; L74-A79 HydrophobicContact CB-CB 3.97Å; L74-A79 VanDerWaalsContact O-CB 3.32Å; L74-A79 WeakPolarHBondContact O-CB 3.47Å; T76-A79 WeakPolarHBondContact O-CB 3.46Å; T76-A79 PolarHBondContact O-N 3.2Å; T76-A79 VanDerWaalsContact O-N 3.08Å; T76-A79 WeakPolarHBondContact OG1-CB 3.14Å; T76-A79 PolarHBondContact OG1-N 3.18Å; A79-D82 PolarHBondContact O-N 3.32Å; A79-N83 PolarHBondContact O-N 2.79Å; A79-N83 PolarHBondContact O-ND2 3.36Å
80	G	91.6	Very high	93.1	Very high	6 Å²	6	61.3 Å²	61.3	6%	0.062	32%	0.32	C	S	.	.	H	α-helix	trans	-59.4	-48.9	170.5	0	0	0	0	0	112.1	T76 P77 I78 N83 L84	T76-G80 PolarHBondContact O-N 2.91Å; T76-G80 VanDerWaalsContact O-N 3.09Å; P77-G80 PolarHBondContact O-N 2.76Å; I78-G80 VanDerWaalsContact C-N 3.3Å; I78-G80 PolarHBondContact O-N 3.13Å; G80-N83 WeakPolarHBondContact O-CB 3.37Å; G80-N83 PolarHBondContact O-N 2.7Å; G80-L84 WeakPolarHBondContact O-CG 3.32Å; G80-L84 PolarHBondContact O-N 3.39Å
81	L	92.8	Very high	93.2	Very high	57 Å²	57	53 Å²	53	30%	0.298	28%	0.284	S	S	.	.	H	α-helix	trans	-65.1	-38.5	177.5	-73	168.1	0	0	0	113.5	P77 I78 N83 L84 S85 P104 Q108	P77-L81 WeakPolarHBondContact O-CG 3.44Å; P77-L81 PolarHBondContact O-N 2.96Å; I78-L81 PolarHBondContact O-N 3.25Å; L81-N83 VanDerWaalsContact C-N 3.34Å; L81-N83 PolarHBondContact O-N 2.8Å; L81-L84 PolarHBondContact O-N 3.24Å; L81-S85 WeakPolarHBondContact O-CB 3.44Å; L81-S85 PolarHBondContact O-N 3.43Å; L81-P104 HydrophobicContact CD2-CB 3.72Å; L81-Q108 HydrophobicContact CD2-CG 4.27Å
82	D	94.5	Very high	93.3	Very high	74 Å²	74	56.7 Å²	56.7	40%	0.396	30%	0.3	S	S	.	.	H	α-helix	trans	-55.9	-50.8	171.5	-70	-25.1	0	0	0	110.1	N72 I78 A79 S85 V86	N72-D82 PolarHBondContact ND2-OD2 3.14Å; N72-D82 VanDerWaalsContact ND2-OD2 3.08Å; I78-D82 PolarHBondContact O-N 3.22Å; A79-D82 PolarHBondContact O-N 3.32Å; D82-S85 PolarHBondContact O-N 2.85Å; D82-S85 PolarHBondContact O-OG 2.91Å; D82-V86 WeakPolarHBondContact O-CG2 3.43Å; D82-V86 PolarHBondContact O-N 3.25Å
83	N	95.4	Very high	93.4	Very high	4 Å²	4	59.2 Å²	59.2	2%	0.021	31%	0.311	C	S	.	.	H	α-helix	trans	-61.3	-45.8	179.3	-67.6	-26.7	0	0	0	111.9	N52 C57 N72 A79 G80 L81 S85 V86 F87	N52-N83 WeakPolarHBondContact O-CB 3.25Å; N52-N83 PolarHBondContact O-ND2 2.89Å; C57-N83 PolarHBondContact SG-O 3.37Å; N72-N83 WeakPolarHBondContact CB-OD1 3.4Å; N72-N83 PolarHBondContact N-OD1 3.14Å; N72-N83 PolarHBondContact O-ND2 3.08Å; A79-N83 PolarHBondContact O-N 2.79Å; A79-N83 PolarHBondContact O-ND2 3.36Å; G80-N83 WeakPolarHBondContact O-CB 3.37Å; G80-N83 PolarHBondContact O-N 2.7Å; L81-N83 VanDerWaalsContact C-N 3.34Å; L81-N83 PolarHBondContact O-N 2.8Å; N83-S85 VanDerWaalsContact C-N 3.3Å; N83-S85 PolarHBondContact O-N 3.01Å; N83-V86 PolarHBondContact O-N 3.33Å; N83-V86 VanDerWaalsContact O-N 3.13Å; N83-F87 WeakPolarHBondContact O-CB 3.47Å; N83-F87 PolarHBondContact O-N 2.92Å
84	L	95.5	Very high	93.3	Very high	2 Å²	2	53.2 Å²	53.2	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-59.7	-40.2	176	-67.1	176.9	0	0	0	111.4	L56 G80 L81 V86 F87 L88 F102 P104 L107	L56-L84 HydrophobicContact CD1-CD2 3.78Å; G80-L84 WeakPolarHBondContact O-CG 3.32Å; G80-L84 PolarHBondContact O-N 3.39Å; L81-L84 PolarHBondContact O-N 3.24Å; L84-V86 VanDerWaalsContact C-N 3.33Å; L84-V86 PolarHBondContact O-N 3.16Å; L84-F87 PolarHBondContact O-N 3.41Å; L84-L88 VanDerWaalsContact O-CG 3.31Å; L84-L88 WeakPolarHBondContact O-CG 3.48Å; L84-L88 PolarHBondContact O-N 3.06Å; L84-F102 HydrophobicContact CD2-CE2 4.19Å; L84-F102 HydrophobicContact CD2-CZ 4.09Å; L84-P104 HydrophobicContact CD1-CB 4.49Å; L84-L107 HydrophobicContact CD1-CB 4.46Å; L84-L107 HydrophobicContact CD1-CD1 4.27Å; L84-L107 HydrophobicContact CD2-CD1 3.71Å
85	S	95.1	Very high	93.4	Very high	52 Å²	52	50.9 Å²	50.9	36%	0.364	29%	0.292	S	S	.	.	H	α-helix	trans	-66.8	-31.4	175.8	83.6	0	0	0	0	113.7	L81 D82 N83 R89	L81-S85 WeakPolarHBondContact O-CB 3.44Å; L81-S85 PolarHBondContact O-N 3.43Å; D82-S85 PolarHBondContact O-N 2.85Å; D82-S85 PolarHBondContact O-OG 2.91Å; N83-S85 VanDerWaalsContact C-N 3.3Å; N83-S85 PolarHBondContact O-N 3.01Å; S85-R89 WeakPolarHBondContact O-CB 3.45Å; S85-R89 PolarHBondContact O-N 3.41Å
86	V	95.6	Very high	93.7	Very high	28 Å²	28	45.2 Å²	45.2	17%	0.17	25%	0.254	C	S	.	.	H	α-helix	trans	-72.8	-42.6	174.9	171.3	0	0	0	0	110.5	V68 D82 N83 L84 G90	V68-V86 HydrophobicContact CB-CG1 4.45Å; V68-V86 HydrophobicContact CG1-CG1 4.03Å; V68-V86 HydrophobicContact CG2-CG1 4.22Å; D82-V86 WeakPolarHBondContact O-CG2 3.43Å; D82-V86 PolarHBondContact O-N 3.25Å; N83-V86 PolarHBondContact O-N 3.33Å; N83-V86 VanDerWaalsContact O-N 3.13Å; L84-V86 VanDerWaalsContact C-N 3.33Å; L84-V86 PolarHBondContact O-N 3.16Å; V86-G90 PolarHBondContact O-N 3.43Å
87	F	96.7	Very high	93.9	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-60.8	-53.8	175.6	169.6	-106.1	0	0	0	112.2	L56 L60 N83 L84 R89 G90 C91 F102 L135	L56-F87 HydrophobicContact CB-CB 4.31Å; L56-F87 HydrophobicContact CB-CD1 4.08Å; L56-F87 HydrophobicContact CB-CD2 3.59Å; L56-F87 HydrophobicContact CB-CE1 4.3Å; L56-F87 HydrophobicContact CB-CE2 3.8Å; L56-F87 HydrophobicContact CB-CG 3.71Å; L56-F87 HydrophobicContact CB-CZ 4.15Å; L56-F87 HydrophobicContact CD1-CD1 4.03Å; L56-F87 HydrophobicContact CD1-CE1 4.03Å; L56-F87 HydrophobicContact CD1-CG 4.49Å; L56-F87 HydrophobicContact CD1-CZ 4.45Å; L56-F87 HydrophobicContact CD2-CE1 4.4Å; L56-F87 HydrophobicContact CD2-CE2 4.29Å; L56-F87 HydrophobicContact CD2-CZ 4.02Å; L56-F87 HydrophobicContact CG-CE1 4.48Å; L56-F87 HydrophobicContact CG-CZ 4.44Å; L56-F87 WeakPolarHBondContact O-CD2 3.5Å; L56-F87 WeakPolarHBondContact O-CE2 3.4Å; L60-F87 HydrophobicContact CB-CD2 4.05Å; L60-F87 HydrophobicContact CB-CE2 4.38Å; L60-F87 HydrophobicContact CD2-CD2 4.09Å; N83-F87 WeakPolarHBondContact O-CB 3.47Å; N83-F87 PolarHBondContact O-N 2.92Å; L84-F87 PolarHBondContact O-N 3.41Å; F87-R89 PolarHBondContact O-N 3.04Å; F87-G90 CarbonylContact O-C 3.58Å; F87-G90 WeakPolarHBondContact O-CA 3.45Å; F87-G90 PolarHBondContact O-N 2.97Å; F87-C91 VanDerWaalsContact CZ-SG 3.56Å; F87-C91 PolarHBondContact O-N 3.11Å; F87-C91 PolarHBondContact O-SG 3.16Å; F87-C91 VanDerWaalsContact O-SG 3.4Å; F87-F102 HydrophobicContact CD1-CE1 4.32Å; F87-F102 HydrophobicContact CD1-CZ 4.09Å; F87-F102 AromaticContact CE1-CE1 3.72Å; F87-F102 HydrophobicContact CE1-CE1 3.72Å; F87-F102 AromaticContact CE1-CZ 3.94Å; F87-F102 HydrophobicContact CE1-CZ 3.94Å; F87-L135 HydrophobicContact CE2-CD2 3.63Å; F87-L135 HydrophobicContact CZ-CD2 3.69Å
88	L	96.2	Very high	94	Very high	19 Å²	19	46.1 Å²	46.1	10%	0.099	26%	0.256	C	S	.	.	H	α-helix	trans	-61.4	-43.8	-176.4	-67.5	177.2	0	0	0	112	L84 G90 C91 E92 L101 F102 P104	L84-L88 VanDerWaalsContact O-CG 3.31Å; L84-L88 WeakPolarHBondContact O-CG 3.48Å; L84-L88 PolarHBondContact O-N 3.06Å; L88-G90 VanDerWaalsContact C-N 3.31Å; L88-G90 PolarHBondContact O-N 2.95Å; L88-C91 WeakPolarHBondContact O-CA 3.37Å; L88-C91 WeakPolarHBondContact O-CB 3.45Å; L88-C91 PolarHBondContact O-N 2.8Å; L88-C91 VanDerWaalsContact O-N 3.08Å; L88-E92 PolarHBondContact O-N 3.04Å; L88-L101 HydrophobicContact CB-CD1 4.43Å; L88-L101 HydrophobicContact CD2-CB 4.18Å; L88-L101 HydrophobicContact CD2-CD2 4.39Å; L88-F102 HydrophobicContact CD1-CE2 4.37Å; L88-F102 WeakPolarHBondContact CD1-O 3.47Å; L88-F102 HydrophobicContact CD2-CD1 4.31Å; L88-F102 HydrophobicContact CD2-CD2 4.36Å; L88-F102 HydrophobicContact CD2-CE1 4.12Å; L88-F102 HydrophobicContact CD2-CE2 4.15Å; L88-F102 HydrophobicContact CD2-CG 4.43Å; L88-F102 HydrophobicContact CD2-CZ 4.03Å; L88-P104 HydrophobicContact CD1-CG 3.8Å
89	R	95.6	Very high	94.1	Very high	115 Å²	115	45.7 Å²	45.7	43%	0.434	26%	0.263	S	S	.	.	H	α-helix	trans	-61.2	-38.8	173.1	179.8	175.1	57.6	-102.9	-6.6	112.3	S85 F87 C91 E92 E93	S85-R89 WeakPolarHBondContact O-CB 3.45Å; S85-R89 PolarHBondContact O-N 3.41Å; F87-R89 PolarHBondContact O-N 3.04Å; R89-C91 VanDerWaalsContact C-N 3.28Å; R89-C91 PolarHBondContact O-N 3.06Å; R89-E92 WeakPolarHBondContact O-CB 3.38Å; R89-E92 PolarHBondContact O-N 3.34Å; R89-E92 VanDerWaalsContact O-N 3.16Å; R89-E93 WeakPolarHBondContact O-CG 3.39Å; R89-E93 PolarHBondContact O-N 3.2Å
90	G	95.2	Very high	94.2	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-66.2	-28.5	174.4	0	0	0	0	0	113.5	V86 F87 L88 E93 L94	V86-G90 PolarHBondContact O-N 3.43Å; F87-G90 CarbonylContact O-C 3.58Å; F87-G90 WeakPolarHBondContact O-CA 3.45Å; F87-G90 PolarHBondContact O-N 2.97Å; L88-G90 VanDerWaalsContact C-N 3.31Å; L88-G90 PolarHBondContact O-N 2.95Å; G90-E93 CarbonylContact O-C 3.6Å; G90-E93 PolarHBondContact O-N 3.13Å; G90-L94 PolarHBondContact O-N 2.95Å
91	C	95.5	Very high	94.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-69.6	-37	169.1	-64.2	0	0	0	0	112.3	F87 L88 R89 E93 L94 G95 L96 L101	F87-C91 VanDerWaalsContact CZ-SG 3.56Å; F87-C91 PolarHBondContact O-N 3.11Å; F87-C91 PolarHBondContact O-SG 3.16Å; F87-C91 VanDerWaalsContact O-SG 3.4Å; L88-C91 WeakPolarHBondContact O-CA 3.37Å; L88-C91 WeakPolarHBondContact O-CB 3.45Å; L88-C91 PolarHBondContact O-N 2.8Å; L88-C91 VanDerWaalsContact O-N 3.08Å; R89-C91 VanDerWaalsContact C-N 3.28Å; R89-C91 PolarHBondContact O-N 3.06Å; C91-E93 VanDerWaalsContact C-N 3.34Å; C91-L94 WeakPolarHBondContact O-CB 3.39Å; C91-L94 PolarHBondContact O-N 3.09Å; C91-L94 VanDerWaalsContact O-N 3.16Å; C91-G95 PolarHBondContact O-N 3.04Å; C91-L96 HydrophobicContact CB-CB 4.4Å; C91-L96 HydrophobicContact CB-CD1 4.45Å; C91-L96 HydrophobicContact CB-CD2 4.22Å; C91-L96 WeakPolarHBondContact O-CB 3.41Å; C91-L96 WeakPolarHBondContact O-CD1 3.49Å; C91-L96 PolarHBondContact O-N 3.03Å; C91-L101 HydrophobicContact CB-CD2 3.74Å
92	E	95.4	Very high	94.5	Very high	106 Å²	106	46.2 Å²	46.2	50%	0.495	26%	0.263	S	S	.	.	H	α-helix	trans	-62.6	-41.4	169.6	-59.3	178.8	129.3	0	0	111.1	L88 R89 L94 G95 L101	L88-E92 PolarHBondContact O-N 3.04Å; R89-E92 WeakPolarHBondContact O-CB 3.38Å; R89-E92 PolarHBondContact O-N 3.34Å; R89-E92 VanDerWaalsContact O-N 3.16Å; E92-L94 PolarHBondContact O-N 2.94Å; E92-G95 WeakPolarHBondContact O-CA 3.47Å; E92-G95 PolarHBondContact O-N 3.05Å; E92-L101 HydrophobicContact CG-CD1 3.74Å
93	E	94.1	Very high	94.5	Very high	99 Å²	99	48.3 Å²	48.3	46%	0.463	27%	0.274	S	S	.	.	H	α-helix	trans	-68.1	-17.2	173.5	-68.1	178.3	-144.7	0	0	113.6	R64 L67 R89 G90 C91	R64-E93 PolarHBondContact NH1-O 3.37Å; L67-E93 HydrophobicContact CD2-CB 3.73Å; R89-E93 WeakPolarHBondContact O-CG 3.39Å; R89-E93 PolarHBondContact O-N 3.2Å; G90-E93 CarbonylContact O-C 3.6Å; G90-E93 PolarHBondContact O-N 3.13Å; C91-E93 VanDerWaalsContact C-N 3.34Å
94	L	93.1	Very high	94.3	Very high	19 Å²	19	49.8 Å²	49.8	10%	0.099	28%	0.284	C	S	.	.	H	α-helix	trans	-80.9	-15.3	165.8	-78.5	170.2	0	0	0	113.2	L60 I63 R64 L67 G90 C91 E92 L96 L135	L60-L94 HydrophobicContact CD1-CD1 3.44Å; L60-L94 VanDerWaalsContact CD1-CD1 3.44Å; L60-L94 HydrophobicContact CD1-CG 4.2Å; I63-L94 HydrophobicContact CG2-CD1 4.19Å; I63-L94 HydrophobicContact CG2-CD2 4.02Å; R64-L94 HydrophobicContact CB-CD2 4.25Å; L67-L94 HydrophobicContact CD1-CD1 4.25Å; L67-L94 HydrophobicContact CD1-CD2 3.95Å; L67-L94 HydrophobicContact CD1-CG 3.7Å; G90-L94 PolarHBondContact O-N 2.95Å; C91-L94 WeakPolarHBondContact O-CB 3.39Å; C91-L94 PolarHBondContact O-N 3.09Å; C91-L94 VanDerWaalsContact O-N 3.16Å; E92-L94 PolarHBondContact O-N 2.94Å; L94-L96 HydrophobicContact CB-CD1 4.05Å; L94-L135 HydrophobicContact CD1-CD1 3.26Å
95	G	91.8	Very high	94	Very high	61 Å²	61	51 Å²	51	63%	0.629	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.2	12.4	-178.5	0	0	0	0	0	115.2	C91 E92	C91-G95 PolarHBondContact O-N 3.04Å; E92-G95 WeakPolarHBondContact O-CA 3.47Å; E92-G95 PolarHBondContact O-N 3.05Å
96	L	95.1	Very high	93.7	Very high	12 Å²	12	49.3 Å²	49.3	6%	0.063	28%	0.284	C	S	.	.			trans	-71	143.9	169.1	-76.8	74.7	0	0	0	109.9	C91 L94 L101 W134 A138	C91-L96 HydrophobicContact CB-CB 4.4Å; C91-L96 HydrophobicContact CB-CD1 4.45Å; C91-L96 HydrophobicContact CB-CD2 4.22Å; C91-L96 WeakPolarHBondContact O-CB 3.41Å; C91-L96 WeakPolarHBondContact O-CD1 3.49Å; C91-L96 PolarHBondContact O-N 3.03Å; L94-L96 HydrophobicContact CB-CD1 4.05Å; L96-L101 HydrophobicContact CB-CD2 4.02Å; L96-L101 HydrophobicContact CD2-CD2 3.86Å; L96-W134 HydrophobicContact CD2-CB 3.67Å; L96-W134 HydrophobicContact CG-CB 4.18Å; L96-A138 HydrophobicContact CD1-CB 3.72Å
97	K	93.5	Very high	93.4	Very high	144 Å²	144	48 Å²	48	63%	0.626	28%	0.276	S	S	*	.			trans	-82.7	148	173.7	-58.9	177.8	-178.9	-179.8	0	109.6	S99 Q100	K97-S99 PolarHBondContact O-N 3.35Å; K97-Q100 HydrophobicContact CB-CG 4.3Å; K97-Q100 WeakPolarHBondContact O-CA 3.49Å; K97-Q100 VanDerWaalsContact O-CB 3.31Å; K97-Q100 WeakPolarHBondContact O-CB 3.36Å; K97-Q100 PolarHBondContact O-N 3.02Å
98	G	90.4	Very high	92.8	Very high	49 Å²	49	51.7 Å²	51.7	51%	0.505	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-53.7	-29.3	175.4	0	0	0	0	0	114.6	Q100 L101	G98-Q100 PolarHBondContact O-N 3.37Å; G98-L101 PolarHBondContact O-N 2.85Å
99	S	91.4	Very high	91.4	Very high	111 Å²	111	54.2 Å²	54.2	78%	0.776	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-74.3	1.3	173.9	70.2	0	0	0	0	115.1	K97	K97-S99 PolarHBondContact O-N 3.35Å
100	Q	93.7	Very high	89.6	Confident	34 Å²	34	49.9 Å²	49.9	16%	0.159	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-111.5	3	175.4	-62	172.8	-59.1	0	0	111.6	K97 G98 T131 W134	K97-Q100 HydrophobicContact CB-CG 4.3Å; K97-Q100 WeakPolarHBondContact O-CA 3.49Å; K97-Q100 VanDerWaalsContact O-CB 3.31Å; K97-Q100 WeakPolarHBondContact O-CB 3.36Å; K97-Q100 PolarHBondContact O-N 3.02Å; G98-Q100 PolarHBondContact O-N 3.37Å; Q100-T131 WeakPolarHBondContact O-CA 3.39Å; Q100-T131 PolarHBondContact O-OG1 3.01Å; Q100-W134 HydrophobicContact CB-CB 4.38Å; Q100-W134 HydrophobicContact CB-CG 4Å; Q100-W134 HydrophobicContact CG-CD2 4.3Å; Q100-W134 HydrophobicContact CG-CG 4.14Å; Q100-W134 VanDerWaalsContact NE2-CE2 3.33Å
101	L	95.9	Very high	87.6	Confident	34 Å²	34	54.1 Å²	54.1	18%	0.178	32%	0.323	C	S	.	.	S	Bend	trans	-107.5	147.1	-176.8	-58.8	-174.6	0	0	0	110.8	L88 C91 E92 L96 G98 T131	L88-L101 HydrophobicContact CB-CD1 4.43Å; L88-L101 HydrophobicContact CD2-CB 4.18Å; L88-L101 HydrophobicContact CD2-CD2 4.39Å; C91-L101 HydrophobicContact CB-CD2 3.74Å; E92-L101 HydrophobicContact CG-CD1 3.74Å; L96-L101 HydrophobicContact CB-CD2 4.02Å; L96-L101 HydrophobicContact CD2-CD2 3.86Å; G98-L101 PolarHBondContact O-N 2.85Å; L101-T131 WeakPolarHBondContact CA-OG1 3.33Å; L101-T131 HydrophobicContact CD2-CG2 3.86Å
102	F	95.4	Very high	85.4	Confident	6 Å²	6	60 Å²	60	3%	0.026	36%	0.359	C	S	.	.			trans	-81	154.3	170.9	66.8	-105.8	0	0	0	111.5	L56 L84 F87 L88 D106 L107 N127 V128 T131	L56-F102 HydrophobicContact CD1-CE1 4.27Å; L56-F102 HydrophobicContact CD1-CZ 3.84Å; L84-F102 HydrophobicContact CD2-CE2 4.19Å; L84-F102 HydrophobicContact CD2-CZ 4.09Å; F87-F102 HydrophobicContact CD1-CE1 4.32Å; F87-F102 HydrophobicContact CD1-CZ 4.09Å; F87-F102 AromaticContact CE1-CE1 3.72Å; F87-F102 HydrophobicContact CE1-CE1 3.72Å; F87-F102 AromaticContact CE1-CZ 3.94Å; F87-F102 HydrophobicContact CE1-CZ 3.94Å; L88-F102 HydrophobicContact CD1-CE2 4.37Å; L88-F102 WeakPolarHBondContact CD1-O 3.47Å; L88-F102 HydrophobicContact CD2-CD1 4.31Å; L88-F102 HydrophobicContact CD2-CD2 4.36Å; L88-F102 HydrophobicContact CD2-CE1 4.12Å; L88-F102 HydrophobicContact CD2-CE2 4.15Å; L88-F102 HydrophobicContact CD2-CG 4.43Å; L88-F102 HydrophobicContact CD2-CZ 4.03Å; F102-D106 HydrophobicContact CB-CB 4.33Å; F102-L107 HydrophobicContact CE2-CD1 3.78Å; F102-L107 HydrophobicContact CE2-CG 4.37Å; F102-L107 HydrophobicContact CZ-CD1 3.74Å; F102-N127 HydrophobicContact CB-CB 4.06Å; F102-V128 HydrophobicContact CB-CG2 4.05Å; F102-V128 HydrophobicContact CD1-CB 4.14Å; F102-V128 HydrophobicContact CD1-CG1 4.09Å; F102-V128 HydrophobicContact CD1-CG2 3.95Å; F102-V128 HydrophobicContact CD2-CG2 4.31Å; F102-V128 HydrophobicContact CE1-CG1 4.08Å; F102-V128 HydrophobicContact CE1-CG2 4.46Å; F102-V128 HydrophobicContact CG-CG2 3.87Å; F102-T131 HydrophobicContact CD1-CG2 3.82Å; F102-T131 WeakPolarHBondContact CD1-OG1 3.3Å; F102-T131 HydrophobicContact CE1-CG2 4.18Å; F102-T131 PolarHBondContact N-OG1 2.76Å
103	D	92.9	Very high	83.4	Confident	118 Å²	118	63.4 Å²	63.4	63%	0.631	37%	0.368	S	S	*	.			trans	-78.9	142.3	172.5	-100.5	-54.6	0	0	0	110.4	G105 D106	D103-G105 PolarHBondContact O-N 2.83Å; D103-D106 PolarHBondContact N-OD2 3.25Å; D103-D106 VanDerWaalsContact N-OD2 3.14Å; D103-D106 VanDerWaalsContact O-CB 3.27Å; D103-D106 WeakPolarHBondContact O-CB 3.3Å; D103-D106 PolarHBondContact O-N 3.03Å
104	P	92	Very high	81.1	Confident	36 Å²	36	65.8 Å²	65.8	23%	0.234	39%	0.392	C	S	.	.	H	α-helix	trans	-58	-9.8	174.4	-26.1	34.8	0	0	0	115.4	L81 L84 L88 Q108	L81-P104 HydrophobicContact CD2-CB 3.72Å; L84-P104 HydrophobicContact CD1-CB 4.49Å; L88-P104 HydrophobicContact CD1-CG 3.8Å; P104-Q108 WeakPolarHBondContact O-CG 3Å; P104-Q108 PolarHBondContact O-NE2 2.94Å
105	G	88.4	Confident	78.8	Confident	28 Å²	28	69 Å²	69	29%	0.289	42%	0.421	S	S	.	.	H	α-helix	trans	-84.8	-8.4	169.4	0	0	0	0	0	115.4	D103 R124	D103-G105 PolarHBondContact O-N 2.83Å; G105-R124 PolarHBondContact O-NH1 3.02Å
106	D	90.6	Very high	76.7	Confident	16 Å²	16	68.6 Å²	68.6	9%	0.086	41%	0.411	C	S	.	.	H	α-helix	trans	-74.5	-41.3	179.2	-73.5	-19.5	0	0	0	111.5	F102 D103 R124 N127 V128	F102-D106 HydrophobicContact CB-CB 4.33Å; D103-D106 PolarHBondContact N-OD2 3.25Å; D103-D106 VanDerWaalsContact N-OD2 3.14Å; D103-D106 VanDerWaalsContact O-CB 3.27Å; D103-D106 WeakPolarHBondContact O-CB 3.3Å; D103-D106 PolarHBondContact O-N 3.03Å; D106-R124 HydrophobicContact CB-CB 3.92Å; D106-R124 HydrophobicContact CB-CG 4.3Å; D106-R124 WeakPolarHBondContact OD1-CG 3.37Å; D106-N127 WeakPolarHBondContact OD2-CB 3.31Å; D106-N127 PolarHBondContact OD2-ND2 3.28Å; D106-V128 HydrophobicContact CB-CG2 4.28Å
107	L	88.3	Confident	74.7	Confident	0 Å²	0	77 Å²	77	0%	0	44%	0.442	C	S	.	.	H	α-helix	trans	-77.7	-44.3	176	-77.2	170.7	0	0	0	113.1	R47 L50 L56 L84 F102 L125 V128	R47-L107 HydrophobicContact CG-CD2 4.38Å; R47-L107 PolarHBondContact NE-O 2.98Å; L50-L107 HydrophobicContact CB-CD1 4.09Å; L50-L107 HydrophobicContact CB-CD2 3.95Å; L56-L107 HydrophobicContact CD1-CD1 4.12Å; L84-L107 HydrophobicContact CD1-CB 4.46Å; L84-L107 HydrophobicContact CD1-CD1 4.27Å; L84-L107 HydrophobicContact CD2-CD1 3.71Å; F102-L107 HydrophobicContact CE2-CD1 3.78Å; F102-L107 HydrophobicContact CE2-CG 4.37Å; F102-L107 HydrophobicContact CZ-CD1 3.74Å; L107-L125 HydrophobicContact CD2-CD2 4.43Å; L107-V128 HydrophobicContact CD2-CG1 4.26Å; L107-V128 HydrophobicContact CD2-CG2 3.95Å; L107-V128 HydrophobicContact CG-CG2 3.89Å
108	Q	83.9	Confident	73	Confident	77 Å²	77	73.1 Å²	73.1	36%	0.36	44%	0.443	S	S	.	.	S	Bend	trans	-46.5	136.8	-177.4	-87.5	177.2	84.1	0	0	113.7	R47 E51 L81 P104 T110	R47-Q108 PolarHBondContact NH2-O 3.39Å; E51-Q108 VanDerWaalsContact OE1-CA 3.32Å; E51-Q108 WeakPolarHBondContact OE1-CA 3.46Å; L81-Q108 HydrophobicContact CD2-CG 4.27Å; P104-Q108 WeakPolarHBondContact O-CG 3Å; P104-Q108 PolarHBondContact O-NE2 2.94Å; Q108-T110 PolarHBondContact O-N 2.84Å
109	D	67.6	Low	71.8	Confident	72 Å²	72	74.6 Å²	74.6	39%	0.385	45%	0.445	S	S	.	.			trans	-74.1	98.8	178.5	-166	34.9	0	0	0	115.8	R47 E51 S111	R47-D109 IonicContact CZ-OD1 2.71Å; R47-D109 IonicContact NH1-OD1 3.23Å; R47-D109 PolarHBondContact NH1-OD1 2.83Å; R47-D109 IonicContact NH2-OD1 2.81Å; R47-D109 PolarHBondContact NH2-OD1 2.74Å; E51-D109 PolarHBondContact OE1-N 3.34Å; D109-S111 VanDerWaalsContact OD1-CB 3.28Å; D109-S111 WeakPolarHBondContact OD1-CB 3.31Å; D109-S111 PolarHBondContact OD1-N 3.32Å; D109-S111 WeakPolarHBondContact OD2-CB 3.49Å
110	T	56.9	Low	70.8	Confident	25 Å²	25	71.6 Å²	71.6	15%	0.153	42%	0.421	C	S	.	.			trans	-89.7	15.3	170	64	0	0	0	0	114.9	Q108 T112 R113 R124	Q108-T110 PolarHBondContact O-N 2.84Å; T110-T112 PolarHBondContact O-N 2.76Å; T110-R113 PolarHBondContact O-N 2.69Å; T110-R124 VanDerWaalsContact CG2-NH1 3.33Å; T110-R124 PolarHBondContact OG1-NH1 2.92Å; T110-R124 PolarHBondContact OG1-NH2 3.47Å; T110-R124 VanDerWaalsContact OG1-NH2 3.14Å
111	S	53.2	Low	69.9	Low	90 Å²	90	72.2 Å²	72.2	63%	0.629	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-33.2	172.7	-170.7	0	0	0	0	112.4	D109 R113	D109-S111 VanDerWaalsContact OD1-CB 3.28Å; D109-S111 WeakPolarHBondContact OD1-CB 3.31Å; D109-S111 PolarHBondContact OD1-N 3.32Å; D109-S111 WeakPolarHBondContact OD2-CB 3.49Å; S111-R113 PolarHBondContact O-N 3.34Å
112	T	49	Very low	69.2	Low	124 Å²	124	73 Å²	73	76%	0.761	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-0.1	174.9	52.9	0	0	0	0	115.6	T110	T110-T112 PolarHBondContact O-N 2.76Å
113	R	53.8	Low	68.8	Low	177 Å²	177	79 Å²	79	67%	0.668	46%	0.459	S	S	*	.	S	Bend	trans	-101.4	116.3	172.6	-65.3	-168.3	-176.3	-171.3	4.8	110.9	T110 S111 A115 A116	T110-R113 PolarHBondContact O-N 2.69Å; S111-R113 PolarHBondContact O-N 3.34Å; R113-A115 PolarHBondContact O-N 2.84Å; R113-A116 PolarHBondContact O-N 2.81Å; R113-A116 VanDerWaalsContact O-N 3.11Å
114	P	45.8	Very low	68.6	Low	149 Å²	149	75.9 Å²	75.9	97%	0.968	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	8.8	-176.6	-26.6	35.4	0	0	0	118.3
115	A	44.8	Very low	68.5	Low	87 Å²	87	75.3 Å²	75.3	72%	0.719	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.1	-1.4	-179.3	0	0	0	0	0	113.5	R113 R117	R113-A115 PolarHBondContact O-N 2.84Å; A115-R117 PolarHBondContact O-N 3.04Å
116	A	48.4	Very low	68.7	Low	51 Å²	51	74.9 Å²	74.9	42%	0.421	42%	0.423	S	S	.	.			trans	-70.1	111	177	0	0	0	0	0	110.3	R113	R113-A116 PolarHBondContact O-N 2.81Å; R113-A116 VanDerWaalsContact O-N 3.11Å
117	R	53.3	Low	68.7	Low	190 Å²	190	76.6 Å²	76.6	72%	0.717	43%	0.432	S	S	*	.			trans	-83.1	146.9	174.1	-60.2	-110.5	-80.1	-128.7	-4.5	108.3	A115 S119 D120	A115-R117 PolarHBondContact O-N 3.04Å; R117-S119 PolarHBondContact O-N 2.73Å; R117-D120 WeakPolarHBondContact O-CB 3.32Å; R117-D120 PolarHBondContact O-N 2.93Å
118	G	57.8	Low	69	Low	62 Å²	62	76.6 Å²	76.6	64%	0.639	43%	0.432	S	S	*	.	H	α-helix	trans	-53.6	-32.9	-178.7	0	0	0	0	0	113.8	D120 C121 S122	G118-D120 VanDerWaalsContact C-N 3.28Å; G118-D120 PolarHBondContact O-N 3.4Å; G118-C121 PolarHBondContact O-N 3.36Å; G118-C121 VanDerWaalsContact O-N 3.15Å; G118-S122 PolarHBondContact O-N 2.94Å; G118-S122 VanDerWaalsContact O-N 3.16Å
119	S	64.1	Low	69.6	Low	79 Å²	79	72.9 Å²	72.9	55%	0.552	42%	0.415	S	S	*	.	H	α-helix	trans	-55.5	-34	171.9	51.3	0	0	0	0	114.7	R117 R123	R117-S119 PolarHBondContact O-N 2.73Å; S119-R123 WeakPolarHBondContact O-CB 3.49Å; S119-R123 PolarHBondContact O-N 3.08Å
120	D	70.9	Confident	70.8	Confident	49 Å²	49	70.8 Å²	70.8	26%	0.262	40%	0.403	S	S	.	.	H	α-helix	trans	-75.7	-31.8	178.1	-73.5	-66.8	0	0	0	112.4	R117 G118 R123 R124	R117-D120 WeakPolarHBondContact O-CB 3.32Å; R117-D120 PolarHBondContact O-N 2.93Å; G118-D120 VanDerWaalsContact C-N 3.28Å; G118-D120 PolarHBondContact O-N 3.4Å; D120-R123 IonicContact OD1-CZ 2.83Å; D120-R123 IonicContact OD1-NE 2.67Å; D120-R123 IonicContact OD1-NH2 2.74Å; D120-R123 PolarHBondContact OD1-NH2 3.35Å; D120-R124 VanDerWaalsContact O-CG 3.26Å; D120-R124 WeakPolarHBondContact O-CG 3.44Å; D120-R124 PolarHBondContact O-N 2.87Å; D120-R124 VanDerWaalsContact O-N 3.12Å
121	C	74.1	Confident	72.7	Confident	46 Å²	46	69.6 Å²	69.6	31%	0.311	40%	0.396	S	S	.	.	H	α-helix	trans	-66.7	-48.6	173.6	-167.1	0	0	0	0	110.5	G118 R123 R124 L125	G118-C121 PolarHBondContact O-N 3.36Å; G118-C121 VanDerWaalsContact O-N 3.15Å; C121-R123 PolarHBondContact O-N 3.4Å; C121-R124 PolarHBondContact O-N 3.44Å; C121-L125 PolarHBondContact O-N 3.21Å; C121-L125 VanDerWaalsContact O-N 3.09Å
122	S	82.5	Confident	74.8	Confident	50 Å²	50	65.3 Å²	65.3	35%	0.35	37%	0.366	S	S	.	.	H	α-helix	trans	-54.3	-51	173.5	176.1	0	0	0	0	111.6	G118 R124 L125 K126	G118-S122 PolarHBondContact O-N 2.94Å; G118-S122 VanDerWaalsContact O-N 3.16Å; S122-R124 VanDerWaalsContact C-N 3.35Å; S122-R124 PolarHBondContact O-N 3.13Å; S122-L125 PolarHBondContact O-N 3.27Å; S122-L125 VanDerWaalsContact O-N 3.15Å; S122-K126 WeakPolarHBondContact O-CG 3.47Å; S122-K126 PolarHBondContact O-N 3.47Å
123	R	86.4	Confident	77	Confident	132 Å²	132	60.7 Å²	60.7	50%	0.498	34%	0.335	S	S	.	.	H	α-helix	trans	-57.9	-41.2	179.9	-176.4	170.7	61.6	95.6	-1.8	113.4	S119 D120 C121 K126 N127	S119-R123 WeakPolarHBondContact O-CB 3.49Å; S119-R123 PolarHBondContact O-N 3.08Å; D120-R123 IonicContact OD1-CZ 2.83Å; D120-R123 IonicContact OD1-NE 2.67Å; D120-R123 IonicContact OD1-NH2 2.74Å; D120-R123 PolarHBondContact OD1-NH2 3.35Å; C121-R123 PolarHBondContact O-N 3.4Å; R123-K126 WeakPolarHBondContact O-CB 3.3Å; R123-K126 PolarHBondContact O-N 3.2Å; R123-N127 PolarHBondContact O-N 3Å; R123-N127 PolarHBondContact O-OD1 2.69Å
124	R	88.9	Confident	79	Confident	53 Å²	53	55.6 Å²	55.6	20%	0.2	32%	0.316	C	S	.	.	H	α-helix	trans	-66.4	-41.1	176.5	-71	174.8	-177.5	-175.2	28.4	112.4	G105 D106 T110 D120 C121 S122 K126 N127 V128	G105-R124 PolarHBondContact O-NH1 3.02Å; D106-R124 HydrophobicContact CB-CB 3.92Å; D106-R124 HydrophobicContact CB-CG 4.3Å; D106-R124 WeakPolarHBondContact OD1-CG 3.37Å; T110-R124 VanDerWaalsContact CG2-NH1 3.33Å; T110-R124 PolarHBondContact OG1-NH1 2.92Å; T110-R124 PolarHBondContact OG1-NH2 3.47Å; T110-R124 VanDerWaalsContact OG1-NH2 3.14Å; D120-R124 VanDerWaalsContact O-CG 3.26Å; D120-R124 WeakPolarHBondContact O-CG 3.44Å; D120-R124 PolarHBondContact O-N 2.87Å; D120-R124 VanDerWaalsContact O-N 3.12Å; C121-R124 PolarHBondContact O-N 3.44Å; S122-R124 VanDerWaalsContact C-N 3.35Å; S122-R124 PolarHBondContact O-N 3.13Å; R124-K126 VanDerWaalsContact C-N 3.31Å; R124-K126 PolarHBondContact O-N 3.48Å; R124-N127 VanDerWaalsContact O-CB 3.31Å; R124-N127 WeakPolarHBondContact O-CB 3.43Å; R124-N127 PolarHBondContact O-N 3.02Å; R124-N127 VanDerWaalsContact O-N 3.13Å; R124-V128 PolarHBondContact O-N 3.19Å
125	L	90.1	Very high	81.4	Confident	24 Å²	24	48.5 Å²	48.5	13%	0.126	27%	0.27	C	S	.	.	H	α-helix	trans	-66.6	-32.2	175.8	-67.9	173.9	0	0	0	112.3	F26 R47 L107 C121 S122 N127 V128 L129	F26-L125 HydrophobicContact CE1-CB 3.87Å; F26-L125 HydrophobicContact CE1-CD1 4.33Å; F26-L125 HydrophobicContact CZ-CB 3.65Å; F26-L125 HydrophobicContact CZ-CD1 4.19Å; R47-L125 HydrophobicContact CB-CD2 3.95Å; R47-L125 HydrophobicContact CG-CD2 3.97Å; L107-L125 HydrophobicContact CD2-CD2 4.43Å; C121-L125 PolarHBondContact O-N 3.21Å; C121-L125 VanDerWaalsContact O-N 3.09Å; S122-L125 PolarHBondContact O-N 3.27Å; S122-L125 VanDerWaalsContact O-N 3.15Å; L125-N127 VanDerWaalsContact C-N 3.33Å; L125-N127 PolarHBondContact O-N 3.12Å; L125-V128 WeakPolarHBondContact O-CB 3.38Å; L125-V128 PolarHBondContact O-N 3.06Å; L125-L129 WeakPolarHBondContact O-CG 3.3Å; L125-L129 PolarHBondContact O-N 2.89Å
126	K	91.4	Very high	83.8	Confident	20 Å²	20	44.3 Å²	44.3	9%	0.087	24%	0.236	C	C	.	.	H	α-helix	trans	-57.9	-41.6	168.9	-65.1	-177	-178.4	-179.7	0	112	S122 R123 R124 V128 L129 I130 L158 M162 E165	S122-K126 WeakPolarHBondContact O-CG 3.47Å; S122-K126 PolarHBondContact O-N 3.47Å; R123-K126 WeakPolarHBondContact O-CB 3.3Å; R123-K126 PolarHBondContact O-N 3.2Å; R124-K126 VanDerWaalsContact C-N 3.31Å; R124-K126 PolarHBondContact O-N 3.48Å; K126-V128 VanDerWaalsContact C-N 3.31Å; K126-V128 PolarHBondContact O-N 3.28Å; K126-L129 PolarHBondContact O-N 2.79Å; K126-I130 WeakPolarHBondContact O-CD1 3.47Å; K126-I130 VanDerWaalsContact O-CG1 3.29Å; K126-I130 WeakPolarHBondContact O-CG1 3.33Å; K126-I130 PolarHBondContact O-N 3.31Å; K126-L158 HydrophobicContact CB-CD1 4.14Å; K126-L158 HydrophobicContact CD-CD1 3.87Å; K126-L158 HydrophobicContact CG-CD1 3.72Å; K126-M162 HydrophobicContact CB-SD 4.44Å; K126-M162 HydrophobicContact CD-SD 4.49Å; K126-E165 IonicContact NZ-OE1 3.18Å; K126-E165 PolarHBondContact NZ-OE1 3.47Å; K126-E165 IonicContact NZ-OE2 2.7Å; K126-E165 PolarHBondContact NZ-OE2 3.34Å
127	N	92.1	Very high	85.9	Confident	51 Å²	51	47.7 Å²	47.7	27%	0.273	24%	0.237	S	C	.	.	H	α-helix	trans	-59.1	-42.6	174.8	-60.5	-10	0	0	0	111.9	F102 D106 R123 R124 L125 I130 T131	F102-N127 HydrophobicContact CB-CB 4.06Å; D106-N127 WeakPolarHBondContact OD2-CB 3.31Å; D106-N127 PolarHBondContact OD2-ND2 3.28Å; R123-N127 PolarHBondContact O-N 3Å; R123-N127 PolarHBondContact O-OD1 2.69Å; R124-N127 VanDerWaalsContact O-CB 3.31Å; R124-N127 WeakPolarHBondContact O-CB 3.43Å; R124-N127 PolarHBondContact O-N 3.02Å; R124-N127 VanDerWaalsContact O-N 3.13Å; L125-N127 VanDerWaalsContact C-N 3.33Å; L125-N127 PolarHBondContact O-N 3.12Å; N127-I130 PolarHBondContact O-N 2.99Å; N127-T131 PolarHBondContact O-N 3.01Å; N127-T131 PolarHBondContact O-OG1 3.5Å
128	V	95.1	Very high	87.9	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.8	-46.4	178.4	-179.5	0	0	0	0	110.7	L50 F102 D106 L107 R124 L125 K126 I130 T131 I132	L50-V128 HydrophobicContact CD1-CG1 4.16Å; F102-V128 HydrophobicContact CB-CG2 4.05Å; F102-V128 HydrophobicContact CD1-CB 4.14Å; F102-V128 HydrophobicContact CD1-CG1 4.09Å; F102-V128 HydrophobicContact CD1-CG2 3.95Å; F102-V128 HydrophobicContact CD2-CG2 4.31Å; F102-V128 HydrophobicContact CE1-CG1 4.08Å; F102-V128 HydrophobicContact CE1-CG2 4.46Å; F102-V128 HydrophobicContact CG-CG2 3.87Å; D106-V128 HydrophobicContact CB-CG2 4.28Å; L107-V128 HydrophobicContact CD2-CG1 4.26Å; L107-V128 HydrophobicContact CD2-CG2 3.95Å; L107-V128 HydrophobicContact CG-CG2 3.89Å; R124-V128 PolarHBondContact O-N 3.19Å; L125-V128 WeakPolarHBondContact O-CB 3.38Å; L125-V128 PolarHBondContact O-N 3.06Å; K126-V128 VanDerWaalsContact C-N 3.31Å; K126-V128 PolarHBondContact O-N 3.28Å; V128-I130 VanDerWaalsContact C-N 3.34Å; V128-I130 PolarHBondContact O-N 2.87Å; V128-T131 WeakPolarHBondContact O-CB 3.33Å; V128-T131 PolarHBondContact O-N 3.33Å; V128-I132 HydrophobicContact CG1-CD1 3.92Å; V128-I132 WeakPolarHBondContact O-CG1 2.98Å; V128-I132 PolarHBondContact O-N 2.71Å
129	L	95.1	Very high	89.6	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60.5	-39.7	175.2	-70	179.2	0	0	0	112.9	A25 F26 A29 F46 L125 K126 T131 I132 Y133 F155 L158	A25-L129 HydrophobicContact CB-CD1 4.07Å; F26-L129 HydrophobicContact CD1-CD1 3.76Å; F26-L129 HydrophobicContact CD1-CD2 3.81Å; F26-L129 HydrophobicContact CD1-CG 4.06Å; F26-L129 HydrophobicContact CD2-CD1 3.97Å; F26-L129 HydrophobicContact CE1-CD1 3.68Å; F26-L129 HydrophobicContact CE1-CD2 4.16Å; F26-L129 HydrophobicContact CE1-CG 3.94Å; F26-L129 HydrophobicContact CE2-CD1 3.9Å; F26-L129 HydrophobicContact CG-CD1 3.89Å; F26-L129 HydrophobicContact CG-CD2 4.37Å; F26-L129 HydrophobicContact CZ-CD1 3.75Å; F26-L129 HydrophobicContact CZ-CG 4.41Å; A29-L129 HydrophobicContact CB-CD2 3.58Å; F46-L129 HydrophobicContact CE1-CD2 3.99Å; F46-L129 HydrophobicContact CZ-CD2 3.75Å; L125-L129 WeakPolarHBondContact O-CG 3.3Å; L125-L129 PolarHBondContact O-N 2.89Å; K126-L129 PolarHBondContact O-N 2.79Å; L129-T131 VanDerWaalsContact C-N 3.32Å; L129-T131 PolarHBondContact O-N 2.89Å; L129-I132 PolarHBondContact O-N 3.37Å; L129-Y133 PolarHBondContact O-N 3.06Å; L129-F155 HydrophobicContact CB-CE1 4.26Å; L129-F155 HydrophobicContact CD2-CE1 4.42Å; L129-F155 WeakPolarHBondContact O-CE1 3.33Å; L129-L158 HydrophobicContact CB-CD2 3.69Å; L129-L158 HydrophobicContact CD1-CD2 3.76Å; L129-L158 HydrophobicContact CG-CD2 4.41Å
130	I	94	Very high	90.8	Very high	27 Å²	27	36 Å²	36	14%	0.138	17%	0.171	C	C	.	.	H	α-helix	trans	-63.8	-40.1	176	-71.2	162.9	0	0	0	110.9	K126 N127 V128 I132 Y133 W134 L159 M162	K126-I130 WeakPolarHBondContact O-CD1 3.47Å; K126-I130 VanDerWaalsContact O-CG1 3.29Å; K126-I130 WeakPolarHBondContact O-CG1 3.33Å; K126-I130 PolarHBondContact O-N 3.31Å; N127-I130 PolarHBondContact O-N 2.99Å; V128-I130 VanDerWaalsContact C-N 3.34Å; V128-I130 PolarHBondContact O-N 2.87Å; I130-I132 VanDerWaalsContact C-N 3.34Å; I130-Y133 WeakPolarHBondContact O-CB 3.43Å; I130-Y133 PolarHBondContact O-N 2.89Å; I130-W134 PolarHBondContact O-N 3.28Å; I130-L159 HydrophobicContact CG1-CD2 4.25Å; I130-M162 HydrophobicContact CD1-CG 4.09Å; I130-M162 HydrophobicContact CD1-SD 3.44Å; I130-M162 WeakPolarHBondContact CD1-SD 3.45Å
131	T	96.1	Very high	91.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.3	-42.4	174.9	-52.3	0	0	0	0	111.1	Q100 L101 F102 N127 V128 L129 W134 L135	Q100-T131 WeakPolarHBondContact O-CA 3.39Å; Q100-T131 PolarHBondContact O-OG1 3.01Å; L101-T131 WeakPolarHBondContact CA-OG1 3.33Å; L101-T131 HydrophobicContact CD2-CG2 3.86Å; F102-T131 HydrophobicContact CD1-CG2 3.82Å; F102-T131 WeakPolarHBondContact CD1-OG1 3.3Å; F102-T131 HydrophobicContact CE1-CG2 4.18Å; F102-T131 PolarHBondContact N-OG1 2.76Å; N127-T131 PolarHBondContact O-N 3.01Å; N127-T131 PolarHBondContact O-OG1 3.5Å; V128-T131 WeakPolarHBondContact O-CB 3.33Å; V128-T131 PolarHBondContact O-N 3.33Å; L129-T131 VanDerWaalsContact C-N 3.32Å; L129-T131 PolarHBondContact O-N 2.89Å; T131-W134 PolarHBondContact O-N 2.99Å; T131-L135 VanDerWaalsContact O-CB 3.3Å; T131-L135 WeakPolarHBondContact O-CB 3.43Å; T131-L135 PolarHBondContact O-N 3.43Å
132	I	96.3	Very high	92.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.5	-41.7	176.1	-68.5	163	0	0	0	111.2	A29 W32 I33 F46 L50 V128 L129 I130 L135 G136 L150	A29-I132 HydrophobicContact CB-CD1 4.34Å; A29-I132 HydrophobicContact CB-CG2 4.02Å; W32-I132 HydrophobicContact CE3-CG2 4Å; W32-I132 HydrophobicContact CZ3-CG2 4.01Å; I33-I132 HydrophobicContact CD1-CD1 3.9Å; I33-I132 HydrophobicContact CD1-CG1 4.41Å; F46-I132 HydrophobicContact CZ-CD1 3.85Å; L50-I132 HydrophobicContact CD1-CD1 4.25Å; V128-I132 HydrophobicContact CG1-CD1 3.92Å; V128-I132 WeakPolarHBondContact O-CG1 2.98Å; V128-I132 PolarHBondContact O-N 2.71Å; L129-I132 PolarHBondContact O-N 3.37Å; I130-I132 VanDerWaalsContact C-N 3.34Å; I132-L135 PolarHBondContact O-N 3.36Å; I132-G136 PolarHBondContact O-N 3.08Å; I132-L150 HydrophobicContact CG2-CD2 4.35Å
133	Y	96	Very high	92.2	Very high	27 Å²	27	41.4 Å²	41.4	11%	0.106	21%	0.207	C	C	.	.	H	α-helix	trans	-57.7	-49	173.3	166.9	-90.4	0	0	0	112.3	L129 I130 L135 G136 R137 L152 F155 L159	L129-Y133 PolarHBondContact O-N 3.06Å; I130-Y133 WeakPolarHBondContact O-CB 3.43Å; I130-Y133 PolarHBondContact O-N 2.89Å; Y133-L135 VanDerWaalsContact C-N 3.32Å; Y133-L135 PolarHBondContact O-N 3.23Å; Y133-G136 PolarHBondContact O-N 3.12Å; Y133-R137 WeakPolarHBondContact O-CB 3.21Å; Y133-R137 PolarHBondContact O-N 3.12Å; Y133-L152 HydrophobicContact CD2-CD2 3.85Å; Y133-L152 HydrophobicContact CE2-CB 3.99Å; Y133-L152 HydrophobicContact CE2-CD2 3.86Å; Y133-L152 HydrophobicContact CE2-CG 4.37Å; Y133-F155 HydrophobicContact CD2-CB 3.64Å; Y133-F155 HydrophobicContact CD2-CD1 4.31Å; Y133-F155 HydrophobicContact CD2-CD2 4.35Å; Y133-F155 AromaticContact CD2-CG 3.86Å; Y133-F155 HydrophobicContact CD2-CG 3.86Å; Y133-F155 HydrophobicContact CE2-CB 4.26Å; Y133-F155 HydrophobicContact CG-CB 4.42Å; Y133-F155 HydrophobicContact CG-CD1 4.46Å; Y133-F155 HydrophobicContact CG-CG 4.45Å; Y133-L159 HydrophobicContact CD1-CD1 4.18Å; Y133-L159 HydrophobicContact CD2-CD1 3.99Å; Y133-L159 HydrophobicContact CE1-CD1 3.89Å; Y133-L159 HydrophobicContact CE2-CD1 3.64Å; Y133-L159 HydrophobicContact CG-CD1 4.25Å
134	W	95.9	Very high	92.2	Very high	70 Å²	70	37.9 Å²	37.9	27%	0.265	20%	0.202	S	C	.	.	H	α-helix	trans	-67.2	-34.5	178.2	-70.3	116.6	0	0	0	112.1	L96 Q100 I130 T131 A138	L96-W134 HydrophobicContact CD2-CB 3.67Å; L96-W134 HydrophobicContact CG-CB 4.18Å; Q100-W134 HydrophobicContact CB-CB 4.38Å; Q100-W134 HydrophobicContact CB-CG 4Å; Q100-W134 HydrophobicContact CG-CD2 4.3Å; Q100-W134 HydrophobicContact CG-CG 4.14Å; Q100-W134 VanDerWaalsContact NE2-CE2 3.33Å; I130-W134 PolarHBondContact O-N 3.28Å; T131-W134 PolarHBondContact O-N 2.99Å; W134-A138 WeakPolarHBondContact O-CB 3.48Å; W134-A138 PolarHBondContact O-N 2.97Å
135	L	96.1	Very high	92.3	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.9	-44.6	175	-179.7	59.5	0	0	0	111.9	W32 L59 I63 F87 L94 T131 I132 Y133 A138 A139	W32-L135 HydrophobicContact CH2-CG 4.19Å; L59-L135 HydrophobicContact CD2-CD2 3.65Å; L59-L135 HydrophobicContact CG-CD2 4.4Å; I63-L135 HydrophobicContact CD1-CD1 3.81Å; I63-L135 HydrophobicContact CD1-CD2 4.14Å; I63-L135 HydrophobicContact CD1-CG 3.82Å; F87-L135 HydrophobicContact CE2-CD2 3.63Å; F87-L135 HydrophobicContact CZ-CD2 3.69Å; L94-L135 HydrophobicContact CD1-CD1 3.26Å; T131-L135 VanDerWaalsContact O-CB 3.3Å; T131-L135 WeakPolarHBondContact O-CB 3.43Å; T131-L135 PolarHBondContact O-N 3.43Å; I132-L135 PolarHBondContact O-N 3.36Å; Y133-L135 VanDerWaalsContact C-N 3.32Å; Y133-L135 PolarHBondContact O-N 3.23Å; L135-A138 CarbonylContact O-C 3.56Å; L135-A138 PolarHBondContact O-N 3.23Å; L135-A139 WeakPolarHBondContact O-CB 3.3Å; L135-A139 PolarHBondContact O-N 3.18Å
136	G	94.9	Very high	92.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.9	-40.6	174.8	0	0	0	0	0	112.2	W32 I132 Y133 A138 A139 N140	W32-G136 VanDerWaalsContact CH2-CA 3.49Å; I132-G136 PolarHBondContact O-N 3.08Å; Y133-G136 PolarHBondContact O-N 3.12Å; G136-A138 VanDerWaalsContact C-N 3.35Å; G136-A138 PolarHBondContact O-N 2.93Å; G136-A139 PolarHBondContact O-N 3.48Å; G136-N140 VanDerWaalsContact O-CG 3.23Å; G136-N140 PolarHBondContact O-N 3.38Å; G136-N140 PolarHBondContact O-OD1 3.26Å
137	R	93.9	Very high	92	Very high	121 Å²	121	43.3 Å²	43.3	46%	0.457	24%	0.242	S	C	.	.	H	α-helix	trans	-63.7	-37.9	172.7	-173.8	174.9	177.1	168.6	0.9	112.7	Y133 S141 L152	Y133-R137 WeakPolarHBondContact O-CB 3.21Å; Y133-R137 PolarHBondContact O-N 3.12Å; R137-S141 PolarHBondContact O-N 3.21Å; R137-S141 PolarHBondContact O-OG 2.92Å; R137-L152 HydrophobicContact CB-CD1 4.34Å; R137-L152 HydrophobicContact CB-CD2 4.46Å; R137-L152 HydrophobicContact CG-CD1 4.4Å
138	A	93.8	Very high	92.1	Very high	16 Å²	16	43.4 Å²	43.4	13%	0.132	25%	0.246	C	C	.	.	H	α-helix	trans	-70.6	-36.8	174.1	0	0	0	0	0	112.3	L96 W134 L135 G136 S141 C142	L96-A138 HydrophobicContact CD1-CB 3.72Å; W134-A138 WeakPolarHBondContact O-CB 3.48Å; W134-A138 PolarHBondContact O-N 2.97Å; L135-A138 CarbonylContact O-C 3.56Å; L135-A138 PolarHBondContact O-N 3.23Å; G136-A138 VanDerWaalsContact C-N 3.35Å; G136-A138 PolarHBondContact O-N 2.93Å; A138-S141 CarbonylContact O-C 3.55Å; A138-S141 WeakPolarHBondContact O-CA 3.33Å; A138-S141 WeakPolarHBondContact O-CB 3.49Å; A138-S141 PolarHBondContact O-N 2.93Å; A138-C142 PolarHBondContact O-N 3.27Å; A138-C142 VanDerWaalsContact O-N 3.11Å; A138-C142 PolarHBondContact O-SG 3.03Å
139	A	93.6	Very high	92	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.008	27%	0.273	C	S	.	.	H	α-helix	trans	-63.1	-46.5	175.1	0	0	0	0	0	111.5	W32 I63 L135 G136 S141 C142 Y145	W32-A139 HydrophobicContact CH2-CB 4.47Å; W32-A139 HydrophobicContact CZ2-CB 4.1Å; I63-A139 HydrophobicContact CB-CB 4.44Å; I63-A139 HydrophobicContact CD1-CB 3.95Å; I63-A139 HydrophobicContact CG1-CB 3.84Å; I63-A139 HydrophobicContact CG2-CB 3.74Å; L135-A139 WeakPolarHBondContact O-CB 3.3Å; L135-A139 PolarHBondContact O-N 3.18Å; G136-A139 PolarHBondContact O-N 3.48Å; A139-S141 PolarHBondContact O-N 3.39Å; A139-S141 VanDerWaalsContact O-N 3.09Å; A139-C142 WeakPolarHBondContact O-CB 3.42Å; A139-C142 PolarHBondContact O-N 3.49Å; A139-Y145 HydrophobicContact CB-CD1 3.86Å; A139-Y145 HydrophobicContact CB-CE1 4Å; A139-Y145 HydrophobicContact CB-CG 4.43Å
140	N	89.2	Confident	92	Very high	69 Å²	69	48 Å²	48	37%	0.369	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-15.7	172.3	-63.9	-2.9	0	0	0	113	G136 T149	G136-N140 VanDerWaalsContact O-CG 3.23Å; G136-N140 PolarHBondContact O-N 3.38Å; G136-N140 PolarHBondContact O-OD1 3.26Å; N140-T149 WeakPolarHBondContact OD1-CG2 3.31Å
141	S	87.6	Confident	92	Very high	94 Å²	94	50 Å²	50	66%	0.657	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	-3.2	175.1	-51.1	0	0	0	0	113.3	R137 A138 A139	R137-S141 PolarHBondContact O-N 3.21Å; R137-S141 PolarHBondContact O-OG 2.92Å; A138-S141 CarbonylContact O-C 3.55Å; A138-S141 WeakPolarHBondContact O-CA 3.33Å; A138-S141 WeakPolarHBondContact O-CB 3.49Å; A138-S141 PolarHBondContact O-N 2.93Å; A139-S141 PolarHBondContact O-N 3.39Å; A139-S141 VanDerWaalsContact O-N 3.09Å
142	C	86.4	Confident	91.9	Very high	16 Å²	16	52.4 Å²	52.4	11%	0.108	30%	0.297	C	S	.	.			trans	-97	113.2	-179.5	-75.5	0	0	0	0	110.9	R64 A138 A139 S144 Y145	R64-C142 PolarHBondContact NH2-SG 3.28Å; R64-C142 VanDerWaalsContact NH2-SG 3.36Å; A138-C142 PolarHBondContact O-N 3.27Å; A138-C142 VanDerWaalsContact O-N 3.11Å; A138-C142 PolarHBondContact O-SG 3.03Å; A139-C142 WeakPolarHBondContact O-CB 3.42Å; A139-C142 PolarHBondContact O-N 3.49Å; C142-S144 PolarHBondContact O-N 3.06Å; C142-Y145 PolarHBondContact O-N 3.24Å
143	T	83.5	Confident	91.7	Very high	149 Å²	149	59.6 Å²	59.6	91%	0.914	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-14.3	176.2	52.8	0	0	0	0	114.6
144	S	85.2	Confident	91.6	Very high	57 Å²	57	62 Å²	62	40%	0.399	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-22.3	171.1	55.7	0	0	0	0	113.7	I63 C142 N146	I63-S144 PolarHBondContact O-OG 2.86Å; I63-S144 VanDerWaalsContact O-OG 3.07Å; C142-S144 PolarHBondContact O-N 3.06Å; S144-N146 PolarHBondContact O-ND2 3.49Å
145	Y	92.1	Very high	91.6	Very high	23 Å²	23	58.7 Å²	58.7	9%	0.09	33%	0.328	C	S	.	.			trans	-92.3	124.1	-172.1	-171.2	-123.6	0	0	0	111.4	W32 A36 S62 I63 A139 C142 P148	W32-Y145 PolarHBondContact NE1-OH 3.19Å; A36-Y145 WeakPolarHBondContact CB-OH 3.4Å; S62-Y145 WeakPolarHBondContact O-CD2 3.41Å; I63-Y145 HydrophobicContact CB-CD2 4.39Å; I63-Y145 HydrophobicContact CG1-CD2 4.24Å; I63-Y145 HydrophobicContact CG1-CE2 4.02Å; A139-Y145 HydrophobicContact CB-CD1 3.86Å; A139-Y145 HydrophobicContact CB-CE1 4Å; A139-Y145 HydrophobicContact CB-CG 4.43Å; C142-Y145 PolarHBondContact O-N 3.24Å; Y145-P148 WeakPolarHBondContact CE1-O 3.38Å; Y145-P148 PolarHBondContact OH-O 3.18Å
146	N	87.4	Confident	91.3	Very high	156 Å²	156	64.5 Å²	64.5	83%	0.834	36%	0.356	S	S	*	.			trans	-126.6	24.2	176.2	-67.1	-96.3	0	0	0	110.6	S144	S144-N146 PolarHBondContact O-ND2 3.49Å
147	G	88.4	Confident	91.1	Very high	33 Å²	33	66 Å²	66	34%	0.34	37%	0.371	S	S	.	.	S	Bend	trans	-87.8	-175.3	177.7	0	0	0	0	0	113
148	P	92.9	Very high	91	Very high	52 Å²	52	60.4 Å²	60.4	34%	0.338	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-62.7	140.5	176.2	27.9	-34.9	0	0	0	111	W32 A35 A36 Y145	W32-P148 PolarHBondContact NE1-O 3.08Å; A35-P148 HydrophobicContact CB-CB 4.3Å; A35-P148 HydrophobicContact CB-CG 3.74Å; A36-P148 HydrophobicContact CB-CG 4.12Å; Y145-P148 WeakPolarHBondContact CE1-O 3.38Å; Y145-P148 PolarHBondContact OH-O 3.18Å
149	T	93.3	Very high	90.8	Very high	95 Å²	95	61.1 Å²	61.1	58%	0.583	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-86.8	132.9	175.9	56.1	0	0	0	0	110.6	N140 D151	N140-T149 WeakPolarHBondContact OD1-CG2 3.31Å; T149-D151 PolarHBondContact O-N 3.04Å
150	L	95.1	Very high	90.5	Very high	3 Å²	3	63.4 Å²	63.4	2%	0.016	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-62	129.6	170.3	-176.6	69.8	0	0	0	110.1	E28 W32 I132 L152 F155	E28-L150 HydrophobicContact CG-CD1 3.93Å; W32-L150 HydrophobicContact CB-CB 4.48Å; W32-L150 HydrophobicContact CB-CD1 3.44Å; W32-L150 VanDerWaalsContact CB-CD1 3.44Å; W32-L150 HydrophobicContact CD2-CB 3.78Å; W32-L150 HydrophobicContact CD2-CD1 3.82Å; W32-L150 HydrophobicContact CD2-CG 4.29Å; W32-L150 HydrophobicContact CE3-CB 4.24Å; W32-L150 HydrophobicContact CE3-CD1 3.86Å; W32-L150 HydrophobicContact CE3-CD2 4.29Å; W32-L150 HydrophobicContact CE3-CG 4.37Å; W32-L150 HydrophobicContact CG-CB 3.85Å; W32-L150 HydrophobicContact CG-CD1 3.64Å; W32-L150 HydrophobicContact CG-CG 4.36Å; I132-L150 HydrophobicContact CG2-CD2 4.35Å; L150-L152 HydrophobicContact CD2-CD2 4.06Å; L150-L152 HydrophobicContact CG-CD2 4.35Å; L150-L152 PolarHBondContact O-N 3.36Å; L150-F155 HydrophobicContact CD1-CE2 3.76Å; L150-F155 HydrophobicContact CD1-CZ 4.02Å; L150-F155 HydrophobicContact CD2-CE2 3.89Å; L150-F155 HydrophobicContact CD2-CZ 4.04Å; L150-F155 HydrophobicContact CG-CE2 3.91Å; L150-F155 HydrophobicContact CG-CZ 4.39Å
151	D	94.2	Very high	90.4	Very high	67 Å²	67	62.6 Å²	62.6	36%	0.358	36%	0.362	S	S	.	.			trans	-73.5	111.2	170.3	-161.5	-26.3	0	0	0	110.3	E28 T149 K153 F155	E28-D151 HydrophobicContact CG-CB 4.18Å; E28-D151 PolarHBondContact OE1-N 3.42Å; T149-D151 PolarHBondContact O-N 3.04Å; D151-K153 PolarHBondContact O-N 2.99Å; D151-K153 VanDerWaalsContact OD1-CB 3.29Å; D151-K153 WeakPolarHBondContact OD1-CB 3.49Å; D151-K153 WeakPolarHBondContact OD1-CG 3.37Å; D151-K153 PolarHBondContact OD1-N 3.42Å; D151-F155 WeakPolarHBondContact O-CD2 3.49Å
152	L	93.4	Very high	90.1	Very high	52 Å²	52	60.5 Å²	60.5	27%	0.272	34%	0.342	S	S	.	.	S	Bend	trans	-74.2	-10.8	-178.2	-58.1	-176.8	0	0	0	113.2	Y133 R137 L150	Y133-L152 HydrophobicContact CD2-CD2 3.85Å; Y133-L152 HydrophobicContact CE2-CB 3.99Å; Y133-L152 HydrophobicContact CE2-CD2 3.86Å; Y133-L152 HydrophobicContact CE2-CG 4.37Å; R137-L152 HydrophobicContact CB-CD1 4.34Å; R137-L152 HydrophobicContact CB-CD2 4.46Å; R137-L152 HydrophobicContact CG-CD1 4.4Å; L150-L152 HydrophobicContact CD2-CD2 4.06Å; L150-L152 HydrophobicContact CG-CD2 4.35Å; L150-L152 PolarHBondContact O-N 3.36Å
153	K	93	Very high	89.9	Confident	150 Å²	150	66.2 Å²	66.2	65%	0.652	36%	0.361	S	S	*	.	S	Bend	trans	-76	-38.4	179.9	-65.9	174	-179.9	173.1	0	113	D151 F155 E156	D151-K153 PolarHBondContact O-N 2.99Å; D151-K153 VanDerWaalsContact OD1-CB 3.29Å; D151-K153 WeakPolarHBondContact OD1-CB 3.49Å; D151-K153 WeakPolarHBondContact OD1-CG 3.37Å; D151-K153 PolarHBondContact OD1-N 3.42Å; K153-F155 PolarHBondContact O-N 2.86Å; K153-E156 VanDerWaalsContact O-CB 3.24Å; K153-E156 WeakPolarHBondContact O-CB 3.34Å; K153-E156 PolarHBondContact O-N 3.25Å
154	E	94.3	Very high	89.9	Confident	77 Å²	77	65.3 Å²	65.3	36%	0.36	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-16.9	178.7	-62.7	-55.3	124.1	0	0	112.6	S24 E28	S24-E154 WeakPolarHBondContact CB-OE2 3.3Å; S24-E154 PolarHBondContact OG-OE2 3.34Å; E28-E154 HydrophobicContact CB-CB 3.94Å; E28-E154 HydrophobicContact CB-CG 4.09Å; E28-E154 HydrophobicContact CG-CB 4.26Å; E28-E154 HydrophobicContact CG-CG 4.27Å
155	F	94.5	Very high	89.4	Confident	1 Å²	1	65.9 Å²	65.9	0%	0.004	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-9.1	174.2	-64.6	-102.1	0	0	0	113.8	A25 E28 A29 L129 Y133 L150 D151 K153 G157 L158 L159	A25-F155 HydrophobicContact CB-CD1 3.75Å; A25-F155 HydrophobicContact CB-CE1 3.92Å; A25-F155 HydrophobicContact CB-CG 4.08Å; A25-F155 HydrophobicContact CB-CZ 4.36Å; E28-F155 HydrophobicContact CB-CE2 4.32Å; E28-F155 HydrophobicContact CG-CE2 4.14Å; A29-F155 HydrophobicContact CB-CZ 4.04Å; L129-F155 HydrophobicContact CB-CE1 4.26Å; L129-F155 HydrophobicContact CD2-CE1 4.42Å; L129-F155 WeakPolarHBondContact O-CE1 3.33Å; Y133-F155 HydrophobicContact CD2-CB 3.64Å; Y133-F155 HydrophobicContact CD2-CD1 4.31Å; Y133-F155 HydrophobicContact CD2-CD2 4.35Å; Y133-F155 AromaticContact CD2-CG 3.86Å; Y133-F155 HydrophobicContact CD2-CG 3.86Å; Y133-F155 HydrophobicContact CE2-CB 4.26Å; Y133-F155 HydrophobicContact CG-CB 4.42Å; Y133-F155 HydrophobicContact CG-CD1 4.46Å; Y133-F155 HydrophobicContact CG-CG 4.45Å; L150-F155 HydrophobicContact CD1-CE2 3.76Å; L150-F155 HydrophobicContact CD1-CZ 4.02Å; L150-F155 HydrophobicContact CD2-CE2 3.89Å; L150-F155 HydrophobicContact CD2-CZ 4.04Å; L150-F155 HydrophobicContact CG-CE2 3.91Å; L150-F155 HydrophobicContact CG-CZ 4.39Å; D151-F155 WeakPolarHBondContact O-CD2 3.49Å; K153-F155 PolarHBondContact O-N 2.86Å; F155-G157 VanDerWaalsContact C-N 3.32Å; F155-G157 PolarHBondContact O-N 2.82Å; F155-L158 HydrophobicContact CD1-CD2 4.44Å; F155-L158 PolarHBondContact O-N 2.97Å; F155-L159 HydrophobicContact CB-CD1 4.34Å; F155-L159 WeakPolarHBondContact O-CB 3.49Å; F155-L159 VanDerWaalsContact O-CG 3.3Å; F155-L159 WeakPolarHBondContact O-CG 3.2Å; F155-L159 PolarHBondContact O-N 3.16Å
156	E	91.6	Very high	88.4	Confident	123 Å²	123	67.4 Å²	67.4	58%	0.575	36%	0.358	S	S	*	.	H	α-helix	trans	-64.6	-36.7	-175.5	-176.1	167.2	-164.2	0	0	112.2	K153 S160	K153-E156 VanDerWaalsContact O-CB 3.24Å; K153-E156 WeakPolarHBondContact O-CB 3.34Å; K153-E156 PolarHBondContact O-N 3.25Å; E156-S160 VanDerWaalsContact O-CB 3.24Å; E156-S160 WeakPolarHBondContact O-CB 3.46Å; E156-S160 PolarHBondContact O-N 2.84Å; E156-S160 PolarHBondContact O-OG 3.41Å
157	G	89.7	Confident	87.5	Confident	32 Å²	32	66.1 Å²	66.1	33%	0.33	35%	0.347	S	S	.	.	H	α-helix	trans	-62.4	-51.5	173	0	0	0	0	0	112.2	F155 L159 S160 Q161	F155-G157 VanDerWaalsContact C-N 3.32Å; F155-G157 PolarHBondContact O-N 2.82Å; G157-L159 PolarHBondContact O-N 2.8Å; G157-S160 PolarHBondContact O-N 2.85Å; G157-Q161 WeakPolarHBondContact O-CB 3.49Å; G157-Q161 PolarHBondContact O-N 3.5Å
158	L	91.7	Very high	86.1	Confident	2 Å²	2	67.7 Å²	67.7	1%	0.01	36%	0.357	C	S	.	.	H	α-helix	trans	-57.4	-46.9	176.4	174.8	60.8	0	0	0	112.6	A21 A22 A25 K126 L129 F155 S160 Q161 M162	A21-L158 PolarHBondContact O-N 3.01Å; A22-L158 HydrophobicContact CB-CD1 4.45Å; A25-L158 HydrophobicContact CB-CB 4.41Å; A25-L158 HydrophobicContact CB-CD2 3.98Å; K126-L158 HydrophobicContact CB-CD1 4.14Å; K126-L158 HydrophobicContact CD-CD1 3.87Å; K126-L158 HydrophobicContact CG-CD1 3.72Å; L129-L158 HydrophobicContact CB-CD2 3.69Å; L129-L158 HydrophobicContact CD1-CD2 3.76Å; L129-L158 HydrophobicContact CG-CD2 4.41Å; F155-L158 HydrophobicContact CD1-CD2 4.44Å; F155-L158 PolarHBondContact O-N 2.97Å; L158-S160 VanDerWaalsContact C-N 3.34Å; L158-S160 PolarHBondContact O-N 3.05Å; L158-Q161 PolarHBondContact O-N 3.2Å; L158-M162 HydrophobicContact CD1-CG 4.42Å; L158-M162 WeakPolarHBondContact O-CG 3.44Å; L158-M162 PolarHBondContact O-N 3.38Å
159	L	89.5	Confident	84.3	Confident	32 Å²	32	69.4 Å²	69.4	17%	0.168	38%	0.376	C	S	.	.	H	α-helix	trans	-67.2	-34.8	179.5	-69.3	170.7	0	0	0	112.3	I130 Y133 F155 G157 M162 R163	I130-L159 HydrophobicContact CG1-CD2 4.25Å; Y133-L159 HydrophobicContact CD1-CD1 4.18Å; Y133-L159 HydrophobicContact CD2-CD1 3.99Å; Y133-L159 HydrophobicContact CE1-CD1 3.89Å; Y133-L159 HydrophobicContact CE2-CD1 3.64Å; Y133-L159 HydrophobicContact CG-CD1 4.25Å; F155-L159 HydrophobicContact CB-CD1 4.34Å; F155-L159 WeakPolarHBondContact O-CB 3.49Å; F155-L159 VanDerWaalsContact O-CG 3.3Å; F155-L159 WeakPolarHBondContact O-CG 3.2Å; F155-L159 PolarHBondContact O-N 3.16Å; G157-L159 PolarHBondContact O-N 2.8Å; L159-M162 PolarHBondContact O-N 2.85Å; L159-R163 PolarHBondContact O-N 3.49Å; L159-R163 VanDerWaalsContact O-N 3.08Å
160	S	88.6	Confident	82	Confident	49 Å²	49	73 Å²	73	34%	0.343	39%	0.386	S	S	.	.	H	α-helix	trans	-71.6	-39.5	175.8	-59.8	0	0	0	0	112.2	E156 G157 L158 M162 R163 K164	E156-S160 VanDerWaalsContact O-CB 3.24Å; E156-S160 WeakPolarHBondContact O-CB 3.46Å; E156-S160 PolarHBondContact O-N 2.84Å; E156-S160 PolarHBondContact O-OG 3.41Å; G157-S160 PolarHBondContact O-N 2.85Å; L158-S160 VanDerWaalsContact C-N 3.34Å; L158-S160 PolarHBondContact O-N 3.05Å; S160-M162 VanDerWaalsContact C-N 3.34Å; S160-R163 PolarHBondContact O-N 3.03Å; S160-R163 PolarHBondContact OG-NH2 3.47Å; S160-K164 WeakPolarHBondContact O-CB 3.45Å; S160-K164 PolarHBondContact O-N 3.39Å; S160-K164 VanDerWaalsContact O-N 3.12Å
161	Q	85.6	Confident	79.1	Confident	52 Å²	52	76.2 Å²	76.2	24%	0.243	41%	0.408	C	S	.	.	H	α-helix	trans	-61.7	-41.7	171.5	179.3	62.4	16.8	0	0	111.3	G157 L158 K164 E165	G157-Q161 WeakPolarHBondContact O-CB 3.49Å; G157-Q161 PolarHBondContact O-N 3.5Å; L158-Q161 PolarHBondContact O-N 3.2Å; Q161-K164 PolarHBondContact O-N 2.83Å; Q161-E165 HydrophobicContact CG-CG 4.47Å; Q161-E165 VanDerWaalsContact CG-OE1 3.31Å; Q161-E165 WeakPolarHBondContact CG-OE1 3.39Å; Q161-E165 PolarHBondContact NE2-OE1 2.69Å; Q161-E165 WeakPolarHBondContact O-CB 3.38Å; Q161-E165 WeakPolarHBondContact O-CG 3.26Å; Q161-E165 PolarHBondContact O-N 3Å
162	M	82.1	Confident	76.7	Confident	50 Å²	50	78.5 Å²	78.5	25%	0.246	43%	0.427	C	S	.	.	H	α-helix	trans	-67.1	-36.6	177.8	-77.8	-113.3	54.1	0	0	113.7	K126 I130 L158 L159 S160 E165 A166	K126-M162 HydrophobicContact CB-SD 4.44Å; K126-M162 HydrophobicContact CD-SD 4.49Å; I130-M162 HydrophobicContact CD1-CG 4.09Å; I130-M162 HydrophobicContact CD1-SD 3.44Å; I130-M162 WeakPolarHBondContact CD1-SD 3.45Å; L158-M162 HydrophobicContact CD1-CG 4.42Å; L158-M162 WeakPolarHBondContact O-CG 3.44Å; L158-M162 PolarHBondContact O-N 3.38Å; L159-M162 PolarHBondContact O-N 2.85Å; S160-M162 VanDerWaalsContact C-N 3.34Å; M162-E165 PolarHBondContact O-N 3.45Å; M162-A166 WeakPolarHBondContact O-CB 3.29Å; M162-A166 PolarHBondContact O-N 2.69Å
163	R	82.1	Confident	74	Confident	136 Å²	136	85.2 Å²	85.2	51%	0.513	46%	0.457	S	S	.	.	H	α-helix	trans	-61.1	-47.3	170.5	-74.9	179.9	-71.5	-126.2	1.2	111.4	L159 S160 E165 A166 E167	L159-R163 PolarHBondContact O-N 3.49Å; L159-R163 VanDerWaalsContact O-N 3.08Å; S160-R163 PolarHBondContact O-N 3.03Å; S160-R163 PolarHBondContact OG-NH2 3.47Å; R163-E165 PolarHBondContact O-N 3.45Å; R163-A166 PolarHBondContact O-N 3.3Å; R163-E167 WeakPolarHBondContact O-CG 3.12Å; R163-E167 PolarHBondContact O-N 2.72Å
164	K	82.5	Confident	71.6	Confident	130 Å²	130	89.2 Å²	89.2	57%	0.565	47%	0.468	S	S	*	.	H	α-helix	trans	-64.1	-37.4	178.1	-171.2	178.1	-179.2	-179.2	0	113	S160 Q161 A168	S160-K164 WeakPolarHBondContact O-CB 3.45Å; S160-K164 PolarHBondContact O-N 3.39Å; S160-K164 VanDerWaalsContact O-N 3.12Å; Q161-K164 PolarHBondContact O-N 2.83Å; K164-A168 VanDerWaalsContact O-CB 3.24Å; K164-A168 WeakPolarHBondContact O-CB 3.27Å; K164-A168 PolarHBondContact O-N 3.4Å; K164-A168 VanDerWaalsContact O-N 3.11Å
165	E	74.8	Confident	68.9	Low	68 Å²	68	91.3 Å²	91.3	32%	0.318	49%	0.491	S	S	.	.	H	α-helix	trans	-66.5	-37.4	173.3	-76.9	173.5	-165.4	0	0	111.7	K126 Q161 M162 R163 A169	K126-E165 IonicContact NZ-OE1 3.18Å; K126-E165 PolarHBondContact NZ-OE1 3.47Å; K126-E165 IonicContact NZ-OE2 2.7Å; K126-E165 PolarHBondContact NZ-OE2 3.34Å; Q161-E165 HydrophobicContact CG-CG 4.47Å; Q161-E165 VanDerWaalsContact CG-OE1 3.31Å; Q161-E165 WeakPolarHBondContact CG-OE1 3.39Å; Q161-E165 PolarHBondContact NE2-OE1 2.69Å; Q161-E165 WeakPolarHBondContact O-CB 3.38Å; Q161-E165 WeakPolarHBondContact O-CG 3.26Å; Q161-E165 PolarHBondContact O-N 3Å; M162-E165 PolarHBondContact O-N 3.45Å; R163-E165 PolarHBondContact O-N 3.45Å; E165-A169 WeakPolarHBondContact O-CB 3.31Å; E165-A169 PolarHBondContact O-N 3.24Å
166	A	71.6	Confident	66.5	Low	55 Å²	55	98.5 Å²	98.5	46%	0.455	53%	0.528	S	S	.	.	H	α-helix	trans	-70.2	-49.9	175.9	0	0	0	0	0	112.6	M162 R163 A168 A169 E170	M162-A166 WeakPolarHBondContact O-CB 3.29Å; M162-A166 PolarHBondContact O-N 2.69Å; R163-A166 PolarHBondContact O-N 3.3Å; A166-A168 VanDerWaalsContact C-N 3.3Å; A166-A168 PolarHBondContact O-N 2.86Å; A166-A169 PolarHBondContact O-N 3.14Å; A166-E170 PolarHBondContact O-N 3.37Å
167	E	67.9	Low	64.4	Low	129 Å²	129	103.9 Å²	103.9	60%	0.603	54%	0.543	S	S	*	.	H	α-helix	trans	-57	-42.6	177.3	-72.2	166	-167.2	0	0	111.6	R163 A169 E170 S171	R163-E167 WeakPolarHBondContact O-CG 3.12Å; R163-E167 PolarHBondContact O-N 2.72Å; E167-A169 VanDerWaalsContact C-N 3.32Å; E167-A169 PolarHBondContact O-N 2.76Å; E167-E170 PolarHBondContact O-N 2.82Å; E167-S171 PolarHBondContact O-N 3.14Å; E167-S171 VanDerWaalsContact O-N 3.1Å; E167-S171 PolarHBondContact O-OG 2.74Å
168	A	60.4	Low	61.6	Low	66 Å²	66	110.5 Å²	110.5	55%	0.545	57%	0.571	S	S	.	*	H	α-helix	trans	-68.9	-26.7	176.8	0	0	0	0	0	113.8	K164 A166	K164-A168 VanDerWaalsContact O-CB 3.24Å; K164-A168 WeakPolarHBondContact O-CB 3.27Å; K164-A168 PolarHBondContact O-N 3.4Å; K164-A168 VanDerWaalsContact O-N 3.11Å; A166-A168 VanDerWaalsContact C-N 3.3Å; A166-A168 PolarHBondContact O-N 2.86Å
169	A	55.2	Low	59.2	Low	88 Å²	88	115.9 Å²	115.9	73%	0.727	61%	0.609	S	S	*	*	H	α-helix	trans	-81.6	-29.9	175.4	0	0	0	0	0	112.7	E165 A166 E167	E165-A169 WeakPolarHBondContact O-CB 3.31Å; E165-A169 PolarHBondContact O-N 3.24Å; A166-A169 PolarHBondContact O-N 3.14Å; E167-A169 VanDerWaalsContact C-N 3.32Å; E167-A169 PolarHBondContact O-N 2.76Å
170	E	44.5	Very low	56.6	Low	172 Å²	172	117.7 Å²	117.7	80%	0.804	64%	0.635	S	S	*	*	H	α-helix	trans	-83.7	-20	178.9	-167.5	160.2	-149.2	0	0	112.8	A166 E167 P172	A166-E170 PolarHBondContact O-N 3.37Å; E167-E170 PolarHBondContact O-N 2.82Å; E170-P172 WeakPolarHBondContact O-CD 3.35Å
171	S	34.1	Very low	54	Low	69 Å²	69	125.1 Å²	125.1	48%	0.483	66%	0.657	S	S	.	*	S	Bend	trans	-91.3	111.4	172.6	71.6	0	0	0	0	113.1	E167 Q173	E167-S171 PolarHBondContact O-N 3.14Å; E167-S171 VanDerWaalsContact O-N 3.1Å; E167-S171 PolarHBondContact O-OG 2.74Å; S171-Q173 PolarHBondContact O-N 2.78Å
172	P	44	Very low	51.4	Low	116 Å²	116	128.5 Å²	128.5	75%	0.753	68%	0.676	S	S	*	*			trans	-66.6	126.1	166.4	-16.3	31.2	0	0	0	109.3	E170 R174	E170-P172 WeakPolarHBondContact O-CD 3.35Å; P172-R174 PolarHBondContact O-N 2.86Å
173	Q	36.2	Very low	49.3	Very low	193 Å²	193	132.4 Å²	132.4	90%	0.902	70%	0.698	S	S	*	*			trans	-59.1	100.5	-179.5	-76.9	-167.9	-45.7	0	0	112	S171 S175	S171-Q173 PolarHBondContact O-N 2.78Å; Q173-S175 PolarHBondContact O-N 2.87Å
174	R	43.8	Very low	47.1	Very low	234 Å²	234	130.7 Å²	130.7	88%	0.883	71%	0.706	S	S	*	*			trans	-73.4	92	165.4	-78.1	-177.1	167.1	142	-3.8	109.1	P172 I176	P172-R174 PolarHBondContact O-N 2.86Å; R174-I176 PolarHBondContact O-N 2.85Å
175	S	36.5	Very low	44.9	Very low	121 Å²	121	135.1 Å²	135.1	85%	0.846	72%	0.719	S	S	*	*			trans	-53.7	133.1	166.2	-173.2	0	0	0	0	109.9	Q173	Q173-S175 PolarHBondContact O-N 2.87Å
176	I	43.3	Very low	42.9	Very low	152 Å²	152	138.1 Å²	138.1	78%	0.779	74%	0.737	S	S	*	*			trans	-92.8	110.5	-165.5	-56.5	171	0	0	0	110.5	R174	R174-I176 PolarHBondContact O-N 2.85Å
177	R	49	Very low	41.1	Very low	236 Å²	236	140 Å²	140	89%	0.891	75%	0.747	S	S	*	*			trans	164.2	106.8	140.8	-92.7	163.2	-177	176	1.6	110.7
178	D	30.2	Very low	39.5	Very low	170 Å²	170	141.2 Å²	141.2	91%	0.909	75%	0.753	S	S	*	*				-156.2	172	97.3	-152	-7.2	0	0	0	110.1
179	S	41.5	Very low	38	Very low	115 Å²	115	150.3 Å²	150.3	80%	0.804	77%	0.773	S	S	*	*			trans	-106.2	130.2	-173.4	178.2	0	0	0	0	112.3
180	G	34.2	Very low	37.1	Very low	71 Å²	71	150.6 Å²	150.6	73%	0.732	77%	0.77	S	S	*	*			trans	176.2	72.5	177.6	0	0	0	0	0	117.7
181	Y	33.9	Very low	36.5	Very low	205 Å²	205	149.6 Å²	149.6	80%	0.804	77%	0.77	S	S	*	*			trans	44.1	108.7	138.3	-163.1	-100.6	0	0	0	120.4
182	I	31.9	Very low	36.4	Very low	122 Å²	122	151.3 Å²	151.3	63%	0.626	78%	0.782	S	S	*	*			trans	72	144.3	153.1	-107	150.5	0	0	0	116.7
183	D	37.4	Very low	35.8	Very low	132 Å²	132	153.8 Å²	153.8	71%	0.706	79%	0.788	S	S	*	*			cis	-128.7	172.6	10.1	-129	-41.9	0	0	0	113.4
184	C	36.2	Very low	35.6	Very low	101 Å²	101	150.2 Å²	150.2	68%	0.682	78%	0.784	S	S	*	*			trans	-119.8	-168.7	-178.3	-71.4	0	0	0	0	112.3
185	W	36.5	Very low	36.3	Very low	222 Å²	222	144.6 Å²	144.6	84%	0.841	78%	0.778	S	S	*	*			trans	78.5	136	166.6	-53.9	92.1	0	0	0	116.3
186	D	32.2	Very low	36.6	Very low	131 Å²	131	144.2 Å²	144.2	70%	0.701	77%	0.773	S	S	*	*			cis	-156	158.5	-11	-156.1	8.4	0	0	0	113.6
187	S	34	Very low	36.2	Very low	94 Å²	94	148.1 Å²	148.1	66%	0.657	78%	0.778	S	S	*	*			trans	154.8	131.7	157.7	-98.7	0	0	0	0	108.9
188	E	34	Very low	35.5	Very low	156 Å²	156	145.4 Å²	145.4	73%	0.729	77%	0.774	S	S	*	*			cis	-161.5	141.1	-4.9	-118.8	164.6	114	0	0	108.6
189	R	30.2	Very low	35.6	Very low	256 Å²	256	140 Å²	140	97%	0.966	76%	0.76	S	S	*	*			trans	-147.6	133.6	157.1	-84	-163.3	172.7	-119	-1.6	110.1
190	S	34.7	Very low	35.6	Very low	95 Å²	95	143.5 Å²	143.5	66%	0.664	76%	0.755	S	S	*	*			trans	-104	173.9	-161.3	-44.1	0	0	0	0	115.1
191	D	31.8	Very low	35.6	Very low	151 Å²	151	146.1 Å²	146.1	81%	0.807	75%	0.748	S	S	*	*			trans	66.5	121.8	164.3	-59.7	-42.9	0	0	0	117.6
192	S	33.6	Very low	35.6	Very low	105 Å²	105	142.8 Å²	142.8	73%	0.734	74%	0.744	S	S	*	*				-168.1	164.1	71.4	-64.2	0	0	0	0	114.8
193	L	30.8	Very low	36	Very low	168 Å²	168	141.1 Å²	141.1	88%	0.88	74%	0.743	S	S	*	*			trans	83.2	158.4	162.4	-48.4	-173.8	0	0	0	119.3
194	S	31.1	Very low	35.6	Very low	117 Å²	117	143.6 Å²	143.6	82%	0.818	75%	0.748	S	S	*	*			trans	-169.6	175.6	-174.5	-68.4	0	0	0	0	109.2
195	P	58.5	Low	35.6	Very low	117 Å²	117	144.4 Å²	144.4	76%	0.76	75%	0.745	S	S	*	*				-120.5	179.4	-50.3	39.7	-27.3	0	0	0	111
196	P	43.7	Very low	35.6	Very low	113 Å²	113	138.4 Å²	138.4	73%	0.734	74%	0.737	S	S	*	*				-157.2	145.1	103.8	36.9	-17	0	0	0	119.3
197	R	34.6	Very low	35.7	Very low	234 Å²	234	139.1 Å²	139.1	88%	0.883	74%	0.74	S	S	*	*			trans	63.7	122.5	138.5	-68.1	179.4	179.5	-88.7	-2.1	123.7
198	H	35.5	Very low	35.5	Very low	178 Å²	178	141.2 Å²	141.2	82%	0.824	75%	0.745	S	S	*	*			trans	74.4	144.4	134.1	-144.9	68.2	0	0	0	118.3
199	G	31.6	Very low	35.4	Very low	58 Å²	58	138.1 Å²	138.1	60%	0.598	74%	0.74	S	S	*	*			cis	-125.8	177.5	-5.7	0	0	0	0	0	111.7
200	R	42.2	Very low	35.1	Very low	188 Å²	188	135.4 Å²	135.4	71%	0.709	74%	0.736	S	S	*	*			cis	70.8	136.7	37	-75.7	-173.8	164.5	-103	-0.8	114.3
201	E	33.2	Very low	34.9	Very low	126 Å²	126	134.4 Å²	134.4	59%	0.589	74%	0.74	S	S	*	*			cis	-98.3	-129	-9.2	-55.8	-61.3	172.9	0	0	109.5
202	D	33.2	Very low	34.6	Very low	135 Å²	135	132.5 Å²	132.5	72%	0.722	74%	0.738	S	S	*	*			cis	-165.5	172.5	-11.9	-127.1	-19.1	0	0	0	107.5
203	S	41.2	Very low	34.4	Very low	86 Å²	86	138.2 Å²	138.2	60%	0.601	74%	0.744	S	S	*	*			cis	-154.4	134	-6.6	41.4	0	0	0	0	111.7
204	F	29.4	Very low	34.3	Very low	185 Å²	185	134.4 Å²	134.4	81%	0.811	73%	0.732	S	S	*	*			trans	59.8	156.7	147.8	-74.7	-113.4	0	0	0	119.3
205	D	35.4	Very low	34.1	Very low	117 Å²	117	136.7 Å²	136.7	63%	0.626	73%	0.729	S	S	*	*			cis	-148.7	146.7	-9.8	-144.5	-6	0	0	0	105.6
206	S	37.9	Very low	32.6	Very low	96 Å²	96	138.6 Å²	138.6	67%	0.671	73%	0.728	S	S	*	*				-167.6	143.1	57.4	-49.3	0	0	0	0	107.9
207	L	32.5	Very low	31.7	Very low	146 Å²	146	139.2 Å²	139.2	76%	0.764	73%	0.73	S	S	*	*				45.1	138.2	96.1	-54.8	175.6	0	0	0	116.1
208	D	30.1	Very low	32.3	Very low	139 Å²	139	133 Å²	133	74%	0.743	72%	0.72	S	S	*	*			cis	-141.3	172.8	20.2	-151.4	-10.2	0	0	0	114.3
209	S	31.7	Very low	31.8	Very low	91 Å²	91	130 Å²	130	64%	0.636	72%	0.719	S	S	*	*			trans	-96	162.5	-172.1	-64.1	0	0	0	0	114.7
210	F	25.2	Very low	33	Very low	199 Å²	199	132 Å²	132	87%	0.873	72%	0.721	S	S	*	*				165.6	110.9	115	-92	-66.7	0	0	0	113.6
211	G	29.6	Very low	32.5	Very low	73 Å²	73	129.7 Å²	129.7	75%	0.753	72%	0.723	S	S	*	*			trans	68.4	149.7	155	0	0	0	0	0	119.1
212	S	25.7	Very low	32.2	Very low	111 Å²	111	129.2 Å²	129.2	78%	0.776	73%	0.728	S	S	*	*			cis	-159.2	161.3	-4.3	-67	0	0	0	0	111.2
213	R	28.7	Very low	32.1	Very low	225 Å²	225	130.5 Å²	130.5	85%	0.849	74%	0.735	S	S	*	*			trans	32.3	116.9	139	-76.1	173.4	165.3	-87	2.7	119.3
214	S	28.6	Very low	31.5	Very low	89 Å²	89	132.5 Å²	132.5	62%	0.622	74%	0.743	S	S	*	*				97	127.1	63.5	73.9	0	0	0	0	115.4
215	Q	27.7	Very low	32.3	Very low	164 Å²	164	128.7 Å²	128.7	77%	0.766	74%	0.736	S	S	*	*			trans	26.9	131.9	139.6	-61.3	-171.2	12.1	0	0	123
216	Q	26.3	Very low	32.1	Very low	157 Å²	157	134.8 Å²	134.8	73%	0.734	75%	0.751	S	S	*	*				78.4	136.9	128.6	-74	-174.2	16	0	0	124.4
217	T	25.6	Very low	31.7	Very low	126 Å²	126	133.2 Å²	133.2	77%	0.773	75%	0.75	S	S	*	*			trans	70.1	-179.5	146.8	62.9	0	0	0	0	118.8
218	P	47.5	Very low	31.5	Very low	105 Å²	105	132.2 Å²	132.2	68%	0.682	76%	0.755	S	S	*	*				-138.6	167.9	-89.8	42.7	-25.1	0	0	0	118
219	S	24.8	Very low	31.6	Very low	113 Å²	113	130.1 Å²	130.1	79%	0.79	75%	0.751	S	S	*	*			trans	66.1	175	153.5	-65.7	0	0	0	0	118.1
220	P	57.3	Low	31.7	Very low	100 Å²	100	133.1 Å²	133.1	65%	0.649	76%	0.76	S	S	*	*				-136.7	-171.3	-54	41	-25.8	0	0	0	114.5
221	D	30	Very low	32	Very low	140 Å²	140	127.6 Å²	127.6	75%	0.749	76%	0.759	S	S	*	*			trans	84.1	120.3	141.3	-72.3	-18.3	0	0	0	125
222	V	28.7	Very low	32.5	Very low	116 Å²	116	136.1 Å²	136.1	70%	0.703	77%	0.768	S	S	*	*				70.4	103.7	124.7	179.1	0	0	0	0	119.5
223	L	30.7	Very low	32.8	Very low	163 Å²	163	134.2 Å²	134.2	85%	0.853	77%	0.767	S	S	*	*				-162.8	146	102.3	-100.7	178.1	0	0	0	114.5
224	V	28.4	Very low	33.2	Very low	127 Å²	127	128.2 Å²	128.2	77%	0.77	76%	0.759	S	S	*	*			trans	-111.7	158.7	175.5	151	0	0	0	0	106.1
225	P	46.3	Very low	33.2	Very low	105 Å²	105	130.4 Å²	130.4	68%	0.682	76%	0.764	S	S	*	*			cis	-143.8	-172.4	23.6	32	-6.8	0	0	0	118.6
226	R	31.9	Very low	33.7	Very low	246 Å²	246	127.9 Å²	127.9	93%	0.928	76%	0.764	S	S	*	*				99.4	149.1	128.9	-114.2	177.3	-179.3	174.1	-0.2	121.6
227	G	28.3	Very low	33.9	Very low	63 Å²	63	129.8 Å²	129.8	65%	0.649	77%	0.773	S	S	*	*			trans	102.8	118.2	-179.6	0	0	0	0	0	111.4
228	S	28.1	Very low	34.1	Very low	125 Å²	125	129.2 Å²	129.2	87%	0.874	77%	0.774	S	S	*	*			cis	68.9	131.4	25.4	-45.7	0	0	0	0	113.5
229	S	31.6	Very low	33.3	Very low	94 Å²	94	132 Å²	132	66%	0.657	78%	0.784	S	S	*	*			cis	-155.6	176	-4.9	89.7	0	0	0	0	113.5
230	D	34.9	Very low	33.5	Very low	154 Å²	154	130 Å²	130	82%	0.824	78%	0.781	S	S	*	*			trans	21.9	132.9	152.1	-41.4	-57.9	0	0	0	121.8
231	G	32.3	Very low	32.4	Very low	83 Å²	83	131.4 Å²	131.4	86%	0.856	79%	0.788	S	S	*	*			trans	-159.5	80.9	174.9	0	0	0	0	0	114.6
232	R	39.4	Very low	33	Very low	252 Å²	252	130.1 Å²	130.1	95%	0.951	79%	0.787	S	S	*	*			trans	-53.9	143.2	-173.5	-65.1	166.3	166.3	-95.7	-0.8	117.5
233	G	31.4	Very low	33.2	Very low	72 Å²	72	132.4 Å²	132.4	74%	0.742	80%	0.795	S	S	*	*			trans	74.4	176.9	137.1	0	0	0	0	0	118.5
234	S	36.4	Very low	33.3	Very low	99 Å²	99	136.2 Å²	136.2	69%	0.692	80%	0.798	S	S	*	*			cis	-170.4	143.3	-27.2	-130.9	0	0	0	0	109.2
235	D	29	Very low	33.7	Very low	135 Å²	135	140 Å²	140	72%	0.722	80%	0.804	S	S	*	*			trans	61.2	124.5	147.3	-48.9	-44.6	0	0	0	122.8
236	S	39.7	Very low	33.1	Very low	110 Å²	110	142.6 Å²	142.6	77%	0.769	81%	0.809	S	S	*	*				54.7	123.5	129.3	-55.2	0	0	0	0	123.1
237	E	28.9	Very low	33.6	Very low	197 Å²	197	136 Å²	136	92%	0.921	80%	0.798	S	S	*	*				-164.3	-169.6	106.9	55.8	-175.9	105.9	0	0	112.1
238	S	29.7	Very low	34.5	Very low	114 Å²	114	137.8 Å²	137.8	80%	0.797	79%	0.793	S	S	*	*			trans	-135.2	169.2	-135.7	-62.2	0	0	0	0	118.1
239	D	31.9	Very low	35.5	Very low	165 Å²	165	137 Å²	137	88%	0.882	78%	0.779	S	S	*	*			trans	87.1	156.8	149.8	-138.1	-18.6	0	0	0	119.6
240	G	29.1	Very low	36.5	Very low	71 Å²	71	140.9 Å²	140.9	73%	0.732	79%	0.786	S	S	*	*			trans	118.1	93.2	177.3	0	0	0	0	0	115.9
241	T	33.3	Very low	37.4	Very low	129 Å²	129	142.3 Å²	142.3	79%	0.791	79%	0.785	S	S	*	*			trans	-85	177.2	177.6	58.7	0	0	0	0	113.4
242	P	42.8	Very low	38.1	Very low	113 Å²	113	142 Å²	142	73%	0.734	76%	0.763	S	S	*	*			cis	-131.9	146.7	-40.8	30.4	-13.9	0	0	0	113.2
243	N	33.5	Very low	39.2	Very low	164 Å²	164	133.6 Å²	133.6	88%	0.877	74%	0.738	S	S	*	*			trans	-156.9	132.1	149.1	-130.9	-40.2	0	0	0	113.7	K245	N243-K245 PolarHBondContact O-N 3.08Å
244	R	32.5	Very low	40.1	Very low	243 Å²	243	136.1 Å²	136.1	92%	0.917	73%	0.731	S	S	*	*			trans	-76.6	112.5	-178.6	-77.4	179.8	171.4	168.6	-3.2	110.7
245	K	35.6	Very low	40.8	Very low	205 Å²	205	136 Å²	136	89%	0.891	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-79.9	124.1	158.6	-78.4	175	177.9	169.7	0	109.1	N243	N243-K245 PolarHBondContact O-N 3.08Å
246	M	34.2	Very low	41.9	Very low	160 Å²	160	131 Å²	131	79%	0.788	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-57.4	143	172.2	-74.1	-81.6	-146.9	0	0	110.5
247	P	42.2	Very low	43.1	Very low	107 Å²	107	133 Å²	133	70%	0.695	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-56.6	144.4	158.3	-21.8	34	0	0	0	110.8	L249	P247-L249 PolarHBondContact O-N 3.43Å
248	D	48.9	Very low	44.4	Very low	102 Å²	102	131.7 Å²	131.7	55%	0.545	68%	0.677	S	S	.	*			trans	-66.1	102.6	178.7	174.4	17.2	0	0	0	111.2	H250 K251	D248-H250 PolarHBondContact O-N 3.27Å; D248-H250 VanDerWaalsContact O-N 3.12Å; D248-H250 VanDerWaalsContact OD1-CB 3.25Å; D248-H250 WeakPolarHBondContact OD1-CB 3.47Å; D248-H250 PolarHBondContact OD1-N 3.49Å; D248-K251 PolarHBondContact O-N 2.97Å
249	L	47.3	Very low	45.2	Very low	108 Å²	108	131.6 Å²	131.6	57%	0.565	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-10.9	-179.4	-63.6	178.2	0	0	0	113.5	P247 K251 A256	P247-L249 PolarHBondContact O-N 3.43Å; L249-K251 PolarHBondContact O-N 3.47Å; L249-A256 HydrophobicContact CD2-CB 4.26Å
250	H	54.4	Low	45.8	Very low	176 Å²	176	128.2 Å²	128.2	82%	0.815	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-17.8	178.3	-158.9	-10.6	0	0	0	112.8	D248	D248-H250 PolarHBondContact O-N 3.27Å; D248-H250 VanDerWaalsContact O-N 3.12Å; D248-H250 VanDerWaalsContact OD1-CB 3.25Å; D248-H250 WeakPolarHBondContact OD1-CB 3.47Å; D248-H250 PolarHBondContact OD1-N 3.49Å
251	K	52.3	Low	46.6	Very low	184 Å²	184	130.7 Å²	130.7	80%	0.8	66%	0.662	S	S	*	*	S	Bend	trans	-103.1	-12.1	-173.8	-79.1	178.3	176.6	171.4	0	116.8	D248 L249	D248-K251 PolarHBondContact O-N 2.97Å; L249-K251 PolarHBondContact O-N 3.47Å
252	D	48.6	Very low	47.1	Very low	75 Å²	75	131.2 Å²	131.2	40%	0.401	67%	0.665	S	S	.	*			trans	-144.8	77.8	177.1	-158.3	-24.3	0	0	0	113.7	M254 L255 A256	D252-M254 PolarHBondContact O-N 3.36Å; D252-M254 WeakPolarHBondContact OD1-CB 3.43Å; D252-M254 PolarHBondContact OD1-N 3Å; D252-L255 HydrophobicContact CB-CB 4.39Å; D252-L255 HydrophobicContact CB-CD1 4.3Å; D252-L255 PolarHBondContact O-N 3.36Å; D252-L255 VanDerWaalsContact O-N 3.13Å; D252-L255 PolarHBondContact OD1-N 3.09Å; D252-L255 WeakPolarHBondContact OD2-CD1 3.42Å; D252-A256 PolarHBondContact O-N 3.21Å
253	D	61.1	Low	46.7	Very low	77 Å²	77	135 Å²	135	41%	0.412	67%	0.673	S	S	.	*	H	α-helix	trans	-58.5	-22.7	174.8	178.2	28	0	0	0	113	R257	D253-R257 WeakPolarHBondContact O-CG 3.39Å; D253-R257 PolarHBondContact O-N 3.19Å; D253-R257 PolarHBondContact O-NE 2.96Å; D253-R257 IonicContact OD1-CZ 3.25Å; D253-R257 IonicContact OD1-NE 2.63Å; D253-R257 PolarHBondContact OD1-NE 3.32Å; D253-R257 IonicContact OD1-NH2 2.75Å; D253-R257 PolarHBondContact OD1-NH2 3.42Å; D253-R257 IonicContact OD2-CZ 3.62Å; D253-R257 IonicContact OD2-NE 3.38Å; D253-R257 PolarHBondContact OD2-NE 3.17Å; D253-R257 IonicContact OD2-NH2 2.85Å; D253-R257 PolarHBondContact OD2-NH2 3.27Å
254	M	51.3	Low	46.9	Very low	124 Å²	124	135.3 Å²	135.3	61%	0.611	67%	0.674	S	S	*	*	H	α-helix	trans	-76.5	-28.8	176.7	-72.4	-70.8	-73.4	0	0	112.9	D252	D252-M254 PolarHBondContact O-N 3.36Å; D252-M254 WeakPolarHBondContact OD1-CB 3.43Å; D252-M254 PolarHBondContact OD1-N 3Å
255	L	51.6	Low	46.9	Very low	97 Å²	97	135.6 Å²	135.6	51%	0.508	68%	0.675	S	S	.	*	H	α-helix	trans	-80.7	-42.6	171.5	-75.1	174.8	0	0	0	112.2	D252 R257 R258 T259	D252-L255 HydrophobicContact CB-CB 4.39Å; D252-L255 HydrophobicContact CB-CD1 4.3Å; D252-L255 PolarHBondContact O-N 3.36Å; D252-L255 VanDerWaalsContact O-N 3.13Å; D252-L255 PolarHBondContact OD1-N 3.09Å; D252-L255 WeakPolarHBondContact OD2-CD1 3.42Å; L255-R257 VanDerWaalsContact C-N 3.25Å; L255-R257 PolarHBondContact O-N 2.73Å; L255-R258 WeakPolarHBondContact O-CB 3.45Å; L255-R258 PolarHBondContact O-N 3.39Å; L255-T259 PolarHBondContact O-N 2.91Å
256	A	51.8	Low	47	Very low	30 Å²	30	132 Å²	132	25%	0.248	67%	0.67	C	S	.	*	H	α-helix	trans	-55.3	-41.2	178.6	0	0	0	0	0	112.3	L249 D252 R258	L249-A256 HydrophobicContact CD2-CB 4.26Å; D252-A256 PolarHBondContact O-N 3.21Å; A256-R258 VanDerWaalsContact C-N 3.27Å; A256-R258 PolarHBondContact O-N 3.08Å
257	R	64.1	Low	47.3	Very low	152 Å²	152	129 Å²	129	57%	0.574	67%	0.671	S	S	*	*	H	α-helix	trans	-75.4	-6.4	176.8	-69.6	-171.6	-94.1	121.3	-14.7	114.9	D253 L255	D253-R257 WeakPolarHBondContact O-CG 3.39Å; D253-R257 PolarHBondContact O-N 3.19Å; D253-R257 PolarHBondContact O-NE 2.96Å; D253-R257 IonicContact OD1-CZ 3.25Å; D253-R257 IonicContact OD1-NE 2.63Å; D253-R257 PolarHBondContact OD1-NE 3.32Å; D253-R257 IonicContact OD1-NH2 2.75Å; D253-R257 PolarHBondContact OD1-NH2 3.42Å; D253-R257 IonicContact OD2-CZ 3.62Å; D253-R257 IonicContact OD2-NE 3.38Å; D253-R257 PolarHBondContact OD2-NE 3.17Å; D253-R257 IonicContact OD2-NH2 2.85Å; D253-R257 PolarHBondContact OD2-NH2 3.27Å; L255-R257 VanDerWaalsContact C-N 3.25Å; L255-R257 PolarHBondContact O-N 2.73Å
258	R	56.7	Low	47.3	Very low	170 Å²	170	132.2 Å²	132.2	64%	0.642	68%	0.679	S	S	*	*	H	α-helix	trans	-98.1	-27.6	176.8	-89.3	-179.6	159.8	-171.5	-5.6	113.9	L255 A256	L255-R258 WeakPolarHBondContact O-CB 3.45Å; L255-R258 PolarHBondContact O-N 3.39Å; A256-R258 VanDerWaalsContact C-N 3.27Å; A256-R258 PolarHBondContact O-N 3.08Å
259	T	45.7	Very low	47	Very low	111 Å²	111	132.8 Å²	132.8	68%	0.681	69%	0.688	S	S	*	*	H	α-helix	trans	-92.1	-15.7	-174.5	51.5	0	0	0	0	114.6	L255 V261	L255-T259 PolarHBondContact O-N 2.91Å; T259-V261 PolarHBondContact O-N 3.46Å
260	S	44.1	Very low	46.4	Very low	94 Å²	94	136.6 Å²	136.6	66%	0.657	70%	0.7	S	S	*	*			trans	-82.2	71.7	-177.4	66.8	0	0	0	0	113.2
261	V	47.8	Very low	45.9	Very low	123 Å²	123	133.2 Å²	133.2	75%	0.745	69%	0.688	S	S	*	*			trans	-118.8	28.9	-176.9	-161.1	0	0	0	0	113.2	T259	T259-V261 PolarHBondContact O-N 3.46Å
262	T	42.4	Very low	45.8	Very low	141 Å²	141	132.4 Å²	132.4	87%	0.865	69%	0.688	S	S	*	*	S	Bend	trans	-147.9	49.3	173.1	-27.4	0	0	0	0	114.7
263	E	35.7	Very low	45.8	Very low	191 Å²	191	138.6 Å²	138.6	89%	0.893	71%	0.707	S	S	*	*	S	Bend	trans	-148.6	147.5	169	-134.5	169.5	-150.2	0	0	113.6	R265	E263-R265 PolarHBondContact O-N 3.39Å
264	L	36.8	Very low	45.2	Very low	171 Å²	171	140.7 Å²	140.7	90%	0.895	72%	0.717	S	S	*	*			trans	-81.3	111	-171	-126.7	72.6	0	0	0	111.1	T266	L264-T266 PolarHBondContact O-N 3.3Å; L264-T266 VanDerWaalsContact O-N 3.08Å
265	R	33.2	Very low	44.7	Very low	249 Å²	249	141.1 Å²	141.1	94%	0.94	73%	0.729	S	S	*	*			trans	-59.3	112.8	-180	-81.6	-173.2	174.3	172.9	-0.4	112.6	E263	E263-R265 PolarHBondContact O-N 3.39Å
266	T	37.7	Very low	44	Very low	129 Å²	129	142.6 Å²	142.6	79%	0.791	74%	0.738	S	S	*	*			trans	-76	146.3	147.8	-60.4	0	0	0	0	108.7	L264 M268	L264-T266 PolarHBondContact O-N 3.3Å; L264-T266 VanDerWaalsContact O-N 3.08Å; T266-M268 PolarHBondContact O-N 3.42Å
267	A	40.4	Very low	43.6	Very low	97 Å²	97	152.9 Å²	152.9	80%	0.802	77%	0.77	S	S	*	*			trans	-69.7	115.3	-172.3	0	0	0	0	0	112.5
268	M	42.8	Very low	42.7	Very low	175 Å²	175	149.5 Å²	149.5	86%	0.862	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-72.9	135.9	167.2	-76.1	-69	-175.8	0	0	110.4	T266	T266-M268 PolarHBondContact O-N 3.42Å
269	P	41.7	Very low	41.8	Very low	114 Å²	114	148.8 Å²	148.8	74%	0.74	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-71	150	177.4	30	-34.7	0	0	0	111.9
270	F	34.3	Very low	41.5	Very low	188 Å²	188	152.7 Å²	152.7	83%	0.825	79%	0.789	S	S	*	*	S	Bend	trans	-73.5	147.2	176	-174.3	-104.3	0	0	0	111.1
271	N	43.6	Very low	41.1	Very low	106 Å²	106	154.1 Å²	154.1	57%	0.567	80%	0.8	S	S	*	*			trans	83	86.3	-174.5	-52.3	-53.9	0	0	0	117.1
272	Q	51.1	Low	40.4	Very low	167 Å²	167	152.3 Å²	152.3	78%	0.78	81%	0.805	S	S	*	*	S	Bend	trans	-116.9	-4.4	163.5	-160.4	172.2	5.6	0	0	113.8
273	Y	47.3	Very low	40	Very low	204 Å²	204	156.1 Å²	156.1	80%	0.8	81%	0.806	S	S	*	*	S	Bend	trans	-118.1	29.3	-178.3	-65.7	-72.9	0	0	0	113.5
274	L	50.2	Low	39.8	Very low	121 Å²	121	152.9 Å²	152.9	63%	0.634	80%	0.798	S	S	*	*	S	Bend	trans	-128.1	146	165.6	-71.1	174.4	0	0	0	108.5	N276	L274-N276 PolarHBondContact O-N 2.87Å
275	P	40.3	Very low	39.8	Very low	134 Å²	134	149.9 Å²	149.9	87%	0.87	79%	0.789	S	S	*	*			trans	-59.8	112	-179.7	-24.9	35	0	0	0	112.5
276	N	36.8	Very low	39.5	Very low	128 Å²	128	142.7 Å²	142.7	68%	0.684	78%	0.783	S	S	*	*			trans	-75.6	142	174	-165.7	-17.2	0	0	0	110.1	L274 S278	L274-N276 PolarHBondContact O-N 2.87Å; N276-S278 PolarHBondContact O-N 3.13Å
277	R	43.3	Very low	39.2	Very low	245 Å²	245	141.9 Å²	141.9	93%	0.925	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	6.4	-177.6	-75.1	-176.2	166.6	-168.5	-4.6	114.7
278	S	44.5	Very low	38.7	Very low	82 Å²	82	143.7 Å²	143.7	57%	0.573	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-10.3	-169.1	52.5	0	0	0	0	115.8	N276	N276-S278 PolarHBondContact O-N 3.13Å
279	N	38.2	Very low	38.2	Very low	154 Å²	154	147.1 Å²	147.1	82%	0.824	78%	0.779	S	S	*	*			trans	-117.8	46.7	-178.1	-75.7	-14.7	0	0	0	113.4
280	Q	38.6	Very low	37.9	Very low	193 Å²	193	150.5 Å²	150.5	90%	0.902	78%	0.782	S	S	*	*			trans	-113.4	108.4	157.1	-80.2	-166.7	3.2	0	0	110.3
281	S	37.2	Very low	37.6	Very low	125 Å²	125	151.7 Å²	151.7	87%	0.874	79%	0.787	S	S	*	*			trans	-131	109.5	162.7	58.1	0	0	0	0	107.5
282	G	32.3	Very low	37	Very low	84 Å²	84	155.9 Å²	155.9	87%	0.866	80%	0.8	S	S	*	*	S	Bend	trans	177.1	-18.7	-173.4	0	0	0	0	0	116.4
283	Y	33.5	Very low	35.8	Very low	222 Å²	222	154.3 Å²	154.3	87%	0.871	80%	0.797	S	S	*	*			trans	-133.3	143.6	171.1	-163.3	-104.6	0	0	0	111.1
284	V	33.1	Very low	34.9	Very low	122 Å²	122	151 Å²	151	74%	0.739	79%	0.789	S	S	*	*			trans	-116.1	114	-167.2	177.6	0	0	0	0	111.1
285	P	35.8	Very low	34.1	Very low	109 Å²	109	152.3 Å²	152.3	71%	0.708	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-75.8	144.8	163	-11.4	28.3	0	0	0	111.1
286	A	27.2	Very low	33.6	Very low	98 Å²	98	153.1 Å²	153.1	81%	0.81	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-67.8	144.3	178.1	0	0	0	0	0	112.5
287	P	30.5	Very low	33.2	Very low	111 Å²	111	155.7 Å²	155.7	72%	0.721	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-88.5	131.4	-163	-11.9	30.9	0	0	0	116.3
288	L	30.8	Very low	32.6	Very low	135 Å²	135	147.7 Å²	147.7	71%	0.707	78%	0.783	S	S	*	*			trans	61.2	131.5	136.1	-64.5	167.1	0	0	0	120.9	K290	L288-K290 HydrophobicContact CD2-CG 4.44Å
289	R	32	Very low	31.8	Very low	247 Å²	247	147 Å²	147	93%	0.932	79%	0.789	S	S	*	*				-133.7	128.4	108.1	-62.9	-162.6	103.3	77.2	-3.3	111.1
290	K	35.9	Very low	31.3	Very low	185 Å²	185	148 Å²	148	80%	0.804	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-101.5	142.3	157.6	-79.4	-173.5	175.7	-178.8	0	108.4	L288	L288-K290 HydrophobicContact CD2-CG 4.44Å
291	K	28.7	Very low	31	Very low	214 Å²	214	147.7 Å²	147.7	93%	0.93	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-80.4	120	161.2	-165.7	175.8	-178.2	-178.1	0	107.5
292	K	29.7	Very low	30.6	Very low	194 Å²	194	147 Å²	147	84%	0.843	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-89.3	149.7	176	-172.3	-172.6	168.3	-169.4	0	109.4
293	N	27.2	Very low	30.4	Very low	134 Å²	134	154.6 Å²	154.6	72%	0.717	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-74.9	154.1	174.5	-148	45.9	0	0	0	112.8
294	E	27.5	Very low	30.4	Very low	135 Å²	135	148.9 Å²	148.9	63%	0.631	77%	0.774	S	S	*	*			trans	-6.4	129.5	156.3	-163.4	-172.1	142.8	0	0	117.9
295	K	34.1	Very low	30.1	Very low	147 Å²	147	149.6 Å²	149.6	64%	0.639	78%	0.779	S	S	*	*				164.4	126.3	105.1	-155.9	127.7	-158.4	151	0	112.9
296	E	28.1	Very low	29.7	Very low	152 Å²	152	148.2 Å²	148.2	71%	0.71	78%	0.777	S	S	*	*			trans	25.4	141.8	130	-160.8	-178.9	163.2	0	0	119.7
297	E	30	Very low	29.8	Very low	182 Å²	182	150.4 Å²	150.4	85%	0.85	78%	0.78	S	S	*	*			cis	-165.4	157.3	-17.8	173.2	167.6	-134.6	0	0	108.5
298	G	29	Very low	29.7	Very low	76 Å²	76	150 Å²	150	78%	0.784	78%	0.78	S	S	*	*			trans	99.6	129.6	151.7	0	0	0	0	0	119.3
299	G	28.7	Very low	30.7	Very low	68 Å²	68	149.1 Å²	149.1	70%	0.701	78%	0.782	S	S	*	*			trans	116.5	61.1	130.3	0	0	0	0	0	122.4
300	H	28.2	Very low	30.8	Very low	175 Å²	175	143.8 Å²	143.8	81%	0.81	78%	0.777	S	S	*	*			trans	61	150.6	140.8	-67.6	-90	0	0	0	123.3
301	K	30.7	Very low	30.5	Very low	187 Å²	187	138.5 Å²	138.5	81%	0.813	78%	0.775	S	S	*	*			trans	64.9	118	160.9	-19.7	-176.9	-168.3	175	0	116
302	S	30.3	Very low	30.5	Very low	110 Å²	110	132.6 Å²	132.6	77%	0.769	78%	0.775	S	S	*	*			cis	88.4	90.7	34.3	-55.8	0	0	0	0	116.1
303	W	27.4	Very low	30.5	Very low	243 Å²	243	126.9 Å²	126.9	92%	0.92	77%	0.771	S	S	*	*				-157.8	140.4	125.7	-89	-38.1	0	0	0	106.5
304	S	33.5	Very low	31.2	Very low	103 Å²	103	132.4 Å²	132.4	72%	0.72	78%	0.782	S	S	*	*				66.4	137.8	56	-49.6	0	0	0	0	111.2
305	T	26.8	Very low	32.4	Very low	136 Å²	136	131.1 Å²	131.1	83%	0.834	79%	0.786	S	S	*	*			cis	-143.5	156.5	30.9	-64.6	0	0	0	0	111.9
306	A	27.8	Very low	32.2	Very low	81 Å²	81	129.3 Å²	129.3	67%	0.669	79%	0.79	S	S	*	*			trans	-111	154.3	172	0	0	0	0	0	111.3
307	T	29.1	Very low	32.4	Very low	143 Å²	143	133.1 Å²	133.1	88%	0.877	80%	0.798	S	S	*	*			trans	-120.1	102	158.5	47.6	0	0	0	0	109.5
308	S	28.8	Very low	32.7	Very low	102 Å²	102	129.3 Å²	129.3	71%	0.713	79%	0.791	S	S	*	*			trans	-79	-160	163.1	-39.8	0	0	0	0	108.6
309	P	52	Low	32.7	Very low	117 Å²	117	133.6 Å²	133.6	76%	0.76	80%	0.796	S	S	*	*			cis	-127.3	-159.4	-3.7	32.6	-7.3	0	0	0	110.6
310	V	32.3	Very low	33.3	Very low	136 Å²	136	135.6 Å²	135.6	82%	0.824	80%	0.799	S	S	*	*			cis	-141.7	150.6	5.7	-174.7	0	0	0	0	105.4
311	G	29.5	Very low	33.5	Very low	74 Å²	74	134.8 Å²	134.8	76%	0.763	80%	0.797	S	S	*	*			cis	144.5	139.9	-0.7	0	0	0	0	0	110
312	G	30.8	Very low	33.7	Very low	89 Å²	89	133.9 Å²	133.9	92%	0.918	80%	0.799	S	S	*	*			trans	149.4	118.8	178.1	0	0	0	0	0	113.8
313	G	29	Very low	34.4	Very low	75 Å²	75	134.8 Å²	134.8	77%	0.773	80%	0.796	S	S	*	*			trans	159.5	162.3	172.4	0	0	0	0	0	113.1
314	R	40.8	Very low	35.1	Very low	249 Å²	249	131 Å²	131	94%	0.94	79%	0.79	S	S	*	*			trans	-158	155.3	155.7	-108.1	-179	-165.7	-85	-1.7	110.9
315	P	54.6	Low	35.8	Very low	109 Å²	109	136.3 Å²	136.3	71%	0.708	80%	0.795	S	S	*	*			trans	-118.3	-173.2	-172.8	43.4	-32.3	0	0	0	112.7
316	C	29.3	Very low	36.1	Very low	109 Å²	109	132.8 Å²	132.8	74%	0.736	79%	0.785	S	S	*	*				178.5	156.2	119.9	-107.8	0	0	0	0	115.9
317	R	31.3	Very low	37	Very low	231 Å²	231	137.6 Å²	137.6	87%	0.872	79%	0.794	S	S	*	*			trans	72.3	155.3	158.9	-66.6	163.4	-177.1	177.5	-0.3	118.3
318	S	36.4	Very low	37.8	Very low	102 Å²	102	138.1 Å²	138.1	71%	0.713	79%	0.791	S	S	*	*			cis	166.2	148.8	-43.2	-93.2	0	0	0	0	109
319	L	28.6	Very low	38.4	Very low	167 Å²	167	143.1 Å²	143.1	87%	0.874	80%	0.803	S	S	*	*			trans	70	128.2	178.3	-45.6	-179.5	0	0	0	112.9
320	S	42.2	Very low	38.2	Very low	109 Å²	109	142 Å²	142	76%	0.762	80%	0.804	S	S	*	*			cis	86.1	92	39.6	-173.7	0	0	0	0	113.5
321	M	33.3	Very low	39.1	Very low	159 Å²	159	142.4 Å²	142.4	78%	0.783	80%	0.8	S	S	*	*			trans	-124.2	118.5	153.8	-80.4	-174.7	65.8	0	0	109.1	M324	M321-M324 HydrophobicContact CE-CG 4.38Å
322	I	35	Very low	39.8	Very low	167 Å²	167	146.8 Å²	146.8	86%	0.856	81%	0.805	S	S	*	*			trans	-111.5	152.8	148.6	-155.6	70	0	0	0	106
323	D	44.1	Very low	40.5	Very low	130 Å²	130	149.5 Å²	149.5	70%	0.695	79%	0.794	S	S	*	*			trans	80.2	83	-174.4	-149.9	7.9	0	0	0	116.5
324	M	41.5	Very low	41.4	Very low	162 Å²	162	151 Å²	151	80%	0.798	79%	0.79	S	S	*	*			trans	-137.9	104.9	137.2	-98.3	-148.3	71.6	0	0	108.6	M321 G326	M321-M324 HydrophobicContact CE-CG 4.38Å; M324-G326 PolarHBondContact O-N 2.87Å
325	R	48.8	Very low	41.9	Very low	216 Å²	216	145.6 Å²	145.6	82%	0.815	78%	0.775	S	S	*	*			trans	-71.6	103.6	166	-177.7	-173.4	-57.4	-87.6	-5.2	108.9
326	G	33.7	Very low	42.3	Very low	62 Å²	62	144.1 Å²	144.1	64%	0.639	77%	0.767	S	S	*	*			trans	-105.4	118.3	170	0	0	0	0	0	110.7	M324 N328	M324-G326 PolarHBondContact O-N 2.87Å; G326-N328 PolarHBondContact O-N 2.88Å; G326-N328 VanDerWaalsContact O-N 3.11Å
327	E	45.2	Very low	44.4	Very low	181 Å²	181	144.9 Å²	144.9	85%	0.846	76%	0.76	S	S	*	*			trans	-74.6	95.1	179.2	-61.6	173.5	137.6	0	0	110.1
328	N	46.5	Very low	46.6	Very low	155 Å²	155	139 Å²	139	83%	0.829	74%	0.744	S	S	*	*			trans	-156.6	17.8	177.1	-104.8	-36.6	0	0	0	116.1	G326 A330	G326-N328 PolarHBondContact O-N 2.88Å; G326-N328 VanDerWaalsContact O-N 3.11Å; N328-A330 VanDerWaalsContact C-N 3.31Å; N328-A330 PolarHBondContact O-N 3.04Å
329	E	42.4	Very low	48.3	Very low	207 Å²	207	142.4 Å²	142.4	97%	0.967	74%	0.742	S	S	*	*			trans	-95.8	36.6	-179.2	-150	167.7	-132.2	0	0	112.6
330	A	46.7	Very low	50.4	Low	94 Å²	94	140.9 Å²	140.9	78%	0.777	73%	0.73	S	S	*	*	S	Bend	trans	-107.8	-5.6	-172.6	0	0	0	0	0	114.7	N328	N328-A330 VanDerWaalsContact C-N 3.31Å; N328-A330 PolarHBondContact O-N 3.04Å
331	I	51.5	Low	52.5	Low	144 Å²	144	140 Å²	140	74%	0.738	71%	0.714	S	S	*	*	S	Bend	trans	-138.4	136.6	-173.1	-50.1	-179.7	0	0	0	108.8
332	L	45.3	Very low	55.1	Low	166 Å²	166	138.3 Å²	138.3	87%	0.869	71%	0.707	S	S	*	*	S	Bend	trans	69.7	122.4	-167.2	-44	175.9	0	0	0	112.6
333	Q	43.5	Very low	57.5	Low	145 Å²	145	135.4 Å²	135.4	68%	0.678	69%	0.691	S	S	*	*			cis	-150.9	103.1	-1	-177.2	-170.5	36.5	0	0	109.2	H335 S336	Q333-H335 VanDerWaalsContact C-N 3.25Å; Q333-H335 PolarHBondContact O-N 3.35Å; Q333-S336 PolarHBondContact O-OG 3.38Å
334	P	49.8	Very low	59.4	Low	106 Å²	106	133.8 Å²	133.8	69%	0.688	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-20.4	-167.1	-28.8	36.3	0	0	0	117.3	S336	P334-S336 VanDerWaalsContact C-N 3.31Å; P334-S336 PolarHBondContact O-N 2.9Å
335	H	50.5	Low	61.8	Low	137 Å²	137	130 Å²	130	63%	0.634	66%	0.662	S	S	*	*	H	α-helix	trans	-69.5	-23.9	-171.8	-161.8	-45.5	0	0	0	113.7	Q333 R339	Q333-H335 VanDerWaalsContact C-N 3.25Å; Q333-H335 PolarHBondContact O-N 3.35Å; H335-R339 VanDerWaalsContact O-CB 3.3Å; H335-R339 WeakPolarHBondContact O-CB 3.27Å; H335-R339 PolarHBondContact O-N 2.59Å; H335-R339 VanDerWaalsContact O-N 3.15Å
336	S	63.1	Low	63.5	Low	77 Å²	77	123.7 Å²	123.7	54%	0.538	64%	0.642	S	S	.	*	H	α-helix	trans	-70.5	-46.8	-177.4	58.5	0	0	0	0	112.4	Q333 P334 R339 H340	Q333-S336 PolarHBondContact O-OG 3.38Å; P334-S336 VanDerWaalsContact C-N 3.31Å; P334-S336 PolarHBondContact O-N 2.9Å; S336-R339 PolarHBondContact O-N 3.04Å; S336-H340 PolarHBondContact O-N 3.38Å
337	H	72.7	Confident	66.2	Low	126 Å²	126	127.5 Å²	127.5	58%	0.583	64%	0.638	S	S	*	*	H	α-helix	trans	-61.9	-50.7	178.1	-169.5	-77.9	0	0	0	111.2	R339 H340 E341	H337-R339 VanDerWaalsContact C-N 3.28Å; H337-R339 PolarHBondContact O-N 2.96Å; H337-H340 PolarHBondContact O-N 3.06Å; H337-H340 VanDerWaalsContact O-N 3.09Å; H337-E341 IonicContact CE1-OE2 3.88Å; H337-E341 PolarHBondContact CE1-OE2 2.85Å; H337-E341 VanDerWaalsContact CE1-OE2 3.28Å; H337-E341 IonicContact ND1-OE2 2.98Å; H337-E341 PolarHBondContact ND1-OE2 3.44Å; H337-E341 VanDerWaalsContact ND1-OE2 3.17Å; H337-E341 VanDerWaalsContact O-CB 3.31Å; H337-E341 WeakPolarHBondContact O-CB 3.46Å; H337-E341 PolarHBondContact O-N 3.03Å
338	I	78	Confident	68.3	Low	107 Å²	107	120.8 Å²	120.8	55%	0.549	61%	0.608	S	S	.	*	H	α-helix	trans	-60.4	-39	-178.6	-60.2	170.9	0	0	0	110.9	L342	I338-L342 VanDerWaalsContact O-CB 3.28Å; I338-L342 WeakPolarHBondContact O-CB 3.47Å; I338-L342 PolarHBondContact O-N 2.8Å
339	R	71.8	Confident	70.4	Confident	174 Å²	174	119.9 Å²	119.9	66%	0.657	59%	0.593	S	S	*	*	H	α-helix	trans	-66.4	-42.5	174.9	-177.3	174.7	178.5	164.6	-0.3	112.3	H335 S336 H337 M343	H335-R339 VanDerWaalsContact O-CB 3.3Å; H335-R339 WeakPolarHBondContact O-CB 3.27Å; H335-R339 PolarHBondContact O-N 2.59Å; H335-R339 VanDerWaalsContact O-N 3.15Å; S336-R339 PolarHBondContact O-N 3.04Å; H337-R339 VanDerWaalsContact C-N 3.28Å; H337-R339 PolarHBondContact O-N 2.96Å; R339-M343 WeakPolarHBondContact O-CB 3.29Å; R339-M343 VanDerWaalsContact O-CG 3.31Å; R339-M343 WeakPolarHBondContact O-CG 3.31Å; R339-M343 PolarHBondContact O-N 2.89Å; R339-M343 VanDerWaalsContact O-N 3.07Å
340	H	73.8	Confident	72.7	Confident	134 Å²	134	114.5 Å²	114.5	62%	0.62	57%	0.57	S	S	*	*	H	α-helix	trans	-66.6	-42	177.5	-176.4	-94.7	0	0	0	111.7	S336 H337 M343 H344	S336-H340 PolarHBondContact O-N 3.38Å; H337-H340 PolarHBondContact O-N 3.06Å; H337-H340 VanDerWaalsContact O-N 3.09Å; H340-M343 PolarHBondContact O-N 2.89Å; H340-H344 VanDerWaalsContact O-CB 3.31Å; H340-H344 WeakPolarHBondContact O-CB 3.49Å; H340-H344 PolarHBondContact O-N 3.24Å
341	E	85.3	Confident	74.7	Confident	91 Å²	91	114.9 Å²	114.9	43%	0.425	55%	0.554	S	S	.	*	H	α-helix	trans	-63.7	-43.9	176.2	-173.3	175.7	170.2	0	0	111.9	H337 H344 N345	H337-E341 IonicContact CE1-OE2 3.88Å; H337-E341 PolarHBondContact CE1-OE2 2.85Å; H337-E341 VanDerWaalsContact CE1-OE2 3.28Å; H337-E341 IonicContact ND1-OE2 2.98Å; H337-E341 PolarHBondContact ND1-OE2 3.44Å; H337-E341 VanDerWaalsContact ND1-OE2 3.17Å; H337-E341 VanDerWaalsContact O-CB 3.31Å; H337-E341 WeakPolarHBondContact O-CB 3.46Å; H337-E341 PolarHBondContact O-N 3.03Å; E341-H344 PolarHBondContact O-N 3.12Å; E341-N345 WeakPolarHBondContact O-CB 3.47Å; E341-N345 PolarHBondContact O-N 3.18Å; E341-N345 PolarHBondContact O-ND2 2.94Å
342	L	87.5	Confident	76.6	Confident	123 Å²	123	114 Å²	114	64%	0.644	55%	0.547	S	S	*	.	H	α-helix	trans	-61.5	-44.6	174.5	-173.9	68.6	0	0	0	112	I338 N345 Q346	I338-L342 VanDerWaalsContact O-CB 3.28Å; I338-L342 WeakPolarHBondContact O-CB 3.47Å; I338-L342 PolarHBondContact O-N 2.8Å; L342-N345 PolarHBondContact O-N 3.21Å; L342-Q346 WeakPolarHBondContact O-CB 3.44Å; L342-Q346 PolarHBondContact O-N 2.83Å
343	M	85.5	Confident	78.7	Confident	107 Å²	107	110.6 Å²	110.6	53%	0.527	53%	0.529	S	S	.	.	H	α-helix	trans	-63.5	-40.6	174.7	-74.2	-60.8	-51.7	0	0	112.1	R339 H340 Q346 Y347	R339-M343 WeakPolarHBondContact O-CB 3.29Å; R339-M343 VanDerWaalsContact O-CG 3.31Å; R339-M343 WeakPolarHBondContact O-CG 3.31Å; R339-M343 PolarHBondContact O-N 2.89Å; R339-M343 VanDerWaalsContact O-N 3.07Å; H340-M343 PolarHBondContact O-N 2.89Å; M343-Q346 PolarHBondContact O-N 2.9Å; M343-Y347 WeakPolarHBondContact O-CB 3.5Å; M343-Y347 PolarHBondContact O-N 2.9Å
344	H	85.1	Confident	80.9	Confident	95 Å²	95	108.1 Å²	108.1	44%	0.44	52%	0.518	S	S	.	.	H	α-helix	trans	-67.3	-41.5	178.3	-169.8	64.6	0	0	0	111.6	H340 E341 Y347 N348	H340-H344 VanDerWaalsContact O-CB 3.31Å; H340-H344 WeakPolarHBondContact O-CB 3.49Å; H340-H344 PolarHBondContact O-N 3.24Å; E341-H344 PolarHBondContact O-N 3.12Å; H344-Y347 PolarHBondContact O-N 3.17Å; H344-N348 PolarHBondContact CD2-ND2 3.34Å; H344-N348 PolarHBondContact NE2-ND2 3.39Å; H344-N348 WeakPolarHBondContact O-CB 3.4Å; H344-N348 VanDerWaalsContact O-CG 3.22Å; H344-N348 PolarHBondContact O-N 3.06Å; H344-N348 PolarHBondContact O-ND2 3.14Å
345	N	90.8	Very high	82.9	Confident	83 Å²	83	106.8 Å²	106.8	44%	0.444	51%	0.505	S	S	.	.	H	α-helix	trans	-67.4	-35	174.6	-70.4	-24.8	0	0	0	112.2	E341 L342 R349	E341-N345 WeakPolarHBondContact O-CB 3.47Å; E341-N345 PolarHBondContact O-N 3.18Å; E341-N345 PolarHBondContact O-ND2 2.94Å; L342-N345 PolarHBondContact O-N 3.21Å; N345-R349 WeakPolarHBondContact O-CB 3.32Å; N345-R349 PolarHBondContact O-N 3.01Å
346	Q	85.4	Confident	84.7	Confident	84 Å²	84	105.4 Å²	105.4	39%	0.393	50%	0.499	S	S	.	.	H	α-helix	trans	-64.9	-44.6	171.5	-173.5	179.2	31.1	0	0	111.6	L342 M343 R349 I350	L342-Q346 WeakPolarHBondContact O-CB 3.44Å; L342-Q346 PolarHBondContact O-N 2.83Å; M343-Q346 PolarHBondContact O-N 2.9Å; Q346-R349 PolarHBondContact O-N 3.12Å; Q346-I350 HydrophobicContact CG-CD1 4.16Å; Q346-I350 VanDerWaalsContact O-CG1 3.32Å; Q346-I350 WeakPolarHBondContact O-CG1 3.49Å; Q346-I350 PolarHBondContact O-N 2.68Å
347	Y	89.1	Confident	86.1	Confident	142 Å²	142	109 Å²	109	56%	0.557	50%	0.501	S	S	*	.	H	α-helix	trans	-64	-43.9	176.2	177.5	-96.7	0	0	0	112.3	M343 H344 I350 K351	M343-Y347 WeakPolarHBondContact O-CB 3.5Å; M343-Y347 PolarHBondContact O-N 2.9Å; H344-Y347 PolarHBondContact O-N 3.17Å; Y347-I350 PolarHBondContact O-N 3.44Å; Y347-K351 HydrophobicContact CE1-CD 4.14Å; Y347-K351 VanDerWaalsContact O-CB 3.31Å; Y347-K351 WeakPolarHBondContact O-CB 3.24Å; Y347-K351 PolarHBondContact O-N 2.82Å
348	N	90.8	Very high	86.6	Confident	40 Å²	40	107.7 Å²	107.7	21%	0.214	50%	0.495	C	S	.	.	H	α-helix	trans	-63.7	-42.1	177.2	-70.7	-20	0	0	0	111.2	H344 K351 E352	H344-N348 PolarHBondContact CD2-ND2 3.34Å; H344-N348 PolarHBondContact NE2-ND2 3.39Å; H344-N348 WeakPolarHBondContact O-CB 3.4Å; H344-N348 VanDerWaalsContact O-CG 3.22Å; H344-N348 PolarHBondContact O-N 3.06Å; H344-N348 PolarHBondContact O-ND2 3.14Å; N348-K351 CarbonylContact O-C 3.45Å; N348-K351 WeakPolarHBondContact O-CB 3.37Å; N348-K351 PolarHBondContact O-N 3.2Å; N348-K351 VanDerWaalsContact O-N 3.17Å; N348-E352 WeakPolarHBondContact O-CB 3.3Å; N348-E352 VanDerWaalsContact O-CG 3.32Å; N348-E352 WeakPolarHBondContact O-CG 3.44Å; N348-E352 PolarHBondContact O-N 3.45Å
349	R	89.5	Confident	87.2	Confident	135 Å²	135	107.5 Å²	107.5	51%	0.509	49%	0.492	S	S	.	.	H	α-helix	trans	-60.2	-48.8	174.4	-170.2	-177.8	69.4	-121.2	3.6	112.3	N345 Q346 K351 E352 D353	N345-R349 WeakPolarHBondContact O-CB 3.32Å; N345-R349 PolarHBondContact O-N 3.01Å; Q346-R349 PolarHBondContact O-N 3.12Å; R349-K351 PolarHBondContact O-N 3.1Å; R349-E352 CarbonylContact O-C 3.49Å; R349-E352 WeakPolarHBondContact O-CA 3.4Å; R349-E352 WeakPolarHBondContact O-CB 3.23Å; R349-E352 PolarHBondContact O-N 3.04Å; R349-D353 VanDerWaalsContact O-CG 3.25Å; R349-D353 PolarHBondContact O-N 3.19Å
350	I	90.4	Very high	88.3	Confident	94 Å²	94	102.5 Å²	102.5	48%	0.482	48%	0.478	S	S	.	.	H	α-helix	trans	-57.8	-37.9	176.1	-68.5	164.1	0	0	0	111	Q346 Y347 E354	Q346-I350 HydrophobicContact CG-CD1 4.16Å; Q346-I350 VanDerWaalsContact O-CG1 3.32Å; Q346-I350 WeakPolarHBondContact O-CG1 3.49Å; Q346-I350 PolarHBondContact O-N 2.68Å; Y347-I350 PolarHBondContact O-N 3.44Å; I350-E354 VanDerWaalsContact O-CB 3.29Å; I350-E354 WeakPolarHBondContact O-CB 3.47Å; I350-E354 PolarHBondContact O-N 3.34Å
351	K	90.5	Very high	89	Confident	103 Å²	103	98.5 Å²	98.5	45%	0.448	46%	0.461	S	S	.	.	H	α-helix	trans	-72.7	-30.9	177.1	-172.3	-178.8	176.4	-169.8	0	113	Y347 N348 R349 N355	Y347-K351 HydrophobicContact CE1-CD 4.14Å; Y347-K351 VanDerWaalsContact O-CB 3.31Å; Y347-K351 WeakPolarHBondContact O-CB 3.24Å; Y347-K351 PolarHBondContact O-N 2.82Å; N348-K351 CarbonylContact O-C 3.45Å; N348-K351 WeakPolarHBondContact O-CB 3.37Å; N348-K351 PolarHBondContact O-N 3.2Å; N348-K351 VanDerWaalsContact O-N 3.17Å; R349-K351 PolarHBondContact O-N 3.1Å; K351-N355 WeakPolarHBondContact O-CB 3.37Å; K351-N355 PolarHBondContact O-N 3.39Å; K351-N355 PolarHBondContact O-ND2 2.93Å; K351-N355 VanDerWaalsContact O-ND2 3.12Å
352	E	90.4	Very high	89.1	Confident	124 Å²	124	96.4 Å²	96.4	58%	0.579	46%	0.459	S	S	*	.	H	α-helix	trans	-71.3	-41.3	171.9	-74.9	161.1	-161.2	0	0	111	N348 R349 N355 H356	N348-E352 WeakPolarHBondContact O-CB 3.3Å; N348-E352 VanDerWaalsContact O-CG 3.32Å; N348-E352 WeakPolarHBondContact O-CG 3.44Å; N348-E352 PolarHBondContact O-N 3.45Å; R349-E352 CarbonylContact O-C 3.49Å; R349-E352 WeakPolarHBondContact O-CA 3.4Å; R349-E352 WeakPolarHBondContact O-CB 3.23Å; R349-E352 PolarHBondContact O-N 3.04Å; E352-N355 PolarHBondContact O-N 3.3Å; E352-H356 VanDerWaalsContact O-CB 3.25Å; E352-H356 WeakPolarHBondContact O-CB 3.24Å; E352-H356 PolarHBondContact O-N 3Å
353	D	89.8	Confident	89.3	Confident	95 Å²	95	95.2 Å²	95.2	51%	0.508	45%	0.446	S	S	.	.	H	α-helix	trans	-61.2	-45.8	172.5	-63.3	-38.1	0	0	0	111.2	R349 H356 W357	R349-D353 VanDerWaalsContact O-CG 3.25Å; R349-D353 PolarHBondContact O-N 3.19Å; D353-H356 PolarHBondContact O-N 3.46Å; D353-W357 WeakPolarHBondContact O-CB 3.41Å; D353-W357 PolarHBondContact O-N 3.48Å
354	E	89.6	Confident	89.4	Confident	93 Å²	93	96.4 Å²	96.4	44%	0.435	45%	0.445	S	S	.	.	H	α-helix	trans	-59.8	-48.8	173.4	174.6	77.1	-126.6	0	0	111.6	I350 H356 W357 Q358	I350-E354 VanDerWaalsContact O-CB 3.29Å; I350-E354 WeakPolarHBondContact O-CB 3.47Å; I350-E354 PolarHBondContact O-N 3.34Å; E354-H356 VanDerWaalsContact C-N 3.34Å; E354-H356 PolarHBondContact O-N 2.84Å; E354-W357 PolarHBondContact O-N 3.31Å; E354-Q358 WeakPolarHBondContact O-CG 3.26Å; E354-Q358 PolarHBondContact O-N 3.11Å; E354-Q358 PolarHBondContact OE1-NE2 3.12Å
355	N	91.8	Very high	89.4	Confident	79 Å²	79	96.4 Å²	96.4	42%	0.422	44%	0.443	S	S	.	.	H	α-helix	trans	-60.2	-43.6	175.6	-73.7	-26.1	0	0	0	111.4	K351 E352 Q358 E359	K351-N355 WeakPolarHBondContact O-CB 3.37Å; K351-N355 PolarHBondContact O-N 3.39Å; K351-N355 PolarHBondContact O-ND2 2.93Å; K351-N355 VanDerWaalsContact O-ND2 3.12Å; E352-N355 PolarHBondContact O-N 3.3Å; N355-Q358 PolarHBondContact O-N 2.91Å; N355-E359 WeakPolarHBondContact O-CG 3.35Å; N355-E359 PolarHBondContact O-N 3.18Å
356	H	88.8	Confident	89.2	Confident	108 Å²	108	95.2 Å²	95.2	50%	0.5	44%	0.442	S	S	.	.	H	α-helix	trans	-62.7	-42.5	179.3	-177	66.9	0	0	0	111.4	E352 D353 E354 E359 D360	E352-H356 VanDerWaalsContact O-CB 3.25Å; E352-H356 WeakPolarHBondContact O-CB 3.24Å; E352-H356 PolarHBondContact O-N 3Å; D353-H356 PolarHBondContact O-N 3.46Å; E354-H356 VanDerWaalsContact C-N 3.34Å; E354-H356 PolarHBondContact O-N 2.84Å; H356-E359 PolarHBondContact O-N 3.32Å; H356-D360 WeakPolarHBondContact O-CB 3.16Å; H356-D360 PolarHBondContact O-N 3.29Å
357	W	92.5	Very high	89.3	Confident	153 Å²	153	97.8 Å²	97.8	58%	0.58	45%	0.448	S	S	*	.	H	α-helix	trans	-63.3	-42.7	172.4	175	82.4	0	0	0	112.5	D353 E354 D360 L361	D353-W357 WeakPolarHBondContact O-CB 3.41Å; D353-W357 PolarHBondContact O-N 3.48Å; E354-W357 PolarHBondContact O-N 3.31Å; W357-D360 PolarHBondContact O-N 2.96Å; W357-L361 HydrophobicContact CH2-CD2 3.73Å; W357-L361 HydrophobicContact CZ2-CD2 3.87Å; W357-L361 HydrophobicContact CZ3-CD2 4.26Å; W357-L361 VanDerWaalsContact O-CB 3.28Å; W357-L361 WeakPolarHBondContact O-CB 3.44Å; W357-L361 PolarHBondContact O-N 3.12Å
358	Q	82.1	Confident	88.6	Confident	98 Å²	98	99.2 Å²	99.2	46%	0.458	45%	0.452	S	S	.	.	H	α-helix	trans	-64.4	-39.9	176.2	-70.9	-176.8	27.5	0	0	112	E354 N355 A362	E354-Q358 WeakPolarHBondContact O-CG 3.26Å; E354-Q358 PolarHBondContact O-N 3.11Å; E354-Q358 PolarHBondContact OE1-NE2 3.12Å; N355-Q358 PolarHBondContact O-N 2.91Å; Q358-A362 WeakPolarHBondContact O-CB 3.08Å; Q358-A362 PolarHBondContact O-N 3.29Å
359	E	91.6	Very high	87.9	Confident	103 Å²	103	104.2 Å²	104.2	48%	0.481	47%	0.468	S	S	.	.	H	α-helix	trans	-63.2	-44.4	171.7	-75	-169.6	171.9	0	0	112	N355 H356 A362 R363	N355-E359 WeakPolarHBondContact O-CG 3.35Å; N355-E359 PolarHBondContact O-N 3.18Å; H356-E359 PolarHBondContact O-N 3.32Å; E359-A362 CarbonylContact O-C 3.59Å; E359-A362 WeakPolarHBondContact O-CA 3.38Å; E359-A362 WeakPolarHBondContact O-CB 3.47Å; E359-A362 PolarHBondContact O-N 3.03Å; E359-A362 VanDerWaalsContact O-N 3.13Å; E359-R363 VanDerWaalsContact CB-NH2 3.34Å; E359-R363 WeakPolarHBondContact O-CB 3.29Å; E359-R363 WeakPolarHBondContact O-CG 3.22Å; E359-R363 PolarHBondContact O-N 3.44Å; E359-R363 IonicContact OE2-CZ 2.76Å; E359-R363 IonicContact OE2-NH1 3.34Å; E359-R363 PolarHBondContact OE2-NH1 3.36Å; E359-R363 IonicContact OE2-NH2 2.69Å; E359-R363 PolarHBondContact OE2-NH2 2.95Å; E359-R363 VanDerWaalsContact OE2-NH2 3.13Å
360	D	94.8	Very high	87.5	Confident	68 Å²	68	100 Å²	100	36%	0.364	46%	0.459	S	S	.	.	H	α-helix	trans	-67.8	-36.5	179.6	-105.2	18.6	0	0	0	112.3	H356 W357 A362 R363 W364	H356-D360 WeakPolarHBondContact O-CB 3.16Å; H356-D360 PolarHBondContact O-N 3.29Å; W357-D360 PolarHBondContact O-N 2.96Å; D360-A362 VanDerWaalsContact C-N 3.32Å; D360-R363 PolarHBondContact O-N 3.13Å; D360-R363 IonicContact OD1-CZ 3.73Å; D360-R363 IonicContact OD1-NE 2.84Å; D360-R363 PolarHBondContact OD1-NE 3.45Å; D360-R363 IonicContact OD1-NH2 3.61Å; D360-R363 PolarHBondContact OD1-NH2 2.96Å; D360-W364 VanDerWaalsContact O-CB 3.26Å; D360-W364 WeakPolarHBondContact O-CB 3.49Å; D360-W364 PolarHBondContact O-N 3.15Å
361	L	87	Confident	87	Confident	50 Å²	50	99.5 Å²	99.5	26%	0.262	46%	0.46	S	S	.	.	H	α-helix	trans	-63.9	-37.4	169.8	-176.2	62	0	0	0	111.4	W357 W364 K365	W357-L361 HydrophobicContact CH2-CD2 3.73Å; W357-L361 HydrophobicContact CZ2-CD2 3.87Å; W357-L361 HydrophobicContact CZ3-CD2 4.26Å; W357-L361 VanDerWaalsContact O-CB 3.28Å; W357-L361 WeakPolarHBondContact O-CB 3.44Å; W357-L361 PolarHBondContact O-N 3.12Å; L361-W364 HydrophobicContact CD1-CE3 4.25Å; L361-K365 HydrophobicContact CD1-CD 4.41Å; L361-K365 HydrophobicContact CG-CD 4.16Å; L361-K365 VanDerWaalsContact O-CB 3.29Å; L361-K365 WeakPolarHBondContact O-CB 3.35Å; L361-K365 WeakPolarHBondContact O-CD 3.29Å; L361-K365 WeakPolarHBondContact O-CG 3.2Å; L361-K365 PolarHBondContact O-N 2.93Å
362	A	89.1	Confident	86	Confident	48 Å²	48	97.6 Å²	97.6	40%	0.397	46%	0.46	S	S	.	.	H	α-helix	trans	-69.4	-44.6	173.4	0	0	0	0	0	112	Q358 E359 D360 W364 K365 S366	Q358-A362 WeakPolarHBondContact O-CB 3.08Å; Q358-A362 PolarHBondContact O-N 3.29Å; E359-A362 CarbonylContact O-C 3.59Å; E359-A362 WeakPolarHBondContact O-CA 3.38Å; E359-A362 WeakPolarHBondContact O-CB 3.47Å; E359-A362 PolarHBondContact O-N 3.03Å; E359-A362 VanDerWaalsContact O-N 3.13Å; D360-A362 VanDerWaalsContact C-N 3.32Å; A362-W364 VanDerWaalsContact C-N 3.32Å; A362-W364 PolarHBondContact O-N 2.87Å; A362-K365 PolarHBondContact O-N 2.9Å; A362-S366 WeakPolarHBondContact O-CB 3.27Å; A362-S366 PolarHBondContact O-N 3.4Å; A362-S366 PolarHBondContact O-OG 2.96Å
363	R	91.9	Very high	85.4	Confident	98 Å²	98	97.9 Å²	97.9	37%	0.37	46%	0.461	S	S	.	.	H	α-helix	trans	-60.6	-38.8	173.5	-74.3	-174.1	-81.5	-97.6	-0.3	111.2	E359 D360 R367	E359-R363 VanDerWaalsContact CB-NH2 3.34Å; E359-R363 WeakPolarHBondContact O-CB 3.29Å; E359-R363 WeakPolarHBondContact O-CG 3.22Å; E359-R363 PolarHBondContact O-N 3.44Å; E359-R363 IonicContact OE2-CZ 2.76Å; E359-R363 IonicContact OE2-NH1 3.34Å; E359-R363 PolarHBondContact OE2-NH1 3.36Å; E359-R363 IonicContact OE2-NH2 2.69Å; E359-R363 PolarHBondContact OE2-NH2 2.95Å; E359-R363 VanDerWaalsContact OE2-NH2 3.13Å; D360-R363 PolarHBondContact O-N 3.13Å; D360-R363 IonicContact OD1-CZ 3.73Å; D360-R363 IonicContact OD1-NE 2.84Å; D360-R363 PolarHBondContact OD1-NE 3.45Å; D360-R363 IonicContact OD1-NH2 3.61Å; D360-R363 PolarHBondContact OD1-NH2 2.96Å; R363-R367 VanDerWaalsContact O-CB 3.32Å; R363-R367 WeakPolarHBondContact O-CB 3.31Å; R363-R367 VanDerWaalsContact O-CG 3.25Å; R363-R367 WeakPolarHBondContact O-CG 3.35Å; R363-R367 PolarHBondContact O-N 3.13Å; R363-R367 PolarHBondContact O-NE 3.31Å
364	W	87.2	Confident	84.9	Confident	132 Å²	132	97.6 Å²	97.6	50%	0.5	46%	0.46	S	S	.	.	H	α-helix	trans	-70.8	-47.5	175.2	178.6	85.8	0	0	0	112	D360 L361 A362 S366 R367 R368	D360-W364 VanDerWaalsContact O-CB 3.26Å; D360-W364 WeakPolarHBondContact O-CB 3.49Å; D360-W364 PolarHBondContact O-N 3.15Å; L361-W364 HydrophobicContact CD1-CE3 4.25Å; A362-W364 VanDerWaalsContact C-N 3.32Å; A362-W364 PolarHBondContact O-N 2.87Å; W364-S366 VanDerWaalsContact C-N 3.27Å; W364-S366 PolarHBondContact O-N 2.93Å; W364-R367 PolarHBondContact O-N 3.33Å; W364-R368 WeakPolarHBondContact O-CB 3.36Å; W364-R368 PolarHBondContact O-N 2.83Å
365	K	84.9	Confident	84.5	Confident	94 Å²	94	98.7 Å²	98.7	41%	0.409	47%	0.468	S	S	.	.	H	α-helix	trans	-58.2	-39.4	174.2	-76.3	167.6	-178.9	168.1	0	111.6	L361 A362 R369	L361-K365 HydrophobicContact CD1-CD 4.41Å; L361-K365 HydrophobicContact CG-CD 4.16Å; L361-K365 VanDerWaalsContact O-CB 3.29Å; L361-K365 WeakPolarHBondContact O-CB 3.35Å; L361-K365 WeakPolarHBondContact O-CD 3.29Å; L361-K365 WeakPolarHBondContact O-CG 3.2Å; L361-K365 PolarHBondContact O-N 2.93Å; A362-K365 PolarHBondContact O-N 2.9Å; K365-R369 WeakPolarHBondContact O-CB 3.24Å; K365-R369 VanDerWaalsContact O-CG 3.31Å; K365-R369 WeakPolarHBondContact O-CG 3.5Å; K365-R369 PolarHBondContact O-N 3.09Å; K365-R369 PolarHBondContact O-NE 3.49Å; K365-R369 VanDerWaalsContact O-NE 3.12Å
366	S	85.7	Confident	83.8	Confident	58 Å²	58	99.2 Å²	99.2	41%	0.406	47%	0.47	S	S	.	.	H	α-helix	trans	-72.4	-42.6	176.1	-68.6	0	0	0	0	112.8	A362 W364 R368 R369 S370	A362-S366 WeakPolarHBondContact O-CB 3.27Å; A362-S366 PolarHBondContact O-N 3.4Å; A362-S366 PolarHBondContact O-OG 2.96Å; W364-S366 VanDerWaalsContact C-N 3.27Å; W364-S366 PolarHBondContact O-N 2.93Å; S366-R368 VanDerWaalsContact C-N 3.33Å; S366-R368 PolarHBondContact O-N 2.84Å; S366-R369 PolarHBondContact O-N 3.45Å; S366-R369 PolarHBondContact OG-NH2 3.23Å; S366-S370 PolarHBondContact O-N 2.95Å; S366-S370 PolarHBondContact O-OG 2.89Å
367	R	87.1	Confident	83.7	Confident	138 Å²	138	99.1 Å²	99.1	52%	0.521	47%	0.468	S	S	.	.	H	α-helix	trans	-58.9	-41.3	171.4	-79	175.5	-74.6	-169.2	-0.7	112.4	R363 W364 S370 V371	R363-R367 VanDerWaalsContact O-CB 3.32Å; R363-R367 WeakPolarHBondContact O-CB 3.31Å; R363-R367 VanDerWaalsContact O-CG 3.25Å; R363-R367 WeakPolarHBondContact O-CG 3.35Å; R363-R367 PolarHBondContact O-N 3.13Å; R363-R367 PolarHBondContact O-NE 3.31Å; W364-R367 PolarHBondContact O-N 3.33Å; R367-S370 PolarHBondContact O-N 2.88Å; R367-S370 PolarHBondContact O-OG 3.41Å; R367-S370 VanDerWaalsContact O-OG 3.12Å; R367-V371 WeakPolarHBondContact O-CB 3.49Å; R367-V371 VanDerWaalsContact O-CG2 3.31Å; R367-V371 WeakPolarHBondContact O-CG2 3.42Å; R367-V371 PolarHBondContact O-N 3.05Å
368	R	74.6	Confident	83.4	Confident	172 Å²	172	98.6 Å²	98.6	65%	0.649	47%	0.47	S	S	*	.	H	α-helix	trans	-65.5	-37.7	176	-172.8	173.6	-177.8	140.4	3.2	112.3	W364 S366 S372	W364-R368 WeakPolarHBondContact O-CB 3.36Å; W364-R368 PolarHBondContact O-N 2.83Å; S366-R368 VanDerWaalsContact C-N 3.33Å; S366-R368 PolarHBondContact O-N 2.84Å; R368-S372 WeakPolarHBondContact O-CB 3.36Å; R368-S372 PolarHBondContact O-N 3Å
369	R	77.1	Confident	83.6	Confident	146 Å²	146	97 Å²	97	55%	0.551	46%	0.462	S	S	*	.	H	α-helix	trans	-70.9	-43.7	174.5	-75	176.5	-63.1	-141.8	2.1	112.1	K365 S366 S372 Q373	K365-R369 WeakPolarHBondContact O-CB 3.24Å; K365-R369 VanDerWaalsContact O-CG 3.31Å; K365-R369 WeakPolarHBondContact O-CG 3.5Å; K365-R369 PolarHBondContact O-N 3.09Å; K365-R369 PolarHBondContact O-NE 3.49Å; K365-R369 VanDerWaalsContact O-NE 3.12Å; S366-R369 PolarHBondContact O-N 3.45Å; S366-R369 PolarHBondContact OG-NH2 3.23Å; R369-S372 PolarHBondContact O-N 3.38Å; R369-Q373 WeakPolarHBondContact O-CB 3.32Å; R369-Q373 PolarHBondContact O-N 3.43Å
370	S	81.7	Confident	83.2	Confident	46 Å²	46	97.9 Å²	97.9	32%	0.322	47%	0.467	S	S	.	.	H	α-helix	trans	-64.2	-49.9	177.9	70.6	0	0	0	0	110.5	S366 R367 S372 Q373 D374	S366-S370 PolarHBondContact O-N 2.95Å; S366-S370 PolarHBondContact O-OG 2.89Å; R367-S370 PolarHBondContact O-N 2.88Å; R367-S370 PolarHBondContact O-OG 3.41Å; R367-S370 VanDerWaalsContact O-OG 3.12Å; S370-S372 VanDerWaalsContact C-N 3.27Å; S370-S372 PolarHBondContact O-N 2.97Å; S370-Q373 CarbonylContact O-C 3.52Å; S370-Q373 WeakPolarHBondContact O-CA 3.29Å; S370-Q373 WeakPolarHBondContact O-CB 3.38Å; S370-Q373 PolarHBondContact O-N 2.89Å; S370-D374 VanDerWaalsContact C-OD2 3.3Å; S370-D374 WeakPolarHBondContact O-CB 3.43Å; S370-D374 PolarHBondContact O-N 2.61Å
371	V	78.3	Confident	82.7	Confident	83 Å²	83	98.9 Å²	98.9	50%	0.503	47%	0.469	S	S	.	.	H	α-helix	trans	-57.4	-39.5	176.1	171.9	0	0	0	0	112	R367 L375	R367-V371 WeakPolarHBondContact O-CB 3.49Å; R367-V371 VanDerWaalsContact O-CG2 3.31Å; R367-V371 WeakPolarHBondContact O-CG2 3.42Å; R367-V371 PolarHBondContact O-N 3.05Å; V371-L375 HydrophobicContact CG1-CD1 4.16Å; V371-L375 WeakPolarHBondContact O-CB 3.32Å; V371-L375 WeakPolarHBondContact O-CD1 3.43Å; V371-L375 VanDerWaalsContact O-CG 3.22Å; V371-L375 WeakPolarHBondContact O-CG 3.38Å; V371-L375 PolarHBondContact O-N 2.98Å
372	S	70	Confident	82.7	Confident	64 Å²	64	102.6 Å²	102.6	45%	0.448	48%	0.48	S	S	.	.	H	α-helix	trans	-67.8	-34.5	173.7	-170.4	0	0	0	0	113.1	R368 R369 S370 I376	R368-S372 WeakPolarHBondContact O-CB 3.36Å; R368-S372 PolarHBondContact O-N 3Å; R369-S372 PolarHBondContact O-N 3.38Å; S370-S372 VanDerWaalsContact C-N 3.27Å; S370-S372 PolarHBondContact O-N 2.97Å; S372-I376 WeakPolarHBondContact O-CD1 3.46Å; S372-I376 VanDerWaalsContact O-CG1 3.24Å; S372-I376 WeakPolarHBondContact O-CG1 3.31Å; S372-I376 PolarHBondContact O-N 3.46Å; S372-I376 VanDerWaalsContact O-N 3.17Å
373	Q	77.1	Confident	82.5	Confident	130 Å²	130	105 Å²	105	61%	0.607	48%	0.481	S	S	*	.	H	α-helix	trans	-76.9	-34.2	178.5	-178.3	175.5	-1.2	0	0	111.9	R369 S370 I376 K377	R369-Q373 WeakPolarHBondContact O-CB 3.32Å; R369-Q373 PolarHBondContact O-N 3.43Å; S370-Q373 CarbonylContact O-C 3.52Å; S370-Q373 WeakPolarHBondContact O-CA 3.29Å; S370-Q373 WeakPolarHBondContact O-CB 3.38Å; S370-Q373 PolarHBondContact O-N 2.89Å; Q373-I376 PolarHBondContact O-N 3.39Å; Q373-K377 VanDerWaalsContact O-CB 3.22Å; Q373-K377 WeakPolarHBondContact O-CB 3.5Å; Q373-K377 PolarHBondContact O-N 2.96Å
374	D	80.3	Confident	81.8	Confident	89 Å²	89	106 Å²	106	48%	0.476	49%	0.491	S	S	.	.	H	α-helix	trans	-72.9	-36.8	176.4	-62.9	-35.2	0	0	0	110.2	S370 K378	S370-D374 VanDerWaalsContact C-OD2 3.3Å; S370-D374 WeakPolarHBondContact O-CB 3.43Å; S370-D374 PolarHBondContact O-N 2.61Å; D374-K378 WeakPolarHBondContact O-CB 3.26Å; D374-K378 PolarHBondContact O-N 3.32Å
375	L	80.9	Confident	81	Confident	116 Å²	116	106 Å²	106	61%	0.607	50%	0.498	S	S	*	.	H	α-helix	trans	-63.5	-43.2	168.9	-75.4	167.6	0	0	0	111.7	V371 E379	V371-L375 HydrophobicContact CG1-CD1 4.16Å; V371-L375 WeakPolarHBondContact O-CB 3.32Å; V371-L375 WeakPolarHBondContact O-CD1 3.43Å; V371-L375 VanDerWaalsContact O-CG 3.22Å; V371-L375 WeakPolarHBondContact O-CG 3.38Å; V371-L375 PolarHBondContact O-N 2.98Å; L375-E379 VanDerWaalsContact O-CB 3.29Å; L375-E379 WeakPolarHBondContact O-CB 3.32Å; L375-E379 PolarHBondContact O-N 2.85Å
376	I	76.3	Confident	80.5	Confident	89 Å²	89	105.9 Å²	105.9	46%	0.456	50%	0.499	S	S	.	.	H	α-helix	trans	-65.4	-46.3	174.7	-70.2	164.1	0	0	0	110.8	S372 Q373 K378 E379 E380	S372-I376 WeakPolarHBondContact O-CD1 3.46Å; S372-I376 VanDerWaalsContact O-CG1 3.24Å; S372-I376 WeakPolarHBondContact O-CG1 3.31Å; S372-I376 PolarHBondContact O-N 3.46Å; S372-I376 VanDerWaalsContact O-N 3.17Å; Q373-I376 PolarHBondContact O-N 3.39Å; I376-K378 PolarHBondContact O-N 2.85Å; I376-E379 CarbonylContact O-C 3.57Å; I376-E379 WeakPolarHBondContact O-CA 3.39Å; I376-E379 WeakPolarHBondContact O-CB 3.42Å; I376-E379 PolarHBondContact O-N 3.09Å; I376-E379 VanDerWaalsContact O-N 3.14Å; I376-E380 HydrophobicContact CG2-CG 4.39Å; I376-E380 WeakPolarHBondContact O-CG 3.43Å; I376-E380 PolarHBondContact O-N 3.01Å
377	K	86.8	Confident	80.1	Confident	106 Å²	106	110.3 Å²	110.3	46%	0.461	51%	0.514	S	S	.	.	H	α-helix	trans	-63.7	-39	179.1	-177.3	171.3	179.1	-72.7	0	112	Q373 E379 E380 E381	Q373-K377 VanDerWaalsContact O-CB 3.22Å; Q373-K377 WeakPolarHBondContact O-CB 3.5Å; Q373-K377 PolarHBondContact O-N 2.96Å; K377-E379 VanDerWaalsContact C-N 3.33Å; K377-E380 PolarHBondContact O-N 3.4Å; K377-E381 IonicContact NZ-OE1 3.86Å; K377-E381 PolarHBondContact NZ-OE1 3.07Å; K377-E381 WeakPolarHBondContact O-CB 3.44Å; K377-E381 VanDerWaalsContact O-CG 3.24Å; K377-E381 WeakPolarHBondContact O-CG 3.49Å; K377-E381 PolarHBondContact O-N 3.04Å
378	K	87.1	Confident	79.2	Confident	143 Å²	143	109.7 Å²	109.7	62%	0.622	52%	0.52	S	S	*	.	H	α-helix	trans	-74.2	-23.4	175.5	-167.3	163.9	-174.3	168	0	112.8	D374 I376 R382	D374-K378 WeakPolarHBondContact O-CB 3.26Å; D374-K378 PolarHBondContact O-N 3.32Å; I376-K378 PolarHBondContact O-N 2.85Å; K378-R382 WeakPolarHBondContact O-CB 3.39Å; K378-R382 PolarHBondContact O-N 2.93Å; K378-R382 VanDerWaalsContact O-N 3.11Å
379	E	85.6	Confident	78.6	Confident	63 Å²	63	108.8 Å²	108.8	29%	0.294	53%	0.525	S	S	.	.	H	α-helix	trans	-73.2	-43.1	167.5	-171.3	66.1	-151.2	0	0	111.1	L375 I376 K377 R382 K383	L375-E379 VanDerWaalsContact O-CB 3.29Å; L375-E379 WeakPolarHBondContact O-CB 3.32Å; L375-E379 PolarHBondContact O-N 2.85Å; I376-E379 CarbonylContact O-C 3.57Å; I376-E379 WeakPolarHBondContact O-CA 3.39Å; I376-E379 WeakPolarHBondContact O-CB 3.42Å; I376-E379 PolarHBondContact O-N 3.09Å; I376-E379 VanDerWaalsContact O-N 3.14Å; K377-E379 VanDerWaalsContact C-N 3.33Å; E379-R382 PolarHBondContact O-N 3.12Å; E379-R382 IonicContact OE1-NH1 3.74Å; E379-R382 PolarHBondContact OE1-NH1 2.83Å; E379-R382 IonicContact OE2-CZ 3.41Å; E379-R382 IonicContact OE2-NH1 3.11Å; E379-R382 PolarHBondContact OE2-NH1 3.27Å; E379-R382 IonicContact OE2-NH2 2.73Å; E379-R382 PolarHBondContact OE2-NH2 3.39Å; E379-R382 VanDerWaalsContact OE2-NH2 3.12Å; E379-K383 HydrophobicContact CG-CD 4.46Å; E379-K383 WeakPolarHBondContact O-CB 3.4Å; E379-K383 VanDerWaalsContact O-CG 3.31Å; E379-K383 WeakPolarHBondContact O-CG 3.14Å; E379-K383 PolarHBondContact O-N 2.93Å; E379-K383 VanDerWaalsContact OE1-CE 3.31Å; E379-K383 WeakPolarHBondContact OE1-CE 3.3Å; E379-K383 IonicContact OE1-NZ 3.45Å
380	E	84.1	Confident	77.7	Confident	123 Å²	123	105.2 Å²	105.2	58%	0.575	52%	0.522	S	S	*	.	H	α-helix	trans	-66.9	-40.2	175.4	-72.6	172.4	168.3	0	0	112.1	I376 K377 K383 M384	I376-E380 HydrophobicContact CG2-CG 4.39Å; I376-E380 WeakPolarHBondContact O-CG 3.43Å; I376-E380 PolarHBondContact O-N 3.01Å; K377-E380 PolarHBondContact O-N 3.4Å; E380-K383 PolarHBondContact O-N 2.96Å; E380-M384 WeakPolarHBondContact O-CB 3.42Å; E380-M384 PolarHBondContact O-N 2.8Å
381	E	84.5	Confident	76.1	Confident	89 Å²	89	106.5 Å²	106.5	42%	0.416	54%	0.543	S	S	.	.	H	α-helix	trans	-65.7	-41.1	172.6	-76.1	167.3	170.1	0	0	111.7	K377 K383 M384 M385	K377-E381 IonicContact NZ-OE1 3.86Å; K377-E381 PolarHBondContact NZ-OE1 3.07Å; K377-E381 WeakPolarHBondContact O-CB 3.44Å; K377-E381 VanDerWaalsContact O-CG 3.24Å; K377-E381 WeakPolarHBondContact O-CG 3.49Å; K377-E381 PolarHBondContact O-N 3.04Å; E381-K383 VanDerWaalsContact C-N 3.33Å; E381-K383 PolarHBondContact O-N 3.17Å; E381-M384 PolarHBondContact O-N 2.93Å; E381-M385 WeakPolarHBondContact O-CB 3.47Å; E381-M385 PolarHBondContact O-N 2.84Å
382	R	85.9	Confident	74.6	Confident	128 Å²	128	110.3 Å²	110.3	48%	0.483	56%	0.56	S	S	.	*	H	α-helix	trans	-64.1	-40.6	173.8	-160.9	-170.5	-41.1	106.4	11.1	111.1	K378 E379 M385 E386	K378-R382 WeakPolarHBondContact O-CB 3.39Å; K378-R382 PolarHBondContact O-N 2.93Å; K378-R382 VanDerWaalsContact O-N 3.11Å; E379-R382 PolarHBondContact O-N 3.12Å; E379-R382 IonicContact OE1-NH1 3.74Å; E379-R382 PolarHBondContact OE1-NH1 2.83Å; E379-R382 IonicContact OE2-CZ 3.41Å; E379-R382 IonicContact OE2-NH1 3.11Å; E379-R382 PolarHBondContact OE2-NH1 3.27Å; E379-R382 IonicContact OE2-NH2 2.73Å; E379-R382 PolarHBondContact OE2-NH2 3.39Å; E379-R382 VanDerWaalsContact OE2-NH2 3.12Å; R382-M385 PolarHBondContact O-N 3.35Å; R382-E386 VanDerWaalsContact O-CB 3.29Å; R382-E386 WeakPolarHBondContact O-CB 3.5Å; R382-E386 PolarHBondContact O-N 2.92Å
383	K	84.9	Confident	73	Confident	99 Å²	99	112.7 Å²	112.7	43%	0.43	58%	0.577	S	S	.	*	H	α-helix	trans	-68.5	-36.4	176.1	-75.4	173.3	-179.7	178.6	0	112.8	E379 E380 E381 E386 Q387	E379-K383 HydrophobicContact CG-CD 4.46Å; E379-K383 WeakPolarHBondContact O-CB 3.4Å; E379-K383 VanDerWaalsContact O-CG 3.31Å; E379-K383 WeakPolarHBondContact O-CG 3.14Å; E379-K383 PolarHBondContact O-N 2.93Å; E379-K383 VanDerWaalsContact OE1-CE 3.31Å; E379-K383 WeakPolarHBondContact OE1-CE 3.3Å; E379-K383 IonicContact OE1-NZ 3.45Å; E380-K383 PolarHBondContact O-N 2.96Å; E381-K383 VanDerWaalsContact C-N 3.33Å; E381-K383 PolarHBondContact O-N 3.17Å; K383-E386 PolarHBondContact O-N 3.25Å; K383-Q387 WeakPolarHBondContact O-CB 3.31Å; K383-Q387 PolarHBondContact O-N 3.05Å
384	M	77	Confident	71.5	Confident	118 Å²	118	111.7 Å²	111.7	58%	0.581	58%	0.583	S	S	*	*	H	α-helix	trans	-61.9	-45	171.3	-173.1	-165.9	-61.1	0	0	110.5	E380 E381 Q387 L388	E380-M384 WeakPolarHBondContact O-CB 3.42Å; E380-M384 PolarHBondContact O-N 2.8Å; E381-M384 PolarHBondContact O-N 2.93Å; M384-Q387 PolarHBondContact O-N 3.34Å; M384-L388 HydrophobicContact CG-CD1 3.98Å; M384-L388 WeakPolarHBondContact O-CB 3.31Å; M384-L388 WeakPolarHBondContact O-CG 3.5Å; M384-L388 PolarHBondContact O-N 2.84Å; M384-L388 HydrophobicContact SD-CD1 4.49Å
385	M	71.1	Confident	69.7	Low	131 Å²	131	115 Å²	115	65%	0.645	60%	0.599	S	S	*	*	H	α-helix	trans	-66	-44.2	176.4	-173.6	175.8	-75.5	0	0	112.1	E381 R382 Q387 L388 M389	E381-M385 WeakPolarHBondContact O-CB 3.47Å; E381-M385 PolarHBondContact O-N 2.84Å; R382-M385 PolarHBondContact O-N 3.35Å; M385-Q387 VanDerWaalsContact C-N 3.32Å; M385-Q387 PolarHBondContact O-N 2.82Å; M385-L388 PolarHBondContact O-N 3.23Å; M385-M389 WeakPolarHBondContact O-CB 3.4Å; M385-M389 WeakPolarHBondContact O-CG 3.46Å; M385-M389 PolarHBondContact O-N 3.37Å
386	E	75.3	Confident	68	Low	92 Å²	92	113.8 Å²	113.8	43%	0.43	60%	0.601	S	S	.	*	H	α-helix	trans	-59	-42.6	174.5	-173	177.5	177	0	0	111	R382 K383 M389 S390	R382-E386 VanDerWaalsContact O-CB 3.29Å; R382-E386 WeakPolarHBondContact O-CB 3.5Å; R382-E386 PolarHBondContact O-N 2.92Å; K383-E386 PolarHBondContact O-N 3.25Å; E386-M389 PolarHBondContact O-N 2.92Å; E386-S390 WeakPolarHBondContact O-CB 3.31Å; E386-S390 PolarHBondContact O-N 3.45Å; E386-S390 PolarHBondContact O-OG 3.28Å
387	Q	75.9	Confident	66.5	Low	152 Å²	152	118 Å²	118	71%	0.71	62%	0.619	S	S	*	*	H	α-helix	trans	-74.1	-32.9	178.9	-170.6	167.1	10.3	0	0	113.3	K383 M384 M385 M389	K383-Q387 WeakPolarHBondContact O-CB 3.31Å; K383-Q387 PolarHBondContact O-N 3.05Å; M384-Q387 PolarHBondContact O-N 3.34Å; M385-Q387 VanDerWaalsContact C-N 3.32Å; M385-Q387 PolarHBondContact O-N 2.82Å; Q387-M389 VanDerWaalsContact C-N 3.31Å
388	L	68.5	Low	64.5	Low	125 Å²	125	124 Å²	124	65%	0.654	64%	0.638	S	S	*	*	H	α-helix	trans	-69.5	-28.3	171.7	-75.9	167.1	0	0	0	112.5	M384 M385	M384-L388 HydrophobicContact CG-CD1 3.98Å; M384-L388 WeakPolarHBondContact O-CB 3.31Å; M384-L388 WeakPolarHBondContact O-CG 3.5Å; M384-L388 PolarHBondContact O-N 2.84Å; M384-L388 HydrophobicContact SD-CD1 4.49Å; M385-L388 PolarHBondContact O-N 3.23Å
389	M	63.1	Low	62.4	Low	153 Å²	153	129 Å²	129	75%	0.754	65%	0.653	S	S	*	*	H	α-helix	trans	-90.9	-20.9	177.1	-63.7	-69.1	94.1	0	0	113.6	M385 E386 Q387	M385-M389 WeakPolarHBondContact O-CB 3.4Å; M385-M389 WeakPolarHBondContact O-CG 3.46Å; M385-M389 PolarHBondContact O-N 3.37Å; E386-M389 PolarHBondContact O-N 2.92Å; Q387-M389 VanDerWaalsContact C-N 3.31Å
390	S	58	Low	60.9	Low	70 Å²	70	136.1 Å²	136.1	49%	0.49	68%	0.683	S	S	.	*	S	Bend	trans	-105.1	53.9	-176.1	-50.6	0	0	0	0	112	E386 D392	E386-S390 WeakPolarHBondContact O-CB 3.31Å; E386-S390 PolarHBondContact O-N 3.45Å; E386-S390 PolarHBondContact O-OG 3.28Å; S390-D392 PolarHBondContact O-N 3.4Å
391	G	47.9	Very low	59.2	Low	73 Å²	73	134.2 Å²	134.2	75%	0.753	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52	108.6	-176	0	0	0	0	0	113.4	S393	G391-S393 PolarHBondContact O-N 2.88Å
392	D	46.8	Very low	58.4	Low	164 Å²	164	138 Å²	138	88%	0.877	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	20.9	76.1	176.2	-68.5	-23.2	0	0	0	118	S390	S390-D392 PolarHBondContact O-N 3.4Å
393	S	36.2	Very low	58.3	Low	113 Å²	113	136 Å²	136	79%	0.79	70%	0.699	S	S	*	*				-166.4	162.3	121	-155.7	0	0	0	0	114.2	G391	G391-S393 PolarHBondContact O-N 2.88Å
394	C	44.8	Very low	58	Low	110 Å²	110	134.9 Å²	134.9	74%	0.743	70%	0.701	S	S	*	*			trans	-29	159.4	175.4	-160.6	0	0	0	0	119.2
395	I	44	Very low	57.9	Low	157 Å²	157	137.1 Å²	137.1	81%	0.805	70%	0.704	S	S	*	*			trans	87	69	167.7	-39.4	166.3	0	0	0	116.6
396	S	43.5	Very low	58.5	Low	92 Å²	92	139.2 Å²	139.2	64%	0.643	70%	0.704	S	S	*	*			trans	-117.9	13.1	155.8	71.8	0	0	0	0	114.2	R398	S396-R398 PolarHBondContact O-N 2.92Å
397	Q	45.8	Very low	58.7	Low	178 Å²	178	137.4 Å²	137.4	83%	0.832	70%	0.696	S	S	*	*			trans	-73.3	54.9	-173.5	-162.6	-174.8	86.5	0	0	114.2
398	R	44.2	Very low	59.1	Low	232 Å²	232	134.2 Å²	134.2	88%	0.875	68%	0.683	S	S	*	*			trans	-149.2	32.8	-178.6	-134.8	-178.4	-164.3	-146.1	3.1	119.9	S396	S396-R398 PolarHBondContact O-N 2.92Å
399	R	42.9	Very low	59.7	Low	247 Å²	247	130.4 Å²	130.4	93%	0.932	67%	0.665	S	S	*	*	S	Bend	trans	-154	66.6	159.4	-109.4	147.2	-162	-153	4	116.7	S401	R399-S401 PolarHBondContact O-N 2.85Å; R399-S401 VanDerWaalsContact O-N 3.14Å
400	K	54.2	Low	60.8	Low	213 Å²	213	127.3 Å²	127.3	93%	0.926	65%	0.649	S	S	*	*			trans	41.2	55.9	149.3	-60	-176.7	179.2	179.6	0	117.5
401	S	48.8	Very low	62	Low	82 Å²	82	124.8 Å²	124.8	57%	0.573	63%	0.63	S	S	*	*			trans	-64.8	149	151.5	49.2	0	0	0	0	109.9	R399 K403	R399-S401 PolarHBondContact O-N 2.85Å; R399-S401 VanDerWaalsContact O-N 3.14Å; S401-K403 PolarHBondContact O-N 2.73Å
402	I	68.4	Low	63.9	Low	168 Å²	168	125.9 Å²	125.9	86%	0.862	61%	0.614	S	S	*	*			trans	-79.4	110.9	170	-64.3	175.6	0	0	0	107.2	T404	I402-T404 PolarHBondContact O-N 3.38Å
403	K	83.3	Confident	65.8	Low	88 Å²	88	123.5 Å²	123.5	38%	0.383	60%	0.597	S	S	.	*			trans	-58.5	134.1	-179.1	-63	-166	163.7	175.8	0	111.2	S401 E407 I408 D411	S401-K403 PolarHBondContact O-N 2.73Å; K403-E407 VanDerWaalsContact CA-OE2 3.3Å; K403-E407 WeakPolarHBondContact CA-OE2 3.32Å; K403-E407 HydrophobicContact CB-CG 4.31Å; K403-E407 HydrophobicContact CG-CG 4.48Å; K403-E407 WeakPolarHBondContact CG-OE1 3.32Å; K403-I408 HydrophobicContact CB-CD1 4.08Å; K403-I408 HydrophobicContact CB-CG1 3.65Å; K403-I408 HydrophobicContact CD-CG1 4.37Å; K403-D411 IonicContact NZ-OD2 3.35Å; K403-D411 PolarHBondContact NZ-OD2 3.45Å
404	T	78.3	Confident	68.4	Low	74 Å²	74	123.8 Å²	123.8	45%	0.454	58%	0.581	S	S	.	*			trans	-72.6	157.9	175.5	68.8	0	0	0	0	111.1	I402 R406 E407 I408	I402-T404 PolarHBondContact O-N 3.38Å; T404-R406 PolarHBondContact O-N 3.45Å; T404-E407 PolarHBondContact N-OE2 3.13Å; T404-E407 WeakPolarHBondContact O-CB 3.32Å; T404-E407 PolarHBondContact O-N 3.21Å; T404-E407 VanDerWaalsContact O-N 3.12Å; T404-E407 WeakPolarHBondContact OG1-CB 3.47Å; T404-E407 PolarHBondContact OG1-N 2.82Å; T404-E407 VanDerWaalsContact OG1-N 3.12Å; T404-I408 VanDerWaalsContact O-CG1 3.31Å; T404-I408 WeakPolarHBondContact O-CG1 3.49Å; T404-I408 PolarHBondContact O-N 3.33Å
405	Y	75.2	Confident	70.3	Confident	166 Å²	166	121.2 Å²	121.2	65%	0.651	56%	0.556	S	S	*	*	H	α-helix	trans	-57.6	-38.9	175.7	176.6	-92.1	0	0	0	112.2	I408 V409	Y405-I408 PolarHBondContact O-N 3.45Å; Y405-V409 HydrophobicContact CD1-CG2 4.25Å; Y405-V409 HydrophobicContact CE1-CG2 3.73Å; Y405-V409 HydrophobicContact CE2-CG2 4.32Å; Y405-V409 WeakPolarHBondContact O-CG2 3.28Å; Y405-V409 PolarHBondContact O-N 3.43Å
406	R	83.8	Confident	72.4	Confident	174 Å²	174	114.3 Å²	114.3	66%	0.657	52%	0.52	S	S	*	.	H	α-helix	trans	-54.6	-56.6	171.9	169.7	-170.1	-78.1	-80.8	7	110.5	T404 I408 V409 E410	T404-R406 PolarHBondContact O-N 3.45Å; R406-I408 VanDerWaalsContact C-N 3.29Å; R406-I408 PolarHBondContact O-N 2.78Å; R406-V409 CarbonylContact O-C 3.58Å; R406-V409 WeakPolarHBondContact O-CA 3.25Å; R406-V409 WeakPolarHBondContact O-CB 3.36Å; R406-V409 PolarHBondContact O-N 2.76Å; R406-E410 VanDerWaalsContact CD-OE1 3.3Å; R406-E410 WeakPolarHBondContact CD-OE1 3.42Å; R406-E410 HydrophobicContact CG-CG 4.32Å; R406-E410 WeakPolarHBondContact CG-OE1 3.33Å; R406-E410 WeakPolarHBondContact CG-OE2 3.44Å; R406-E410 IonicContact CZ-OE1 3.13Å; R406-E410 IonicContact NH1-OE1 2.78Å; R406-E410 PolarHBondContact NH1-OE1 3.27Å; R406-E410 WeakPolarHBondContact O-CG 3.43Å; R406-E410 PolarHBondContact O-N 3.37Å
407	E	79.6	Confident	74.4	Confident	54 Å²	54	114.1 Å²	114.1	25%	0.252	51%	0.509	S	S	.	.	H	α-helix	trans	-61.7	-34.5	-179	-179.6	-171.4	168.6	0	0	112.4	K403 T404 D411	K403-E407 VanDerWaalsContact CA-OE2 3.3Å; K403-E407 WeakPolarHBondContact CA-OE2 3.32Å; K403-E407 HydrophobicContact CB-CG 4.31Å; K403-E407 HydrophobicContact CG-CG 4.48Å; K403-E407 WeakPolarHBondContact CG-OE1 3.32Å; T404-E407 PolarHBondContact N-OE2 3.13Å; T404-E407 WeakPolarHBondContact O-CB 3.32Å; T404-E407 PolarHBondContact O-N 3.21Å; T404-E407 VanDerWaalsContact O-N 3.12Å; T404-E407 WeakPolarHBondContact OG1-CB 3.47Å; T404-E407 PolarHBondContact OG1-N 2.82Å; T404-E407 VanDerWaalsContact OG1-N 3.12Å; E407-D411 WeakPolarHBondContact O-CB 3.45Å; E407-D411 PolarHBondContact O-N 2.9Å
408	I	84.4	Confident	76.5	Confident	85 Å²	85	110.1 Å²	110.1	44%	0.436	49%	0.49	S	S	.	.	H	α-helix	trans	-67.1	-37.6	173.9	-67.8	165.8	0	0	0	111.3	K403 T404 Y405 R406 K412	K403-I408 HydrophobicContact CB-CD1 4.08Å; K403-I408 HydrophobicContact CB-CG1 3.65Å; K403-I408 HydrophobicContact CD-CG1 4.37Å; T404-I408 VanDerWaalsContact O-CG1 3.31Å; T404-I408 WeakPolarHBondContact O-CG1 3.49Å; T404-I408 PolarHBondContact O-N 3.33Å; Y405-I408 PolarHBondContact O-N 3.45Å; R406-I408 VanDerWaalsContact C-N 3.29Å; R406-I408 PolarHBondContact O-N 2.78Å; I408-K412 VanDerWaalsContact O-CB 3.32Å; I408-K412 WeakPolarHBondContact O-CB 3.2Å; I408-K412 PolarHBondContact O-N 3.19Å
409	V	81.3	Confident	78.7	Confident	45 Å²	45	99.5 Å²	99.5	27%	0.273	45%	0.451	S	S	.	.	H	α-helix	trans	-70.6	-49.8	174.6	171	0	0	0	0	110.7	Y405 R406 D411 K412 E413	Y405-V409 HydrophobicContact CD1-CG2 4.25Å; Y405-V409 HydrophobicContact CE1-CG2 3.73Å; Y405-V409 HydrophobicContact CE2-CG2 4.32Å; Y405-V409 WeakPolarHBondContact O-CG2 3.28Å; Y405-V409 PolarHBondContact O-N 3.43Å; R406-V409 CarbonylContact O-C 3.58Å; R406-V409 WeakPolarHBondContact O-CA 3.25Å; R406-V409 WeakPolarHBondContact O-CB 3.36Å; R406-V409 PolarHBondContact O-N 2.76Å; V409-D411 VanDerWaalsContact C-N 3.33Å; V409-D411 PolarHBondContact O-N 3.04Å; V409-K412 CarbonylContact O-C 3.48Å; V409-K412 WeakPolarHBondContact O-CA 3.44Å; V409-K412 WeakPolarHBondContact O-CB 3.26Å; V409-K412 PolarHBondContact O-N 3Å; V409-E413 HydrophobicContact CG1-CG 4.28Å; V409-E413 WeakPolarHBondContact O-CG 3.25Å; V409-E413 PolarHBondContact O-N 3.42Å
410	E	85.1	Confident	80.7	Confident	89 Å²	89	88.7 Å²	88.7	42%	0.416	41%	0.41	S	S	.	.	H	α-helix	trans	-61.5	-39.3	178.7	-69.9	163.2	179.6	0	0	111.3	R406 R414	R406-E410 VanDerWaalsContact CD-OE1 3.3Å; R406-E410 WeakPolarHBondContact CD-OE1 3.42Å; R406-E410 HydrophobicContact CG-CG 4.32Å; R406-E410 WeakPolarHBondContact CG-OE1 3.33Å; R406-E410 WeakPolarHBondContact CG-OE2 3.44Å; R406-E410 IonicContact CZ-OE1 3.13Å; R406-E410 IonicContact NH1-OE1 2.78Å; R406-E410 PolarHBondContact NH1-OE1 3.27Å; R406-E410 WeakPolarHBondContact O-CG 3.43Å; R406-E410 PolarHBondContact O-N 3.37Å; E410-R414 VanDerWaalsContact O-CB 3.3Å; E410-R414 WeakPolarHBondContact O-CB 3.47Å; E410-R414 PolarHBondContact O-N 2.85Å
411	D	84.3	Confident	82.4	Confident	17 Å²	17	82.7 Å²	82.7	9%	0.091	39%	0.385	C	S	.	.	H	α-helix	trans	-72.1	-25.5	174	-173.1	39.7	0	0	0	112.8	K403 E407 V409 R414 R415	K403-D411 IonicContact NZ-OD2 3.35Å; K403-D411 PolarHBondContact NZ-OD2 3.45Å; E407-D411 WeakPolarHBondContact O-CB 3.45Å; E407-D411 PolarHBondContact O-N 2.9Å; V409-D411 VanDerWaalsContact C-N 3.33Å; V409-D411 PolarHBondContact O-N 3.04Å; D411-R414 IonicContact OD1-CZ 2.67Å; D411-R414 VanDerWaalsContact OD1-CZ 3.29Å; D411-R414 IonicContact OD1-NH1 3.51Å; D411-R414 PolarHBondContact OD1-NH1 3.33Å; D411-R414 IonicContact OD1-NH2 2.7Å; D411-R414 PolarHBondContact OD1-NH2 2.91Å; D411-R415 WeakPolarHBondContact O-CB 3.49Å; D411-R415 WeakPolarHBondContact O-CG 3.36Å; D411-R415 PolarHBondContact O-N 2.92Å; D411-R415 PolarHBondContact O-NE 2.91Å; D411-R415 PolarHBondContact O-NH2 3.12Å; D411-R415 IonicContact OD1-CZ 3.47Å; D411-R415 IonicContact OD1-NE 2.79Å; D411-R415 PolarHBondContact OD1-NE 3.37Å; D411-R415 IonicContact OD1-NH2 2.76Å; D411-R415 IonicContact OD2-CZ 2.61Å; D411-R415 IonicContact OD2-NE 3.17Å; D411-R415 IonicContact OD2-NH2 2.76Å; D411-R415 PolarHBondContact OD2-NH2 3.47Å
412	K	86.4	Confident	84.3	Confident	95 Å²	95	80.6 Å²	80.6	41%	0.413	37%	0.373	S	S	.	.	H	α-helix	trans	-72.1	-54.3	168.3	180	176.2	-177.5	-77.5	0	110.5	I408 V409 R414 R415 E416	I408-K412 VanDerWaalsContact O-CB 3.32Å; I408-K412 WeakPolarHBondContact O-CB 3.2Å; I408-K412 PolarHBondContact O-N 3.19Å; V409-K412 CarbonylContact O-C 3.48Å; V409-K412 WeakPolarHBondContact O-CA 3.44Å; V409-K412 WeakPolarHBondContact O-CB 3.26Å; V409-K412 PolarHBondContact O-N 3Å; K412-R414 VanDerWaalsContact C-N 3.33Å; K412-R414 PolarHBondContact O-N 2.69Å; K412-R415 CarbonylContact O-C 3.58Å; K412-R415 PolarHBondContact O-N 2.76Å; K412-R415 VanDerWaalsContact O-N 3.08Å; K412-E416 IonicContact NZ-OE1 2.81Å; K412-E416 PolarHBondContact NZ-OE1 2.99Å; K412-E416 WeakPolarHBondContact O-CG 3.22Å; K412-E416 PolarHBondContact O-N 2.82Å
413	E	86.9	Confident	85.3	Confident	114 Å²	114	74.6 Å²	74.6	53%	0.533	34%	0.339	S	S	.	.	H	α-helix	trans	-58.9	-41.4	-177.7	-71.4	178.8	157.4	0	0	112.1	V409 E416 E417	V409-E413 HydrophobicContact CG1-CG 4.28Å; V409-E413 WeakPolarHBondContact O-CG 3.25Å; V409-E413 PolarHBondContact O-N 3.42Å; E413-E416 WeakPolarHBondContact O-CB 3.32Å; E413-E416 PolarHBondContact O-N 3.11Å; E413-E417 PolarHBondContact O-N 2.78Å
414	R	91.2	Very high	85.5	Confident	119 Å²	119	78.4 Å²	78.4	45%	0.449	35%	0.352	S	S	.	.	H	α-helix	trans	-61.7	-44.8	173.5	-163.3	-165.4	72	-101.7	-14.8	111.9	E410 D411 K412 E416 E417 E418	E410-R414 VanDerWaalsContact O-CB 3.3Å; E410-R414 WeakPolarHBondContact O-CB 3.47Å; E410-R414 PolarHBondContact O-N 2.85Å; D411-R414 IonicContact OD1-CZ 2.67Å; D411-R414 VanDerWaalsContact OD1-CZ 3.29Å; D411-R414 IonicContact OD1-NH1 3.51Å; D411-R414 PolarHBondContact OD1-NH1 3.33Å; D411-R414 IonicContact OD1-NH2 2.7Å; D411-R414 PolarHBondContact OD1-NH2 2.91Å; K412-R414 VanDerWaalsContact C-N 3.33Å; K412-R414 PolarHBondContact O-N 2.69Å; R414-E416 VanDerWaalsContact C-N 3.29Å; R414-E416 PolarHBondContact O-N 2.84Å; R414-E417 PolarHBondContact O-N 3.34Å; R414-E417 VanDerWaalsContact O-N 3.14Å; R414-E418 IonicContact CZ-OE1 3.47Å; R414-E418 IonicContact NE-OE1 3.49Å; R414-E418 PolarHBondContact NE-OE1 3.35Å; R414-E418 IonicContact NH2-OE1 2.75Å; R414-E418 PolarHBondContact NH2-OE1 3.33Å; R414-E418 WeakPolarHBondContact O-CB 3.31Å; R414-E418 VanDerWaalsContact O-CG 3.25Å; R414-E418 WeakPolarHBondContact O-CG 3.42Å; R414-E418 PolarHBondContact O-N 2.79Å
415	R	85.8	Confident	86	Confident	57 Å²	57	81 Å²	81	22%	0.215	36%	0.357	C	S	.	.	H	α-helix	trans	-66.1	-27.6	175.5	-76.8	-176.2	-89.8	99	-5	113.3	D411 K412 L419	D411-R415 WeakPolarHBondContact O-CB 3.49Å; D411-R415 WeakPolarHBondContact O-CG 3.36Å; D411-R415 PolarHBondContact O-N 2.92Å; D411-R415 PolarHBondContact O-NE 2.91Å; D411-R415 PolarHBondContact O-NH2 3.12Å; D411-R415 IonicContact OD1-CZ 3.47Å; D411-R415 IonicContact OD1-NE 2.79Å; D411-R415 PolarHBondContact OD1-NE 3.37Å; D411-R415 IonicContact OD1-NH2 2.76Å; D411-R415 IonicContact OD2-CZ 2.61Å; D411-R415 IonicContact OD2-NE 3.17Å; D411-R415 IonicContact OD2-NH2 2.76Å; D411-R415 PolarHBondContact OD2-NH2 3.47Å; K412-R415 CarbonylContact O-C 3.58Å; K412-R415 PolarHBondContact O-N 2.76Å; K412-R415 VanDerWaalsContact O-N 3.08Å; R415-L419 PolarHBondContact O-N 3.33Å
416	E	87.3	Confident	86.8	Confident	11 Å²	11	74.2 Å²	74.2	5%	0.051	33%	0.334	C	S	.	.	H	α-helix	trans	-72.5	-36.7	170	-65.5	-175.4	-169.1	0	0	112.7	K412 E413 R414 L419 R420 I449	K412-E416 IonicContact NZ-OE1 2.81Å; K412-E416 PolarHBondContact NZ-OE1 2.99Å; K412-E416 WeakPolarHBondContact O-CG 3.22Å; K412-E416 PolarHBondContact O-N 2.82Å; E413-E416 WeakPolarHBondContact O-CB 3.32Å; E413-E416 PolarHBondContact O-N 3.11Å; R414-E416 VanDerWaalsContact C-N 3.29Å; R414-E416 PolarHBondContact O-N 2.84Å; E416-L419 WeakPolarHBondContact O-CB 3.37Å; E416-L419 PolarHBondContact O-N 3.5Å; E416-R420 WeakPolarHBondContact O-CG 3.38Å; E416-R420 PolarHBondContact O-N 3.38Å; E416-R420 IonicContact OE2-CZ 3.65Å; E416-R420 IonicContact OE2-NH1 3.2Å; E416-R420 IonicContact OE2-NH2 3.29Å; E416-R420 PolarHBondContact OE2-NH2 2.85Å; E416-I449 HydrophobicContact CB-CD1 4.44Å; E416-I449 HydrophobicContact CB-CG1 4.42Å; E416-I449 HydrophobicContact CG-CD1 3.58Å; E416-I449 HydrophobicContact CG-CG1 3.91Å
417	E	86	Confident	86.8	Confident	89 Å²	89	77.1 Å²	77.1	42%	0.416	35%	0.345	S	S	.	.	H	α-helix	trans	-75.5	-37.7	177.8	-157.4	58.5	-141.2	0	0	111.8	E413 R414 L419 R420 E421 R424	E413-E417 PolarHBondContact O-N 2.78Å; R414-E417 PolarHBondContact O-N 3.34Å; R414-E417 VanDerWaalsContact O-N 3.14Å; E417-L419 PolarHBondContact O-N 3.41Å; E417-R420 PolarHBondContact O-N 3.43Å; E417-R420 VanDerWaalsContact O-N 3.14Å; E417-R420 VanDerWaalsContact OE2-CD 3.31Å; E417-R420 WeakPolarHBondContact OE2-CD 3.47Å; E417-R420 IonicContact OE2-CZ 3.9Å; E417-R420 IonicContact OE2-NE 3.69Å; E417-R420 IonicContact OE2-NH1 2.69Å; E417-R420 PolarHBondContact OE2-NH1 2.88Å; E417-E421 WeakPolarHBondContact O-CB 3.39Å; E417-E421 PolarHBondContact O-N 2.85Å; E417-R424 IonicContact OE1-NH2 3.55Å
418	E	89.9	Confident	87.2	Confident	94 Å²	94	78.4 Å²	78.4	44%	0.439	36%	0.357	S	S	.	.	H	α-helix	trans	-51.8	-43.2	166.6	-72.4	163.2	-153.9	0	0	110.8	R414 A422	R414-E418 IonicContact CZ-OE1 3.47Å; R414-E418 IonicContact NE-OE1 3.49Å; R414-E418 PolarHBondContact NE-OE1 3.35Å; R414-E418 IonicContact NH2-OE1 2.75Å; R414-E418 PolarHBondContact NH2-OE1 3.33Å; R414-E418 WeakPolarHBondContact O-CB 3.31Å; R414-E418 VanDerWaalsContact O-CG 3.25Å; R414-E418 WeakPolarHBondContact O-CG 3.42Å; R414-E418 PolarHBondContact O-N 2.79Å; E418-A422 VanDerWaalsContact O-CB 3.26Å; E418-A422 WeakPolarHBondContact O-CB 3.24Å; E418-A422 PolarHBondContact O-N 2.81Å
419	L	89.5	Confident	87.3	Confident	8 Å²	8	79.4 Å²	79.4	4%	0.042	37%	0.372	C	S	.	.	H	α-helix	trans	-67	-45.5	174.9	174.1	66.8	0	0	0	112.7	R415 E416 E417 E421 A422 Y423 I435 L436 Y439 I449	R415-L419 PolarHBondContact O-N 3.33Å; E416-L419 WeakPolarHBondContact O-CB 3.37Å; E416-L419 PolarHBondContact O-N 3.5Å; E417-L419 PolarHBondContact O-N 3.41Å; L419-E421 VanDerWaalsContact C-N 3.32Å; L419-E421 PolarHBondContact O-N 3.34Å; L419-A422 PolarHBondContact O-N 2.97Å; L419-Y423 WeakPolarHBondContact O-CB 3.18Å; L419-Y423 PolarHBondContact O-N 2.78Å; L419-I435 HydrophobicContact CD1-CG2 3.58Å; L419-L436 HydrophobicContact CD1-CD2 4.16Å; L419-L436 HydrophobicContact CD2-CD2 4.3Å; L419-Y439 HydrophobicContact CB-CD2 3.94Å; L419-Y439 HydrophobicContact CB-CE2 3.96Å; L419-Y439 HydrophobicContact CD1-CD2 3.98Å; L419-Y439 HydrophobicContact CD1-CG 4.18Å; L419-Y439 HydrophobicContact CD2-CD1 4.05Å; L419-Y439 HydrophobicContact CD2-CD2 3.66Å; L419-Y439 HydrophobicContact CD2-CE1 4.2Å; L419-Y439 HydrophobicContact CD2-CE2 3.84Å; L419-Y439 HydrophobicContact CD2-CG 3.75Å; L419-Y439 HydrophobicContact CG-CD2 4.07Å; L419-Y439 HydrophobicContact CG-CE2 4.39Å; L419-Y439 HydrophobicContact CG-CG 4.45Å; L419-I449 HydrophobicContact CD2-CG2 3.63Å
420	R	84.9	Confident	87.5	Confident	20 Å²	20	84.6 Å²	84.6	8%	0.075	39%	0.393	C	S	.	.	H	α-helix	trans	-62.8	-39.4	178.2	-71.9	172.1	-162.1	114.3	11.2	111.9	E416 E417 R424 L453	E416-R420 WeakPolarHBondContact O-CG 3.38Å; E416-R420 PolarHBondContact O-N 3.38Å; E416-R420 IonicContact OE2-CZ 3.65Å; E416-R420 IonicContact OE2-NH1 3.2Å; E416-R420 IonicContact OE2-NH2 3.29Å; E416-R420 PolarHBondContact OE2-NH2 2.85Å; E417-R420 PolarHBondContact O-N 3.43Å; E417-R420 VanDerWaalsContact O-N 3.14Å; E417-R420 VanDerWaalsContact OE2-CD 3.31Å; E417-R420 WeakPolarHBondContact OE2-CD 3.47Å; E417-R420 IonicContact OE2-CZ 3.9Å; E417-R420 IonicContact OE2-NE 3.69Å; E417-R420 IonicContact OE2-NH1 2.69Å; E417-R420 PolarHBondContact OE2-NH1 2.88Å; R420-R424 VanDerWaalsContact O-CB 3.25Å; R420-R424 WeakPolarHBondContact O-CB 3.22Å; R420-R424 PolarHBondContact O-N 2.69Å; R420-L453 HydrophobicContact CB-CD2 4.26Å; R420-L453 HydrophobicContact CG-CD2 3.83Å; R420-L453 HydrophobicContact CG-CG 4.49Å
421	E	89.8	Confident	87.7	Confident	88 Å²	88	84.5 Å²	84.5	41%	0.411	39%	0.392	S	S	.	.	H	α-helix	trans	-72.5	-40.4	177.9	-150.6	-160.1	-174.2	0	0	111.6	E417 L419 R424 K425	E417-E421 WeakPolarHBondContact O-CB 3.39Å; E417-E421 PolarHBondContact O-N 2.85Å; L419-E421 VanDerWaalsContact C-N 3.32Å; L419-E421 PolarHBondContact O-N 3.34Å; E421-R424 PolarHBondContact O-N 3.29Å; E421-K425 VanDerWaalsContact CD-CE 3.42Å; E421-K425 HydrophobicContact CG-CD 4.24Å; E421-K425 WeakPolarHBondContact O-CB 3.13Å; E421-K425 VanDerWaalsContact O-CG 3.26Å; E421-K425 WeakPolarHBondContact O-CG 3.39Å; E421-K425 PolarHBondContact O-N 3.14Å; E421-K425 WeakPolarHBondContact OE1-CE 3.31Å; E421-K425 IonicContact OE1-NZ 3.88Å; E421-K425 PolarHBondContact OE1-NZ 3.43Å; E421-K425 IonicContact OE2-NZ 3.7Å; E421-K425 PolarHBondContact OE2-NZ 3.16Å
422	A	89.4	Confident	87.9	Confident	37 Å²	37	84.2 Å²	84.2	31%	0.306	39%	0.392	S	S	.	.	H	α-helix	trans	-60.7	-46.1	173.3	0	0	0	0	0	111.8	E418 L419 R424 K425 A426 I435	E418-A422 VanDerWaalsContact O-CB 3.26Å; E418-A422 WeakPolarHBondContact O-CB 3.24Å; E418-A422 PolarHBondContact O-N 2.81Å; L419-A422 PolarHBondContact O-N 2.97Å; A422-R424 PolarHBondContact O-N 3.01Å; A422-K425 PolarHBondContact O-N 2.76Å; A422-A426 PolarHBondContact O-N 3.15Å; A422-I435 HydrophobicContact CB-CD1 4.25Å; A422-I435 HydrophobicContact CB-CG2 4.07Å; A422-I435 WeakPolarHBondContact O-CD1 3.33Å
423	Y	88.7	Confident	87.8	Confident	42 Å²	42	82.8 Å²	82.8	17%	0.165	40%	0.395	C	S	.	.	H	α-helix	trans	-62.1	-41.4	176.2	-175.3	-91.6	0	0	0	112	L419 K425 A426 A432 L436 L453 L455	L419-Y423 WeakPolarHBondContact O-CB 3.18Å; L419-Y423 PolarHBondContact O-N 2.78Å; Y423-K425 VanDerWaalsContact C-N 3.3Å; Y423-K425 PolarHBondContact O-N 2.85Å; Y423-A426 WeakPolarHBondContact O-CB 3.43Å; Y423-A426 PolarHBondContact O-N 2.84Å; Y423-A432 HydrophobicContact CD2-CB 3.91Å; Y423-A432 HydrophobicContact CE2-CB 3.67Å; Y423-L436 HydrophobicContact CD2-CD1 3.91Å; Y423-L436 HydrophobicContact CD2-CG 4.08Å; Y423-L436 HydrophobicContact CE2-CD1 3.59Å; Y423-L436 HydrophobicContact CE2-CG 4.27Å; Y423-L453 HydrophobicContact CD1-CB 4.35Å; Y423-L453 HydrophobicContact CD1-CD2 3.77Å; Y423-L453 HydrophobicContact CD2-CD2 4.42Å; Y423-L453 HydrophobicContact CE1-CB 4.31Å; Y423-L453 VanDerWaalsContact CE1-O 3.27Å; Y423-L453 WeakPolarHBondContact CE1-O 3.38Å; Y423-L453 HydrophobicContact CG-CD2 3.71Å; Y423-L455 HydrophobicContact CE2-CD2 4.15Å; Y423-L455 VanDerWaalsContact OH-CD2 3.29Å; Y423-L455 WeakPolarHBondContact OH-CD2 3.45Å
424	R	87	Confident	87.9	Confident	169 Å²	169	78.6 Å²	78.6	64%	0.638	38%	0.379	S	S	*	.	H	α-helix	trans	-67.8	-26.4	175.5	-164.9	-167.8	-51	150.1	9.4	113.3	E417 R420 E421 A422	E417-R424 IonicContact OE1-NH2 3.55Å; R420-R424 VanDerWaalsContact O-CB 3.25Å; R420-R424 WeakPolarHBondContact O-CB 3.22Å; R420-R424 PolarHBondContact O-N 2.69Å; E421-R424 PolarHBondContact O-N 3.29Å; A422-R424 PolarHBondContact O-N 3.01Å
425	K	89.8	Confident	87.9	Confident	129 Å²	129	73.9 Å²	73.9	56%	0.561	36%	0.363	S	S	*	.	H	α-helix	trans	-85.6	-15.2	176.6	-75.9	170.1	176.7	169.3	0	113.2	E421 A422 Y423 R427	E421-K425 VanDerWaalsContact CD-CE 3.42Å; E421-K425 HydrophobicContact CG-CD 4.24Å; E421-K425 WeakPolarHBondContact O-CB 3.13Å; E421-K425 VanDerWaalsContact O-CG 3.26Å; E421-K425 WeakPolarHBondContact O-CG 3.39Å; E421-K425 PolarHBondContact O-N 3.14Å; E421-K425 WeakPolarHBondContact OE1-CE 3.31Å; E421-K425 IonicContact OE1-NZ 3.88Å; E421-K425 PolarHBondContact OE1-NZ 3.43Å; E421-K425 IonicContact OE2-NZ 3.7Å; E421-K425 PolarHBondContact OE2-NZ 3.16Å; A422-K425 PolarHBondContact O-N 2.76Å; Y423-K425 VanDerWaalsContact C-N 3.3Å; Y423-K425 PolarHBondContact O-N 2.85Å; K425-R427 PolarHBondContact O-N 3.25Å
426	A	90.9	Very high	88	Confident	22 Å²	22	72.1 Å²	72.1	18%	0.182	36%	0.357	C	S	.	.			trans	-62.9	132.2	178.2	0	0	0	0	0	111	A422 Y423 E431 A432 I435	A422-A426 PolarHBondContact O-N 3.15Å; Y423-A426 WeakPolarHBondContact O-CB 3.43Å; Y423-A426 PolarHBondContact O-N 2.84Å; A426-E431 VanDerWaalsContact CA-OE2 3.29Å; A426-E431 WeakPolarHBondContact CA-OE2 3.13Å; A426-E431 HydrophobicContact CB-CB 4.22Å; A426-E431 HydrophobicContact CB-CG 3.91Å; A426-A432 HydrophobicContact CB-CB 3.91Å; A426-I435 HydrophobicContact CB-CD1 3.97Å
427	R	84.8	Confident	87.8	Confident	236 Å²	236	77.2 Å²	77.2	89%	0.891	38%	0.381	S	S	*	.	S	Bend	trans	-95.4	-12.6	-177.2	-64.2	-174.1	178.5	-168.3	-0.7	113.4	K425 E431	K425-R427 PolarHBondContact O-N 3.25Å; R427-E431 PolarHBondContact N-OE2 3.28Å
428	T	88.4	Confident	87.9	Confident	80 Å²	80	79.2 Å²	79.2	49%	0.491	39%	0.385	S	S	.	.	S	Bend	trans	-133.1	153.9	177.2	73.5	0	0	0	0	111.3	E430 E431 A432	T428-E430 PolarHBondContact O-N 2.75Å; T428-E431 PolarHBondContact O-N 3.49Å; T428-E431 WeakPolarHBondContact OG1-CB 3.33Å; T428-E431 PolarHBondContact OG1-N 3.43Å; T428-E431 VanDerWaalsContact OG1-N 3.09Å; T428-A432 WeakPolarHBondContact O-CB 3.22Å; T428-A432 PolarHBondContact O-N 2.79Å
429	S	85.3	Confident	87.8	Confident	107 Å²	107	75.9 Å²	75.9	75%	0.748	37%	0.369	S	S	*	.	H	α-helix	trans	-64.1	-24.8	176.2	-170	0	0	0	0	112.9	S433	S429-S433 WeakPolarHBondContact O-CB 3.22Å; S429-S433 PolarHBondContact O-N 3.4Å; S429-S433 PolarHBondContact O-OG 3.43Å
430	E	87.1	Confident	87.5	Confident	154 Å²	154	78.1 Å²	78.1	72%	0.72	39%	0.388	S	S	*	.	H	α-helix	trans	-75	-42.8	175.8	-173.4	179	-173	0	0	111.4	T428 A432 S433 A434	T428-E430 PolarHBondContact O-N 2.75Å; E430-A432 VanDerWaalsContact C-N 3.32Å; E430-A432 PolarHBondContact O-N 2.95Å; E430-S433 PolarHBondContact O-N 3.34Å; E430-S433 PolarHBondContact O-OG 3.3Å; E430-A434 WeakPolarHBondContact O-CB 3.35Å; E430-A434 PolarHBondContact O-N 3.04Å
431	E	89.4	Confident	87.5	Confident	86 Å²	86	83.8 Å²	83.8	40%	0.402	42%	0.416	S	S	.	.	H	α-helix	trans	-61.6	-43.5	173.3	179.9	177.2	-147.9	0	0	111	A426 R427 T428 S433 A434 I435	A426-E431 VanDerWaalsContact CA-OE2 3.29Å; A426-E431 WeakPolarHBondContact CA-OE2 3.13Å; A426-E431 HydrophobicContact CB-CB 4.22Å; A426-E431 HydrophobicContact CB-CG 3.91Å; R427-E431 PolarHBondContact N-OE2 3.28Å; T428-E431 PolarHBondContact O-N 3.49Å; T428-E431 WeakPolarHBondContact OG1-CB 3.33Å; T428-E431 PolarHBondContact OG1-N 3.43Å; T428-E431 VanDerWaalsContact OG1-N 3.09Å; E431-S433 PolarHBondContact O-N 2.84Å; E431-A434 PolarHBondContact O-N 2.75Å; E431-I435 HydrophobicContact CG-CD1 4.04Å; E431-I435 WeakPolarHBondContact O-CB 3.35Å; E431-I435 VanDerWaalsContact O-CG1 3.25Å; E431-I435 WeakPolarHBondContact O-CG1 3.29Å; E431-I435 PolarHBondContact O-N 3.33Å
432	A	86.7	Confident	87.1	Confident	11 Å²	11	89.1 Å²	89.1	9%	0.091	43%	0.432	C	S	.	.	H	α-helix	trans	-61	-41.2	176.3	0	0	0	0	0	112.5	Y423 A426 T428 E430 L436	Y423-A432 HydrophobicContact CD2-CB 3.91Å; Y423-A432 HydrophobicContact CE2-CB 3.67Å; A426-A432 HydrophobicContact CB-CB 3.91Å; T428-A432 WeakPolarHBondContact O-CB 3.22Å; T428-A432 PolarHBondContact O-N 2.79Å; E430-A432 VanDerWaalsContact C-N 3.32Å; E430-A432 PolarHBondContact O-N 2.95Å; A432-L436 PolarHBondContact O-N 2.82Å
433	S	85.6	Confident	86.8	Confident	66 Å²	66	91.5 Å²	91.5	46%	0.462	44%	0.436	S	S	.	.	H	α-helix	trans	-71.2	-39.1	176.7	74.3	0	0	0	0	112.1	S429 E430 E431 I435 L436 Q437	S429-S433 WeakPolarHBondContact O-CB 3.22Å; S429-S433 PolarHBondContact O-N 3.4Å; S429-S433 PolarHBondContact O-OG 3.43Å; E430-S433 PolarHBondContact O-N 3.34Å; E430-S433 PolarHBondContact O-OG 3.3Å; E431-S433 PolarHBondContact O-N 2.84Å; S433-I435 VanDerWaalsContact C-N 3.34Å; S433-I435 PolarHBondContact O-N 2.63Å; S433-L436 PolarHBondContact O-N 3.31Å; S433-Q437 WeakPolarHBondContact O-CB 3.43Å; S433-Q437 PolarHBondContact O-N 3.15Å
434	A	88.5	Confident	86.2	Confident	26 Å²	26	95 Å²	95	22%	0.215	47%	0.466	C	S	.	.	H	α-helix	trans	-65.6	-34.5	175.2	0	0	0	0	0	112.6	E430 E431 R438	E430-A434 WeakPolarHBondContact O-CB 3.35Å; E430-A434 PolarHBondContact O-N 3.04Å; E431-A434 PolarHBondContact O-N 2.75Å; A434-R438 WeakPolarHBondContact O-CB 3.24Å; A434-R438 VanDerWaalsContact O-CG 3.27Å; A434-R438 WeakPolarHBondContact O-CG 3.36Å; A434-R438 PolarHBondContact O-N 2.91Å; A434-R438 PolarHBondContact O-NE 3.3Å
435	I	90.3	Very high	85.4	Confident	20 Å²	20	89.1 Å²	89.1	10%	0.103	45%	0.447	C	S	.	.	H	α-helix	trans	-60.7	-47.9	170.9	-74.5	165.2	0	0	0	110.5	L419 A422 A426 E431 S433 R438 Y439	L419-I435 HydrophobicContact CD1-CG2 3.58Å; A422-I435 HydrophobicContact CB-CD1 4.25Å; A422-I435 HydrophobicContact CB-CG2 4.07Å; A422-I435 WeakPolarHBondContact O-CD1 3.33Å; A426-I435 HydrophobicContact CB-CD1 3.97Å; E431-I435 HydrophobicContact CG-CD1 4.04Å; E431-I435 WeakPolarHBondContact O-CB 3.35Å; E431-I435 VanDerWaalsContact O-CG1 3.25Å; E431-I435 WeakPolarHBondContact O-CG1 3.29Å; E431-I435 PolarHBondContact O-N 3.33Å; S433-I435 VanDerWaalsContact C-N 3.34Å; S433-I435 PolarHBondContact O-N 2.63Å; I435-R438 VanDerWaalsContact CG1-NH2 3.32Å; I435-R438 PolarHBondContact O-N 3.03Å; I435-Y439 PolarHBondContact O-N 3.42Å; I435-Y439 VanDerWaalsContact O-N 3.13Å
436	L	88.3	Confident	84.7	Confident	19 Å²	19	85 Å²	85	10%	0.099	43%	0.434	C	S	.	.	H	α-helix	trans	-65.5	-42	177.6	-71.5	168.2	0	0	0	112.7	L419 Y423 A432 S433 R438 Y439 A440 I445 L453 L455	L419-L436 HydrophobicContact CD1-CD2 4.16Å; L419-L436 HydrophobicContact CD2-CD2 4.3Å; Y423-L436 HydrophobicContact CD2-CD1 3.91Å; Y423-L436 HydrophobicContact CD2-CG 4.08Å; Y423-L436 HydrophobicContact CE2-CD1 3.59Å; Y423-L436 HydrophobicContact CE2-CG 4.27Å; A432-L436 PolarHBondContact O-N 2.82Å; S433-L436 PolarHBondContact O-N 3.31Å; L436-R438 PolarHBondContact O-N 3.21Å; L436-Y439 PolarHBondContact O-N 3.03Å; L436-Y439 VanDerWaalsContact O-N 3.16Å; L436-A440 WeakPolarHBondContact O-CB 3.48Å; L436-A440 PolarHBondContact O-N 3.37Å; L436-I445 HydrophobicContact CD2-CD1 4.38Å; L436-L453 HydrophobicContact CD2-CD1 3.39Å; L436-L455 HydrophobicContact CD1-CD1 4.09Å; L436-L455 HydrophobicContact CD1-CD2 3.87Å; L436-L455 HydrophobicContact CD1-CG 4.34Å
437	Q	84.4	Confident	83.6	Confident	119 Å²	119	91.8 Å²	91.8	56%	0.556	46%	0.462	S	S	*	.	H	α-helix	trans	-62.4	-43.4	177.9	-165.7	-175.8	32.8	0	0	111.7	S433 Y439 A440 Q441	S433-Q437 WeakPolarHBondContact O-CB 3.43Å; S433-Q437 PolarHBondContact O-N 3.15Å; Q437-Y439 VanDerWaalsContact C-N 3.26Å; Q437-Y439 PolarHBondContact O-N 2.91Å; Q437-A440 PolarHBondContact O-N 3.46Å; Q437-Q441 WeakPolarHBondContact O-CB 3.31Å; Q437-Q441 VanDerWaalsContact O-CG 3.27Å; Q437-Q441 WeakPolarHBondContact O-CG 3.04Å; Q437-Q441 PolarHBondContact O-N 3.25Å
438	R	86.4	Confident	83.1	Confident	131 Å²	131	82.8 Å²	82.8	49%	0.494	44%	0.439	S	S	.	.	H	α-helix	trans	-64.3	-29.1	174.9	-73.9	-177.6	-62.8	-127.8	5.1	113	A434 I435 L436 R442	A434-R438 WeakPolarHBondContact O-CB 3.24Å; A434-R438 VanDerWaalsContact O-CG 3.27Å; A434-R438 WeakPolarHBondContact O-CG 3.36Å; A434-R438 PolarHBondContact O-N 2.91Å; A434-R438 PolarHBondContact O-NE 3.3Å; I435-R438 VanDerWaalsContact CG1-NH2 3.32Å; I435-R438 PolarHBondContact O-N 3.03Å; L436-R438 PolarHBondContact O-N 3.21Å; R438-R442 WeakPolarHBondContact O-CG 3.28Å
439	Y	87.6	Confident	82.5	Confident	23 Å²	23	79 Å²	79	9%	0.09	42%	0.415	C	S	.	.	H	α-helix	trans	-74.8	-49	171.8	-165.7	-80	0	0	0	111	L419 I435 L436 Q437 Q441 R442 F443 I445 I449	L419-Y439 HydrophobicContact CB-CD2 3.94Å; L419-Y439 HydrophobicContact CB-CE2 3.96Å; L419-Y439 HydrophobicContact CD1-CD2 3.98Å; L419-Y439 HydrophobicContact CD1-CG 4.18Å; L419-Y439 HydrophobicContact CD2-CD1 4.05Å; L419-Y439 HydrophobicContact CD2-CD2 3.66Å; L419-Y439 HydrophobicContact CD2-CE1 4.2Å; L419-Y439 HydrophobicContact CD2-CE2 3.84Å; L419-Y439 HydrophobicContact CD2-CG 3.75Å; L419-Y439 HydrophobicContact CG-CD2 4.07Å; L419-Y439 HydrophobicContact CG-CE2 4.39Å; L419-Y439 HydrophobicContact CG-CG 4.45Å; I435-Y439 PolarHBondContact O-N 3.42Å; I435-Y439 VanDerWaalsContact O-N 3.13Å; L436-Y439 PolarHBondContact O-N 3.03Å; L436-Y439 VanDerWaalsContact O-N 3.16Å; Q437-Y439 VanDerWaalsContact C-N 3.26Å; Q437-Y439 PolarHBondContact O-N 2.91Å; Y439-Q441 VanDerWaalsContact C-N 3.26Å; Y439-Q441 PolarHBondContact O-N 2.97Å; Y439-R442 CarbonylContact O-C 3.59Å; Y439-R442 PolarHBondContact O-N 3.46Å; Y439-F443 HydrophobicContact CD1-CB 4.1Å; Y439-F443 HydrophobicContact CD1-CD2 4.4Å; Y439-F443 HydrophobicContact CD2-CD2 4.25Å; Y439-F443 HydrophobicContact CE1-CB 3.75Å; Y439-F443 HydrophobicContact CE1-CD2 4.27Å; Y439-F443 HydrophobicContact CE1-CG 4.44Å; Y439-F443 HydrophobicContact CE2-CD2 4.09Å; Y439-F443 HydrophobicContact CG-CD2 4.43Å; Y439-F443 PolarHBondContact O-N 3.13Å; Y439-F443 VanDerWaalsContact O-O 3.06Å; Y439-I445 HydrophobicContact CD1-CG1 3.72Å; Y439-I445 HydrophobicContact CE1-CG1 4.29Å; Y439-I449 HydrophobicContact CE1-CD1 4.41Å
440	A	84.8	Confident	81.9	Confident	55 Å²	55	77.3 Å²	77.3	46%	0.455	40%	0.398	S	S	.	.	H	α-helix	trans	-55.3	-38.4	178.2	0	0	0	0	0	113.3	L436 Q437 R442 F443 I445	L436-A440 WeakPolarHBondContact O-CB 3.48Å; L436-A440 PolarHBondContact O-N 3.37Å; Q437-A440 PolarHBondContact O-N 3.46Å; A440-R442 VanDerWaalsContact C-N 3.25Å; A440-R442 PolarHBondContact O-N 2.84Å; A440-F443 CarbonylContact C-O 3.6Å; A440-F443 WeakPolarHBondContact CA-O 3.42Å; A440-I445 HydrophobicContact CB-CD1 3.84Å; A440-I445 HydrophobicContact CB-CG1 4.24Å
441	Q	83.9	Confident	81.3	Confident	140 Å²	140	77.2 Å²	77.2	65%	0.654	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-18.6	176	-73.4	170.7	-7.3	0	0	113.9	Q437 Y439	Q437-Q441 WeakPolarHBondContact O-CB 3.31Å; Q437-Q441 VanDerWaalsContact O-CG 3.27Å; Q437-Q441 WeakPolarHBondContact O-CG 3.04Å; Q437-Q441 PolarHBondContact O-N 3.25Å; Y439-Q441 VanDerWaalsContact C-N 3.26Å; Y439-Q441 PolarHBondContact O-N 2.97Å
442	R	82.4	Confident	80.7	Confident	199 Å²	199	80.9 Å²	80.9	75%	0.751	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	-30.9	-178.9	-69.6	178	173.7	-177.6	-1.9	113	R438 Y439 A440	R438-R442 WeakPolarHBondContact O-CG 3.28Å; Y439-R442 CarbonylContact O-C 3.59Å; Y439-R442 PolarHBondContact O-N 3.46Å; A440-R442 VanDerWaalsContact C-N 3.25Å; A440-R442 PolarHBondContact O-N 2.84Å
443	F	82.3	Confident	79.9	Confident	88 Å²	88	81 Å²	81	39%	0.386	41%	0.406	S	S	.	.	S	Bend	trans	-150	145.4	-173.4	-51	-69.2	0	0	0	110.3	Y439 A440 I445	Y439-F443 HydrophobicContact CD1-CB 4.1Å; Y439-F443 HydrophobicContact CD1-CD2 4.4Å; Y439-F443 HydrophobicContact CD2-CD2 4.25Å; Y439-F443 HydrophobicContact CE1-CB 3.75Å; Y439-F443 HydrophobicContact CE1-CD2 4.27Å; Y439-F443 HydrophobicContact CE1-CG 4.44Å; Y439-F443 HydrophobicContact CE2-CD2 4.09Å; Y439-F443 HydrophobicContact CG-CD2 4.43Å; Y439-F443 PolarHBondContact O-N 3.13Å; Y439-F443 VanDerWaalsContact O-O 3.06Å; A440-F443 CarbonylContact C-O 3.6Å; A440-F443 WeakPolarHBondContact CA-O 3.42Å; F443-I445 PolarHBondContact O-N 2.78Å
444	S	76.6	Confident	78.7	Confident	115 Å²	115	86 Å²	86	80%	0.804	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-63.4	120.2	167.9	43.1	0	0	0	0	110.2	S446	S444-S446 PolarHBondContact O-N 2.7Å
445	I	69.8	Low	77.1	Confident	46 Å²	46	88 Å²	88	24%	0.236	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-69.2	125.1	171.5	-56.6	171.7	0	0	0	107.5	L436 Y439 A440 F443 I449 L450	L436-I445 HydrophobicContact CD2-CD1 4.38Å; Y439-I445 HydrophobicContact CD1-CG1 3.72Å; Y439-I445 HydrophobicContact CE1-CG1 4.29Å; A440-I445 HydrophobicContact CB-CD1 3.84Å; A440-I445 HydrophobicContact CB-CG1 4.24Å; F443-I445 PolarHBondContact O-N 2.78Å; I445-I449 HydrophobicContact CG2-CB 4.04Å; I445-I449 HydrophobicContact CG2-CD1 4.32Å; I445-I449 HydrophobicContact CG2-CG2 4.17Å; I445-L450 HydrophobicContact CG2-CD1 4.18Å; I445-L450 HydrophobicContact CG2-CD2 3.88Å; I445-L450 HydrophobicContact CG2-CG 3.67Å
446	S	74.3	Confident	74.9	Confident	41 Å²	41	91.2 Å²	91.2	29%	0.287	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-83.8	146.7	170.9	56.2	0	0	0	0	111.4	S444 A448 I449 L450	S444-S446 PolarHBondContact O-N 2.7Å; S446-A448 VanDerWaalsContact C-N 3.29Å; S446-A448 PolarHBondContact O-N 3.04Å; S446-I449 WeakPolarHBondContact O-CA 3.35Å; S446-I449 VanDerWaalsContact O-CB 3.25Å; S446-I449 WeakPolarHBondContact O-CB 3.42Å; S446-I449 PolarHBondContact O-N 3.11Å; S446-I449 VanDerWaalsContact OG-CD1 3.3Å; S446-I449 WeakPolarHBondContact OG-CD1 3.28Å; S446-I449 WeakPolarHBondContact OG-CG1 3.31Å; S446-L450 PolarHBondContact O-N 2.74Å
447	E	67.8	Low	72.8	Confident	165 Å²	165	100.6 Å²	100.6	77%	0.771	49%	0.491	S	S	*	.	H	α-helix	trans	-54.3	-40.3	-176.4	-164	164.3	-156.2	0	0	113.5	I449 L450 E451	E447-I449 PolarHBondContact O-N 3.19Å; E447-I449 VanDerWaalsContact O-N 3.14Å; E447-L450 WeakPolarHBondContact O-CB 3.4Å; E447-L450 PolarHBondContact O-N 2.74Å; E447-E451 PolarHBondContact O-N 2.59Å
448	A	75.9	Confident	70.6	Confident	48 Å²	48	102 Å²	102	40%	0.397	50%	0.502	S	S	.	.	H	α-helix	trans	-64.2	-15.1	174.1	0	0	0	0	0	114.7	S446 R452	S446-A448 VanDerWaalsContact C-N 3.29Å; S446-A448 PolarHBondContact O-N 3.04Å; A448-R452 VanDerWaalsContact O-CB 3.3Å; A448-R452 WeakPolarHBondContact O-CB 3.19Å; A448-R452 VanDerWaalsContact O-CD 3.27Å; A448-R452 WeakPolarHBondContact O-CD 3.4Å; A448-R452 WeakPolarHBondContact O-CG 3.33Å; A448-R452 PolarHBondContact O-N 3.45Å
449	I	75.1	Confident	68.2	Low	1 Å²	1	103.6 Å²	103.6	1%	0.005	52%	0.519	C	S	.	.	H	α-helix	trans	-78.9	-50	167.7	-61.7	164.8	0	0	0	109	E416 L419 Y439 I445 S446 E447 E451 R452 L453	E416-I449 HydrophobicContact CB-CD1 4.44Å; E416-I449 HydrophobicContact CB-CG1 4.42Å; E416-I449 HydrophobicContact CG-CD1 3.58Å; E416-I449 HydrophobicContact CG-CG1 3.91Å; L419-I449 HydrophobicContact CD2-CG2 3.63Å; Y439-I449 HydrophobicContact CE1-CD1 4.41Å; I445-I449 HydrophobicContact CG2-CB 4.04Å; I445-I449 HydrophobicContact CG2-CD1 4.32Å; I445-I449 HydrophobicContact CG2-CG2 4.17Å; S446-I449 WeakPolarHBondContact O-CA 3.35Å; S446-I449 VanDerWaalsContact O-CB 3.25Å; S446-I449 WeakPolarHBondContact O-CB 3.42Å; S446-I449 PolarHBondContact O-N 3.11Å; S446-I449 VanDerWaalsContact OG-CD1 3.3Å; S446-I449 WeakPolarHBondContact OG-CD1 3.28Å; S446-I449 WeakPolarHBondContact OG-CG1 3.31Å; E447-I449 PolarHBondContact O-N 3.19Å; E447-I449 VanDerWaalsContact O-N 3.14Å; I449-E451 VanDerWaalsContact C-N 3.27Å; I449-E451 PolarHBondContact O-N 3Å; I449-R452 CarbonylContact O-C 3.43Å; I449-R452 PolarHBondContact O-N 2.97Å; I449-R452 VanDerWaalsContact O-N 3.12Å; I449-L453 HydrophobicContact CG2-CD1 3.68Å; I449-L453 HydrophobicContact CG2-CG 4.08Å; I449-L453 WeakPolarHBondContact O-CB 3.25Å; I449-L453 WeakPolarHBondContact O-CG 3.47Å; I449-L453 PolarHBondContact O-N 3.44Å
450	L	73.2	Confident	65.7	Low	71 Å²	71	109.6 Å²	109.6	37%	0.372	55%	0.553	S	S	.	*	H	α-helix	trans	-57.5	-42	-179.8	-65.4	166.3	0	0	0	111.4	I445 S446 E447 L453 L455	I445-L450 HydrophobicContact CG2-CD1 4.18Å; I445-L450 HydrophobicContact CG2-CD2 3.88Å; I445-L450 HydrophobicContact CG2-CG 3.67Å; S446-L450 PolarHBondContact O-N 2.74Å; E447-L450 WeakPolarHBondContact O-CB 3.4Å; E447-L450 PolarHBondContact O-N 2.74Å; L450-L453 PolarHBondContact O-N 3.05Å; L450-L455 HydrophobicContact CB-CD1 4.46Å; L450-L455 HydrophobicContact CD2-CD1 3.59Å
451	E	72.9	Confident	63.4	Low	151 Å²	151	116.8 Å²	116.8	71%	0.706	57%	0.568	S	S	*	*	H	α-helix	trans	-61.6	-50.3	173.2	-173.8	-177.4	-151.5	0	0	112.1	E447 I449 L453 Q454	E447-E451 PolarHBondContact O-N 2.59Å; I449-E451 VanDerWaalsContact C-N 3.27Å; I449-E451 PolarHBondContact O-N 3Å; E451-L453 VanDerWaalsContact C-N 3.26Å; E451-L453 PolarHBondContact O-N 3.03Å; E451-Q454 PolarHBondContact O-N 3.2Å
452	R	77.2	Confident	61.2	Low	163 Å²	163	114.9 Å²	114.9	62%	0.615	57%	0.57	S	S	*	*	H	α-helix	trans	-66.9	-22	179.4	-78	176	173.5	179.8	-5.1	114.4	A448 I449 Q454	A448-R452 VanDerWaalsContact O-CB 3.3Å; A448-R452 WeakPolarHBondContact O-CB 3.19Å; A448-R452 VanDerWaalsContact O-CD 3.27Å; A448-R452 WeakPolarHBondContact O-CD 3.4Å; A448-R452 WeakPolarHBondContact O-CG 3.33Å; A448-R452 PolarHBondContact O-N 3.45Å; I449-R452 CarbonylContact O-C 3.43Å; I449-R452 PolarHBondContact O-N 2.97Å; I449-R452 VanDerWaalsContact O-N 3.12Å; R452-Q454 VanDerWaalsContact C-N 3.29Å
453	L	71.1	Confident	58.8	Low	13 Å²	13	112.2 Å²	112.2	7%	0.068	58%	0.576	C	S	.	*	T	Hydrogen-bonded Turn	trans	-77.9	-13.7	176.8	-73.6	170.1	0	0	0	113.1	R420 Y423 L436 I449 L450 E451 L455	R420-L453 HydrophobicContact CB-CD2 4.26Å; R420-L453 HydrophobicContact CG-CD2 3.83Å; R420-L453 HydrophobicContact CG-CG 4.49Å; Y423-L453 HydrophobicContact CD1-CB 4.35Å; Y423-L453 HydrophobicContact CD1-CD2 3.77Å; Y423-L453 HydrophobicContact CD2-CD2 4.42Å; Y423-L453 HydrophobicContact CE1-CB 4.31Å; Y423-L453 VanDerWaalsContact CE1-O 3.27Å; Y423-L453 WeakPolarHBondContact CE1-O 3.38Å; Y423-L453 HydrophobicContact CG-CD2 3.71Å; L436-L453 HydrophobicContact CD2-CD1 3.39Å; I449-L453 HydrophobicContact CG2-CD1 3.68Å; I449-L453 HydrophobicContact CG2-CG 4.08Å; I449-L453 WeakPolarHBondContact O-CB 3.25Å; I449-L453 WeakPolarHBondContact O-CG 3.47Å; I449-L453 PolarHBondContact O-N 3.44Å; L450-L453 PolarHBondContact O-N 3.05Å; E451-L453 VanDerWaalsContact C-N 3.26Å; E451-L453 PolarHBondContact O-N 3.03Å; L453-L455 VanDerWaalsContact C-N 3.25Å; L453-L455 PolarHBondContact O-N 3.2Å
454	Q	59.7	Low	56.5	Low	171 Å²	171	113.7 Å²	113.7	80%	0.799	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	49.6	46.1	-176.6	-63.8	-171.5	-15.9	0	0	113	E451 R452	E451-Q454 PolarHBondContact O-N 3.2Å; R452-Q454 VanDerWaalsContact C-N 3.29Å
455	L	55.3	Low	54.4	Low	68 Å²	68	112.6 Å²	112.6	36%	0.356	60%	0.595	S	S	.	*			trans	-49.7	129.7	167.8	-85.5	155.9	0	0	0	109.8	Y423 L436 L450 L453 K457	Y423-L455 HydrophobicContact CE2-CD2 4.15Å; Y423-L455 VanDerWaalsContact OH-CD2 3.29Å; Y423-L455 WeakPolarHBondContact OH-CD2 3.45Å; L436-L455 HydrophobicContact CD1-CD1 4.09Å; L436-L455 HydrophobicContact CD1-CD2 3.87Å; L436-L455 HydrophobicContact CD1-CG 4.34Å; L450-L455 HydrophobicContact CB-CD1 4.46Å; L450-L455 HydrophobicContact CD2-CD1 3.59Å; L453-L455 VanDerWaalsContact C-N 3.25Å; L453-L455 PolarHBondContact O-N 3.2Å; L455-K457 PolarHBondContact O-N 2.62Å
456	P	43.8	Very low	52.4	Low	89 Å²	89	117.1 Å²	117.1	58%	0.578	62%	0.62	S	S	*	*			trans	-53.5	125.1	174.6	-27.6	35.6	0	0	0	110.4	L458	P456-L458 HydrophobicContact CB-CG 4.26Å; P456-L458 PolarHBondContact O-N 3.18Å
457	K	44.5	Very low	50.7	Low	215 Å²	215	120.7 Å²	120.7	94%	0.935	64%	0.642	S	S	*	*			trans	-73.1	71.3	178.2	-67.4	-173.6	178.2	-175.8	0	110.1	L455 L459	L455-K457 PolarHBondContact O-N 2.62Å; K457-L459 VanDerWaalsContact C-N 3.34Å; K457-L459 PolarHBondContact O-N 2.99Å
458	L	38.3	Very low	49	Very low	149 Å²	149	116.3 Å²	116.3	78%	0.78	63%	0.63	S	S	*	*			trans	-73.4	89.3	179	-69.5	-177.1	0	0	0	111	P456	P456-L458 HydrophobicContact CB-CG 4.26Å; P456-L458 PolarHBondContact O-N 3.18Å
459	L	36.2	Very low	46.9	Very low	165 Å²	165	123.4 Å²	123.4	86%	0.864	65%	0.652	S	S	*	*			trans	61.9	131.9	154.4	-68.6	164.8	0	0	0	118.2	K457 R461	K457-L459 VanDerWaalsContact C-N 3.34Å; K457-L459 PolarHBondContact O-N 2.99Å; L459-R461 PolarHBondContact O-N 2.91Å
460	D	35.4	Very low	45.4	Very low	149 Å²	149	128.7 Å²	128.7	80%	0.797	69%	0.686	S	S	*	*			trans	-70.7	126.3	171.4	-164.7	19.7	0	0	0	110.7
461	R	36.3	Very low	43.3	Very low	205 Å²	205	132.5 Å²	132.5	77%	0.774	71%	0.713	S	S	*	*	S	Bend	trans	38.1	98.5	141.7	-171.8	172.1	168.3	75.6	-0.5	118.9	L459	L459-R461 PolarHBondContact O-N 2.91Å
462	S	36.3	Very low	41.1	Very low	100 Å²	100	130.2 Å²	130.2	70%	0.699	71%	0.713	S	S	*	*			trans	65.1	110	130.4	-54.6	0	0	0	0	119.7	S464	S462-S464 PolarHBondContact O-N 2.89Å
463	V	32.1	Very low	39.5	Very low	143 Å²	143	127 Å²	127	87%	0.867	71%	0.713	S	S	*	*			trans	-54.7	129.6	151.9	174.4	0	0	0	0	109.8
464	S	33.7	Very low	37.5	Very low	119 Å²	119	135.1 Å²	135.1	83%	0.832	75%	0.749	S	S	*	*			trans	-104.9	96.4	175.8	60	0	0	0	0	111.3	S462	S462-S464 PolarHBondContact O-N 2.89Å
465	A	32.9	Very low	35.9	Very low	92 Å²	92	131.4 Å²	131.4	76%	0.76	74%	0.742	S	S	*	*			trans	-152.2	121.1	167.9	0	0	0	0	0	110.9
466	D	28	Very low	34.7	Very low	142 Å²	142	136.1 Å²	136.1	76%	0.759	77%	0.766	S	S	*	*			trans	-141.6	124.9	163.2	-179.8	13.7	0	0	0	106	S468	D466-S468 PolarHBondContact OD1-N 3.19Å
467	P	39	Very low	33.9	Very low	115 Å²	115	137 Å²	137	75%	0.747	78%	0.775	S	S	*	*				-140.8	99.3	126.3	34.6	-19.6	0	0	0	113
468	S	32.6	Very low	33.1	Very low	74 Å²	74	134.7 Å²	134.7	52%	0.517	77%	0.772	S	S	.	*				50.6	137.2	124.7	68.3	0	0	0	0	121	D466	D466-S468 PolarHBondContact OD1-N 3.19Å
469	F	31.9	Very low	32.5	Very low	196 Å²	196	132 Å²	132	86%	0.86	77%	0.766	S	S	*	*			trans	96	146.7	164.4	-59.9	-68	0	0	0	117.4
470	P	43.4	Very low	32	Very low	112 Å²	112	129 Å²	129	73%	0.727	76%	0.758	S	S	*	*			trans	-131.2	147.7	-136.2	39.1	-22.5	0	0	0	116
471	T	28.1	Very low	31.8	Very low	152 Å²	152	127.5 Å²	127.5	93%	0.933	76%	0.76	S	S	*	*			trans	-147.2	150.8	156.8	-24.3	0	0	0	0	111.6
472	S	26.6	Very low	32.3	Very low	102 Å²	102	123.2 Å²	123.2	71%	0.713	76%	0.758	S	S	*	*			trans	-114.2	165.5	172.8	-179.6	0	0	0	0	108
473	P	43.6	Very low	31.9	Very low	95 Å²	95	124.4 Å²	124.4	62%	0.617	76%	0.761	S	S	*	*			cis	-124.1	-159	-11.6	16.5	9.6	0	0	0	112.2
474	F	30.1	Very low	32.1	Very low	184 Å²	184	123.5 Å²	123.5	81%	0.807	76%	0.756	S	S	*	*			trans	97.5	111.5	153.9	-66.7	-64.2	0	0	0	120.8
475	S	26	Very low	32.5	Very low	93 Å²	93	123.4 Å²	123.4	65%	0.65	75%	0.753	S	S	*	*				83.8	120.3	118.6	-68.1	0	0	0	0	123.1
476	L	29.1	Very low	32.2	Very low	168 Å²	168	125.9 Å²	125.9	88%	0.88	75%	0.753	S	S	*	*			trans	85.6	127.4	133.6	-67.5	169	0	0	0	120.5
477	S	27	Very low	33	Very low	108 Å²	108	123.4 Å²	123.4	76%	0.755	75%	0.745	S	S	*	*			trans	-64.9	157.2	163.7	-35.3	0	0	0	0	112.7
478	L	28.1	Very low	32.5	Very low	165 Å²	165	125.6 Å²	125.6	86%	0.864	74%	0.743	S	S	*	*			trans	172.5	117.7	132.6	-89.5	161.6	0	0	0	106.5
479	S	25.6	Very low	32.4	Very low	94 Å²	94	129.9 Å²	129.9	66%	0.657	76%	0.76	S	S	*	*				84.1	92	76.8	-176.9	0	0	0	0	115
480	S	27	Very low	32.6	Very low	100 Å²	100	127.4 Å²	127.4	70%	0.699	75%	0.751	S	S	*	*				52.8	96.6	126.3	-47.1	0	0	0	0	121.1
481	S	29.9	Very low	33	Very low	119 Å²	119	126.7 Å²	126.7	83%	0.832	75%	0.746	S	S	*	*			trans	65.2	-174.4	136.6	-47.4	0	0	0	0	116.4
482	P	47.4	Very low	33.2	Very low	114 Å²	114	124.3 Å²	124.3	74%	0.74	74%	0.736	S	S	*	*			cis	-133.3	-173.4	-8.6	34.7	-13.5	0	0	0	115.8
483	T	27.6	Very low	33.5	Very low	126 Å²	126	128.5 Å²	128.5	77%	0.773	75%	0.745	S	S	*	*			trans	103.8	129.6	148.4	-21.1	0	0	0	0	119.7
484	T	36.5	Very low	33	Very low	124 Å²	124	127 Å²	127	76%	0.761	75%	0.746	S	S	*	*			trans	-66.1	171.4	165	27.7	0	0	0	0	112.9
485	P	41.8	Very low	33.3	Very low	116 Å²	116	124.7 Å²	124.7	75%	0.753	75%	0.749	S	S	*	*			cis	-147	173.2	38.2	42.1	-20.5	0	0	0	119.8
486	D	26.1	Very low	33.5	Very low	145 Å²	145	127.2 Å²	127.2	78%	0.775	76%	0.755	S	S	*	*			trans	18.7	160.1	131.3	-125.1	29	0	0	0	121
487	P	44.8	Very low	33.6	Very low	89 Å²	89	129.6 Å²	129.6	58%	0.578	75%	0.752	S	S	*	*			cis	-147.7	-175.5	11.8	47.2	-28.5	0	0	0	118.9
488	F	28.8	Very low	33.9	Very low	162 Å²	162	136.1 Å²	136.1	71%	0.711	76%	0.762	S	S	*	*			trans	60.3	125.5	152	-78.6	-68.1	0	0	0	123.1	E490	F488-E490 HydrophobicContact CD1-CG 4.14Å; F488-E490 HydrophobicContact CE1-CG 4.1Å
489	D	31.6	Very low	33.9	Very low	164 Å²	164	134.8 Å²	134.8	88%	0.877	76%	0.755	S	S	*	*				-145.2	165.1	108.6	-143.7	-24.4	0	0	0	110.7
490	E	36.3	Very low	34.1	Very low	143 Å²	143	139.1 Å²	139.1	67%	0.668	76%	0.757	S	S	*	*			trans	-128.9	-175.2	-163	-105	-158.6	94.7	0	0	112.6	F488	F488-E490 HydrophobicContact CD1-CG 4.14Å; F488-E490 HydrophobicContact CE1-CG 4.1Å
491	P	49.9	Very low	34.3	Very low	97 Å²	97	143.4 Å²	143.4	63%	0.63	77%	0.766	S	S	*	*			cis	-137.1	-145.9	-46.5	40.7	-22.2	0	0	0	112.5
492	S	33.8	Very low	34.4	Very low	103 Å²	103	146.8 Å²	146.8	72%	0.72	77%	0.769	S	S	*	*			trans	80.8	134.6	166.9	-62.2	0	0	0	0	117.2
493	E	32.2	Very low	33.4	Very low	190 Å²	190	145.6 Å²	145.6	89%	0.888	76%	0.763	S	S	*	*			cis	-144.3	158.9	3.9	-142.4	175.6	-129.9	0	0	110.9
494	G	34.3	Very low	33.7	Very low	63 Å²	63	143.9 Å²	143.9	65%	0.649	76%	0.762	S	S	*	*			trans	-136.6	161.5	175.7	0	0	0	0	0	111.6
495	P	34.6	Very low	33.8	Very low	135 Å²	135	144.1 Å²	144.1	88%	0.877	77%	0.765	S	S	*	*				-138	148.6	116.9	36.1	-25.6	0	0	0	114.5
496	L	30.1	Very low	33.4	Very low	147 Å²	147	142.7 Å²	142.7	77%	0.77	76%	0.763	S	S	*	*			trans	-78.9	158.3	173.9	-61.3	165.3	0	0	0	111.9
497	R	31.4	Very low	34.1	Very low	217 Å²	217	141.3 Å²	141.3	82%	0.819	76%	0.762	S	S	*	*			trans	72.1	118	161.7	-52.6	176.2	-87.7	-132	2.9	115.8
498	Y	33.6	Very low	33.3	Very low	245 Å²	245	148.1 Å²	148.1	96%	0.961	78%	0.777	S	S	*	*				-146	140.2	108	-91.9	-66.5	0	0	0	111.1
499	L	28.3	Very low	33.6	Very low	137 Å²	137	149.9 Å²	149.9	72%	0.717	78%	0.784	S	S	*	*			trans	-102.5	144.9	179.5	-169.4	82.1	0	0	0	109.1
500	R	30.3	Very low	33.5	Very low	186 Å²	186	147.6 Å²	147.6	70%	0.702	78%	0.777	S	S	*	*			trans	66.5	80.5	157.7	-167.6	-171.8	-65.1	125.7	-0.9	117.4
501	Q	31.7	Very low	33.2	Very low	190 Å²	190	145.9 Å²	145.9	89%	0.888	78%	0.78	S	S	*	*			trans	-138.3	136.3	131	-81.2	-176.9	-2.7	0	0	106.9
502	Q	31.3	Very low	32.3	Very low	190 Å²	190	146.8 Å²	146.8	89%	0.888	78%	0.784	S	S	*	*			cis	-117.6	157.6	5.4	-61.2	169.9	-1.8	0	0	111
503	S	26.4	Very low	32.2	Very low	88 Å²	88	149.8 Å²	149.8	62%	0.615	79%	0.791	S	S	*	*			trans	-151.4	132.2	178.9	58.1	0	0	0	0	112.5
504	A	32.8	Very low	32	Very low	91 Å²	91	149.4 Å²	149.4	75%	0.752	79%	0.789	S	S	*	*			trans	68.9	158.3	177.1	0	0	0	0	0	115.2
505	P	38.9	Very low	31.6	Very low	128 Å²	128	150.6 Å²	150.6	83%	0.831	79%	0.793	S	S	*	*			cis	-91.6	146.4	2.6	38	-34.4	0	0	0	113.3
506	A	33.9	Very low	31.4	Very low	86 Å²	86	152.7 Å²	152.7	71%	0.711	79%	0.791	S	S	*	*			cis	72.6	126.3	40.3	0	0	0	0	0	112.9
507	P	41.7	Very low	31.2	Very low	117 Å²	117	153 Å²	153	76%	0.76	79%	0.792	S	S	*	*			cis	-139	151.8	49.9	41.7	-23.6	0	0	0	116.5
508	R	27.4	Very low	31.1	Very low	232 Å²	232	150.7 Å²	150.7	88%	0.875	79%	0.79	S	S	*	*				78.5	146	99.2	-59.6	-81.1	-168.4	149.9	4.8	118.4
509	F	35.4	Very low	30.6	Very low	198 Å²	198	147.6 Å²	147.6	87%	0.868	79%	0.785	S	S	*	*			trans	95.9	91.7	-178.8	-75.8	-84.5	0	0	0	115.5
510	T	29	Very low	30.8	Very low	117 Å²	117	150.5 Å²	150.5	72%	0.718	79%	0.792	S	S	*	*			cis	91.3	96.7	47.2	66.4	0	0	0	0	116.5
511	S	31.1	Very low	31	Very low	106 Å²	106	147 Å²	147	74%	0.741	79%	0.794	S	S	*	*			trans	-176.4	128.9	136.7	-151.5	0	0	0	0	106.4
512	T	30.9	Very low	30.9	Very low	116 Å²	116	146.8 Å²	146.8	71%	0.712	79%	0.789	S	S	*	*			cis	64.5	101.3	38.8	70.5	0	0	0	0	114.7
513	L	30.1	Very low	30.7	Very low	167 Å²	167	142.8 Å²	142.8	87%	0.874	77%	0.774	S	S	*	*				179.1	149.4	98	-97.7	168.8	0	0	0	113.3
514	E	28.5	Very low	30.9	Very low	182 Å²	182	143.1 Å²	143.1	85%	0.85	78%	0.776	S	S	*	*			trans	-99.7	-179.7	151.8	-62.5	178.3	110.4	0	0	108.6
515	A	26	Very low	30.8	Very low	87 Å²	87	143.9 Å²	143.9	72%	0.719	78%	0.776	S	S	*	*			trans	66	124.6	170.6	0	0	0	0	0	116
516	Q	31	Very low	30.4	Very low	179 Å²	179	143.4 Å²	143.4	84%	0.836	78%	0.776	S	S	*	*				75.2	112.2	55.8	-177	-170.7	-8.3	0	0	113.1
517	I	24.7	Very low	30.3	Very low	153 Å²	153	148 Å²	148	79%	0.785	78%	0.783	S	S	*	*			trans	-174.6	167.9	140	-97.8	156	0	0	0	109.9
518	E	30.1	Very low	29.7	Very low	169 Å²	169	151.9 Å²	151.9	79%	0.79	79%	0.79	S	S	*	*			trans	-49.1	153.1	-175.8	-62	150.7	117.9	0	0	115.1
519	E	24.1	Very low	29.6	Very low	181 Å²	181	151.7 Å²	151.7	85%	0.846	79%	0.79	S	S	*	*				-159	159.3	71.8	-96.4	-170.2	119.8	0	0	115
520	F	31	Very low	30.2	Very low	197 Å²	197	147.6 Å²	147.6	86%	0.864	78%	0.783	S	S	*	*			trans	-81.4	138.4	152.7	-93.5	-93.2	0	0	0	108.9
521	P	35.8	Very low	30.2	Very low	114 Å²	114	149.5 Å²	149.5	74%	0.74	78%	0.784	S	S	*	*				-150	137	101	34.4	-16.5	0	0	0	117.6
522	K	29.2	Very low	30.1	Very low	184 Å²	184	151.7 Å²	151.7	80%	0.8	79%	0.785	S	S	*	*			trans	43.1	126.3	138.5	-76.8	177.7	177.1	167.3	0	123.5
523	D	27.8	Very low	29.9	Very low	107 Å²	107	156.7 Å²	156.7	57%	0.572	79%	0.791	S	S	*	*				91.7	137.6	128.7	-89	-63.1	0	0	0	122.7	K973	D523-K973 IonicContact OD1-NZ 3.7Å; D523-K973 PolarHBondContact OD1-NZ 3.41Å
524	S	30.4	Very low	30	Very low	94 Å²	94	154.3 Å²	154.3	66%	0.657	79%	0.789	S	S	*	*			trans	84.7	93.7	146.7	-60.6	0	0	0	0	123.4
525	S	29	Very low	30	Very low	108 Å²	108	157.2 Å²	157.2	76%	0.755	79%	0.792	S	S	*	*				106.5	143.3	103.2	78.2	0	0	0	0	123.2
526	S	31	Very low	30.1	Very low	117 Å²	117	158.8 Å²	158.8	82%	0.818	80%	0.797	S	S	*	*			trans	90.3	152.4	148.2	80	0	0	0	0	121.6
527	H	31.2	Very low	30.1	Very low	184 Å²	184	155.5 Å²	155.5	85%	0.852	79%	0.794	S	S	*	*			trans	-117.1	157.4	-178.5	-67.6	-109	0	0	0	111.1
528	Q	30.8	Very low	30.2	Very low	197 Å²	197	157 Å²	157	92%	0.921	80%	0.798	S	S	*	*				179.5	175.6	112.5	-95	-176.8	12.6	0	0	114.7
529	R	25.2	Very low	30.6	Very low	228 Å²	228	154.8 Å²	154.8	86%	0.86	80%	0.798	S	S	*	*			trans	-176.5	159.3	-158.4	167.4	-179.2	-65.3	178.4	0.1	108.7
530	P	46.8	Very low	31.5	Very low	113 Å²	113	152.4 Å²	152.4	73%	0.734	80%	0.798	S	S	*	*			cis	-120	-133.2	5.3	27.6	-0.7	0	0	0	111.8
531	Q	29.3	Very low	31.4	Very low	157 Å²	157	148.4 Å²	148.4	73%	0.734	80%	0.795	S	S	*	*			cis	-164.2	152.1	3.1	-138.8	-51.4	77.8	0	0	111.5
532	I	29.2	Very low	31.2	Very low	151 Å²	151	149.7 Å²	149.7	77%	0.774	80%	0.801	S	S	*	*			trans	-136.8	165.8	174.7	-68.3	-174.9	0	0	0	113
533	R	27.6	Very low	31.2	Very low	222 Å²	222	152.3 Å²	152.3	84%	0.838	81%	0.805	S	S	*	*			trans	-132.1	148.1	-165.2	171.9	-171.7	-176	176.8	2.3	112.8
534	S	31.1	Very low	31.1	Very low	117 Å²	117	151.1 Å²	151.1	82%	0.818	81%	0.81	S	S	*	*			trans	-142.1	166.5	176.6	-62	0	0	0	0	114.5
535	R	28.2	Very low	31	Very low	243 Å²	243	155.1 Å²	155.1	92%	0.917	82%	0.824	S	S	*	*			trans	-158	160.9	176.5	-106.1	-169.9	173.3	-150.6	-2.1	112.7
536	S	28.2	Very low	30.9	Very low	119 Å²	119	155.2 Å²	155.2	83%	0.832	82%	0.824	S	S	*	*			trans	-162.9	-171.4	169	-144.8	0	0	0	0	108.7
537	S	31.9	Very low	31.3	Very low	110 Å²	110	155.8 Å²	155.8	77%	0.769	83%	0.825	S	S	*	*			cis	-165.6	160	3	45.2	0	0	0	0	110.4
538	E	26.5	Very low	31.4	Very low	186 Å²	186	155.8 Å²	155.8	87%	0.869	82%	0.823	S	S	*	*			trans	-145.8	146.8	169.4	-118.7	-177.2	150.1	0	0	111.1
539	P	38.5	Very low	31.5	Very low	121 Å²	121	152.7 Å²	152.7	79%	0.786	82%	0.82	S	S	*	*				-155.4	-174.6	93.7	41.3	-20.8	0	0	0	116.3
540	P	42.3	Very low	31.8	Very low	131 Å²	131	147.5 Å²	147.5	85%	0.851	81%	0.813	S	S	*	*			trans	-107.4	-154.8	-175.2	41.5	-35.2	0	0	0	117.3
541	S	29.5	Very low	31.4	Very low	113 Å²	113	147.2 Å²	147.2	79%	0.79	81%	0.811	S	S	*	*			trans	-119.9	167.7	-149	-179.5	0	0	0	0	117.9
542	T	31.4	Very low	31.3	Very low	141 Å²	141	147 Å²	147	87%	0.865	81%	0.814	S	S	*	*			trans	-151.1	176.4	177.9	-33.7	0	0	0	0	112.5
543	R	28.6	Very low	31.4	Very low	239 Å²	239	146.3 Å²	146.3	90%	0.902	81%	0.812	S	S	*	*			trans	-164.2	144.3	-154.9	174	-168.7	173.4	-147.9	1.4	115.3
544	A	26	Very low	31.7	Very low	82 Å²	82	141.8 Å²	141.8	68%	0.678	81%	0.809	S	S	*	*			trans	136.8	156.3	136.1	0	0	0	0	0	120.5
545	L	28.8	Very low	31.9	Very low	179 Å²	179	142.1 Å²	142.1	94%	0.937	81%	0.808	S	S	*	*			trans	88.2	159.8	157.9	-53	-171.2	0	0	0	122.2
546	S	27.3	Very low	32.5	Very low	110 Å²	110	140 Å²	140	77%	0.769	81%	0.805	S	S	*	*			trans	-151.2	170.8	-171.9	72.8	0	0	0	0	110.4
547	P	38.6	Very low	32.9	Very low	129 Å²	129	140.5 Å²	140.5	84%	0.838	81%	0.806	S	S	*	*				-148.7	-155.3	76.3	40.5	-19.3	0	0	0	114.9
548	K	33.3	Very low	32.8	Very low	183 Å²	183	144.8 Å²	144.8	80%	0.796	81%	0.807	S	S	*	*			trans	-128.6	153.9	-175.4	-110.1	175.5	179.6	173.8	0	112.4
549	P	33.2	Very low	32.9	Very low	132 Å²	132	143.8 Å²	143.8	86%	0.857	80%	0.8	S	S	*	*				-138	-172	115.8	36.9	-23.5	0	0	0	114.3
550	V	31.7	Very low	32.6	Very low	119 Å²	119	145.8 Å²	145.8	72%	0.721	80%	0.799	S	S	*	*			trans	-145.5	143.6	-166.6	169.8	0	0	0	0	108.4
551	P	38.4	Very low	31.9	Very low	107 Å²	107	145.5 Å²	145.5	70%	0.695	80%	0.797	S	S	*	*				-158.5	166.3	112.3	43.9	-25.1	0	0	0	118.8
552	L	28	Very low	31.8	Very low	152 Å²	152	150 Å²	150	80%	0.796	80%	0.796	S	S	*	*			trans	70.7	152.8	159.8	-43.7	-169	0	0	0	120.2
553	L	29.7	Very low	31.7	Very low	138 Å²	138	150.4 Å²	150.4	72%	0.723	79%	0.793	S	S	*	*			cis	-167.6	131	-49	-115.3	-179.8	0	0	0	111.6
554	T	33.8	Very low	31.6	Very low	126 Å²	126	144.9 Å²	144.9	77%	0.773	79%	0.791	S	S	*	*			trans	62.1	170.3	156.6	42.9	0	0	0	0	119.9
555	P	36.3	Very low	31.6	Very low	124 Å²	124	145.1 Å²	145.1	81%	0.805	79%	0.793	S	S	*	*			cis	-125.1	-174.9	2	42.1	-26.5	0	0	0	117
556	K	40	Very low	31.5	Very low	198 Å²	198	144 Å²	144	86%	0.861	79%	0.788	S	S	*	*			trans	-90	167.1	171.7	-84.3	-178.6	174.3	177	0	112.5
557	P	37.3	Very low	31.4	Very low	131 Å²	131	147.1 Å²	147.1	85%	0.851	79%	0.79	S	S	*	*				-142.8	-176.6	116.1	39.4	-26.5	0	0	0	115.1
558	Y	28.9	Very low	30.9	Very low	199 Å²	199	149.2 Å²	149.2	78%	0.78	79%	0.786	S	S	*	*			trans	-152.2	157.8	172.4	-155.4	-71.4	0	0	0	109.1
559	F	30.2	Very low	30.5	Very low	166 Å²	166	151.7 Å²	151.7	73%	0.728	79%	0.79	S	S	*	*			trans	88.7	117.8	167.9	-70	-68.9	0	0	0	120.7
560	Q	31.3	Very low	30.1	Very low	162 Å²	162	152.2 Å²	152.2	76%	0.757	79%	0.786	S	S	*	*			trans	56.1	151.6	135.6	-114.7	172.3	-2.3	0	0	122
561	P	28.8	Very low	29.7	Very low	125 Å²	125	152.3 Å²	152.3	81%	0.812	79%	0.792	S	S	*	*				-143.1	-180	108.9	38.8	-25.4	0	0	0	115
562	R	25.9	Very low	29.1	Very low	207 Å²	207	157.3 Å²	157.3	78%	0.781	80%	0.803	S	S	*	*			trans	-130.3	145.2	166.7	-78.1	-124.6	-71.1	-170.3	-3.2	110.6
563	L	29.8	Very low	29.1	Very low	151 Å²	151	153.9 Å²	153.9	79%	0.791	80%	0.797	S	S	*	*			trans	46.1	129.4	149.2	-62	170.8	0	0	0	121
564	S	25.6	Very low	29	Very low	123 Å²	123	154 Å²	154	86%	0.86	80%	0.798	S	S	*	*			trans	-137.2	166.5	148.2	59.9	0	0	0	0	109.1
565	A	26.8	Very low	28.8	Very low	87 Å²	87	152.4 Å²	152.4	72%	0.719	79%	0.792	S	S	*	*			trans	-126.3	169.6	-170.7	0	0	0	0	0	113.1
566	D	27.4	Very low	28.6	Very low	155 Å²	155	154.4 Å²	154.4	83%	0.829	80%	0.795	S	S	*	*			trans	61.8	147.6	177.7	-71.3	-51	0	0	0	116.2
567	E	25.4	Very low	28.1	Very low	176 Å²	176	152.5 Å²	152.5	82%	0.822	79%	0.793	S	S	*	*			cis	-130.2	140.4	15.9	-73.9	-176.3	76.5	0	0	115.2
568	K	26.4	Very low	27.9	Very low	172 Å²	172	157.5 Å²	157.5	75%	0.748	80%	0.795	S	S	*	*				15.1	121	129.4	-167.9	-178	-169.1	176.9	0	119.6
569	W	25.1	Very low	28.1	Very low	235 Å²	235	154 Å²	154	89%	0.89	79%	0.794	S	S	*	*				-162.3	169.7	122.5	-120.2	65.5	0	0	0	112.6
570	N	24.8	Very low	28.2	Very low	144 Å²	144	153.7 Å²	153.7	77%	0.77	80%	0.8	S	S	*	*			trans	-91	151.2	-165.5	-69.2	-48.7	0	0	0	114.7
571	S	23.2	Very low	28.2	Very low	121 Å²	121	149.7 Å²	149.7	85%	0.846	80%	0.802	S	S	*	*			trans	-105.7	117.5	165	-64.7	0	0	0	0	111.3
572	K	26.6	Very low	28.1	Very low	211 Å²	211	150.4 Å²	150.4	92%	0.917	80%	0.8	S	S	*	*			trans	-163.2	164.7	152.6	-116.7	172.2	-174.5	-178.9	0	112.3
573	A	28.1	Very low	28.3	Very low	81 Å²	81	147 Å²	147	67%	0.669	80%	0.795	S	S	*	*			trans	-56.8	174.5	-177.7	0	0	0	0	0	115
574	D	27.4	Very low	28.1	Very low	140 Å²	140	151 Å²	151	75%	0.749	80%	0.8	S	S	*	*			cis	-159.8	177.4	15.6	-142.2	-47	0	0	0	113
575	S	29	Very low	28.2	Very low	92 Å²	92	151.7 Å²	151.7	64%	0.643	79%	0.794	S	S	*	*			trans	23.8	118.9	143.4	-67.6	0	0	0	0	121.3
576	L	32.4	Very low	28	Very low	167 Å²	167	154.9 Å²	154.9	87%	0.874	80%	0.799	S	S	*	*			trans	7.4	111.8	130.7	-174.8	69.5	0	0	0	117.3
577	L	28.8	Very low	28.8	Very low	157 Å²	157	152.2 Å²	152.2	82%	0.822	79%	0.79	S	S	*	*			trans	-77.8	148.6	168.1	-69.7	170.2	0	0	0	112.5
578	R	33	Very low	28.8	Very low	236 Å²	236	149.2 Å²	149.2	89%	0.891	79%	0.789	S	S	*	*			trans	-106.9	154.8	154.4	-66.2	-174.1	75.9	-121.3	4.5	109.1
579	V	33.7	Very low	28.8	Very low	125 Å²	125	145.5 Å²	145.5	76%	0.758	78%	0.784	S	S	*	*			trans	-109	144.3	-166.3	163.8	0	0	0	0	112.9
580	N	33.2	Very low	28.7	Very low	160 Å²	160	141.8 Å²	141.8	86%	0.856	78%	0.779	S	S	*	*			trans	122.4	137.9	161.2	-71	-30	0	0	0	115
581	G	29.9	Very low	28.7	Very low	78 Å²	78	143.7 Å²	143.7	80%	0.804	78%	0.78	S	S	*	*			trans	147	58.1	167.7	0	0	0	0	0	116.8
582	D	28.3	Very low	28.8	Very low	141 Å²	141	143 Å²	143	75%	0.754	78%	0.776	S	S	*	*			trans	-59.9	149.7	-171.6	-87.1	-64.2	0	0	0	119.8
583	I	28.5	Very low	28.7	Very low	134 Å²	134	142 Å²	142	69%	0.687	77%	0.774	S	S	*	*			trans	63.4	116.7	139.3	-62.6	164.9	0	0	0	120.1
584	R	27.1	Very low	28.7	Very low	235 Å²	235	142.9 Å²	142.9	89%	0.887	78%	0.775	S	S	*	*				-162.9	151.4	102.5	-173.7	160.5	-80.5	-122.6	0.3	112.8
585	N	26.5	Very low	28.7	Very low	139 Å²	139	144.1 Å²	144.1	74%	0.743	77%	0.774	S	S	*	*			trans	-97.7	138.7	-170.8	-58.2	-35.4	0	0	0	113.7
586	D	23.7	Very low	28.5	Very low	153 Å²	153	146 Å²	146	82%	0.818	77%	0.772	S	S	*	*				63.4	178.1	118.4	-138.1	44.9	0	0	0	119.2
587	P	44.9	Very low	28.4	Very low	99 Å²	99	147 Å²	147	64%	0.643	77%	0.765	S	S	*	*				-122.7	-162.8	-81.4	41.9	-31.3	0	0	0	115.7
588	S	24.5	Very low	28.2	Very low	113 Å²	113	145.5 Å²	145.5	79%	0.79	76%	0.758	S	S	*	*			trans	85.6	157.1	175.3	84.9	0	0	0	0	115.7
589	S	25.9	Very low	28	Very low	94 Å²	94	139.9 Å²	139.9	66%	0.657	75%	0.754	S	S	*	*			cis	-158.6	138.6	13.3	-143	0	0	0	0	114.7
590	M	23.9	Very low	28.9	Very low	157 Å²	157	139.5 Å²	139.5	77%	0.773	75%	0.754	S	S	*	*			trans	61.4	119.8	144.1	-60.1	-67	162.6	0	0	124.9
591	K	23.9	Very low	30.2	Very low	185 Å²	185	137 Å²	137	80%	0.804	75%	0.747	S	S	*	*				89.1	148.5	126.6	-77.7	-174.2	174	-172.4	0	124.3
592	S	24.6	Very low	30	Very low	107 Å²	107	140.3 Å²	140.3	75%	0.748	75%	0.746	S	S	*	*			trans	73	113.6	165.8	-51.4	0	0	0	0	115.7
593	E	24.7	Very low	29.8	Very low	189 Å²	189	141.9 Å²	141.9	88%	0.883	75%	0.746	S	S	*	*			cis	68.4	122.4	32.2	-145.7	-173.8	142.1	0	0	111.8
594	S	29.2	Very low	29.7	Very low	100 Å²	100	143.4 Å²	143.4	70%	0.699	75%	0.75	S	S	*	*			cis	-146	178.3	40	55.6	0	0	0	0	111.3
595	K	26.8	Very low	29.6	Very low	166 Å²	166	136.6 Å²	136.6	72%	0.722	74%	0.744	S	S	*	*			cis	-163.2	129.8	29.6	-166.3	170.3	-180	175.5	0	114.2
596	E	25.9	Very low	29.6	Very low	130 Å²	130	135.7 Å²	135.7	61%	0.607	75%	0.748	S	S	*	*			trans	46.9	142.6	146.5	-61	-172.5	95.7	0	0	121.9
597	R	29.3	Very low	31.1	Very low	189 Å²	189	133.1 Å²	133.1	71%	0.713	74%	0.74	S	S	*	*			cis	-166.8	152.3	-0.2	-128.9	-174.8	155.7	124.1	-8.6	115.6
598	D	25.2	Very low	30.2	Very low	126 Å²	126	136 Å²	136	67%	0.674	75%	0.75	S	S	*	*			trans	48.9	171	142.2	-77.8	-38.9	0	0	0	123.1
599	S	28.3	Very low	30.3	Very low	117 Å²	117	134.9 Å²	134.9	82%	0.818	75%	0.748	S	S	*	*			trans	-145.4	-155.7	-174.7	-55	0	0	0	0	112.6
600	P	53.6	Low	31.7	Very low	117 Å²	117	136.1 Å²	136.1	76%	0.76	75%	0.754	S	S	*	*				-117.5	-154.5	-125.1	43.4	-24.5	0	0	0	113.4
601	P	59.2	Low	33	Very low	107 Å²	107	133.7 Å²	133.7	70%	0.695	75%	0.75	S	S	*	*			cis	-125.9	-178.1	-32.7	37.1	-21.7	0	0	0	113.4
602	L	25	Very low	33.3	Very low	149 Å²	149	130 Å²	130	78%	0.78	75%	0.747	S	S	*	*			trans	175.6	154.9	139.8	-116.7	54.6	0	0	0	118.5
603	F	25	Very low	33.4	Very low	174 Å²	174	132.2 Å²	132.2	76%	0.763	75%	0.75	S	S	*	*			trans	75.1	176.4	154.4	-90.9	-75.8	0	0	0	125.6
604	Q	26.3	Very low	33.5	Very low	166 Å²	166	127.3 Å²	127.3	78%	0.776	74%	0.742	S	S	*	*			trans	-131.7	151.3	-144.9	-58.7	173.4	-76.4	0	0	117.4
605	A	26.1	Very low	33.4	Very low	91 Å²	91	127.9 Å²	127.9	75%	0.752	75%	0.747	S	S	*	*			trans	62.2	125.4	136.3	0	0	0	0	0	126
606	S	24.7	Very low	34.5	Very low	120 Å²	120	125.8 Å²	125.8	84%	0.839	75%	0.75	S	S	*	*			trans	67.5	164.3	137.8	-85.7	0	0	0	0	122.3
607	P	57.1	Low	34.6	Very low	100 Å²	100	123.9 Å²	123.9	65%	0.649	76%	0.756	S	S	*	*			cis	-131.6	-168.2	-6.5	35.7	-15	0	0	0	116.1
608	D	24.6	Very low	34.4	Very low	159 Å²	159	126.7 Å²	126.7	85%	0.85	77%	0.767	S	S	*	*			trans	82.5	159	154.2	-61.1	-27.8	0	0	0	123.1
609	A	27.6	Very low	34.8	Very low	90 Å²	90	125.5 Å²	125.5	74%	0.744	77%	0.768	S	S	*	*			trans	-162.4	-172.6	-172	0	0	0	0	0	108.9
610	P	54.2	Low	36.3	Very low	120 Å²	120	125.5 Å²	125.5	78%	0.779	77%	0.766	S	S	*	*			cis	-118.6	-137.7	-18.7	43	-25.5	0	0	0	108.7
611	P	51.9	Low	36.2	Very low	106 Å²	106	125.2 Å²	125.2	69%	0.688	76%	0.763	S	S	*	*			cis	-128	179.1	-28	40.3	-24.2	0	0	0	114.6
612	S	30	Very low	34.6	Very low	107 Å²	107	124.7 Å²	124.7	75%	0.748	77%	0.768	S	S	*	*			trans	44.5	154.2	151.5	-56.4	0	0	0	0	121.5
613	D	26.4	Very low	34.9	Very low	153 Å²	153	123.1 Å²	123.1	82%	0.818	77%	0.77	S	S	*	*			cis	-162.5	-176.6	25.2	-143.7	-39.7	0	0	0	112.3
614	A	26.8	Very low	35.9	Very low	86 Å²	86	120.4 Å²	120.4	71%	0.711	77%	0.77	S	S	*	*			trans	74.1	126.7	156.4	0	0	0	0	0	122.1
615	S	27.8	Very low	36	Very low	113 Å²	113	118.9 Å²	118.9	79%	0.79	76%	0.763	S	S	*	*			trans	-97.4	-169.3	155.3	-52	0	0	0	0	108.9
616	P	50.1	Low	36.2	Very low	122 Å²	122	124.9 Å²	124.9	79%	0.792	77%	0.766	S	S	*	*			cis	-147.5	-174.4	4.8	42.6	-21.5	0	0	0	118.4
617	A	26.8	Very low	36.2	Very low	89 Å²	89	122.7 Å²	122.7	74%	0.736	76%	0.763	S	S	*	*			trans	99.8	153.9	134.3	0	0	0	0	0	124.1
618	R	26.5	Very low	34.8	Very low	249 Å²	249	129.1 Å²	129.1	94%	0.94	77%	0.774	S	S	*	*			trans	88	151.5	160.8	-76.3	-178.6	170.2	-104.1	2	121.9
619	S	32.8	Very low	35.7	Very low	101 Å²	101	126.4 Å²	126.4	71%	0.706	77%	0.765	S	S	*	*			trans	-158.5	-178.8	-178.3	59.8	0	0	0	0	108.6
620	P	59.6	Low	35.8	Very low	117 Å²	117	127.6 Å²	127.6	76%	0.76	76%	0.762	S	S	*	*			cis	-105.8	-98.7	-19.7	29.4	-8.1	0	0	0	110.4
621	P	51.5	Low	34.5	Very low	110 Å²	110	127.8 Å²	127.8	71%	0.714	77%	0.767	S	S	*	*			cis	-132.7	177.7	-20.3	42.4	-25.1	0	0	0	116.9
622	A	26.1	Very low	33.3	Very low	97 Å²	97	129.1 Å²	129.1	80%	0.802	77%	0.773	S	S	*	*			trans	77.8	145.4	145.8	0	0	0	0	0	124.5
623	S	31.6	Very low	33.1	Very low	115 Å²	115	133 Å²	133	80%	0.804	78%	0.777	S	S	*	*			trans	-131.7	167.7	169.7	-42.5	0	0	0	0	109
624	P	45.6	Very low	33.2	Very low	118 Å²	118	132.4 Å²	132.4	77%	0.766	78%	0.779	S	S	*	*				-164.2	-170.1	91.7	40.4	-16.8	0	0	0	118.7
625	E	28.6	Very low	33.1	Very low	134 Å²	134	133.7 Å²	133.7	63%	0.626	78%	0.782	S	S	*	*			trans	99.2	117.8	151.4	-60.9	-97.2	103.3	0	0	123.8
626	R	29.6	Very low	32.9	Very low	216 Å²	216	131.8 Å²	131.8	82%	0.815	78%	0.78	S	S	*	*			trans	42.2	147	141.4	-45.2	-175.8	-148.2	-99	-12.6	123.1
627	G	25.7	Very low	31.9	Very low	75 Å²	75	136.8 Å²	136.8	77%	0.773	78%	0.783	S	S	*	*			cis	156.7	151.6	-12.6	0	0	0	0	0	116.7
628	R	26.9	Very low	32	Very low	235 Å²	235	141.2 Å²	141.2	89%	0.887	79%	0.789	S	S	*	*			trans	71.9	167.9	167.7	-100.3	-176.5	178.4	-125.2	-0.2	119.2
629	P	44.8	Very low	32	Very low	102 Å²	102	134.8 Å²	134.8	66%	0.662	78%	0.782	S	S	*	*			cis	-140	156.1	-15	37.5	-17.9	0	0	0	119.4
630	V	28.1	Very low	31.6	Very low	114 Å²	114	135.3 Å²	135.3	69%	0.691	79%	0.786	S	S	*	*			trans	41.7	137.2	133.7	-175.1	0	0	0	0	124.2	T632	V630-T632 HydrophobicContact CG1-CG2 4.33Å
631	S	28.2	Very low	30	Very low	125 Å²	125	137.8 Å²	137.8	87%	0.874	79%	0.789	S	S	*	*			trans	-155.5	168.4	144	-84.3	0	0	0	0	112.7
632	T	26.2	Very low	28.7	Very low	133 Å²	133	140.5 Å²	140.5	82%	0.816	79%	0.792	S	S	*	*			trans	-133.6	175.2	-155.7	52.7	0	0	0	0	117.3	V630	V630-T632 HydrophobicContact CG1-CG2 4.33Å
633	K	26.4	Very low	28.7	Very low	190 Å²	190	139.8 Å²	139.8	83%	0.826	79%	0.787	S	S	*	*			trans	-61.9	170.7	168.1	-54	176.5	-178.6	177.6	0	111.3
634	T	27.2	Very low	28.3	Very low	140 Å²	140	139 Å²	139	86%	0.859	79%	0.787	S	S	*	*			cis	-156.8	175	39.4	39.9	0	0	0	0	115.5
635	S	26.1	Very low	27.3	Very low	113 Å²	113	138.3 Å²	138.3	79%	0.79	79%	0.785	S	S	*	*			trans	-72.2	164.1	179.7	162.3	0	0	0	0	116.7
636	G	21.9	Very low	27.1	Very low	72 Å²	72	137.9 Å²	137.9	74%	0.742	79%	0.791	S	S	*	*			trans	-128	160.5	160.7	0	0	0	0	0	111.9
637	R	29	Very low	26.9	Very low	228 Å²	228	132.8 Å²	132.8	86%	0.86	79%	0.788	S	S	*	*			trans	-164.4	140.3	-161.5	168.1	-169.3	167.9	-160.3	-2	112.7
638	Q	30.8	Very low	26.9	Very low	181 Å²	181	138.5 Å²	138.5	85%	0.846	80%	0.795	S	S	*	*			trans	165.7	163.4	136	-94.3	-179.5	-58	0	0	115.1
639	S	25.3	Very low	26.9	Very low	114 Å²	114	131.2 Å²	131.2	80%	0.797	79%	0.793	S	S	*	*			trans	78.6	117	-174.3	-137.6	0	0	0	0	114.2
640	S	23.9	Very low	25.9	Very low	113 Å²	113	132 Å²	132	79%	0.79	80%	0.801	S	S	*	*			cis	93.9	146.6	36.3	-58.3	0	0	0	0	113
641	M	27.2	Very low	26.5	Very low	169 Å²	169	132 Å²	132	83%	0.833	80%	0.804	S	S	*	*			cis	-143	-111.6	14.4	-161.2	158.6	168.5	0	0	115.8
642	E	24.3	Very low	26.5	Very low	166 Å²	166	132 Å²	132	78%	0.776	80%	0.798	S	S	*	*			trans	-117.4	165	-165.8	-86.4	-171.9	110.8	0	0	112.5
643	A	25.5	Very low	27	Very low	83 Å²	83	131.7 Å²	131.7	69%	0.686	80%	0.799	S	S	*	*			cis	-166.2	177.4	-8.3	0	0	0	0	0	112.3
644	A	23.6	Very low	26.9	Very low	97 Å²	97	129 Å²	129	80%	0.802	80%	0.799	S	S	*	*			trans	79.1	146	163.1	0	0	0	0	0	119.9
645	S	23.4	Very low	27	Very low	105 Å²	105	130.6 Å²	130.6	73%	0.734	79%	0.789	S	S	*	*			cis	-170.3	179.7	-24.4	54.9	0	0	0	0	111
646	V	25.2	Very low	27.7	Very low	125 Å²	125	130.4 Å²	130.4	76%	0.758	79%	0.785	S	S	*	*			trans	75.8	103.2	174.4	-169	0	0	0	0	114.4
647	S	26.1	Very low	28	Very low	108 Å²	108	132.1 Å²	132.1	76%	0.755	78%	0.781	S	S	*	*				75.8	134	71.5	-59.8	0	0	0	0	113.9
648	E	25.1	Very low	27.7	Very low	195 Å²	195	126.9 Å²	126.9	91%	0.911	78%	0.779	S	S	*	*			cis	-144	175.7	12.9	-62.5	-174.3	123	0	0	113.5
649	G	26.1	Very low	27.8	Very low	82 Å²	82	125.7 Å²	125.7	85%	0.845	78%	0.778	S	S	*	*			trans	106	95.1	134.9	0	0	0	0	0	121.1
650	S	25.2	Very low	28.2	Very low	120 Å²	120	125 Å²	125	84%	0.839	77%	0.771	S	S	*	*			trans	-166.6	151.9	165.7	-166.9	0	0	0	0	108
651	P	39.4	Very low	28.2	Very low	113 Å²	113	126.2 Å²	126.2	73%	0.734	76%	0.764	S	S	*	*			cis	-145.8	-158.6	30.3	44.1	-21.6	0	0	0	117.3
652	T	28.5	Very low	28.2	Very low	125 Å²	125	125.7 Å²	125.7	77%	0.767	76%	0.759	S	S	*	*			trans	-37.8	152.7	170.8	54	0	0	0	0	118
653	P	37.4	Very low	28.3	Very low	127 Å²	127	124.2 Å²	124.2	83%	0.825	76%	0.756	S	S	*	*				-153.5	-124	78.1	42.2	-19	0	0	0	118
654	T	23.7	Very low	28.3	Very low	134 Å²	134	127.5 Å²	127.5	82%	0.822	76%	0.755	S	S	*	*			trans	-120	167.8	-145.6	47.5	0	0	0	0	119.2
655	R	30.5	Very low	28.3	Very low	172 Å²	172	128.9 Å²	128.9	65%	0.649	75%	0.745	S	S	*	*			trans	-32.9	153.1	162.8	179.7	-178.7	-160.3	-130.8	9.9	114.6	E802	R655-E802 IonicContact CZ-OE2 2.7Å; R655-E802 IonicContact NH1-OE1 2.67Å; R655-E802 PolarHBondContact NH1-OE1 3.3Å; R655-E802 IonicContact NH1-OE2 3.35Å; R655-E802 PolarHBondContact NH1-OE2 3.09Å; R655-E802 VanDerWaalsContact NH1-OE2 3.09Å; R655-E802 IonicContact NH2-OE1 3.76Å; R655-E802 IonicContact NH2-OE2 2.7Å; R655-E802 PolarHBondContact NH2-OE2 2.89Å
656	P	40.5	Very low	28.5	Very low	109 Å²	109	130 Å²	130	71%	0.708	75%	0.75	S	S	*	*			cis	-136.4	178.7	18.8	19.1	8.8	0	0	0	119.2
657	T	27	Very low	28.5	Very low	108 Å²	108	131.4 Å²	131.4	66%	0.663	75%	0.748	S	S	*	*			trans	35.8	121.9	143.3	-52.1	0	0	0	0	123.6
658	S	23.6	Very low	28.4	Very low	118 Å²	118	133.8 Å²	133.8	83%	0.825	75%	0.753	S	S	*	*				-176.8	162.2	129.3	39.5	0	0	0	0	113.2
659	L	32.5	Very low	28.4	Very low	157 Å²	157	130.5 Å²	130.5	82%	0.822	75%	0.751	S	S	*	*			trans	-146.1	149.1	165.4	-110.3	172.7	0	0	0	107.4
660	P	34.4	Very low	28.3	Very low	100 Å²	100	135.8 Å²	135.8	65%	0.649	75%	0.751	S	S	*	*				-152.7	-171.5	103.9	40.1	-21	0	0	0	115.6
661	E	24.2	Very low	28.3	Very low	138 Å²	138	135.2 Å²	135.2	65%	0.645	74%	0.742	S	S	*	*			trans	-63.1	166.1	178.9	-63.6	97.6	132.9	0	0	116.7	K817	E661-K817 IonicContact OE1-NZ 3.63Å; E661-K817 PolarHBondContact OE1-NZ 3.32Å; E661-K817 IonicContact OE2-NZ 3.79Å; E661-K817 PolarHBondContact OE2-NZ 2.97Å
662	E	26.7	Very low	27.7	Very low	157 Å²	157	138 Å²	138	73%	0.734	75%	0.746	S	S	*	*			cis	-128.6	-97.9	-10.1	-174.3	-147.1	119.1	0	0	111.7	K664	E662-K664 PolarHBondContact OE1-N 3.2Å
663	L	25.2	Very low	27.5	Very low	136 Å²	136	138.3 Å²	138.3	71%	0.712	75%	0.747	S	S	*	*			cis	-150.2	131.2	-4.1	-116.3	-174.5	0	0	0	113.1
664	K	26	Very low	27	Very low	151 Å²	151	135.8 Å²	135.8	66%	0.657	74%	0.744	S	S	*	*			trans	80.6	125.9	161.1	-56.7	-166.6	176.3	-173.1	0	121.9	E662	E662-K664 PolarHBondContact OE1-N 3.2Å
665	Q	23.6	Very low	27.1	Very low	126 Å²	126	133.3 Å²	133.3	59%	0.589	75%	0.746	S	S	*	*			trans	45.6	125.9	133.1	-65.8	171.1	-70.7	0	0	121.2	E667	Q665-E667 PolarHBondContact NE2-OE1 3.07Å
666	P	27	Very low	27.1	Very low	130 Å²	130	133.9 Å²	133.9	84%	0.844	76%	0.756	S	S	*	*			trans	-95.8	121.4	138.5	33.7	-24	0	0	0	110.8
667	E	25.2	Very low	26.6	Very low	154 Å²	154	138 Å²	138	72%	0.72	76%	0.762	S	S	*	*			trans	-120.1	159.4	160.7	-75.7	-176.7	-158.6	0	0	109.3	Q665	Q665-E667 PolarHBondContact NE2-OE1 3.07Å
668	D	24.7	Very low	26.6	Very low	158 Å²	158	137.8 Å²	137.8	85%	0.845	77%	0.772	S	S	*	*			trans	-46.9	143.5	-167.5	-61.9	-66.9	0	0	0	114.5
669	S	25.5	Very low	26.6	Very low	125 Å²	125	136.7 Å²	136.7	87%	0.874	77%	0.77	S	S	*	*				-173.7	-179.1	77.3	38.6	0	0	0	0	114.2
670	F	23.4	Very low	26.3	Very low	193 Å²	193	133.6 Å²	133.6	85%	0.846	77%	0.767	S	S	*	*			trans	-119.5	153.5	-161.1	-173.7	-122.6	0	0	0	110.5
671	V	25.8	Very low	25.9	Very low	108 Å²	108	136.9 Å²	136.9	66%	0.655	77%	0.774	S	S	*	*			trans	72.1	146.5	175.8	-148.2	0	0	0	0	112.5
672	E	26.2	Very low	26.1	Very low	173 Å²	173	137.8 Å²	137.8	81%	0.808	78%	0.778	S	S	*	*			cis	-140.1	168.8	13.2	-155.7	140.1	-165.5	0	0	116.1
673	T	24.9	Very low	26	Very low	130 Å²	130	137.8 Å²	137.8	80%	0.798	78%	0.778	S	S	*	*			trans	-58	121	179	-46.7	0	0	0	0	117.9
674	G	25.8	Very low	26	Very low	74 Å²	74	139.7 Å²	139.7	76%	0.763	78%	0.783	S	S	*	*				70.9	-175.9	128.8	0	0	0	0	0	121.4
675	G	26.6	Very low	26	Very low	83 Å²	83	141.8 Å²	141.8	86%	0.856	79%	0.792	S	S	*	*			trans	99.8	134.6	173.3	0	0	0	0	0	115.9
676	Q	30.5	Very low	26.1	Very low	183 Å²	183	141 Å²	141	86%	0.855	80%	0.8	S	S	*	*			trans	-116	135.4	175.3	-73.2	-171.9	-7.2	0	0	112.5
677	K	28.7	Very low	26	Very low	195 Å²	195	140.5 Å²	140.5	85%	0.848	80%	0.795	S	S	*	*			trans	66	103.5	153.4	-68.6	-176.7	174.7	-179.1	0	121.2
678	A	27.8	Very low	26	Very low	104 Å²	104	139.2 Å²	139.2	86%	0.86	80%	0.798	S	S	*	*				84.3	100.2	113.6	0	0	0	0	0	122.7
679	A	23.8	Very low	26.1	Very low	96 Å²	96	136.2 Å²	136.2	79%	0.793	80%	0.795	S	S	*	*			trans	-153.3	143	141.5	0	0	0	0	0	106
680	A	26.7	Very low	26.2	Very low	91 Å²	91	133.9 Å²	133.9	75%	0.752	78%	0.784	S	S	*	*				64.7	129.8	53.1	0	0	0	0	0	112.9
681	Q	26.3	Very low	26.3	Very low	170 Å²	170	133.5 Å²	133.5	79%	0.794	78%	0.784	S	S	*	*			cis	-166.7	174.8	-7.5	-132.8	175.4	6.7	0	0	110
682	Q	26.7	Very low	26.2	Very low	156 Å²	156	138 Å²	138	73%	0.729	80%	0.795	S	S	*	*			trans	68.9	159.4	163.8	-72.1	172.3	-69.9	0	0	117.4
683	E	26	Very low	26	Very low	157 Å²	157	133.9 Å²	133.9	73%	0.734	79%	0.79	S	S	*	*			cis	-148.9	-175.2	5.8	-142.2	164	-161.9	0	0	114.8
684	E	24.8	Very low	27.3	Very low	177 Å²	177	133.4 Å²	133.4	83%	0.827	79%	0.789	S	S	*	*			trans	85.8	147.2	159	-74.3	-86	71.4	0	0	120.3
685	K	25.9	Very low	28.5	Very low	195 Å²	195	135 Å²	135	85%	0.848	79%	0.787	S	S	*	*			trans	-160.9	122.2	-160.9	169.5	-161.1	169.4	-171.8	0	113.3
686	S	26.4	Very low	28.5	Very low	108 Å²	108	135.6 Å²	135.6	76%	0.755	78%	0.783	S	S	*	*			trans	-171.2	150.1	163.5	41.9	0	0	0	0	109.8
687	T	24.2	Very low	28.2	Very low	120 Å²	120	136.4 Å²	136.4	74%	0.736	79%	0.787	S	S	*	*			cis	-160.4	167.4	-1.4	4.1	0	0	0	0	111.3
688	T	25.7	Very low	28.2	Very low	128 Å²	128	131.6 Å²	131.6	79%	0.785	78%	0.784	S	S	*	*			trans	63.2	135.4	160.7	47	0	0	0	0	118.9
689	A	25.9	Very low	28.1	Very low	95 Å²	95	135.8 Å²	135.8	79%	0.785	78%	0.782	S	S	*	*			cis	89.1	145.8	32.2	0	0	0	0	0	114.8
690	A	27.6	Very low	28.3	Very low	76 Å²	76	137.6 Å²	137.6	63%	0.628	78%	0.778	S	S	*	*			cis	-173.5	159.3	-20.5	0	0	0	0	0	112.5
691	H	26.3	Very low	28.2	Very low	184 Å²	184	140.5 Å²	140.5	85%	0.852	78%	0.776	S	S	*	*			trans	64.9	165.1	161.4	-60.4	-54.8	0	0	0	118.2
692	K	23.2	Very low	28.1	Very low	203 Å²	203	139.5 Å²	139.5	88%	0.883	77%	0.769	S	S	*	*			cis	-153.8	167	11.4	-143.9	165.8	-174	179.7	0	112.2
693	A	22.8	Very low	28	Very low	86 Å²	86	137 Å²	137	71%	0.711	76%	0.764	S	S	*	*			trans	-110.7	-158.2	173.3	0	0	0	0	0	110.4
694	P	52.3	Low	27.9	Very low	121 Å²	121	135.9 Å²	135.9	79%	0.786	76%	0.759	S	S	*	*			cis	-127.6	-132.4	-12.2	39.7	-16.9	0	0	0	110.1
695	P	49.5	Very low	28	Very low	108 Å²	108	134.5 Å²	134.5	70%	0.701	75%	0.753	S	S	*	*			cis	-135.7	173.7	-29.8	39.3	-21.5	0	0	0	117.3
696	A	27.1	Very low	27.9	Very low	95 Å²	95	133.4 Å²	133.4	79%	0.785	75%	0.748	S	S	*	*			trans	63.8	162.5	148.9	0	0	0	0	0	120.3
697	E	25.3	Very low	27.9	Very low	200 Å²	200	133.8 Å²	133.8	94%	0.935	75%	0.746	S	S	*	*			cis	-129.5	-176.5	9	-85.3	-164.4	128.5	0	0	114.1
698	A	28	Very low	27.9	Very low	94 Å²	94	131.7 Å²	131.7	78%	0.777	75%	0.748	S	S	*	*			trans	-98.6	167.4	-161.9	0	0	0	0	0	117.5
699	K	24.8	Very low	28	Very low	192 Å²	192	133.4 Å²	133.4	84%	0.835	75%	0.752	S	S	*	*				-178	160.1	120.9	-99.9	-174.2	178.5	-179.6	0	115.3
700	L	28.8	Very low	28	Very low	134 Å²	134	135.7 Å²	135.7	70%	0.702	76%	0.757	S	S	*	*			trans	10.4	147.1	150.6	-81.8	71.6	0	0	0	120.4
701	E	24.9	Very low	28.1	Very low	151 Å²	151	139 Å²	139	71%	0.706	76%	0.763	S	S	*	*			cis	-160.8	163.1	-3.9	-134	174.6	162.4	0	0	114.2
702	K	24.2	Very low	28.2	Very low	150 Å²	150	138 Å²	138	65%	0.652	76%	0.759	S	S	*	*			trans	1.7	153.3	149.7	-73.4	-169.7	91	-158.7	0	121.2	E704	K702-E704 WeakPolarHBondContact CE-OE1 3.49Å; K702-E704 IonicContact NZ-OE1 3.06Å; K702-E704 PolarHBondContact NZ-OE1 3.35Å
703	T	24.3	Very low	28.3	Very low	102 Å²	102	134.9 Å²	134.9	63%	0.626	75%	0.75	S	S	*	*			cis	-174.7	-155.2	-30.8	27.9	0	0	0	0	104.7
704	E	23.6	Very low	28.2	Very low	134 Å²	134	138 Å²	138	63%	0.626	75%	0.754	S	S	*	*			cis	-140.3	147	9.8	-76.2	-177.9	-168.8	0	0	106.4	K702	K702-E704 WeakPolarHBondContact CE-OE1 3.49Å; K702-E704 IonicContact NZ-OE1 3.06Å; K702-E704 PolarHBondContact NZ-OE1 3.35Å
705	Q	26.8	Very low	28	Very low	148 Å²	148	137.1 Å²	137.1	69%	0.692	75%	0.748	S	S	*	*				61	143.1	68.3	-56.4	-176.6	-64.3	0	0	112.7
706	F	24.3	Very low	26.7	Very low	172 Å²	172	136.6 Å²	136.6	75%	0.754	75%	0.747	S	S	*	*			cis	-153.6	-171.1	5.8	-146.1	-133.3	0	0	0	113.6
707	T	26.8	Very low	26.6	Very low	117 Å²	117	140.8 Å²	140.8	72%	0.718	75%	0.75	S	S	*	*			trans	-47.7	155.9	179.3	56.1	0	0	0	0	118.5
708	G	24.5	Very low	26.5	Very low	75 Å²	75	136.6 Å²	136.6	77%	0.773	74%	0.738	S	S	*	*			trans	-174.5	141.8	158.3	0	0	0	0	0	114.7
709	N	27.3	Very low	26.2	Very low	164 Å²	164	138.4 Å²	138.4	88%	0.877	74%	0.735	S	S	*	*			trans	-113.2	176.5	175.9	-80	-28.3	0	0	0	111.1
710	V	25.3	Very low	26.2	Very low	144 Å²	144	135 Å²	135	87%	0.873	73%	0.73	S	S	*	*			trans	108.7	155.9	156.8	-173.7	0	0	0	0	116.6
711	L	30.1	Very low	26.9	Very low	146 Å²	146	133.5 Å²	133.5	76%	0.764	73%	0.729	S	S	*	*			trans	-77.2	136.6	-163.7	-74.4	148.2	0	0	0	115.9
712	Q	28.2	Very low	26.9	Very low	163 Å²	163	133.1 Å²	133.1	76%	0.762	73%	0.732	S	S	*	*				56.8	140.3	117.8	-131.3	-170.1	36.8	0	0	122.5
713	I	24.9	Very low	27	Very low	136 Å²	136	133 Å²	133	70%	0.697	74%	0.738	S	S	*	*			trans	75.3	151.8	159.4	-11.8	178.7	0	0	0	120.5
714	L	21.9	Very low	27.8	Very low	153 Å²	153	133.3 Å²	133.3	80%	0.801	74%	0.742	S	S	*	*			trans	95.4	149.8	156.5	-72.9	148.4	0	0	0	118
715	P	46.5	Very low	27.8	Very low	101 Å²	101	132.5 Å²	132.5	66%	0.656	75%	0.746	S	S	*	*				-145.3	-161	-126.6	42.3	-19.6	0	0	0	116.1
716	S	24	Very low	27.7	Very low	98 Å²	98	130 Å²	130	69%	0.685	75%	0.745	S	S	*	*			trans	82	150.4	150.2	-68.7	0	0	0	0	121.1
717	E	23.7	Very low	27.9	Very low	182 Å²	182	127 Å²	127	85%	0.85	74%	0.741	S	S	*	*			trans	70.1	150.6	154.8	-75.6	178.7	-156.9	0	0	120.3
718	V	23.3	Very low	27.8	Very low	112 Å²	112	129.1 Å²	129.1	68%	0.679	74%	0.743	S	S	*	*			cis	-169.2	167.9	-32.7	104.9	0	0	0	0	110.8
719	N	23	Very low	27.6	Very low	132 Å²	132	129.6 Å²	129.6	71%	0.706	73%	0.734	S	S	*	*			trans	65.9	123.4	172.9	-65.3	-25.7	0	0	0	117.7
720	T	23.3	Very low	27.4	Very low	120 Å²	120	129.7 Å²	129.7	74%	0.736	73%	0.727	S	S	*	*				56.4	152.4	61	73.5	0	0	0	0	114.4
721	P	43.3	Very low	27.3	Very low	103 Å²	103	131.7 Å²	131.7	67%	0.669	73%	0.727	S	S	*	*			cis	-141.2	-164.9	16.4	33.5	-8.5	0	0	0	116.5
722	N	26.2	Very low	27.2	Very low	144 Å²	144	127.9 Å²	127.9	77%	0.77	72%	0.723	S	S	*	*			trans	118.1	78.6	151.6	-58.2	-28.2	0	0	0	117.8
723	D	25.2	Very low	27.2	Very low	148 Å²	148	126.8 Å²	126.8	79%	0.791	73%	0.727	S	S	*	*				13	153.6	97.4	-123	-6.6	0	0	0	118
724	P	41.1	Very low	27.5	Very low	108 Å²	108	128 Å²	128	70%	0.701	73%	0.73	S	S	*	*				-148.1	171.3	58.8	38.7	-18.4	0	0	0	118.6
725	T	24	Very low	27.8	Very low	116 Å²	116	125.6 Å²	125.6	71%	0.712	72%	0.722	S	S	*	*			trans	106.4	128.6	141.9	-44	0	0	0	0	116.6
726	S	25.5	Very low	27.3	Very low	95 Å²	95	125.1 Å²	125.1	66%	0.664	73%	0.727	S	S	*	*			cis	-176.9	-179	-24.4	-105	0	0	0	0	110.1
727	T	27.4	Very low	28.4	Very low	111 Å²	111	125.9 Å²	125.9	68%	0.681	73%	0.729	S	S	*	*			trans	76.3	115.9	143.5	30.5	0	0	0	0	120.6
728	E	24.9	Very low	29.1	Very low	160 Å²	160	122.4 Å²	122.4	75%	0.748	73%	0.725	S	S	*	*				60.9	125.8	125.2	-65.9	-176	139	0	0	119.6
729	S	20.3	Very low	30.3	Very low	86 Å²	86	122.5 Å²	122.5	60%	0.601	73%	0.728	S	S	*	*			cis	86.7	157.3	49.3	92.4	0	0	0	0	114
730	F	23.5	Very low	30.6	Very low	165 Å²	165	120.6 Å²	120.6	72%	0.724	73%	0.73	S	S	*	*			trans	76.7	116.4	-173.4	-60.4	-82.5	0	0	0	119.4
731	Q	23.5	Very low	30.7	Very low	186 Å²	186	119.6 Å²	119.6	87%	0.869	74%	0.735	S	S	*	*				39.2	128.9	128.2	-61.1	176.8	-17.4	0	0	121.9
732	G	27.9	Very low	30.7	Very low	66 Å²	66	120.7 Å²	120.7	68%	0.68	74%	0.741	S	S	*	*			trans	149.7	118	159.3	0	0	0	0	0	110.7
733	V	27.6	Very low	30.8	Very low	141 Å²	141	117.5 Å²	117.5	86%	0.855	74%	0.742	S	S	*	*				62	93.4	51.9	-174.1	0	0	0	0	109.5
734	E	31.6	Very low	31.1	Very low	162 Å²	162	116.3 Å²	116.3	76%	0.757	75%	0.746	S	S	*	*			cis	-145.8	147.4	7	-101.2	-160.1	95.3	0	0	114.9
735	T	28.7	Very low	30.5	Very low	101 Å²	101	119.1 Å²	119.1	62%	0.62	75%	0.754	S	S	*	*				45.2	107.3	127.3	-42.7	0	0	0	0	116.9
736	A	35.4	Very low	30.6	Very low	92 Å²	92	117.2 Å²	117.2	76%	0.76	76%	0.757	S	S	*	*			cis	58.8	178	44.6	0	0	0	0	0	112.8
737	P	48	Very low	30.6	Very low	113 Å²	113	121.8 Å²	121.8	73%	0.734	77%	0.768	S	S	*	*			cis	-116.7	-149	-19	38.3	-18.2	0	0	0	108.7
738	S	36.9	Very low	30.9	Very low	109 Å²	109	123.9 Å²	123.9	76%	0.762	78%	0.775	S	S	*	*			cis	-155	162.9	-1.7	-141.7	0	0	0	0	110.5
739	P	49.4	Very low	32.2	Very low	114 Å²	114	121.7 Å²	121.7	74%	0.74	78%	0.775	S	S	*	*			trans	-120.2	-172.8	-170.3	43.8	-32.5	0	0	0	114.9
740	A	28.4	Very low	32.9	Very low	92 Å²	92	125.3 Å²	125.3	76%	0.76	79%	0.786	S	S	*	*			trans	73	143.2	143.1	0	0	0	0	0	121.1
741	A	26	Very low	33.1	Very low	100 Å²	100	127.7 Å²	127.7	83%	0.826	79%	0.79	S	S	*	*			trans	-115.3	125.1	139.4	0	0	0	0	0	107.8
742	P	42.5	Very low	33.5	Very low	125 Å²	125	125.6 Å²	125.6	81%	0.812	78%	0.781	S	S	*	*			trans	-88.4	157.2	170.6	35.4	-33.1	0	0	0	111
743	G	29.5	Very low	33.4	Very low	77 Å²	77	128.3 Å²	128.3	79%	0.794	78%	0.784	S	S	*	*			trans	-106.9	154	156.9	0	0	0	0	0	110.4
744	S	30.3	Very low	33.3	Very low	124 Å²	124	126.2 Å²	126.2	87%	0.867	78%	0.776	S	S	*	*			trans	-163.1	168.1	156.2	-156.1	0	0	0	0	113.3
745	L	29.1	Very low	33.2	Very low	167 Å²	167	123.1 Å²	123.1	87%	0.874	77%	0.772	S	S	*	*			trans	-73.5	154.8	-175.2	-62.3	151.5	0	0	0	113
746	G	25.5	Very low	33.2	Very low	75 Å²	75	125.9 Å²	125.9	77%	0.773	78%	0.778	S	S	*	*			trans	-151	5.1	-168.6	0	0	0	0	0	122
747	H	26.3	Very low	32.7	Very low	191 Å²	191	129.1 Å²	129.1	88%	0.884	78%	0.775	S	S	*	*			trans	69.9	168.6	167.6	-80.2	43.6	0	0	0	120.4
748	N	33.9	Very low	31.8	Very low	155 Å²	155	130.2 Å²	130.2	83%	0.829	77%	0.771	S	S	*	*			trans	-84.4	179.5	-178.8	-79.1	-57.4	0	0	0	113
749	P	52	Low	31.4	Very low	115 Å²	115	131.5 Å²	131.5	75%	0.747	77%	0.767	S	S	*	*			cis	-136.3	167.7	2.6	31.4	-9	0	0	0	118.3
750	L	34.4	Very low	30.4	Very low	161 Å²	161	130.9 Å²	130.9	84%	0.843	77%	0.766	S	S	*	*			trans	21.2	117.7	142.7	-175.2	69.9	0	0	0	121.7
751	R	27.6	Very low	30.7	Very low	215 Å²	215	133.1 Å²	133.1	81%	0.811	77%	0.77	S	S	*	*			trans	-167.5	152.8	131.9	-114.5	-70.6	-179.1	-175.4	-0.5	112.5
752	E	32.3	Very low	30.8	Very low	142 Å²	142	140 Å²	140	66%	0.664	77%	0.774	S	S	*	*			trans	-88.1	150	169.5	-50.6	155.3	116.8	0	0	110.9
753	T	25.9	Very low	30.4	Very low	123 Å²	123	139.2 Å²	139.2	76%	0.755	77%	0.772	S	S	*	*				167.9	145.8	108.7	32.4	0	0	0	0	114.1
754	S	25.8	Very low	31.3	Very low	97 Å²	97	141.1 Å²	141.1	68%	0.678	77%	0.77	S	S	*	*			trans	50	134.2	139.9	-47.8	0	0	0	0	123.8
755	S	28.7	Very low	31.1	Very low	97 Å²	97	144.3 Å²	144.3	68%	0.678	77%	0.771	S	S	*	*				66.1	144.2	123.3	68.9	0	0	0	0	120.8
756	E	28.6	Very low	31.3	Very low	160 Å²	160	141.4 Å²	141.4	75%	0.748	77%	0.765	S	S	*	*			cis	-171.3	168.7	-1.4	-117.4	177.1	143.1	0	0	110.1
757	F	26.1	Very low	31.8	Very low	159 Å²	159	143.6 Å²	143.6	70%	0.697	77%	0.769	S	S	*	*			trans	65.7	155.3	154	-84.7	-126.1	0	0	0	119.2
758	E	28.7	Very low	32	Very low	137 Å²	137	140.5 Å²	140.5	64%	0.64	77%	0.769	S	S	*	*			cis	-165.5	173.6	-27.6	-132.4	-164.2	162.2	0	0	112.8
759	I	28.6	Very low	32.3	Very low	135 Å²	135	139.9 Å²	139.9	69%	0.692	77%	0.765	S	S	*	*			trans	80.8	131.2	146.5	-76.9	165.3	0	0	0	123.4
760	S	27.4	Very low	31.5	Very low	101 Å²	101	139.9 Å²	139.9	71%	0.706	77%	0.765	S	S	*	*			trans	62.3	98.5	152.5	-73.5	0	0	0	0	125
761	V	36.6	Very low	31.8	Very low	140 Å²	140	141.3 Å²	141.3	85%	0.848	77%	0.765	S	S	*	*				36.5	108.8	109.4	-174.3	0	0	0	0	119
762	R	27.1	Very low	32.3	Very low	244 Å²	244	136.5 Å²	136.5	92%	0.921	76%	0.764	S	S	*	*				-164.6	136.9	110.3	-145.1	172.8	179.9	149.2	-0.7	112.4
763	S	33.7	Very low	32.6	Very low	109 Å²	109	139.9 Å²	139.9	76%	0.762	77%	0.771	S	S	*	*			trans	-80	161.6	165.7	-56.3	0	0	0	0	110.3
764	P	49.2	Very low	33	Very low	116 Å²	116	144.4 Å²	144.4	75%	0.753	77%	0.774	S	S	*	*			cis	-148.4	-166.8	33.4	43.6	-22.4	0	0	0	117.9
765	Q	25.8	Very low	33.7	Very low	191 Å²	191	148.5 Å²	148.5	89%	0.893	78%	0.783	S	S	*	*			trans	84.2	167.4	163.5	-71.2	-173.4	-7.7	0	0	118.9
766	S	33.7	Very low	34.1	Very low	107 Å²	107	152.5 Å²	152.5	75%	0.748	79%	0.788	S	S	*	*			trans	-138.7	136.3	-141.7	53.8	0	0	0	0	113.3
767	S	35.3	Very low	34.8	Very low	121 Å²	121	153.2 Å²	153.2	85%	0.846	79%	0.789	S	S	*	*			trans	177.3	116	135.8	54.8	0	0	0	0	112.4
768	S	31.6	Very low	35.6	Very low	126 Å²	126	148.9 Å²	148.9	88%	0.881	78%	0.783	S	S	*	*			trans	-164.1	161.5	152.5	61.1	0	0	0	0	111.3
769	N	40.1	Very low	36.6	Very low	141 Å²	141	146.5 Å²	146.5	75%	0.754	78%	0.779	S	S	*	*			trans	-101.9	121.2	-163.8	-167.6	-2	0	0	0	112	K771	N769-K771 PolarHBondContact O-N 3.03Å
770	P	34.8	Very low	37.9	Very low	116 Å²	116	144.6 Å²	144.6	75%	0.753	78%	0.775	S	S	*	*			trans	-94.2	82.5	-171	36.1	-34.6	0	0	0	113.1
771	K	39.7	Very low	39	Very low	190 Å²	190	147.5 Å²	147.5	83%	0.826	78%	0.778	S	S	*	*			trans	-133.3	-3.4	176.6	-141.9	171	-177	179	0	117.4	N769	N769-K771 PolarHBondContact O-N 3.03Å
772	S	39.5	Very low	39.7	Very low	115 Å²	115	143 Å²	143	80%	0.804	76%	0.756	S	S	*	*	S	Bend	trans	-115.7	23.2	-173.3	50.8	0	0	0	0	115
773	R	36.9	Very low	41.1	Very low	212 Å²	212	133.4 Å²	133.4	80%	0.8	73%	0.728	S	S	*	*	S	Bend	trans	-107.1	-14.7	-174.1	-170.1	165.5	180	171.1	1.4	115.8
774	W	35.3	Very low	42.5	Very low	218 Å²	218	134.2 Å²	134.2	83%	0.826	72%	0.72	S	S	*	*	S	Bend	trans	-99	-15.4	-166	-66.1	113.7	0	0	0	115.9	F776	W774-F776 VanDerWaalsContact C-N 3.28Å; W774-F776 PolarHBondContact O-N 3.17Å
775	E	40.8	Very low	42.9	Very low	183 Å²	183	134 Å²	134	86%	0.855	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-74.4	-13.1	-174.7	-63.8	179.7	156.9	0	0	114.2	F777	E775-F777 PolarHBondContact O-N 3.25Å
776	F	36.1	Very low	44.7	Very low	181 Å²	181	129.9 Å²	129.9	79%	0.794	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-82.8	-3.5	-174.2	-160.1	-100.8	0	0	0	115.1	W774	W774-F776 VanDerWaalsContact C-N 3.28Å; W774-F776 PolarHBondContact O-N 3.17Å
777	F	43.2	Very low	46.4	Very low	175 Å²	175	131.7 Å²	131.7	77%	0.768	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-125.4	13.3	-173.2	-77	-78.3	0	0	0	115	E775	E775-F777 PolarHBondContact O-N 3.25Å
778	A	44.4	Very low	48.3	Very low	68 Å²	68	131.5 Å²	131.5	56%	0.562	67%	0.667	S	S	*	*			trans	-75.3	129.1	170.8	0	0	0	0	0	110.9
779	P	49	Very low	49.9	Very low	87 Å²	87	130.1 Å²	130.1	57%	0.565	65%	0.647	S	S	*	*			trans	-61.1	138.9	171.8	-23.1	34.4	0	0	0	111.3	E781 A782	P779-E781 VanDerWaalsContact C-N 3.26Å; P779-E781 PolarHBondContact O-N 3.07Å; P779-A782 WeakPolarHBondContact O-CB 3.19Å; P779-A782 PolarHBondContact O-N 3.19Å; P779-A782 VanDerWaalsContact O-N 3.07Å
780	P	55.2	Low	51.4	Low	95 Å²	95	127.5 Å²	127.5	62%	0.617	63%	0.633	S	S	*	*	H	α-helix	trans	-60.8	-33.1	-171.9	22.4	-33.2	0	0	0	113.5	A782 A783 E784	P780-A782 PolarHBondContact O-N 3.22Å; P780-A783 PolarHBondContact O-N 3.11Å; P780-A783 VanDerWaalsContact O-N 3.17Å; P780-E784 PolarHBondContact O-N 3.35Å
781	E	51.5	Low	53.9	Low	162 Å²	162	126.1 Å²	126.1	76%	0.757	62%	0.616	S	S	*	*	H	α-helix	trans	-59.2	-31.7	177.7	-60.2	-178	161.7	0	0	113	P779 K785	P779-E781 VanDerWaalsContact C-N 3.26Å; P779-E781 PolarHBondContact O-N 3.07Å; E781-K785 WeakPolarHBondContact O-CB 3.39Å; E781-K785 PolarHBondContact O-N 3.17Å; E781-K785 VanDerWaalsContact O-N 3.07Å
782	A	50	Low	55.8	Low	47 Å²	47	121.8 Å²	121.8	39%	0.388	60%	0.598	S	S	.	*	H	α-helix	trans	-70.9	-46	176	0	0	0	0	0	111.4	P779 P780 E784 K785 D786	P779-A782 WeakPolarHBondContact O-CB 3.19Å; P779-A782 PolarHBondContact O-N 3.19Å; P779-A782 VanDerWaalsContact O-N 3.07Å; P780-A782 PolarHBondContact O-N 3.22Å; A782-E784 VanDerWaalsContact C-N 3.27Å; A782-E784 PolarHBondContact O-N 3.28Å; A782-K785 PolarHBondContact O-N 2.87Å; A782-D786 PolarHBondContact O-N 3.34Å
783	A	57.8	Low	57.8	Low	41 Å²	41	122.9 Å²	122.9	34%	0.339	59%	0.585	S	S	.	*	H	α-helix	trans	-69.1	-23.1	179.4	0	0	0	0	0	113.3	P780 R787	P780-A783 PolarHBondContact O-N 3.11Å; P780-A783 VanDerWaalsContact O-N 3.17Å; A783-R787 WeakPolarHBondContact O-CG 3.36Å; A783-R787 PolarHBondContact O-N 3.07Å; A783-R787 PolarHBondContact O-NE 3.38Å
784	E	62.8	Low	59.8	Low	126 Å²	126	118.1 Å²	118.1	59%	0.589	57%	0.572	S	S	*	*	H	α-helix	trans	-78.5	-39.8	169.5	-71.6	-175.9	172.8	0	0	112.2	P780 A782 R787 H788	P780-E784 PolarHBondContact O-N 3.35Å; A782-E784 VanDerWaalsContact C-N 3.27Å; A782-E784 PolarHBondContact O-N 3.28Å; E784-R787 VanDerWaalsContact CG-NH2 3.35Å; E784-R787 PolarHBondContact O-N 3.29Å; E784-H788 PolarHBondContact O-N 2.9Å
785	K	57.7	Low	62.3	Low	113 Å²	113	114.3 Å²	114.3	49%	0.491	56%	0.557	S	S	.	*	H	α-helix	trans	-62.4	-46.5	174.4	-173.1	176.8	173.8	-68.4	0	112.2	E781 A782 R787 H788 E789	E781-K785 WeakPolarHBondContact O-CB 3.39Å; E781-K785 PolarHBondContact O-N 3.17Å; E781-K785 VanDerWaalsContact O-N 3.07Å; A782-K785 PolarHBondContact O-N 2.87Å; K785-R787 VanDerWaalsContact C-N 3.31Å; K785-R787 PolarHBondContact O-N 3.23Å; K785-H788 PolarHBondContact O-N 3.48Å; K785-E789 VanDerWaalsContact CE-OE1 3.25Å; K785-E789 WeakPolarHBondContact CE-OE1 3.48Å; K785-E789 IonicContact NZ-OE1 3.32Å; K785-E789 PolarHBondContact NZ-OE1 2.89Å; K785-E789 IonicContact NZ-OE2 2.66Å; K785-E789 PolarHBondContact NZ-OE2 2.91Å; K785-E789 PolarHBondContact O-N 3.13Å
786	D	63.6	Low	64.4	Low	103 Å²	103	110.3 Å²	110.3	55%	0.551	54%	0.539	S	S	*	.	H	α-helix	trans	-62.8	-37	177.5	-76	9	0	0	0	112	A782 E789 N790	A782-D786 PolarHBondContact O-N 3.34Å; D786-E789 PolarHBondContact O-N 2.84Å; D786-N790 VanDerWaalsContact O-CB 3.26Å; D786-N790 WeakPolarHBondContact O-CB 3.36Å; D786-N790 PolarHBondContact O-N 3.34Å
787	R	69.3	Low	65.9	Low	146 Å²	146	106 Å²	106	55%	0.551	52%	0.521	S	S	*	.	H	α-helix	trans	-66.1	-43.7	173.1	-83	178.7	-71.6	-180	4.2	111.9	A783 E784 K785 E789 N790 E791	A783-R787 WeakPolarHBondContact O-CG 3.36Å; A783-R787 PolarHBondContact O-N 3.07Å; A783-R787 PolarHBondContact O-NE 3.38Å; E784-R787 VanDerWaalsContact CG-NH2 3.35Å; E784-R787 PolarHBondContact O-N 3.29Å; K785-R787 VanDerWaalsContact C-N 3.31Å; K785-R787 PolarHBondContact O-N 3.23Å; R787-E789 VanDerWaalsContact C-N 3.34Å; R787-E789 PolarHBondContact O-N 3.48Å; R787-N790 PolarHBondContact O-N 2.96Å; R787-E791 WeakPolarHBondContact O-CB 3.43Å; R787-E791 WeakPolarHBondContact O-CG 3.46Å; R787-E791 PolarHBondContact O-N 3.49Å
788	H	74.4	Confident	68.2	Low	117 Å²	117	104.4 Å²	104.4	54%	0.542	52%	0.516	S	S	.	.	H	α-helix	trans	-65.1	-36.2	176.7	-175.6	-90.6	0	0	0	112.6	E784 K785 K792	E784-H788 PolarHBondContact O-N 2.9Å; K785-H788 PolarHBondContact O-N 3.48Å; H788-K792 WeakPolarHBondContact O-CB 3.34Å; H788-K792 PolarHBondContact O-N 2.95Å
789	E	65.6	Low	70.7	Confident	96 Å²	96	105.9 Å²	105.9	45%	0.449	51%	0.509	S	S	.	.	H	α-helix	trans	-72.1	-38.6	175.4	-73.9	178.4	179.1	0	0	112.2	K785 D786 R787 K792 Y793	K785-E789 VanDerWaalsContact CE-OE1 3.25Å; K785-E789 WeakPolarHBondContact CE-OE1 3.48Å; K785-E789 IonicContact NZ-OE1 3.32Å; K785-E789 PolarHBondContact NZ-OE1 2.89Å; K785-E789 IonicContact NZ-OE2 2.66Å; K785-E789 PolarHBondContact NZ-OE2 2.91Å; K785-E789 PolarHBondContact O-N 3.13Å; D786-E789 PolarHBondContact O-N 2.84Å; R787-E789 VanDerWaalsContact C-N 3.34Å; R787-E789 PolarHBondContact O-N 3.48Å; E789-K792 PolarHBondContact O-N 2.81Å; E789-Y793 WeakPolarHBondContact O-CB 3.41Å; E789-Y793 PolarHBondContact O-N 2.73Å
790	N	71.8	Confident	72.6	Confident	87 Å²	87	107 Å²	107	47%	0.465	51%	0.51	S	S	.	.	H	α-helix	trans	-65.9	-42.3	172	-173.6	14.5	0	0	0	112.3	D786 R787 K792 Y793 Q794	D786-N790 VanDerWaalsContact O-CB 3.26Å; D786-N790 WeakPolarHBondContact O-CB 3.36Å; D786-N790 PolarHBondContact O-N 3.34Å; R787-N790 PolarHBondContact O-N 2.96Å; N790-K792 VanDerWaalsContact C-N 3.34Å; N790-K792 PolarHBondContact O-N 3.47Å; N790-Y793 PolarHBondContact O-N 3.42Å; N790-Q794 WeakPolarHBondContact O-CG 3.26Å; N790-Q794 PolarHBondContact O-N 3.11Å; N790-Q794 PolarHBondContact OD1-NE2 3.36Å; N790-Q794 VanDerWaalsContact OD1-NE2 3.07Å
791	E	87.2	Confident	74.3	Confident	87 Å²	87	109.4 Å²	109.4	41%	0.407	51%	0.511	S	S	.	.	H	α-helix	trans	-62	-40.6	172.2	-77	-172.9	-166.6	0	0	112.2	R787 Y793 Q794 R795	R787-E791 WeakPolarHBondContact O-CB 3.43Å; R787-E791 WeakPolarHBondContact O-CG 3.46Å; R787-E791 PolarHBondContact O-N 3.49Å; E791-Y793 VanDerWaalsContact C-N 3.35Å; E791-Q794 PolarHBondContact O-N 3.27Å; E791-R795 VanDerWaalsContact O-CG 3.32Å; E791-R795 WeakPolarHBondContact O-CG 3.41Å; E791-R795 PolarHBondContact O-N 3.1Å; E791-R795 IonicContact OE2-CZ 3.3Å; E791-R795 IonicContact OE2-NH1 3.61Å; E791-R795 PolarHBondContact OE2-NH1 2.94Å; E791-R795 IonicContact OE2-NH2 3.6Å; E791-R795 PolarHBondContact OE2-NH2 3.31Å
792	K	79.8	Confident	76.3	Confident	99 Å²	99	106.1 Å²	106.1	43%	0.43	50%	0.496	S	S	.	.	H	α-helix	trans	-62.3	-43.5	175.2	-179.7	179.1	173.9	-64.7	0	110.9	H788 E789 N790 R795 E796	H788-K792 WeakPolarHBondContact O-CB 3.34Å; H788-K792 PolarHBondContact O-N 2.95Å; E789-K792 PolarHBondContact O-N 2.81Å; N790-K792 VanDerWaalsContact C-N 3.34Å; N790-K792 PolarHBondContact O-N 3.47Å; K792-R795 PolarHBondContact O-N 3.25Å; K792-E796 WeakPolarHBondContact CE-OE1 3.44Å; K792-E796 VanDerWaalsContact NZ-CD 3.26Å; K792-E796 IonicContact NZ-OE1 2.89Å; K792-E796 PolarHBondContact NZ-OE1 3.29Å; K792-E796 IonicContact NZ-OE2 3.45Å; K792-E796 PolarHBondContact NZ-OE2 3.29Å; K792-E796 WeakPolarHBondContact O-CB 3.3Å; K792-E796 WeakPolarHBondContact O-CG 3.41Å; K792-E796 PolarHBondContact O-N 3.05Å
793	Y	81.1	Confident	78.3	Confident	138 Å²	138	107.8 Å²	107.8	54%	0.541	50%	0.495	S	S	.	.	H	α-helix	trans	-61.3	-42.8	174.9	180	-107	0	0	0	112.2	E789 N790 E791 E796 Q797	E789-Y793 WeakPolarHBondContact O-CB 3.41Å; E789-Y793 PolarHBondContact O-N 2.73Å; N790-Y793 PolarHBondContact O-N 3.42Å; E791-Y793 VanDerWaalsContact C-N 3.35Å; Y793-E796 PolarHBondContact O-N 2.91Å; Y793-Q797 HydrophobicContact CD1-CG 4.43Å; Y793-Q797 HydrophobicContact CE1-CG 4.04Å; Y793-Q797 HydrophobicContact CE2-CG 4.27Å; Y793-Q797 WeakPolarHBondContact O-CG 3.49Å; Y793-Q797 PolarHBondContact O-N 2.93Å; Y793-Q797 PolarHBondContact OH-NE2 2.67Å; Y793-Q797 VanDerWaalsContact OH-NE2 3.13Å
794	Q	78.6	Confident	79.8	Confident	111 Å²	111	113.4 Å²	113.4	52%	0.519	51%	0.508	S	S	.	.	H	α-helix	trans	-63.8	-42.6	175.7	-71.3	174.6	29.2	0	0	112.2	N790 E791 E796 Q797 E798	N790-Q794 WeakPolarHBondContact O-CG 3.26Å; N790-Q794 PolarHBondContact O-N 3.11Å; N790-Q794 PolarHBondContact OD1-NE2 3.36Å; N790-Q794 VanDerWaalsContact OD1-NE2 3.07Å; E791-Q794 PolarHBondContact O-N 3.27Å; Q794-E796 VanDerWaalsContact C-N 3.32Å; Q794-E796 PolarHBondContact O-N 3.47Å; Q794-Q797 PolarHBondContact O-N 2.98Å; Q794-E798 WeakPolarHBondContact O-CB 3.47Å; Q794-E798 PolarHBondContact O-N 3.23Å
795	R	87.7	Confident	81.3	Confident	139 Å²	139	111.8 Å²	111.8	53%	0.525	50%	0.5	S	S	.	.	H	α-helix	trans	-64.3	-35	174	-70.5	171.4	-175.2	121.5	11	112.4	E791 K792 K799	E791-R795 VanDerWaalsContact O-CG 3.32Å; E791-R795 WeakPolarHBondContact O-CG 3.41Å; E791-R795 PolarHBondContact O-N 3.1Å; E791-R795 IonicContact OE2-CZ 3.3Å; E791-R795 IonicContact OE2-NH1 3.61Å; E791-R795 PolarHBondContact OE2-NH1 2.94Å; E791-R795 IonicContact OE2-NH2 3.6Å; E791-R795 PolarHBondContact OE2-NH2 3.31Å; K792-R795 PolarHBondContact O-N 3.25Å; R795-K799 VanDerWaalsContact O-CB 3.29Å; R795-K799 WeakPolarHBondContact O-CB 3.29Å; R795-K799 PolarHBondContact O-N 3.39Å
796	E	86.6	Confident	82.9	Confident	99 Å²	99	111.2 Å²	111.2	46%	0.463	50%	0.498	S	S	.	.	H	α-helix	trans	-70.9	-39.2	175.2	-78	173.1	177	0	0	111.9	K792 Y793 Q794 K799 L800	K792-E796 WeakPolarHBondContact CE-OE1 3.44Å; K792-E796 VanDerWaalsContact NZ-CD 3.26Å; K792-E796 IonicContact NZ-OE1 2.89Å; K792-E796 PolarHBondContact NZ-OE1 3.29Å; K792-E796 IonicContact NZ-OE2 3.45Å; K792-E796 PolarHBondContact NZ-OE2 3.29Å; K792-E796 WeakPolarHBondContact O-CB 3.3Å; K792-E796 WeakPolarHBondContact O-CG 3.41Å; K792-E796 PolarHBondContact O-N 3.05Å; Y793-E796 PolarHBondContact O-N 2.91Å; Q794-E796 VanDerWaalsContact C-N 3.32Å; Q794-E796 PolarHBondContact O-N 3.47Å; E796-K799 PolarHBondContact O-N 2.88Å; E796-L800 WeakPolarHBondContact O-CB 3.32Å; E796-L800 PolarHBondContact O-N 3.27Å
797	Q	67.5	Low	84	Confident	91 Å²	91	108.7 Å²	108.7	43%	0.425	49%	0.491	S	S	.	.	H	α-helix	trans	-64.3	-42.9	171.4	-72.8	-69.2	-22	0	0	112.3	Y793 Q794 L800 K801	Y793-Q797 HydrophobicContact CD1-CG 4.43Å; Y793-Q797 HydrophobicContact CE1-CG 4.04Å; Y793-Q797 HydrophobicContact CE2-CG 4.27Å; Y793-Q797 WeakPolarHBondContact O-CG 3.49Å; Y793-Q797 PolarHBondContact O-N 2.93Å; Y793-Q797 PolarHBondContact OH-NE2 2.67Å; Y793-Q797 VanDerWaalsContact OH-NE2 3.13Å; Q794-Q797 PolarHBondContact O-N 2.98Å; Q797-L800 PolarHBondContact O-N 2.93Å; Q797-K801 WeakPolarHBondContact O-CB 3.41Å; Q797-K801 PolarHBondContact O-N 2.7Å
798	E	91.4	Very high	84.5	Confident	141 Å²	141	107.1 Å²	107.1	66%	0.659	49%	0.49	S	S	*	.	H	α-helix	trans	-64.1	-42.3	175.8	-175.7	169.1	-134.4	0	0	111.7	Q794 K801 E802	Q794-E798 WeakPolarHBondContact O-CB 3.47Å; Q794-E798 PolarHBondContact O-N 3.23Å; E798-K801 WeakPolarHBondContact O-CB 3.05Å; E798-K801 PolarHBondContact O-N 2.91Å; E798-E802 PolarHBondContact O-N 2.81Å
799	K	95.6	Very high	85.4	Confident	98 Å²	98	109 Å²	109	43%	0.426	49%	0.492	S	S	.	.	H	α-helix	trans	-61.5	-42.7	172.6	-179.9	-179.3	177.3	-69	0	112.2	R795 E796 K801 E802 E803	R795-K799 VanDerWaalsContact O-CB 3.29Å; R795-K799 WeakPolarHBondContact O-CB 3.29Å; R795-K799 PolarHBondContact O-N 3.39Å; E796-K799 PolarHBondContact O-N 2.88Å; K799-K801 PolarHBondContact O-N 3.33Å; K799-E802 WeakPolarHBondContact O-CB 3.38Å; K799-E802 PolarHBondContact O-N 2.9Å; K799-E803 WeakPolarHBondContact CE-OE1 3.44Å; K799-E803 IonicContact NZ-OE1 2.69Å; K799-E803 PolarHBondContact NZ-OE1 3.47Å; K799-E803 IonicContact NZ-OE2 2.79Å; K799-E803 PolarHBondContact NZ-OE2 3.1Å; K799-E803 PolarHBondContact O-N 2.89Å
800	L	89.2	Confident	86.7	Confident	112 Å²	112	109.6 Å²	109.6	59%	0.586	50%	0.495	S	S	*	.	H	α-helix	trans	-63.9	-34.4	178	-143.1	72.8	0	0	0	111.3	E796 Q797 W804	E796-L800 WeakPolarHBondContact O-CB 3.32Å; E796-L800 PolarHBondContact O-N 3.27Å; Q797-L800 PolarHBondContact O-N 2.93Å; L800-W804 VanDerWaalsContact O-CB 3.3Å; L800-W804 WeakPolarHBondContact O-CB 3.35Å; L800-W804 PolarHBondContact O-N 3.34Å
801	K	91.8	Very high	87.7	Confident	144 Å²	144	109.1 Å²	109.1	63%	0.626	50%	0.495	S	S	*	.	H	α-helix	trans	-71.2	-40.1	173	-173.1	-172.4	171.9	-162.3	0	112.6	Q797 E798 K799 E803 W804 E805	Q797-K801 WeakPolarHBondContact O-CB 3.41Å; Q797-K801 PolarHBondContact O-N 2.7Å; E798-K801 WeakPolarHBondContact O-CB 3.05Å; E798-K801 PolarHBondContact O-N 2.91Å; K799-K801 PolarHBondContact O-N 3.33Å; K801-E803 VanDerWaalsContact C-N 3.34Å; K801-W804 PolarHBondContact O-N 2.71Å; K801-E805 WeakPolarHBondContact O-CB 3.24Å; K801-E805 PolarHBondContact O-N 2.79Å
802	E	94	Very high	87.8	Confident	93 Å²	93	107.2 Å²	107.2	44%	0.435	49%	0.494	S	S	.	.	H	α-helix	trans	-57.9	-47.4	171.2	-174.7	-167.3	-142.6	0	0	110.3	R655 E798 K799 E805 K806	R655-E802 IonicContact CZ-OE2 2.7Å; R655-E802 IonicContact NH1-OE1 2.67Å; R655-E802 PolarHBondContact NH1-OE1 3.3Å; R655-E802 IonicContact NH1-OE2 3.35Å; R655-E802 PolarHBondContact NH1-OE2 3.09Å; R655-E802 VanDerWaalsContact NH1-OE2 3.09Å; R655-E802 IonicContact NH2-OE1 3.76Å; R655-E802 IonicContact NH2-OE2 2.7Å; R655-E802 PolarHBondContact NH2-OE2 2.89Å; E798-E802 PolarHBondContact O-N 2.81Å; K799-E802 WeakPolarHBondContact O-CB 3.38Å; K799-E802 PolarHBondContact O-N 2.9Å; E802-E805 PolarHBondContact O-N 3.06Å; E802-K806 WeakPolarHBondContact O-CB 3.32Å; E802-K806 PolarHBondContact O-N 2.85Å
803	E	91.8	Very high	88.4	Confident	82 Å²	82	107.4 Å²	107.4	38%	0.383	50%	0.497	S	S	.	.	H	α-helix	trans	-69.4	-34.9	-179.5	-72.5	174.7	157.7	0	0	112.3	K799 K801 A807	K799-E803 WeakPolarHBondContact CE-OE1 3.44Å; K799-E803 IonicContact NZ-OE1 2.69Å; K799-E803 PolarHBondContact NZ-OE1 3.47Å; K799-E803 IonicContact NZ-OE2 2.79Å; K799-E803 PolarHBondContact NZ-OE2 3.1Å; K799-E803 PolarHBondContact O-N 2.89Å; K801-E803 VanDerWaalsContact C-N 3.34Å; E803-A807 WeakPolarHBondContact O-CB 3.45Å; E803-A807 PolarHBondContact O-N 2.98Å
804	W	89.3	Confident	88.6	Confident	160 Å²	160	107.3 Å²	107.3	61%	0.606	50%	0.501	S	S	*	.	H	α-helix	trans	-68.6	-44	173	-179.7	86.2	0	0	0	113	L800 K801 K806 A807 Q808	L800-W804 VanDerWaalsContact O-CB 3.3Å; L800-W804 WeakPolarHBondContact O-CB 3.35Å; L800-W804 PolarHBondContact O-N 3.34Å; K801-W804 PolarHBondContact O-N 2.71Å; W804-K806 VanDerWaalsContact C-N 3.33Å; W804-A807 PolarHBondContact O-N 3.3Å; W804-Q808 HydrophobicContact CH2-CG 4.08Å; W804-Q808 HydrophobicContact CZ2-CG 4.04Å; W804-Q808 HydrophobicContact CZ3-CG 4.33Å; W804-Q808 PolarHBondContact O-N 3.08Å
805	E	93.1	Very high	88.9	Confident	92 Å²	92	107.8 Å²	107.8	43%	0.43	50%	0.503	S	S	.	.	H	α-helix	trans	-66.4	-37.8	176.3	-162.8	-157.6	116.3	0	0	110.9	K801 E802 A807 Q808 R809	K801-E805 WeakPolarHBondContact O-CB 3.24Å; K801-E805 PolarHBondContact O-N 2.79Å; E802-E805 PolarHBondContact O-N 3.06Å; E805-A807 VanDerWaalsContact C-N 3.35Å; E805-Q808 PolarHBondContact O-N 3.22Å; E805-R809 WeakPolarHBondContact O-CB 3.44Å; E805-R809 PolarHBondContact O-N 3.46Å; E805-R809 IonicContact OE1-CZ 3.16Å; E805-R809 IonicContact OE1-NH2 2.74Å; E805-R809 PolarHBondContact OE1-NH2 2.66Å
806	K	92.6	Very high	89.1	Confident	101 Å²	101	109.1 Å²	109.1	44%	0.439	51%	0.508	S	S	.	.	H	α-helix	trans	-60	-45.3	171.6	-170.2	-164.8	166.8	-157.5	0	111	E802 W804 Q808 R809 E810	E802-K806 WeakPolarHBondContact O-CB 3.32Å; E802-K806 PolarHBondContact O-N 2.85Å; W804-K806 VanDerWaalsContact C-N 3.33Å; K806-Q808 PolarHBondContact O-N 3.4Å; K806-R809 WeakPolarHBondContact O-CB 3.33Å; K806-R809 PolarHBondContact O-N 2.97Å; K806-R809 VanDerWaalsContact O-N 3.08Å; K806-E810 IonicContact NZ-OE2 3.91Å; K806-E810 WeakPolarHBondContact O-CB 3.41Å; K806-E810 PolarHBondContact O-N 2.9Å
807	A	86.6	Confident	89.3	Confident	49 Å²	49	108.5 Å²	108.5	41%	0.405	50%	0.504	S	S	.	.	H	α-helix	trans	-62.5	-39.5	177.6	0	0	0	0	0	112.6	E803 W804 E805 R809 E810 V811	E803-A807 WeakPolarHBondContact O-CB 3.45Å; E803-A807 PolarHBondContact O-N 2.98Å; W804-A807 PolarHBondContact O-N 3.3Å; E805-A807 VanDerWaalsContact C-N 3.35Å; A807-R809 VanDerWaalsContact C-N 3.31Å; A807-R809 PolarHBondContact O-N 2.69Å; A807-E810 PolarHBondContact O-N 2.98Å; A807-V811 WeakPolarHBondContact O-CG2 3.48Å; A807-V811 PolarHBondContact O-N 3.41Å
808	Q	79.8	Confident	90.2	Very high	113 Å²	113	111.3 Å²	111.3	53%	0.528	51%	0.512	S	S	.	.	H	α-helix	trans	-61.2	-39.8	170.7	-75.5	-143.2	-68.2	0	0	112.4	W804 E805 K806 V811 A812	W804-Q808 HydrophobicContact CH2-CG 4.08Å; W804-Q808 HydrophobicContact CZ2-CG 4.04Å; W804-Q808 HydrophobicContact CZ3-CG 4.33Å; W804-Q808 PolarHBondContact O-N 3.08Å; E805-Q808 PolarHBondContact O-N 3.22Å; K806-Q808 PolarHBondContact O-N 3.4Å; Q808-V811 PolarHBondContact O-N 2.92Å; Q808-A812 WeakPolarHBondContact O-CB 3.1Å; Q808-A812 PolarHBondContact O-N 3.25Å
809	R	92.9	Very high	89.9	Confident	156 Å²	156	109.4 Å²	109.4	59%	0.589	50%	0.503	S	S	*	.	H	α-helix	trans	-67.8	-37.6	179.3	-161.8	-177.5	-58.7	-178.5	2.5	112.1	E805 K806 A807 A812 E813	E805-R809 WeakPolarHBondContact O-CB 3.44Å; E805-R809 PolarHBondContact O-N 3.46Å; E805-R809 IonicContact OE1-CZ 3.16Å; E805-R809 IonicContact OE1-NH2 2.74Å; E805-R809 PolarHBondContact OE1-NH2 2.66Å; K806-R809 WeakPolarHBondContact O-CB 3.33Å; K806-R809 PolarHBondContact O-N 2.97Å; K806-R809 VanDerWaalsContact O-N 3.08Å; A807-R809 VanDerWaalsContact C-N 3.31Å; A807-R809 PolarHBondContact O-N 2.69Å; R809-A812 PolarHBondContact O-N 3.09Å; R809-E813 WeakPolarHBondContact O-CB 3.3Å; R809-E813 PolarHBondContact O-N 3.35Å
810	E	92.2	Very high	89.6	Confident	109 Å²	109	109.6 Å²	109.6	51%	0.509	51%	0.505	S	S	.	.	H	α-helix	trans	-64.6	-45.9	175.4	-163	164.3	147.9	0	0	110.7	K806 A807 A812 E813 E814	K806-E810 IonicContact NZ-OE2 3.91Å; K806-E810 WeakPolarHBondContact O-CB 3.41Å; K806-E810 PolarHBondContact O-N 2.9Å; A807-E810 PolarHBondContact O-N 2.98Å; E810-A812 PolarHBondContact O-N 2.79Å; E810-E813 WeakPolarHBondContact O-CB 3.45Å; E810-E813 PolarHBondContact O-N 3.48Å; E810-E813 VanDerWaalsContact O-N 3.09Å; E810-E814 PolarHBondContact O-N 3.04Å
811	V	92.3	Very high	89.4	Confident	77 Å²	77	108.7 Å²	108.7	47%	0.467	50%	0.498	S	S	.	.	H	α-helix	trans	-60.1	-44.7	172.3	171.7	0	0	0	0	111.8	A807 Q808 E813 E814 E815	A807-V811 WeakPolarHBondContact O-CG2 3.48Å; A807-V811 PolarHBondContact O-N 3.41Å; Q808-V811 PolarHBondContact O-N 2.92Å; V811-E813 PolarHBondContact O-N 2.91Å; V811-E814 PolarHBondContact O-N 2.85Å; V811-E815 HydrophobicContact CG1-CG 4.43Å; V811-E815 WeakPolarHBondContact O-CG 3.42Å; V811-E815 PolarHBondContact O-N 2.94Å
812	A	90.5	Very high	89	Confident	47 Å²	47	105.7 Å²	105.7	39%	0.388	49%	0.486	S	S	.	.	H	α-helix	trans	-70.5	-10.8	177.1	0	0	0	0	0	114	Q808 R809 E810	Q808-A812 WeakPolarHBondContact O-CB 3.1Å; Q808-A812 PolarHBondContact O-N 3.25Å; R809-A812 PolarHBondContact O-N 3.09Å; E810-A812 PolarHBondContact O-N 2.79Å
813	E	92.4	Very high	88.4	Confident	103 Å²	103	107.4 Å²	107.4	48%	0.481	49%	0.489	S	S	.	.	H	α-helix	trans	-91.5	-39.8	170.3	-165.7	172.5	149.5	0	0	111	R809 E810 V811 R816 K817	R809-E813 WeakPolarHBondContact O-CB 3.3Å; R809-E813 PolarHBondContact O-N 3.35Å; E810-E813 WeakPolarHBondContact O-CB 3.45Å; E810-E813 PolarHBondContact O-N 3.48Å; E810-E813 VanDerWaalsContact O-N 3.09Å; V811-E813 PolarHBondContact O-N 2.91Å; E813-R816 WeakPolarHBondContact O-CB 3.35Å; E813-R816 PolarHBondContact O-N 2.76Å; E813-K817 PolarHBondContact O-N 2.78Å
814	E	85.1	Confident	87.9	Confident	137 Å²	137	109.5 Å²	109.5	64%	0.64	49%	0.493	S	S	*	.	H	α-helix	trans	-62.2	-44	169.6	-74.1	-158.4	134.9	0	0	112.4	E810 V811 R816 K817 Y818	E810-E814 PolarHBondContact O-N 3.04Å; V811-E814 PolarHBondContact O-N 2.85Å; E814-R816 PolarHBondContact O-N 3.16Å; E814-K817 PolarHBondContact O-N 3.24Å; E814-Y818 WeakPolarHBondContact O-CB 3.35Å; E814-Y818 PolarHBondContact O-N 3.17Å
815	E	85.4	Confident	87.5	Confident	120 Å²	120	106 Å²	106	56%	0.561	49%	0.485	S	S	*	.	H	α-helix	trans	-58.8	-36.2	173.7	-74.6	-178.9	161	0	0	111.5	V811 H819	V811-E815 HydrophobicContact CG1-CG 4.43Å; V811-E815 WeakPolarHBondContact O-CG 3.42Å; V811-E815 PolarHBondContact O-N 2.94Å; E815-H819 PolarHBondContact O-CD2 3.11Å; E815-H819 PolarHBondContact O-N 3.39Å
816	R	91.6	Very high	86.6	Confident	167 Å²	167	106.8 Å²	106.8	63%	0.63	49%	0.492	S	S	*	.	H	α-helix	trans	-72.2	-44.1	176.2	-167.4	-169	-48.5	-176.9	8.2	112	E813 E814 Y818 H819 E820	E813-R816 WeakPolarHBondContact O-CB 3.35Å; E813-R816 PolarHBondContact O-N 2.76Å; E814-R816 PolarHBondContact O-N 3.16Å; R816-Y818 VanDerWaalsContact C-N 3.29Å; R816-Y818 PolarHBondContact O-N 2.84Å; R816-H819 PolarHBondContact O-N 3.29Å; R816-E820 WeakPolarHBondContact O-CB 3.05Å; R816-E820 PolarHBondContact O-N 3.39Å
817	K	91.2	Very high	85.6	Confident	87 Å²	87	109.2 Å²	109.2	38%	0.378	51%	0.505	S	S	.	.	H	α-helix	trans	-58.7	-42.7	173.1	-79.8	-178.1	167	-169.8	0	110.9	E661 E813 E814 E820 E821	E661-K817 IonicContact OE1-NZ 3.63Å; E661-K817 PolarHBondContact OE1-NZ 3.32Å; E661-K817 IonicContact OE2-NZ 3.79Å; E661-K817 PolarHBondContact OE2-NZ 2.97Å; E813-K817 PolarHBondContact O-N 2.78Å; E814-K817 PolarHBondContact O-N 3.24Å; K817-E820 WeakPolarHBondContact O-CB 3.14Å; K817-E820 PolarHBondContact O-N 3.29Å; K817-E821 WeakPolarHBondContact O-CB 3.3Å; K817-E821 PolarHBondContact O-N 2.75Å
818	Y	84.8	Confident	84.6	Confident	149 Å²	149	112.9 Å²	112.9	58%	0.584	51%	0.514	S	S	*	.	H	α-helix	trans	-59.3	-49.6	175.1	177.5	-92.5	0	0	0	111.5	E814 R816 E820 E821 E822	E814-Y818 WeakPolarHBondContact O-CB 3.35Å; E814-Y818 PolarHBondContact O-N 3.17Å; R816-Y818 VanDerWaalsContact C-N 3.29Å; R816-Y818 PolarHBondContact O-N 2.84Å; Y818-E820 VanDerWaalsContact C-N 3.28Å; Y818-E820 PolarHBondContact O-N 2.83Å; Y818-E821 PolarHBondContact O-N 3.02Å; Y818-E822 VanDerWaalsContact O-CB 3.24Å; Y818-E822 WeakPolarHBondContact O-CB 3.43Å; Y818-E822 PolarHBondContact O-N 2.97Å
819	H	85.8	Confident	83.9	Confident	101 Å²	101	113 Å²	113	47%	0.468	52%	0.522	S	S	.	.	H	α-helix	trans	-70.3	-19.9	176.2	-71.3	-50.4	0	0	0	114.2	E815 R816 E822 R823	E815-H819 PolarHBondContact O-CD2 3.11Å; E815-H819 PolarHBondContact O-N 3.39Å; R816-H819 PolarHBondContact O-N 3.29Å; H819-E822 IonicContact CE1-OE2 3.35Å; H819-E822 IonicContact CG-OE2 3.4Å; H819-E822 IonicContact ND1-OE2 2.74Å; H819-E822 PolarHBondContact ND1-OE2 3.1Å; H819-R823 WeakPolarHBondContact O-CG 3.47Å; H819-R823 PolarHBondContact O-N 3.39Å; H819-R823 PolarHBondContact O-NE 2.74Å; H819-R823 VanDerWaalsContact O-NE 3.13Å
820	E	89.5	Confident	82.3	Confident	103 Å²	103	110.9 Å²	110.9	48%	0.481	53%	0.526	S	S	.	.	H	α-helix	trans	-76.7	-42.5	170.1	-170	113.4	-97.3	0	0	111.5	R816 K817 Y818 R823 R824	R816-E820 WeakPolarHBondContact O-CB 3.05Å; R816-E820 PolarHBondContact O-N 3.39Å; K817-E820 WeakPolarHBondContact O-CB 3.14Å; K817-E820 PolarHBondContact O-N 3.29Å; Y818-E820 VanDerWaalsContact C-N 3.28Å; Y818-E820 PolarHBondContact O-N 2.83Å; E820-R823 VanDerWaalsContact CD-NH2 3.34Å; E820-R823 PolarHBondContact O-N 2.92Å; E820-R823 IonicContact OE1-CZ 3.17Å; E820-R823 IonicContact OE1-NH1 2.75Å; E820-R823 PolarHBondContact OE1-NH1 2.99Å; E820-R823 IonicContact OE1-NH2 2.68Å; E820-R823 PolarHBondContact OE1-NH2 3.37Å; E820-R824 WeakPolarHBondContact O-CB 3.49Å; E820-R824 PolarHBondContact O-N 3.45Å
821	E	84.2	Confident	80	Confident	93 Å²	93	113 Å²	113	44%	0.435	54%	0.538	S	S	.	.	H	α-helix	trans	-71.3	-36	175.2	-176.7	150.7	-113.9	0	0	112	K817 Y818 R823 R824 I825	K817-E821 WeakPolarHBondContact O-CB 3.3Å; K817-E821 PolarHBondContact O-N 2.75Å; Y818-E821 PolarHBondContact O-N 3.02Å; E821-R823 VanDerWaalsContact C-N 3.34Å; E821-R823 PolarHBondContact O-N 3.25Å; E821-R824 PolarHBondContact O-N 2.92Å; E821-R824 IonicContact OE1-CZ 2.71Å; E821-R824 IonicContact OE1-NH1 2.83Å; E821-R824 PolarHBondContact OE1-NH1 3.31Å; E821-R824 IonicContact OE1-NH2 3.99Å; E821-R824 PolarHBondContact OE1-NH2 3.1Å; E821-I825 HydrophobicContact CG-CD1 3.81Å; E821-I825 HydrophobicContact CG-CG1 4.29Å; E821-I825 WeakPolarHBondContact O-CB 3.46Å; E821-I825 WeakPolarHBondContact O-CD1 3.2Å; E821-I825 WeakPolarHBondContact O-CG1 3.45Å; E821-I825 PolarHBondContact O-N 2.88Å
822	E	84.4	Confident	78.1	Confident	80 Å²	80	114.8 Å²	114.8	37%	0.374	55%	0.551	S	S	.	*	H	α-helix	trans	-58.2	-45.1	169.9	-176.4	173.5	-143.5	0	0	110.9	Y818 H819 L826	Y818-E822 VanDerWaalsContact O-CB 3.24Å; Y818-E822 WeakPolarHBondContact O-CB 3.43Å; Y818-E822 PolarHBondContact O-N 2.97Å; H819-E822 IonicContact CE1-OE2 3.35Å; H819-E822 IonicContact CG-OE2 3.4Å; H819-E822 IonicContact ND1-OE2 2.74Å; H819-E822 PolarHBondContact ND1-OE2 3.1Å; E822-L826 HydrophobicContact CG-CD1 4.41Å; E822-L826 WeakPolarHBondContact O-CB 3.42Å; E822-L826 WeakPolarHBondContact O-CD1 3.42Å; E822-L826 VanDerWaalsContact O-CG 3.3Å; E822-L826 WeakPolarHBondContact O-CG 3.29Å; E822-L826 PolarHBondContact O-N 3.43Å
823	R	80.3	Confident	75.6	Confident	129 Å²	129	120.6 Å²	120.6	49%	0.487	58%	0.575	S	S	.	*	H	α-helix	trans	-64.1	-44.2	171.2	-80.8	-177.7	-70.5	113	-8.3	112.7	H819 E820 E821 I825 L826 E827	H819-R823 WeakPolarHBondContact O-CG 3.47Å; H819-R823 PolarHBondContact O-N 3.39Å; H819-R823 PolarHBondContact O-NE 2.74Å; H819-R823 VanDerWaalsContact O-NE 3.13Å; E820-R823 VanDerWaalsContact CD-NH2 3.34Å; E820-R823 PolarHBondContact O-N 2.92Å; E820-R823 IonicContact OE1-CZ 3.17Å; E820-R823 IonicContact OE1-NH1 2.75Å; E820-R823 PolarHBondContact OE1-NH1 2.99Å; E820-R823 IonicContact OE1-NH2 2.68Å; E820-R823 PolarHBondContact OE1-NH2 3.37Å; E821-R823 VanDerWaalsContact C-N 3.34Å; E821-R823 PolarHBondContact O-N 3.25Å; R823-I825 VanDerWaalsContact C-N 3.35Å; R823-I825 PolarHBondContact O-N 3.18Å; R823-L826 WeakPolarHBondContact O-CB 3.41Å; R823-L826 PolarHBondContact O-N 3.48Å; R823-E827 WeakPolarHBondContact O-CB 3.42Å; R823-E827 PolarHBondContact O-N 3.16Å
824	R	82.3	Confident	72.9	Confident	126 Å²	126	122 Å²	122	48%	0.475	59%	0.591	S	S	.	*	H	α-helix	trans	-61.2	-43.8	178.9	-164.5	-168.4	77.2	-127	-6.1	111.2	E820 E821 E827 E828	E820-R824 WeakPolarHBondContact O-CB 3.49Å; E820-R824 PolarHBondContact O-N 3.45Å; E821-R824 PolarHBondContact O-N 2.92Å; E821-R824 IonicContact OE1-CZ 2.71Å; E821-R824 IonicContact OE1-NH1 2.83Å; E821-R824 PolarHBondContact OE1-NH1 3.31Å; E821-R824 IonicContact OE1-NH2 3.99Å; E821-R824 PolarHBondContact OE1-NH2 3.1Å; R824-E827 PolarHBondContact O-N 3.27Å; R824-E828 IonicContact NE-OE2 3.94Å; R824-E828 WeakPolarHBondContact O-CB 3.39Å; R824-E828 PolarHBondContact O-N 3.31Å
825	I	80.3	Confident	70.9	Confident	86 Å²	86	121.6 Å²	121.6	44%	0.441	60%	0.6	S	S	.	*	H	α-helix	trans	-63.5	-42.7	176.1	-70	163.9	0	0	0	110.4	E821 R823 T829	E821-I825 HydrophobicContact CG-CD1 3.81Å; E821-I825 HydrophobicContact CG-CG1 4.29Å; E821-I825 WeakPolarHBondContact O-CB 3.46Å; E821-I825 WeakPolarHBondContact O-CD1 3.2Å; E821-I825 WeakPolarHBondContact O-CG1 3.45Å; E821-I825 PolarHBondContact O-N 2.88Å; R823-I825 VanDerWaalsContact C-N 3.35Å; R823-I825 PolarHBondContact O-N 3.18Å; I825-T829 VanDerWaalsContact O-CB 3.23Å; I825-T829 WeakPolarHBondContact O-CB 3.42Å; I825-T829 PolarHBondContact O-N 2.73Å; I825-T829 PolarHBondContact O-OG1 2.76Å
826	L	75.1	Confident	69	Low	109 Å²	109	127.5 Å²	127.5	57%	0.571	62%	0.617	S	S	*	*	H	α-helix	trans	-61.5	-41.8	174.9	-78.4	163.5	0	0	0	112.2	E822 R823 V830	E822-L826 HydrophobicContact CG-CD1 4.41Å; E822-L826 WeakPolarHBondContact O-CB 3.42Å; E822-L826 WeakPolarHBondContact O-CD1 3.42Å; E822-L826 VanDerWaalsContact O-CG 3.3Å; E822-L826 WeakPolarHBondContact O-CG 3.29Å; E822-L826 PolarHBondContact O-N 3.43Å; R823-L826 WeakPolarHBondContact O-CB 3.41Å; R823-L826 PolarHBondContact O-N 3.48Å; L826-V830 WeakPolarHBondContact O-CB 3.34Å; L826-V830 WeakPolarHBondContact O-CG2 3.29Å; L826-V830 PolarHBondContact O-N 3.4Å
827	E	71.8	Confident	66.1	Low	152 Å²	152	125.6 Å²	125.6	71%	0.71	63%	0.63	S	S	*	*	H	α-helix	trans	-70.5	-45	177.9	-171.1	169	-161.8	0	0	112.2	R823 R824 T829 V830 M831	R823-E827 WeakPolarHBondContact O-CB 3.42Å; R823-E827 PolarHBondContact O-N 3.16Å; R824-E827 PolarHBondContact O-N 3.27Å; E827-T829 VanDerWaalsContact C-N 3.34Å; E827-T829 PolarHBondContact O-N 2.7Å; E827-V830 PolarHBondContact O-N 2.99Å; E827-V830 VanDerWaalsContact O-N 3.08Å; E827-M831 PolarHBondContact O-N 3.47Å
828	E	65.7	Low	63.5	Low	127 Å²	127	127.3 Å²	127.3	59%	0.593	65%	0.652	S	S	*	*	H	α-helix	trans	-61.5	-39.9	176.4	-174	175.5	174.2	0	0	111.9	R824 V830	R824-E828 IonicContact NE-OE2 3.94Å; R824-E828 WeakPolarHBondContact O-CB 3.39Å; R824-E828 PolarHBondContact O-N 3.31Å; E828-V830 PolarHBondContact O-N 3.07Å
829	T	64.3	Low	60.9	Low	114 Å²	114	125 Å²	125	70%	0.699	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-15.9	176.6	-51.4	0	0	0	0	112.8	I825 E827	I825-T829 VanDerWaalsContact O-CB 3.23Å; I825-T829 WeakPolarHBondContact O-CB 3.42Å; I825-T829 PolarHBondContact O-N 2.73Å; I825-T829 PolarHBondContact O-OG1 2.76Å; E827-T829 VanDerWaalsContact C-N 3.34Å; E827-T829 PolarHBondContact O-N 2.7Å
830	V	60.2	Low	58.4	Low	112 Å²	112	128.3 Å²	128.3	68%	0.679	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-15.4	-176.9	165.8	0	0	0	0	113.1	L826 E827 E828 P832	L826-V830 WeakPolarHBondContact O-CB 3.34Å; L826-V830 WeakPolarHBondContact O-CG2 3.29Å; L826-V830 PolarHBondContact O-N 3.4Å; E827-V830 PolarHBondContact O-N 2.99Å; E827-V830 VanDerWaalsContact O-N 3.08Å; E828-V830 PolarHBondContact O-N 3.07Å; V830-P832 WeakPolarHBondContact O-CD 3.38Å
831	M	42.6	Very low	56.1	Low	155 Å²	155	129.1 Å²	129.1	76%	0.764	70%	0.698	S	S	*	*			trans	-84.5	110.5	-178.8	-177	164.1	54.9	0	0	113.4	E827	E827-M831 PolarHBondContact O-N 3.47Å
832	P	53.8	Low	53.7	Low	113 Å²	113	129.9 Å²	129.9	73%	0.734	71%	0.714	S	S	*	*			trans	-88.8	132.8	-176.5	-4.5	25.5	0	0	0	112.3	V830 T834	V830-P832 WeakPolarHBondContact O-CD 3.38Å; P832-T834 PolarHBondContact O-N 3.24Å
833	L	36.6	Very low	51.8	Low	170 Å²	170	131.6 Å²	131.6	89%	0.89	73%	0.732	S	S	*	*			trans	-72.2	123.7	169.8	-70	174.1	0	0	0	111.6
834	T	35.4	Very low	49.4	Very low	133 Å²	133	130.5 Å²	130.5	82%	0.816	74%	0.744	S	S	*	*			trans	-122.6	117.3	158.2	20.3	0	0	0	0	109.7	P832	P832-T834 PolarHBondContact O-N 3.24Å
835	P	44	Very low	47.1	Very low	127 Å²	127	136.7 Å²	136.7	83%	0.825	77%	0.768	S	S	*	*			trans	-67.9	149.8	-177.5	-22.6	34.2	0	0	0	114.3
836	R	44.4	Very low	44.7	Very low	244 Å²	244	136.6 Å²	136.6	92%	0.921	79%	0.788	S	S	*	*			trans	-75.6	144.6	171.7	-84.1	-179.3	162.1	-168.3	-3.4	112.5
837	S	30.7	Very low	42.7	Very low	128 Å²	128	134.9 Å²	134.9	90%	0.895	80%	0.796	S	S	*	*			trans	-156	152.2	144.6	-82.1	0	0	0	0	109.3
838	S	36.7	Very low	41	Very low	123 Å²	123	136 Å²	136	86%	0.86	81%	0.806	S	S	*	*			trans	-142.2	126.1	-156.3	55.1	0	0	0	0	115.1
839	A	30	Very low	39.5	Very low	101 Å²	101	135.7 Å²	135.7	84%	0.835	82%	0.818	S	S	*	*			trans	-157.5	156.1	157.7	0	0	0	0	0	110.9
840	L	35	Very low	38.1	Very low	169 Å²	169	134.6 Å²	134.6	89%	0.885	82%	0.815	S	S	*	*			trans	-96.4	175.4	176.8	-66.3	171.1	0	0	0	110.4
841	P	40.4	Very low	37.3	Very low	120 Å²	120	135 Å²	135	78%	0.779	82%	0.818	S	S	*	*			cis	-131.5	170.6	2.6	41.5	-25.9	0	0	0	116
842	S	34.2	Very low	37.3	Very low	110 Å²	110	133 Å²	133	77%	0.769	82%	0.819	S	S	*	*			trans	-76.2	159.8	165.2	-45.3	0	0	0	0	111.8
843	P	43.4	Very low	36.6	Very low	115 Å²	115	134.4 Å²	134.4	75%	0.747	82%	0.816	S	S	*	*				-150.1	167.7	94.1	39.4	-22.8	0	0	0	117.9
844	S	29.9	Very low	37.1	Very low	106 Å²	106	130.6 Å²	130.6	74%	0.741	80%	0.802	S	S	*	*			trans	62	99.9	149.6	59.1	0	0	0	0	122.4
845	R	35.4	Very low	37.3	Very low	257 Å²	257	129.6 Å²	129.6	97%	0.97	79%	0.788	S	S	*	*				63	92.8	109.4	-157.9	-174.6	-146.5	-145.1	7.4	118.9
846	G	28.6	Very low	37.3	Very low	83 Å²	83	129.3 Å²	129.3	86%	0.856	78%	0.779	S	S	*	*			trans	-156.5	159.3	158.9	0	0	0	0	0	109.1
847	G	34.7	Very low	37.5	Very low	73 Å²	73	122.4 Å²	122.4	75%	0.753	76%	0.764	S	S	*	*			trans	-136.9	-177.2	-172.2	0	0	0	0	0	115.8
848	L	34.3	Very low	38.6	Very low	176 Å²	176	121.8 Å²	121.8	92%	0.921	75%	0.75	S	S	*	*			trans	87.8	128.2	177.4	-52.5	176.7	0	0	0	118
849	S	34.6	Very low	39.5	Very low	121 Å²	121	120.6 Å²	120.6	85%	0.846	74%	0.737	S	S	*	*			trans	64.8	150.6	166.2	-112.4	0	0	0	0	118.2
850	S	34.6	Very low	40.7	Very low	90 Å²	90	124.3 Å²	124.3	63%	0.629	73%	0.729	S	S	*	*			cis	-156.1	150.9	9.7	-167.5	0	0	0	0	112.7
851	T	43.3	Very low	42.1	Very low	122 Å²	122	120 Å²	120	75%	0.748	71%	0.713	S	S	*	*			trans	36.3	135.7	146.6	53.7	0	0	0	0	123.6
852	S	44.3	Very low	42.9	Very low	112 Å²	112	119.2 Å²	119.2	78%	0.783	70%	0.702	S	S	*	*			trans	86.2	118.2	141.6	78.2	0	0	0	0	121
853	E	38.1	Very low	44.1	Very low	142 Å²	142	115.7 Å²	115.7	66%	0.664	68%	0.68	S	S	*	*			trans	-143	150.3	134.8	-80.8	-139.6	91	0	0	110	Q855	E853-Q855 PolarHBondContact OE1-NE2 3.25Å
854	P	46.3	Very low	45	Very low	91 Å²	91	114.8 Å²	114.8	59%	0.591	67%	0.669	S	S	*	*	S	Bend	trans	-96.7	4.3	178.2	38.2	-35.9	0	0	0	114.1	T857	P854-T857 PolarHBondContact O-OG1 3.49Å; P854-T857 VanDerWaalsContact O-OG1 3.09Å
855	Q	40	Very low	46.7	Very low	112 Å²	112	117.5 Å²	117.5	52%	0.523	66%	0.663	S	S	.	*	H	α-helix	trans	-80	-37.4	-167.5	-54.6	-170.9	25.2	0	0	113	E853 T857 I858 V859	E853-Q855 PolarHBondContact OE1-NE2 3.25Å; Q855-T857 VanDerWaalsContact C-N 3.25Å; Q855-T857 PolarHBondContact O-N 3.05Å; Q855-T857 VanDerWaalsContact O-N 3.17Å; Q855-I858 WeakPolarHBondContact O-CB 3.38Å; Q855-I858 PolarHBondContact O-N 3.09Å; Q855-V859 PolarHBondContact O-N 2.89Å
856	D	44.2	Very low	48.4	Very low	121 Å²	121	110.9 Å²	110.9	65%	0.647	64%	0.643	S	S	*	*	H	α-helix	trans	-54.6	-36.1	-179.8	-86.1	-16.2	0	0	0	114.1	R860	D856-R860 WeakPolarHBondContact O-CB 3.45Å; D856-R860 WeakPolarHBondContact O-CD 3.47Å; D856-R860 WeakPolarHBondContact O-CG 3.29Å; D856-R860 PolarHBondContact O-N 2.7Å; D856-R860 VanDerWaalsContact O-N 3.14Å
857	T	48	Very low	50.1	Low	99 Å²	99	114.4 Å²	114.4	61%	0.607	63%	0.63	S	S	*	*	H	α-helix	trans	-73.8	-28.8	179	49.7	0	0	0	0	112.2	P854 Q855 S861	P854-T857 PolarHBondContact O-OG1 3.49Å; P854-T857 VanDerWaalsContact O-OG1 3.09Å; Q855-T857 VanDerWaalsContact C-N 3.25Å; Q855-T857 PolarHBondContact O-N 3.05Å; Q855-T857 VanDerWaalsContact O-N 3.17Å; T857-S861 VanDerWaalsContact O-CB 3.23Å; T857-S861 WeakPolarHBondContact O-CB 3.2Å; T857-S861 PolarHBondContact O-N 3.08Å; T857-S861 VanDerWaalsContact O-N 3.09Å
858	I	54.8	Low	51.5	Low	114 Å²	114	117.7 Å²	117.7	59%	0.585	62%	0.624	S	S	*	*	H	α-helix	trans	-75.3	-48	176.1	-59	175.1	0	0	0	109.7	Q855 R860 S861 L862	Q855-I858 WeakPolarHBondContact O-CB 3.38Å; Q855-I858 PolarHBondContact O-N 3.09Å; I858-R860 VanDerWaalsContact C-N 3.34Å; I858-R860 PolarHBondContact O-N 2.87Å; I858-S861 CarbonylContact O-C 3.56Å; I858-S861 PolarHBondContact O-N 2.97Å; I858-S861 VanDerWaalsContact O-N 3.12Å; I858-L862 PolarHBondContact O-N 3.34Å
859	V	54.6	Low	52.4	Low	98 Å²	98	113.4 Å²	113.4	59%	0.594	60%	0.599	S	S	*	*	H	α-helix	trans	-58.9	-44.6	178.6	176.3	0	0	0	0	111.2	Q855 L862 A863	Q855-V859 PolarHBondContact O-N 2.89Å; V859-L862 PolarHBondContact O-N 2.67Å; V859-A863 PolarHBondContact O-N 2.84Å
860	R	56.8	Low	53.9	Low	179 Å²	179	112.6 Å²	112.6	68%	0.675	58%	0.582	S	S	*	*	H	α-helix	trans	-66.6	-38.3	175.5	-72.2	161.6	63.1	173.8	-0.1	112.4	D856 I858 L862 D864	D856-R860 WeakPolarHBondContact O-CB 3.45Å; D856-R860 WeakPolarHBondContact O-CD 3.47Å; D856-R860 WeakPolarHBondContact O-CG 3.29Å; D856-R860 PolarHBondContact O-N 2.7Å; D856-R860 VanDerWaalsContact O-N 3.14Å; I858-R860 VanDerWaalsContact C-N 3.34Å; I858-R860 PolarHBondContact O-N 2.87Å; R860-L862 VanDerWaalsContact C-N 3.26Å; R860-L862 PolarHBondContact O-N 2.96Å; R860-D864 WeakPolarHBondContact O-CB 3.24Å; R860-D864 PolarHBondContact O-N 2.84Å; R860-D864 VanDerWaalsContact O-N 3.07Å
861	S	63.6	Low	55.2	Low	79 Å²	79	113.7 Å²	113.7	55%	0.552	58%	0.58	S	S	*	*	H	α-helix	trans	-66.8	-24.9	174.3	-173.1	0	0	0	0	113.4	T857 I858 W865	T857-S861 VanDerWaalsContact O-CB 3.23Å; T857-S861 WeakPolarHBondContact O-CB 3.2Å; T857-S861 PolarHBondContact O-N 3.08Å; T857-S861 VanDerWaalsContact O-N 3.09Å; I858-S861 CarbonylContact O-C 3.56Å; I858-S861 PolarHBondContact O-N 2.97Å; I858-S861 VanDerWaalsContact O-N 3.12Å; S861-W865 WeakPolarHBondContact O-CB 3.36Å; S861-W865 PolarHBondContact O-N 3.47Å
862	L	57.6	Low	56.1	Low	104 Å²	104	112.5 Å²	112.5	55%	0.545	57%	0.569	S	S	.	*	H	α-helix	trans	-76.8	-49.5	177.8	-159	69.9	0	0	0	110.5	I858 V859 R860 D864 W865 E866	I858-L862 PolarHBondContact O-N 3.34Å; V859-L862 PolarHBondContact O-N 2.67Å; R860-L862 VanDerWaalsContact C-N 3.26Å; R860-L862 PolarHBondContact O-N 2.96Å; L862-D864 VanDerWaalsContact C-N 3.26Å; L862-D864 PolarHBondContact O-N 3.01Å; L862-W865 WeakPolarHBondContact O-CA 3.44Å; L862-W865 WeakPolarHBondContact O-CB 3.38Å; L862-W865 PolarHBondContact O-N 3.46Å; L862-E866 PolarHBondContact O-N 3.39Å
863	A	59.6	Low	56.8	Low	36 Å²	36	111.1 Å²	111.1	30%	0.298	55%	0.55	S	S	.	.	H	α-helix	trans	-64	-27.2	175.9	0	0	0	0	0	113.7	V859 R867	V859-A863 PolarHBondContact O-N 2.84Å; A863-R867 WeakPolarHBondContact O-CB 3.47Å; A863-R867 VanDerWaalsContact O-CG 3.3Å; A863-R867 WeakPolarHBondContact O-CG 3.1Å; A863-R867 PolarHBondContact O-N 2.99Å; A863-R867 PolarHBondContact O-NE 3.21Å
864	D	62.8	Low	57.9	Low	96 Å²	96	112.6 Å²	112.6	51%	0.513	55%	0.549	S	S	.	.	H	α-helix	trans	-77.9	-19.5	170.4	-76.3	-14.9	0	0	0	113.1	R860 L862 R867 K868	R860-D864 WeakPolarHBondContact O-CB 3.24Å; R860-D864 PolarHBondContact O-N 2.84Å; R860-D864 VanDerWaalsContact O-N 3.07Å; L862-D864 VanDerWaalsContact C-N 3.26Å; L862-D864 PolarHBondContact O-N 3.01Å; D864-R867 IonicContact OD1-CZ 3.67Å; D864-R867 IonicContact OD1-NE 3.96Å; D864-R867 IonicContact OD1-NH2 2.66Å; D864-R867 PolarHBondContact OD1-NH2 3.11Å; D864-K868 WeakPolarHBondContact O-CB 3.34Å
865	W	65.6	Low	58.2	Low	162 Å²	162	114.5 Å²	114.5	61%	0.614	55%	0.55	S	S	*	*	H	α-helix	trans	-85.3	-45.4	175.3	-162.6	92.4	0	0	0	111.5	S861 L862 K868 Q869	S861-W865 WeakPolarHBondContact O-CB 3.36Å; S861-W865 PolarHBondContact O-N 3.47Å; L862-W865 WeakPolarHBondContact O-CA 3.44Å; L862-W865 WeakPolarHBondContact O-CB 3.38Å; L862-W865 PolarHBondContact O-N 3.46Å; W865-K868 CarbonylContact O-C 3.56Å; W865-K868 WeakPolarHBondContact O-CA 3.48Å; W865-K868 WeakPolarHBondContact O-CB 3.44Å; W865-K868 PolarHBondContact O-N 3.38Å; W865-K868 VanDerWaalsContact O-N 3.08Å; W865-Q869 HydrophobicContact CE3-CG 4.45Å; W865-Q869 HydrophobicContact CH2-CG 4.09Å; W865-Q869 HydrophobicContact CZ3-CB 4.39Å; W865-Q869 HydrophobicContact CZ3-CG 3.91Å; W865-Q869 PolarHBondContact O-N 3.47Å
866	E	69.8	Low	58.7	Low	118 Å²	118	112.8 Å²	112.8	55%	0.551	55%	0.551	S	S	*	*	H	α-helix	trans	-58.2	-49.6	176.2	-69.1	174.9	129.1	0	0	112	L862 K868 Q869 E870	L862-E866 PolarHBondContact O-N 3.39Å; E866-K868 PolarHBondContact O-N 3.23Å; E866-K868 VanDerWaalsContact O-N 3.14Å; E866-Q869 WeakPolarHBondContact O-CA 3.25Å; E866-Q869 WeakPolarHBondContact O-CB 3.45Å; E866-Q869 PolarHBondContact O-N 3.37Å; E866-E870 PolarHBondContact O-N 2.92Å
867	R	64.4	Low	58.9	Low	157 Å²	157	114.5 Å²	114.5	59%	0.592	55%	0.548	S	S	*	.	H	α-helix	trans	-60.9	-24.9	176.5	-70.5	-175.4	-68.9	-169	2.8	113.3	A863 D864 L871	A863-R867 WeakPolarHBondContact O-CB 3.47Å; A863-R867 VanDerWaalsContact O-CG 3.3Å; A863-R867 WeakPolarHBondContact O-CG 3.1Å; A863-R867 PolarHBondContact O-N 2.99Å; A863-R867 PolarHBondContact O-NE 3.21Å; D864-R867 IonicContact OD1-CZ 3.67Å; D864-R867 IonicContact OD1-NE 3.96Å; D864-R867 IonicContact OD1-NH2 2.66Å; D864-R867 PolarHBondContact OD1-NH2 3.11Å; R867-L871 WeakPolarHBondContact O-CB 3.49Å; R867-L871 PolarHBondContact O-N 2.84Å
868	K	64.9	Low	58.8	Low	142 Å²	142	111.2 Å²	111.2	62%	0.617	53%	0.534	S	S	*	.	H	α-helix	trans	-81.4	-29.7	173.7	-169.7	174.9	-177	176	0	112.1	D864 W865 E866 L872	D864-K868 WeakPolarHBondContact O-CB 3.34Å; W865-K868 CarbonylContact O-C 3.56Å; W865-K868 WeakPolarHBondContact O-CA 3.48Å; W865-K868 WeakPolarHBondContact O-CB 3.44Å; W865-K868 PolarHBondContact O-N 3.38Å; W865-K868 VanDerWaalsContact O-N 3.08Å; E866-K868 PolarHBondContact O-N 3.23Å; E866-K868 VanDerWaalsContact O-N 3.14Å; K868-L872 WeakPolarHBondContact O-CG 3.3Å; K868-L872 PolarHBondContact O-N 2.75Å
869	Q	53.5	Low	58.4	Low	87 Å²	87	109.8 Å²	109.8	41%	0.407	54%	0.535	S	S	.	.	H	α-helix	trans	-74.8	-41.9	176	-132	-97.3	-128	0	0	111.7	W865 E866 L871 L872 E873	W865-Q869 HydrophobicContact CE3-CG 4.45Å; W865-Q869 HydrophobicContact CH2-CG 4.09Å; W865-Q869 HydrophobicContact CZ3-CB 4.39Å; W865-Q869 HydrophobicContact CZ3-CG 3.91Å; W865-Q869 PolarHBondContact O-N 3.47Å; E866-Q869 WeakPolarHBondContact O-CA 3.25Å; E866-Q869 WeakPolarHBondContact O-CB 3.45Å; E866-Q869 PolarHBondContact O-N 3.37Å; Q869-L871 VanDerWaalsContact C-N 3.33Å; Q869-L871 PolarHBondContact O-N 2.92Å; Q869-L872 PolarHBondContact O-N 3.33Å; Q869-E873 PolarHBondContact O-N 3.07Å
870	E	66.3	Low	58.2	Low	104 Å²	104	109.3 Å²	109.3	49%	0.486	53%	0.532	S	S	.	.	H	α-helix	trans	-60.8	-42.6	173.2	-166.4	-153.8	150.8	0	0	111.2	E866 L872 E873 R874	E866-E870 PolarHBondContact O-N 2.92Å; E870-L872 VanDerWaalsContact C-N 3.31Å; E870-L872 PolarHBondContact O-N 2.91Å; E870-E873 PolarHBondContact O-N 2.87Å; E870-R874 WeakPolarHBondContact O-CB 3.23Å; E870-R874 WeakPolarHBondContact O-CG 3.46Å; E870-R874 PolarHBondContact O-N 3.45Å; E870-R874 IonicContact OE1-CZ 3.56Å; E870-R874 IonicContact OE1-NE 2.74Å; E870-R874 PolarHBondContact OE1-NE 3.36Å; E870-R874 IonicContact OE1-NH2 3.48Å; E870-R874 PolarHBondContact OE1-NH2 3.49Å
871	L	61.1	Low	57.6	Low	112 Å²	112	105.6 Å²	105.6	59%	0.586	52%	0.522	S	S	*	.	H	α-helix	trans	-67.4	-31.1	-179.5	-165.3	144.6	0	0	0	112.4	R867 Q869 Q875	R867-L871 WeakPolarHBondContact O-CB 3.49Å; R867-L871 PolarHBondContact O-N 2.84Å; Q869-L871 VanDerWaalsContact C-N 3.33Å; Q869-L871 PolarHBondContact O-N 2.92Å; L871-Q875 WeakPolarHBondContact O-CB 3.49Å; L871-Q875 PolarHBondContact O-N 2.78Å; L871-Q875 VanDerWaalsContact O-N 3.16Å
872	L	61.8	Low	56.5	Low	98 Å²	98	105.1 Å²	105.1	51%	0.513	52%	0.519	S	S	.	.	H	α-helix	trans	-73.2	-40.1	172	-75	167.7	0	0	0	112.3	K868 Q869 E870 Q875 S876	K868-L872 WeakPolarHBondContact O-CG 3.3Å; K868-L872 PolarHBondContact O-N 2.75Å; Q869-L872 PolarHBondContact O-N 3.33Å; E870-L872 VanDerWaalsContact C-N 3.31Å; E870-L872 PolarHBondContact O-N 2.91Å; L872-Q875 PolarHBondContact O-N 3.08Å; L872-S876 WeakPolarHBondContact O-CB 3.17Å; L872-S876 PolarHBondContact O-N 3.31Å
873	E	60	Low	56.1	Low	83 Å²	83	102.9 Å²	102.9	39%	0.388	52%	0.515	S	S	.	.	H	α-helix	trans	-64.7	-43.9	173.7	-91	-158.8	81	0	0	112.7	Q869 E870 Q875 S876 R877	Q869-E873 PolarHBondContact O-N 3.07Å; E870-E873 PolarHBondContact O-N 2.87Å; E873-Q875 VanDerWaalsContact C-N 3.26Å; E873-Q875 PolarHBondContact O-N 3.31Å; E873-S876 WeakPolarHBondContact O-CB 3.49Å; E873-S876 PolarHBondContact O-N 3.04Å; E873-S876 VanDerWaalsContact O-N 3.08Å; E873-R877 WeakPolarHBondContact O-CG 3.44Å; E873-R877 PolarHBondContact O-N 3.02Å; E873-R877 IonicContact OE1-CZ 3.19Å; E873-R877 IonicContact OE1-NE 2.7Å; E873-R877 PolarHBondContact OE1-NE 3.49Å; E873-R877 IonicContact OE1-NH2 3.12Å; E873-R877 PolarHBondContact OE1-NH2 3.29Å
874	R	60.5	Low	55.5	Low	172 Å²	172	107.8 Å²	107.8	65%	0.649	53%	0.532	S	S	*	.	H	α-helix	trans	-56.9	-41.2	173.5	-77.5	173.5	161.9	-83.9	1.6	111.9	E870 G878	E870-R874 WeakPolarHBondContact O-CB 3.23Å; E870-R874 WeakPolarHBondContact O-CG 3.46Å; E870-R874 PolarHBondContact O-N 3.45Å; E870-R874 IonicContact OE1-CZ 3.56Å; E870-R874 IonicContact OE1-NE 2.74Å; E870-R874 PolarHBondContact OE1-NE 3.36Å; E870-R874 IonicContact OE1-NH2 3.48Å; E870-R874 PolarHBondContact OE1-NH2 3.49Å; R874-G878 PolarHBondContact O-N 2.74Å
875	Q	52.1	Low	54.3	Low	132 Å²	132	112.6 Å²	112.6	62%	0.617	54%	0.543	S	S	*	.	H	α-helix	trans	-69.4	-34.8	175.5	-176	166.4	91.2	0	0	112.5	L871 L872 E873 S879	L871-Q875 WeakPolarHBondContact O-CB 3.49Å; L871-Q875 PolarHBondContact O-N 2.78Å; L871-Q875 VanDerWaalsContact O-N 3.16Å; L872-Q875 PolarHBondContact O-N 3.08Å; E873-Q875 VanDerWaalsContact C-N 3.26Å; E873-Q875 PolarHBondContact O-N 3.31Å; Q875-S879 WeakPolarHBondContact O-CB 3.47Å; Q875-S879 PolarHBondContact O-N 2.81Å
876	S	51.3	Low	53.3	Low	76 Å²	76	111.3 Å²	111.3	53%	0.531	54%	0.542	S	S	.	.	H	α-helix	trans	-68.1	-51.8	176.6	-167.8	0	0	0	0	112	L872 E873 S879 T880	L872-S876 WeakPolarHBondContact O-CB 3.17Å; L872-S876 PolarHBondContact O-N 3.31Å; E873-S876 WeakPolarHBondContact O-CB 3.49Å; E873-S876 PolarHBondContact O-N 3.04Å; E873-S876 VanDerWaalsContact O-N 3.08Å; S876-S879 PolarHBondContact O-N 3.16Å; S876-S879 VanDerWaalsContact O-N 3.16Å; S876-T880 PolarHBondContact O-N 2.79Å; S876-T880 PolarHBondContact O-OG1 2.87Å
877	R	48.2	Very low	52.2	Low	156 Å²	156	114.1 Å²	114.1	59%	0.589	55%	0.547	S	S	*	.	H	α-helix	trans	-61.3	-47.5	-178.5	-66.9	175.2	-171.8	-101.8	2.4	111.1	E873 S879 T880 E881	E873-R877 WeakPolarHBondContact O-CG 3.44Å; E873-R877 PolarHBondContact O-N 3.02Å; E873-R877 IonicContact OE1-CZ 3.19Å; E873-R877 IonicContact OE1-NE 2.7Å; E873-R877 PolarHBondContact OE1-NE 3.49Å; E873-R877 IonicContact OE1-NH2 3.12Å; E873-R877 PolarHBondContact OE1-NH2 3.29Å; R877-S879 PolarHBondContact O-N 3.48Å; R877-T880 PolarHBondContact O-N 3.23Å; R877-T880 PolarHBondContact O-OG1 3.3Å; R877-E881 WeakPolarHBondContact O-CG 3.4Å; R877-E881 PolarHBondContact O-N 3.37Å; R877-E881 VanDerWaalsContact O-N 3.12Å
878	G	46.3	Very low	51.2	Low	31 Å²	31	113.6 Å²	113.6	32%	0.32	55%	0.549	S	S	.	.	H	α-helix	trans	-57.3	-31.5	175.1	0	0	0	0	0	114.4	R874 E881 S882	R874-G878 PolarHBondContact O-N 2.74Å; G878-E881 VanDerWaalsContact CA-OE1 3.27Å; G878-E881 WeakPolarHBondContact CA-OE1 3.47Å; G878-E881 PolarHBondContact N-OE1 2.71Å; G878-S882 WeakPolarHBondContact O-CB 3.38Å; G878-S882 PolarHBondContact O-N 2.85Å
879	S	46.1	Very low	50	Low	84 Å²	84	112.7 Å²	112.7	59%	0.587	55%	0.547	S	S	*	.	H	α-helix	trans	-78.5	-28.6	177.8	-170.5	0	0	0	0	113.5	Q875 S876 R877 A883	Q875-S879 WeakPolarHBondContact O-CB 3.47Å; Q875-S879 PolarHBondContact O-N 2.81Å; S876-S879 PolarHBondContact O-N 3.16Å; S876-S879 VanDerWaalsContact O-N 3.16Å; R877-S879 PolarHBondContact O-N 3.48Å; S879-A883 WeakPolarHBondContact O-CB 3.47Å
880	T	49.5	Very low	49.5	Very low	87 Å²	87	113.8 Å²	113.8	53%	0.534	56%	0.556	S	S	.	*	H	α-helix	trans	-75.2	-49.9	174.6	33.7	0	0	0	0	111.4	S876 R877 S882 A883 E884	S876-T880 PolarHBondContact O-N 2.79Å; S876-T880 PolarHBondContact O-OG1 2.87Å; R877-T880 PolarHBondContact O-N 3.23Å; R877-T880 PolarHBondContact O-OG1 3.3Å; T880-S882 PolarHBondContact O-N 2.83Å; T880-A883 PolarHBondContact O-N 3.03Å; T880-E884 PolarHBondContact O-N 3.35Å; T880-E884 VanDerWaalsContact O-N 3.14Å
881	E	45.3	Very low	48.4	Very low	102 Å²	102	114.3 Å²	114.3	48%	0.477	56%	0.562	S	S	.	*	H	α-helix	trans	-64.9	-43	-178.6	63.6	-160.2	118.3	0	0	111.8	R877 G878 A883 E884 W885	R877-E881 WeakPolarHBondContact O-CG 3.4Å; R877-E881 PolarHBondContact O-N 3.37Å; R877-E881 VanDerWaalsContact O-N 3.12Å; G878-E881 VanDerWaalsContact CA-OE1 3.27Å; G878-E881 WeakPolarHBondContact CA-OE1 3.47Å; G878-E881 PolarHBondContact N-OE1 2.71Å; E881-A883 PolarHBondContact O-N 3.23Å; E881-E884 PolarHBondContact O-N 3.03Å; E881-E884 VanDerWaalsContact O-N 3.1Å; E881-W885 PolarHBondContact O-N 3.23Å
882	S	39.6	Very low	47.6	Very low	68 Å²	68	119.1 Å²	119.1	48%	0.476	57%	0.572	S	S	.	*	H	α-helix	trans	-60.9	-30.9	176.7	-170.7	0	0	0	0	113.3	G878 T880 K886	G878-S882 WeakPolarHBondContact O-CB 3.38Å; G878-S882 PolarHBondContact O-N 2.85Å; T880-S882 PolarHBondContact O-N 2.83Å; S882-K886 WeakPolarHBondContact O-CB 3.13Å; S882-K886 PolarHBondContact O-N 3.19Å
883	A	50.1	Low	46.8	Very low	57 Å²	57	119.8 Å²	119.8	47%	0.471	58%	0.581	S	S	.	*	H	α-helix	trans	-75.5	-33.3	175.9	0	0	0	0	0	112.9	S879 T880 E881 R887	S879-A883 WeakPolarHBondContact O-CB 3.47Å; T880-A883 PolarHBondContact O-N 3.03Å; E881-A883 PolarHBondContact O-N 3.23Å; A883-R887 PolarHBondContact O-N 3.04Å; A883-R887 VanDerWaalsContact O-N 3.13Å
884	E	47.1	Very low	45.9	Very low	140 Å²	140	120 Å²	120	65%	0.654	59%	0.591	S	S	*	*	H	α-helix	trans	-75.7	-43.2	175.8	-68.8	-171.1	145.9	0	0	112.3	T880 E881 K886 R887 K888	T880-E884 PolarHBondContact O-N 3.35Å; T880-E884 VanDerWaalsContact O-N 3.14Å; E881-E884 PolarHBondContact O-N 3.03Å; E881-E884 VanDerWaalsContact O-N 3.1Å; E884-K886 VanDerWaalsContact C-N 3.34Å; E884-K886 PolarHBondContact O-N 3.25Å; E884-R887 PolarHBondContact O-N 3.07Å; E884-R887 VanDerWaalsContact O-N 3.16Å; E884-K888 WeakPolarHBondContact O-CB 3.38Å; E884-K888 PolarHBondContact O-N 2.65Å
885	W	37.8	Very low	44.8	Very low	197 Å²	197	118.9 Å²	118.9	75%	0.746	60%	0.598	S	S	*	*	H	α-helix	trans	-58	-45.8	173.3	-80.6	98.8	0	0	0	111.2	E881 R887 K888 E889	E881-W885 PolarHBondContact O-N 3.23Å; W885-R887 PolarHBondContact O-N 2.81Å; W885-K888 PolarHBondContact O-N 3.44Å; W885-E889 WeakPolarHBondContact O-CB 3.2Å; W885-E889 PolarHBondContact O-N 3.2Å
886	K	42.9	Very low	43.8	Very low	134 Å²	134	120.3 Å²	120.3	58%	0.583	61%	0.608	S	S	*	*	H	α-helix	trans	-63.5	-36.6	174.5	-83.8	-169.6	170.3	-174.5	0	113.7	S882 E884 N890	S882-K886 WeakPolarHBondContact O-CB 3.13Å; S882-K886 PolarHBondContact O-N 3.19Å; E884-K886 VanDerWaalsContact C-N 3.34Å; E884-K886 PolarHBondContact O-N 3.25Å; K886-N890 PolarHBondContact O-N 3.19Å; K886-N890 PolarHBondContact O-ND2 3.47Å
887	R	46.9	Very low	42.8	Very low	178 Å²	178	121.7 Å²	121.7	67%	0.672	62%	0.618	S	S	*	*	H	α-helix	trans	-63.7	-45.8	175.4	-167.6	-177.3	-60	-110.9	2.3	110.8	A883 E884 W885 E889 N890 D891	A883-R887 PolarHBondContact O-N 3.04Å; A883-R887 VanDerWaalsContact O-N 3.13Å; E884-R887 PolarHBondContact O-N 3.07Å; E884-R887 VanDerWaalsContact O-N 3.16Å; W885-R887 PolarHBondContact O-N 2.81Å; R887-E889 VanDerWaalsContact C-N 3.28Å; R887-E889 PolarHBondContact O-N 3.11Å; R887-N890 PolarHBondContact O-N 2.82Å; R887-D891 PolarHBondContact O-N 2.93Å
888	K	43	Very low	42.1	Very low	146 Å²	146	120.5 Å²	120.5	64%	0.635	63%	0.629	S	S	*	*	H	α-helix	trans	-72.2	-16.6	-177.4	-157.5	165.6	-170.5	168.8	0	114.7	E884 W885	E884-K888 WeakPolarHBondContact O-CB 3.38Å; E884-K888 PolarHBondContact O-N 2.65Å; W885-K888 PolarHBondContact O-N 3.44Å
889	E	39.8	Very low	41.3	Very low	123 Å²	123	123.6 Å²	123.6	58%	0.575	65%	0.651	S	S	*	*	H	α-helix	trans	-79.6	-42.2	170.1	-175.8	174.4	-141.3	0	0	111.7	W885 R887 R892 T893	W885-E889 WeakPolarHBondContact O-CB 3.2Å; W885-E889 PolarHBondContact O-N 3.2Å; R887-E889 VanDerWaalsContact C-N 3.28Å; R887-E889 PolarHBondContact O-N 3.11Å; E889-R892 PolarHBondContact O-N 2.79Å; E889-T893 PolarHBondContact O-N 2.91Å; E889-T893 PolarHBondContact O-OG1 3.34Å
890	N	44.3	Very low	40.5	Very low	109 Å²	109	126.8 Å²	126.8	58%	0.583	66%	0.661	S	S	*	*	H	α-helix	trans	-67.3	-42.8	175.7	-75.3	-88.5	0	0	0	111.7	K886 R887 R892 T893	K886-N890 PolarHBondContact O-N 3.19Å; K886-N890 PolarHBondContact O-ND2 3.47Å; R887-N890 PolarHBondContact O-N 2.82Å; N890-R892 PolarHBondContact O-N 3.31Å; N890-T893 PolarHBondContact O-N 3.01Å; N890-T893 PolarHBondContact O-OG1 3.22Å
891	D	43.4	Very low	39.5	Very low	116 Å²	116	129.1 Å²	129.1	62%	0.62	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-1.6	174.1	-66.9	-26.9	0	0	0	113.5	R887	R887-D891 PolarHBondContact O-N 2.93Å
892	R	43.9	Very low	38.9	Very low	212 Å²	212	129.2 Å²	129.2	80%	0.8	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.7	2.2	176.6	-93.4	-175.5	161.5	178.6	-6.2	114.6	E889 N890	E889-R892 PolarHBondContact O-N 2.79Å; N890-R892 PolarHBondContact O-N 3.31Å
893	T	44.1	Very low	38.5	Very low	113 Å²	113	133.4 Å²	133.4	69%	0.693	70%	0.696	S	S	*	*	S	Bend	trans	-118.6	4.7	-178.6	33.8	0	0	0	0	114	E889 N890	E889-T893 PolarHBondContact O-N 2.91Å; E889-T893 PolarHBondContact O-OG1 3.34Å; N890-T893 PolarHBondContact O-N 3.01Å; N890-T893 PolarHBondContact O-OG1 3.22Å
894	S	41	Very low	37.7	Very low	87 Å²	87	139.2 Å²	139.2	61%	0.608	71%	0.711	S	S	*	*	S	Bend	trans	-85.3	-20.5	178	49.6	0	0	0	0	115.5
895	D	37.4	Very low	36.9	Very low	149 Å²	149	139.1 Å²	139.1	80%	0.797	72%	0.72	S	S	*	*			trans	-109.2	73.2	-175.1	-73.3	-50.2	0	0	0	112.6
896	I	31.2	Very low	36.3	Very low	161 Å²	161	132.7 Å²	132.7	83%	0.826	72%	0.715	S	S	*	*	S	Bend	trans	-151.4	121.7	157.9	-108.2	155.5	0	0	0	111.6
897	S	31.6	Very low	35.6	Very low	105 Å²	105	138.6 Å²	138.6	73%	0.734	73%	0.734	S	S	*	*			trans	41.5	102.1	159.1	-57.1	0	0	0	0	122.7
898	T	31.8	Very low	34.7	Very low	132 Å²	132	135.1 Å²	135.1	81%	0.81	74%	0.737	S	S	*	*				8.9	135.4	121.2	56.5	0	0	0	0	122
899	A	29.5	Very low	34.1	Very low	95 Å²	95	135.4 Å²	135.4	79%	0.785	75%	0.745	S	S	*	*			trans	67.3	153.4	147.6	0	0	0	0	0	118.4
900	D	29.5	Very low	33.7	Very low	152 Å²	152	135.6 Å²	135.6	81%	0.813	75%	0.754	S	S	*	*			cis	-152.8	-178.1	-0.7	-143.9	-32.8	0	0	0	111.8
901	D	29.3	Very low	33	Very low	135 Å²	135	134.3 Å²	134.3	72%	0.722	75%	0.754	S	S	*	*			trans	67.1	92.7	153.3	-124.9	-38.7	0	0	0	122.5
902	S	32.3	Very low	32.5	Very low	104 Å²	104	136.7 Å²	136.7	73%	0.727	76%	0.761	S	S	*	*				54.7	178	120.7	-149.8	0	0	0	0	124.8
903	M	31.9	Very low	31.6	Very low	156 Å²	156	133.4 Å²	133.4	77%	0.768	76%	0.759	S	S	*	*			trans	77.8	79.7	163.8	-63.2	-63.3	-154.6	0	0	122.1
904	K	33	Very low	30.9	Very low	179 Å²	179	133 Å²	133	78%	0.778	76%	0.761	S	S	*	*				59.9	138	113.1	-162.3	179.5	-176.8	178.2	0	121.7
905	T	29.3	Very low	30.4	Very low	138 Å²	138	134 Å²	134	85%	0.847	77%	0.768	S	S	*	*			trans	67.2	147.9	168.2	21.6	0	0	0	0	116.6
906	G	27.2	Very low	30	Very low	63 Å²	63	135.2 Å²	135.2	65%	0.649	77%	0.769	S	S	*	*			cis	151	163.8	-8.1	0	0	0	0	0	113.5
907	R	27.8	Very low	30	Very low	257 Å²	257	132.6 Å²	132.6	97%	0.97	76%	0.761	S	S	*	*			trans	90.4	164.8	-179.7	-53.7	174.6	70.5	167.7	1.3	116.2
908	S	27.2	Very low	30	Very low	105 Å²	105	134 Å²	134	73%	0.734	76%	0.756	S	S	*	*			trans	-152.6	-177.8	-167.2	-178.6	0	0	0	0	109.4
909	L	31.4	Very low	30	Very low	153 Å²	153	136.7 Å²	136.7	80%	0.801	75%	0.751	S	S	*	*			trans	74.4	147.9	174.4	-50.1	170.8	0	0	0	113.8
910	V	29.9	Very low	30.1	Very low	127 Å²	127	139.6 Å²	139.6	77%	0.77	75%	0.752	S	S	*	*			cis	-162.5	174.6	-1.4	-104.5	0	0	0	0	108.2
911	S	30.1	Very low	30.1	Very low	82 Å²	82	135.6 Å²	135.6	57%	0.573	74%	0.741	S	S	*	*			cis	-156	-178.7	11.2	-140.9	0	0	0	0	115.7
912	Q	33.7	Very low	30.1	Very low	165 Å²	165	138.1 Å²	138.1	77%	0.771	75%	0.748	S	S	*	*			trans	-18.4	159.4	149.6	-59.1	148.7	-16.9	0	0	119.2
913	N	25.3	Very low	29.8	Very low	144 Å²	144	137.7 Å²	137.7	77%	0.77	75%	0.745	S	S	*	*				-148.2	142.1	59.9	-81.3	-29.7	0	0	0	112.4
914	S	29.8	Very low	29.8	Very low	104 Å²	104	136.7 Å²	136.7	73%	0.727	75%	0.747	S	S	*	*				79.2	141	73.4	-146.8	0	0	0	0	113.5
915	S	29.8	Very low	29.6	Very low	108 Å²	108	136.2 Å²	136.2	76%	0.755	75%	0.747	S	S	*	*			cis	-156.8	-175.2	12.1	-23.1	0	0	0	0	112.6
916	Q	28.8	Very low	29.5	Very low	174 Å²	174	136.7 Å²	136.7	81%	0.813	75%	0.745	S	S	*	*			trans	-101.1	-162.2	170.2	-57.4	-177	17.3	0	0	110.9
917	T	31.1	Very low	29.6	Very low	107 Å²	107	136.3 Å²	136.3	66%	0.656	74%	0.741	S	S	*	*			cis	-173.1	169	23.8	-19	0	0	0	0	111.7
918	E	30.6	Very low	29.7	Very low	135 Å²	135	132.9 Å²	132.9	63%	0.631	74%	0.736	S	S	*	*			trans	72.9	160.1	154.6	-52.7	-116.8	129.2	0	0	119.6
919	R	33.3	Very low	29.6	Very low	188 Å²	188	135.9 Å²	135.9	71%	0.709	74%	0.736	S	S	*	*			cis	-163.3	167.5	-25.2	-106.1	-167	-159.9	-174.7	24.4	112.8
920	L	32.1	Very low	29.4	Very low	155 Å²	155	136.2 Å²	136.2	81%	0.812	74%	0.737	S	S	*	*			trans	5.1	157.5	158.1	-79.3	68.6	0	0	0	121.7
921	A	28.5	Very low	30.5	Very low	69 Å²	69	135.4 Å²	135.4	57%	0.57	73%	0.734	S	S	*	*				-173.9	172.7	50.2	0	0	0	0	0	116.7
922	H	29.1	Very low	30.9	Very low	188 Å²	188	136.7 Å²	136.7	87%	0.87	74%	0.741	S	S	*	*			trans	67	158.6	158.5	-52.9	-53.6	0	0	0	120.6
923	S	26.2	Very low	30.6	Very low	95 Å²	95	135.2 Å²	135.2	66%	0.664	74%	0.743	S	S	*	*			cis	-172.1	150	-34.9	-165.9	0	0	0	0	111.7
924	V	31.3	Very low	31.1	Very low	135 Å²	135	133.7 Å²	133.7	82%	0.818	74%	0.744	S	S	*	*			trans	50.7	155.2	166.2	-83.8	0	0	0	0	120.7
925	H	29.7	Very low	31.3	Very low	169 Å²	169	134.9 Å²	134.9	78%	0.782	75%	0.749	S	S	*	*			cis	-154.7	150.7	-18.7	-162.2	64.9	0	0	0	106.6
926	N	27	Very low	31	Very low	148 Å²	148	139.4 Å²	139.4	79%	0.791	76%	0.755	S	S	*	*				174.3	156.7	96.7	-166.6	8.7	0	0	0	110.2
927	G	29.1	Very low	30.7	Very low	55 Å²	55	136.6 Å²	136.6	57%	0.567	75%	0.754	S	S	*	*			trans	-95.5	-163.3	-173.3	0	0	0	0	0	116.3
928	Q	29.3	Very low	30.4	Very low	185 Å²	185	136 Å²	136	86%	0.864	75%	0.754	S	S	*	*			cis	-166.5	156.1	-1.4	-137.9	-175.7	50.5	0	0	112.8
929	K	25.4	Very low	30.1	Very low	168 Å²	168	136 Å²	136	73%	0.73	76%	0.763	S	S	*	*			trans	81.6	93	141	-159	174.9	-176.4	-179	0	123.9
930	L	26.9	Very low	31	Very low	160 Å²	160	132.7 Å²	132.7	84%	0.838	77%	0.766	S	S	*	*				67.4	160.5	125.1	-68.9	174.3	0	0	0	123.3
931	P	53.1	Low	31.6	Very low	109 Å²	109	130.4 Å²	130.4	71%	0.708	76%	0.761	S	S	*	*			trans	-101.3	-176.5	-165.3	42.2	-38	0	0	0	114.8
932	P	40	Very low	31.6	Very low	110 Å²	110	136.6 Å²	136.6	71%	0.714	78%	0.775	S	S	*	*				-157.3	169.4	107.3	42.2	-24.3	0	0	0	118.7
933	T	26.9	Very low	31.6	Very low	133 Å²	133	136 Å²	136	82%	0.816	77%	0.77	S	S	*	*			trans	44.4	144.2	144.4	54.8	0	0	0	0	124.6
934	S	36	Very low	31.8	Very low	113 Å²	113	138 Å²	138	79%	0.79	77%	0.768	S	S	*	*			trans	-83.7	155.9	162.9	56.7	0	0	0	0	113.5
935	P	34.3	Very low	31.6	Very low	129 Å²	129	137.2 Å²	137.2	84%	0.838	76%	0.764	S	S	*	*				-145.1	-163.2	126.5	39.4	-24	0	0	0	114.9
936	K	23.5	Very low	31.3	Very low	202 Å²	202	132.1 Å²	132.1	88%	0.878	76%	0.757	S	S	*	*			trans	-92.9	143.1	-158.1	-57.1	167.5	-178.1	171.3	0	115.8
937	C	20.8	Very low	32.5	Very low	115 Å²	115	130.8 Å²	130.8	78%	0.777	76%	0.757	S	S	*	*				59.1	117	128.4	-153.5	0	0	0	0	123.1
938	S	24.9	Very low	32.5	Very low	96 Å²	96	135 Å²	135	67%	0.671	77%	0.766	S	S	*	*			trans	86.1	144.9	135.9	74.5	0	0	0	0	125
939	T	25.3	Very low	32.4	Very low	134 Å²	134	130.5 Å²	130.5	82%	0.822	76%	0.755	S	S	*	*			trans	112.4	136.2	150.5	64.9	0	0	0	0	120.7
940	P	51.3	Low	32.4	Very low	118 Å²	118	128 Å²	128	77%	0.766	75%	0.754	S	S	*	*			trans	-110.7	-154.1	173.2	46.7	-38	0	0	0	111
941	P	44.9	Very low	32.5	Very low	107 Å²	107	130.6 Å²	130.6	70%	0.695	75%	0.753	S	S	*	*			cis	-140.3	-157.8	-2.9	41.6	-19.1	0	0	0	116
942	K	29.5	Very low	31.2	Very low	200 Å²	200	130.3 Å²	130.3	87%	0.87	75%	0.749	S	S	*	*			trans	89.1	149.3	176.4	-59.2	171.9	178.4	172.6	0	114.1
943	K	29	Very low	30.4	Very low	176 Å²	176	130.2 Å²	130.2	77%	0.765	75%	0.751	S	S	*	*			cis	-144.5	177.1	11	-131.5	-171.8	-177.9	-160.6	0	107
944	Q	29.5	Very low	30.5	Very low	135 Å²	135	135.1 Å²	135.1	63%	0.631	76%	0.755	S	S	*	*			cis	-160.4	175.6	-3.9	-147.4	-176.5	-102	0	0	104.6
945	T	27.5	Very low	30.9	Very low	120 Å²	120	135.6 Å²	135.6	74%	0.736	76%	0.755	S	S	*	*			cis	-143.5	-79.9	8.5	-42.8	0	0	0	0	113.2
946	G	23.4	Very low	30.5	Very low	61 Å²	61	134.1 Å²	134.1	63%	0.629	75%	0.754	S	S	*	*			trans	120.4	-158.4	-163.7	0	0	0	0	0	111.4
947	P	52.2	Low	30.7	Very low	121 Å²	121	127.9 Å²	127.9	79%	0.786	75%	0.747	S	S	*	*			cis	-114.1	-156.2	-7.2	45.8	-33.3	0	0	0	109.5
948	D	28	Very low	30.9	Very low	142 Å²	142	129.4 Å²	129.4	76%	0.759	74%	0.742	S	S	*	*			cis	-160.4	165.2	-13.3	-127.9	-33.3	0	0	0	105.8
949	S	27.6	Very low	30.9	Very low	91 Å²	91	134.1 Å²	134.1	64%	0.636	75%	0.745	S	S	*	*			cis	-137.5	-99.7	-3.6	-162.2	0	0	0	0	112
950	T	26.8	Very low	31	Very low	115 Å²	115	138 Å²	138	71%	0.706	75%	0.745	S	S	*	*			cis	-150.2	79.4	-7.1	-46.6	0	0	0	0	111.9
951	R	27.2	Very low	29.5	Very low	216 Å²	216	137.9 Å²	137.9	82%	0.815	75%	0.746	S	S	*	*			trans	66.9	147.1	163.9	-64.3	178.6	57.6	-170	-2.7	117.1
952	T	26.6	Very low	28.9	Very low	103 Å²	103	138.1 Å²	138.1	63%	0.632	75%	0.75	S	S	*	*			cis	-152	143.9	-2.7	-5.1	0	0	0	0	113.8
953	S	23.8	Very low	29.3	Very low	107 Å²	107	134 Å²	134	75%	0.748	74%	0.744	S	S	*	*			trans	46.5	110.3	141.9	62	0	0	0	0	123.7
954	R	28.9	Very low	29.2	Very low	237 Å²	237	131 Å²	131	89%	0.894	74%	0.74	S	S	*	*			trans	-50.7	171.9	137.2	-99.8	179.3	179.3	-166.9	0.1	113.7
955	P	43.9	Very low	28.9	Very low	122 Å²	122	130.4 Å²	130.4	79%	0.792	74%	0.741	S	S	*	*			cis	-136.1	-152.8	45.8	35.7	-10.9	0	0	0	113.3
956	A	26.8	Very low	28.9	Very low	99 Å²	99	131.2 Å²	131.2	82%	0.818	74%	0.741	S	S	*	*			cis	-159.1	-169.4	8.3	0	0	0	0	0	112.3
957	G	26.5	Very low	29	Very low	71 Å²	71	134.6 Å²	134.6	73%	0.732	75%	0.745	S	S	*	*				114.7	37.3	122	0	0	0	0	0	124.8
958	E	24.4	Very low	27.8	Very low	147 Å²	147	134.3 Å²	134.3	69%	0.687	74%	0.741	S	S	*	*			trans	47	122.2	131	-152.6	168.4	162.7	0	0	125.4
959	R	26.8	Very low	27.7	Very low	194 Å²	194	138.4 Å²	138.4	73%	0.732	75%	0.745	S	S	*	*			trans	50.6	138.1	145.1	-66.2	-172.3	-108.8	-135.9	0.9	124.4
960	R	25.5	Very low	27.6	Very low	215 Å²	215	138.3 Å²	138.3	81%	0.811	75%	0.745	S	S	*	*			trans	90.9	142.9	141.1	-91.5	-173.3	-67	-152.1	-0.3	121.7
961	C	21.6	Very low	27.5	Very low	116 Å²	116	138 Å²	138	78%	0.784	75%	0.747	S	S	*	*			trans	62.3	134.5	145	-65.1	0	0	0	0	122.4
962	S	30.8	Very low	27.6	Very low	112 Å²	112	133.1 Å²	133.1	78%	0.783	75%	0.747	S	S	*	*			trans	-67.8	160.9	149.6	-31.6	0	0	0	0	109.8
963	P	38.3	Very low	27.8	Very low	114 Å²	114	135.7 Å²	135.7	74%	0.74	75%	0.749	S	S	*	*				-155.1	-170.2	64.6	46.6	-26.1	0	0	0	116.7
964	T	26.3	Very low	28.4	Very low	113 Å²	113	136.7 Å²	136.7	69%	0.693	75%	0.753	S	S	*	*			trans	26.7	157.8	156.8	-6.5	0	0	0	0	125.2
965	D	24.8	Very low	28.3	Very low	122 Å²	122	133.6 Å²	133.6	65%	0.652	75%	0.753	S	S	*	*			trans	78.1	114.4	151.6	-69.5	-48.5	0	0	0	117.4
966	N	26.3	Very low	27.5	Very low	137 Å²	137	132.4 Å²	132.4	73%	0.733	75%	0.753	S	S	*	*				74	138.9	79.8	-86.4	-46.3	0	0	0	112.5
967	N	25.5	Very low	27.4	Very low	133 Å²	133	132.5 Å²	132.5	71%	0.711	76%	0.755	S	S	*	*			cis	-172.2	-173.7	-8.6	-167.6	-16.6	0	0	0	106.2
968	V	27.6	Very low	27.1	Very low	114 Å²	114	134.8 Å²	134.8	69%	0.691	76%	0.758	S	S	*	*			trans	70.9	135.9	159.3	171.7	0	0	0	0	114
969	R	25.8	Very low	27	Very low	228 Å²	228	133.6 Å²	133.6	86%	0.86	77%	0.766	S	S	*	*			cis	-164.5	-178	1.4	-123.7	-179.5	-174.5	-179.5	-0.8	106.8
970	S	25.1	Very low	27	Very low	89 Å²	89	129.7 Å²	129.7	62%	0.622	77%	0.768	S	S	*	*			cis	-162	157.7	0.6	-139.9	0	0	0	0	111.3
971	S	25.7	Very low	27.6	Very low	109 Å²	109	123.8 Å²	123.8	76%	0.762	77%	0.766	S	S	*	*			trans	43.7	119.2	137.3	-177.2	0	0	0	0	120.3
972	S	28.8	Very low	28.1	Very low	114 Å²	114	123.9 Å²	123.9	80%	0.797	76%	0.764	S	S	*	*				-152.9	160.6	90.4	52.1	0	0	0	0	116.8
973	K	31	Very low	28.1	Very low	157 Å²	157	126 Å²	126	68%	0.683	77%	0.767	S	S	*	*			trans	-78.3	176	158.4	-67.5	179.9	-179.8	174.4	0	109.6	D523	D523-K973 IonicContact OD1-NZ 3.7Å; D523-K973 PolarHBondContact OD1-NZ 3.41Å
974	P	36.9	Very low	27.8	Very low	128 Å²	128	126.2 Å²	126.2	83%	0.831	77%	0.766	S	S	*	*			cis	-132.1	-165.7	3.2	33.2	-9.5	0	0	0	115.6
975	L	26.1	Very low	28.3	Very low	171 Å²	171	129.3 Å²	129.3	90%	0.895	77%	0.771	S	S	*	*			trans	-69.6	151.1	-177.4	-56.5	155.9	0	0	0	115.5
976	A	27.2	Very low	28.9	Very low	97 Å²	97	129 Å²	129	80%	0.802	78%	0.776	S	S	*	*			trans	-171.8	148.4	138.6	0	0	0	0	0	114
977	A	24.1	Very low	29.4	Very low	102 Å²	102	127.7 Å²	127.7	84%	0.843	77%	0.774	S	S	*	*			trans	63.9	176	152.2	0	0	0	0	0	121
978	C	20.7	Very low	29.8	Very low	119 Å²	119	126.4 Å²	126.4	80%	0.804	77%	0.773	S	S	*	*			trans	-118.2	173.6	-162	-58.4	0	0	0	0	113.4
979	S	22.5	Very low	30.3	Very low	122 Å²	122	126.6 Å²	126.6	85%	0.853	78%	0.777	S	S	*	*			trans	72.7	141.8	169.2	-57.2	0	0	0	0	115.9
980	S	27	Very low	30.9	Very low	111 Å²	111	122.3 Å²	122.3	78%	0.776	77%	0.771	S	S	*	*			cis	-150.3	163.6	-4.8	48.3	0	0	0	0	110.6
981	A	36.9	Very low	32.4	Very low	92 Å²	92	126.4 Å²	126.4	76%	0.76	77%	0.773	S	S	*	*			trans	36.6	132.9	165.8	0	0	0	0	0	120.2
982	P	32.3	Very low	33.9	Very low	117 Å²	117	125.6 Å²	125.6	76%	0.76	77%	0.767	S	S	*	*				-138	132.9	97.8	35.8	-25.2	0	0	0	114.1
983	D	32.2	Very low	35.3	Very low	156 Å²	156	122 Å²	122	83%	0.834	74%	0.74	S	S	*	*			trans	-70.7	132.8	157.5	-102	-55.5	0	0	0	109.5
984	T	31.7	Very low	36.6	Very low	119 Å²	119	118 Å²	118	73%	0.73	73%	0.732	S	S	*	*			trans	-150.4	105.3	168.8	-60.7	0	0	0	0	109
985	F	37	Very low	37.8	Very low	179 Å²	179	113.4 Å²	113.4	79%	0.785	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-52.9	143.4	172.9	-67	-95.4	0	0	0	111.1
986	P	35.5	Very low	39.8	Very low	116 Å²	116	114.2 Å²	114.2	75%	0.753	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-60.7	131	172.4	26.6	-33.7	0	0	0	109.4
987	P	38.2	Very low	42.4	Very low	108 Å²	108	113.7 Å²	113.7	70%	0.701	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-66.3	147.2	-174.2	26.3	-34.8	0	0	0	111.5
988	P	34.1	Very low	45.4	Very low	106 Å²	106	113.5 Å²	113.5	69%	0.688	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-60.6	152.6	177.5	25.8	-34.4	0	0	0	111.6	N990	P988-N990 PolarHBondContact O-N 2.81Å
989	P	37.4	Very low	48.6	Very low	118 Å²	118	108 Å²	108	77%	0.766	63%	0.631	S	S	*	*			trans	-64.6	113.3	-173.8	25.6	-34.3	0	0	0	111.3	R991	P989-R991 VanDerWaalsContact C-N 3.35Å; P989-R991 PolarHBondContact O-N 2.89Å
990	N	39.4	Very low	51.7	Low	138 Å²	138	105.2 Å²	105.2	74%	0.738	61%	0.611	S	S	*	*			trans	-62.1	85.9	179.9	-87.1	-71.2	0	0	0	112.3	P988 S992	P988-N990 PolarHBondContact O-N 2.81Å; N990-S992 PolarHBondContact O-N 2.83Å
991	R	55.5	Low	54.3	Low	176 Å²	176	103.6 Å²	103.6	66%	0.664	60%	0.6	S	S	*	*			trans	-73	46.8	166.8	-78	-176.7	164.4	-103.7	1.9	111.5	P989 V993 E1015	P989-R991 VanDerWaalsContact C-N 3.35Å; P989-R991 PolarHBondContact O-N 2.89Å; R991-V993 PolarHBondContact O-N 3.29Å; R991-V993 VanDerWaalsContact O-N 3.09Å; R991-E1015 IonicContact CZ-OE2 2.69Å; R991-E1015 IonicContact NH1-OE1 3.45Å; R991-E1015 IonicContact NH1-OE2 3.83Å; R991-E1015 PolarHBondContact NH1-OE2 3.22Å; R991-E1015 IonicContact NH2-OE2 3.09Å; R991-E1015 PolarHBondContact NH2-OE2 3.2Å; R991-E1015 VanDerWaalsContact NH2-OE2 3.11Å
992	S	57.7	Low	56.7	Low	92 Å²	92	101.1 Å²	101.1	64%	0.643	58%	0.577	S	S	*	*			trans	-69.7	103.6	-179.3	-49	0	0	0	0	110.7	N990 S994	N990-S992 PolarHBondContact O-N 2.83Å; S992-S994 PolarHBondContact O-N 3.47Å
993	V	58.4	Low	59.3	Low	37 Å²	37	99.8 Å²	99.8	22%	0.224	57%	0.57	C	S	.	*			trans	-62.5	126.6	174.8	-174.9	0	0	0	0	109.2	R991 G995 K997 L1006 I1013 Y1020	R991-V993 PolarHBondContact O-N 3.29Å; R991-V993 VanDerWaalsContact O-N 3.09Å; V993-G995 PolarHBondContact O-N 3.38Å; V993-G995 VanDerWaalsContact O-N 3.16Å; V993-K997 HydrophobicContact CG1-CB 3.97Å; V993-K997 HydrophobicContact CG1-CG 4.02Å; V993-L1006 HydrophobicContact CG1-CD1 4.22Å; V993-I1013 HydrophobicContact CG2-CD1 3.39Å; V993-I1013 HydrophobicContact CG2-CG1 4.08Å; V993-Y1020 HydrophobicContact CG1-CD1 4.46Å
994	S	58.6	Low	61.8	Low	75 Å²	75	98.3 Å²	98.3	52%	0.524	56%	0.558	S	S	.	*			trans	-64	118.8	172.4	-169.9	0	0	0	0	109.3	S992 K996 K997	S992-S994 PolarHBondContact O-N 3.47Å; S994-K996 PolarHBondContact O-N 3.13Å; S994-K997 PolarHBondContact O-N 3.19Å
995	G	61.5	Low	64.4	Low	31 Å²	31	96.2 Å²	96.2	32%	0.32	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	4.8	-176.8	0	0	0	0	0	116.8	V993 K997 G1007	V993-G995 PolarHBondContact O-N 3.38Å; V993-G995 VanDerWaalsContact O-N 3.16Å; G995-K997 VanDerWaalsContact C-N 3.33Å; G995-G1007 WeakPolarHBondContact CA-O 3.43Å
996	K	67.8	Low	66.5	Low	187 Å²	187	88.2 Å²	88.2	81%	0.813	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-15.3	165.8	-58.4	-179.4	179.9	-178.7	0	113	S994	S994-K996 PolarHBondContact O-N 3.13Å
997	K	82.6	Confident	68.4	Low	86 Å²	86	84.3 Å²	84.3	37%	0.374	49%	0.493	S	S	.	.	S	Bend	trans	-76.1	136.1	175.4	-67.6	-70.7	-171.5	157.1	0	110.3	V993 S994 G995 L1006 Y1020	V993-K997 HydrophobicContact CG1-CB 3.97Å; V993-K997 HydrophobicContact CG1-CG 4.02Å; S994-K997 PolarHBondContact O-N 3.19Å; G995-K997 VanDerWaalsContact C-N 3.33Å; K997-L1006 HydrophobicContact CB-CD1 3.87Å; K997-L1006 WeakPolarHBondContact O-CG 3.46Å; K997-L1006 PolarHBondContact O-N 2.83Å; K997-Y1020 HydrophobicContact CB-CD2 4.44Å; K997-Y1020 HydrophobicContact CD-CD2 4.25Å; K997-Y1020 HydrophobicContact CD-CE1 4.47Å; K997-Y1020 HydrophobicContact CD-CE2 3.64Å; K997-Y1020 WeakPolarHBondContact CE-OH 3.46Å; K997-Y1020 HydrophobicContact CG-CE1 4.48Å; K997-Y1020 HydrophobicContact CG-CE2 4.33Å; K997-Y1020 PolarHBondContact NZ-OH 2.74Å
998	L	86.1	Confident	69.9	Low	98 Å²	98	89.9 Å²	89.9	51%	0.513	51%	0.506	S	S	.	.	B	Isolated β-bridge	trans	-95.1	149.3	179.2	-55.2	-177.7	0	0	0	110.8	P1005	L998-P1005 HydrophobicContact CD2-CB 4.12Å
999	C	88	Confident	71.7	Confident	3 Å²	3	87.2 Å²	87.2	2%	0.02	50%	0.498	C	S	.	.	P	Polyproline II helix	trans	-73.4	124.3	172.8	176.4	0	0	0	0	111	S1001 C1002 S1003 Q1004 L1006 Y1020 H1022	C999-S1001 PolarHBondContact O-N 2.75Å; C999-S1001 VanDerWaalsContact O-N 3.11Å; C999-C1002 VanDerWaalsContact CB-SG 3.55Å; C999-S1003 WeakPolarHBondContact O-CA 3.27Å; C999-S1003 PolarHBondContact O-N 2.76Å; C999-Q1004 WeakPolarHBondContact CB-O 3.45Å; C999-Q1004 PolarHBondContact N-O 3.06Å; C999-L1006 HydrophobicContact CB-CD2 3.86Å; C999-Y1020 CarbonylContact C-O 3.56Å; C999-Y1020 VanDerWaalsContact CA-O 3.3Å; C999-Y1020 WeakPolarHBondContact CA-O 3.36Å; C999-H1022 VanDerWaalsContact CB-CE1 3.41Å; C999-H1022 WeakPolarHBondContact CB-CE1 3.46Å; C999-H1022 VanDerWaalsContact CB-ND1 3.29Å; C999-H1022 WeakPolarHBondContact CB-ND1 3.44Å; C999-H1022 PolarHBondContact SG-ND1 3.19Å; C999-H1022 VanDerWaalsContact SG-ND1 3.38Å
1000	S	87	Confident	73.5	Confident	64 Å²	64	85.4 Å²	85.4	45%	0.448	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-9.7	-179.7	-54.3	0	0	0	0	114.1	Y1020	S1000-Y1020 PolarHBondContact N-O 3.16Å; S1000-Y1020 PolarHBondContact OG-N 2.7Å; S1000-Y1020 PolarHBondContact OG-O 3.44Å
1001	S	83.3	Confident	75.6	Confident	77 Å²	77	79.9 Å²	79.9	54%	0.538	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-40.4	178.3	170	0	0	0	0	113.8	C999	C999-S1001 PolarHBondContact O-N 2.75Å; C999-S1001 VanDerWaalsContact O-N 3.11Å
1002	C	86.7	Confident	77	Confident	40 Å²	40	73.5 Å²	73.5	27%	0.27	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	1.8	-176.7	72.1	0	0	0	0	114.4	C999 Q1004 H1022	C999-C1002 VanDerWaalsContact CB-SG 3.55Å; C1002-Q1004 PolarHBondContact O-N 3.35Å; C1002-H1022 PolarHBondContact SG-CE1 3.24Å; C1002-H1022 PolarHBondContact SG-ND1 3.08Å; C1002-H1022 VanDerWaalsContact SG-ND1 3.39Å
1003	S	85.9	Confident	78.3	Confident	90 Å²	90	71.9 Å²	71.9	63%	0.629	43%	0.428	S	S	*	.			trans	59.7	-3	-177.7	71	0	0	0	0	117.2	C999	C999-S1003 WeakPolarHBondContact O-CA 3.27Å; C999-S1003 PolarHBondContact O-N 2.76Å
1004	Q	85.4	Confident	79.6	Confident	125 Å²	125	71.3 Å²	71.3	58%	0.584	42%	0.423	S	S	*	.	S	Bend	trans	-77.9	152.3	177.9	-65.3	177.9	6.4	0	0	112.2	C999 C1002	C999-Q1004 WeakPolarHBondContact CB-O 3.45Å; C999-Q1004 PolarHBondContact N-O 3.06Å; C1002-Q1004 PolarHBondContact O-N 3.35Å
1005	P	86.5	Confident	80.8	Confident	75 Å²	75	73.6 Å²	73.6	49%	0.487	43%	0.426	S	S	.	.	B	Isolated β-bridge	trans	-63	147.6	175	26.8	-35	0	0	0	112.4	L998 G1007 H1022	L998-P1005 HydrophobicContact CD2-CB 4.12Å; P1005-G1007 VanDerWaalsContact C-N 3.3Å; P1005-G1007 PolarHBondContact O-N 3.25Å; P1005-H1022 PolarHBondContact O-NE2 3.1Å
1006	L	80.3	Confident	81.7	Confident	11 Å²	11	78.3 Å²	78.3	6%	0.058	45%	0.449	C	S	.	.			trans	-79.6	-11.4	-177.3	-62.7	159.2	0	0	0	113.5	V993 K997 C999 A1011 Y1020	V993-L1006 HydrophobicContact CG1-CD1 4.22Å; K997-L1006 HydrophobicContact CB-CD1 3.87Å; K997-L1006 WeakPolarHBondContact O-CG 3.46Å; K997-L1006 PolarHBondContact O-N 2.83Å; C999-L1006 HydrophobicContact CB-CD2 3.86Å; L1006-A1011 HydrophobicContact CD2-CB 4.14Å; L1006-Y1020 VanDerWaalsContact CD1-CB 3.42Å; L1006-Y1020 HydrophobicContact CD1-CG 4.13Å
1007	G	76	Confident	82.4	Confident	34 Å²	34	74 Å²	74	35%	0.351	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.9	-140.1	174.9	0	0	0	0	0	113.6	G995 P1005	G995-G1007 WeakPolarHBondContact CA-O 3.43Å; P1005-G1007 VanDerWaalsContact C-N 3.3Å; P1005-G1007 PolarHBondContact O-N 3.25Å
1008	K	70.3	Confident	82.4	Confident	225 Å²	225	73.4 Å²	73.4	98%	0.978	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	40.6	174.5	-64.2	-175.6	178.2	-178.3	0	111
1009	G	70.4	Confident	82.4	Confident	49 Å²	49	71 Å²	71	51%	0.505	43%	0.428	S	S	.	.	S	Bend	trans	-113.1	168.3	-179.1	0	0	0	0	0	112.8
1010	A	75.9	Confident	82.4	Confident	80 Å²	80	72.5 Å²	72.5	66%	0.661	43%	0.434	S	S	*	.			trans	-65.3	140	167.6	0	0	0	0	0	110.6	I1023	A1010-I1023 HydrophobicContact CB-CD1 3.78Å
1011	A	83.9	Confident	82.5	Confident	22 Å²	22	70 Å²	70	18%	0.182	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	145.6	-174.4	0	0	0	0	0	109.9	L1006 F1021	L1006-A1011 HydrophobicContact CD2-CB 4.14Å; A1011-F1021 CarbonylContact C-O 3.57Å; A1011-F1021 WeakPolarHBondContact CA-O 3.46Å; A1011-F1021 WeakPolarHBondContact CB-O 3.19Å
1012	M	85.4	Confident	82.7	Confident	42 Å²	42	68.2 Å²	68.2	21%	0.207	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	129.7	174.4	-61.6	-60	-75.3	0	0	109	Y1020 F1021 I1023 F1026	M1012-Y1020 CarbonylContact O-C 3.48Å; M1012-F1021 HydrophobicContact CB-CB 4.42Å; M1012-F1021 PolarHBondContact N-O 3.14Å; M1012-F1021 PolarHBondContact O-N 3.02Å; M1012-I1023 HydrophobicContact CG-CG1 4.42Å; M1012-F1026 HydrophobicContact CB-CB 4Å; M1012-F1026 HydrophobicContact CB-CD1 3.68Å; M1012-F1026 HydrophobicContact CB-CD2 4Å; M1012-F1026 HydrophobicContact CB-CE1 4.16Å; M1012-F1026 HydrophobicContact CB-CE2 4.43Å; M1012-F1026 HydrophobicContact CB-CG 3.62Å; M1012-F1026 HydrophobicContact CE-CD1 3.64Å; M1012-F1026 HydrophobicContact CE-CE1 3.57Å; M1012-F1026 HydrophobicContact CG-CB 3.88Å; M1012-F1026 HydrophobicContact CG-CD1 3.55Å; M1012-F1026 HydrophobicContact CG-CE1 4.28Å; M1012-F1026 HydrophobicContact CG-CG 3.8Å; M1012-F1026 HydrophobicContact SD-CD1 4.44Å
1013	I	84.8	Confident	82.6	Confident	59 Å²	59	68.7 Å²	68.7	30%	0.303	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122.1	-169.9	-48.6	169.4	0	0	0	108.9	V993 E1015 Y1020	V993-I1013 HydrophobicContact CG2-CD1 3.39Å; V993-I1013 HydrophobicContact CG2-CG1 4.08Å; I1013-E1015 HydrophobicContact CG2-CB 4.31Å; I1013-Y1020 HydrophobicContact CB-CD1 4.49Å; I1013-Y1020 HydrophobicContact CG1-CD1 4.29Å; I1013-Y1020 HydrophobicContact CG2-CD1 3.78Å; I1013-Y1020 HydrophobicContact CG2-CE1 3.79Å
1014	I	85.6	Confident	82.4	Confident	25 Å²	25	71.5 Å²	71.5	13%	0.128	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	85	166.4	-54.8	179.9	0	0	0	106.7	T1016 L1017 S1018 L1019 F1021 F1026 V1044 I1046 L1051	I1014-T1016 VanDerWaalsContact C-N 3.28Å; I1014-T1016 PolarHBondContact O-N 2.9Å; I1014-L1017 HydrophobicContact CG2-CB 4.08Å; I1014-L1017 HydrophobicContact CG2-CD1 4.09Å; I1014-L1017 HydrophobicContact CG2-CG 4.13Å; I1014-L1017 PolarHBondContact O-N 3.47Å; I1014-S1018 PolarHBondContact O-N 3.31Å; I1014-S1018 VanDerWaalsContact O-N 3.08Å; I1014-L1019 HydrophobicContact CB-CB 4.34Å; I1014-L1019 PolarHBondContact N-O 3.44Å; I1014-L1019 PolarHBondContact O-N 3.29Å; I1014-F1021 HydrophobicContact CD1-CE2 4.28Å; I1014-F1026 HydrophobicContact CD1-CE2 4.03Å; I1014-F1026 HydrophobicContact CD1-CZ 4.36Å; I1014-F1026 HydrophobicContact CG1-CE2 4.39Å; I1014-V1044 HydrophobicContact CD1-CG2 3.95Å; I1014-I1046 HydrophobicContact CD1-CD1 3.81Å; I1014-L1051 HydrophobicContact CD1-CD2 3.72Å
1015	E	83.4	Confident	82.5	Confident	122 Å²	122	67 Å²	67	57%	0.57	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-57.3	-40	-169.7	-170.7	162.1	-160.5	0	0	112	R991 I1013 L1017 S1018	R991-E1015 IonicContact CZ-OE2 2.69Å; R991-E1015 IonicContact NH1-OE1 3.45Å; R991-E1015 IonicContact NH1-OE2 3.83Å; R991-E1015 PolarHBondContact NH1-OE2 3.22Å; R991-E1015 IonicContact NH2-OE2 3.09Å; R991-E1015 PolarHBondContact NH2-OE2 3.2Å; R991-E1015 VanDerWaalsContact NH2-OE2 3.11Å; I1013-E1015 HydrophobicContact CG2-CB 4.31Å; E1015-L1017 VanDerWaalsContact C-N 3.25Å; E1015-L1017 PolarHBondContact O-N 2.76Å; E1015-S1018 PolarHBondContact O-N 3.13Å
1016	T	81.4	Confident	82.6	Confident	131 Å²	131	63.8 Å²	63.8	80%	0.804	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-63.4	-21.9	177.4	50	0	0	0	0	115	I1014	I1014-T1016 VanDerWaalsContact C-N 3.28Å; I1014-T1016 PolarHBondContact O-N 2.9Å
1017	L	81.6	Confident	83	Confident	96 Å²	96	67.4 Å²	67.4	50%	0.503	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-116.1	3.5	-179.7	-62.2	177.7	0	0	0	112.6	I1014 E1015 L1019 I1046	I1014-L1017 HydrophobicContact CG2-CB 4.08Å; I1014-L1017 HydrophobicContact CG2-CD1 4.09Å; I1014-L1017 HydrophobicContact CG2-CG 4.13Å; I1014-L1017 PolarHBondContact O-N 3.47Å; E1015-L1017 VanDerWaalsContact C-N 3.25Å; E1015-L1017 PolarHBondContact O-N 2.76Å; L1017-L1019 HydrophobicContact CB-CD1 4.12Å; L1017-L1019 HydrophobicContact CB-CG 3.92Å; L1017-L1019 HydrophobicContact CD1-CD1 4.33Å; L1017-L1019 PolarHBondContact O-N 2.95Å; L1017-L1019 VanDerWaalsContact O-N 3.1Å; L1017-I1046 HydrophobicContact CD1-CD1 3.42Å; L1017-I1046 VanDerWaalsContact CD1-CD1 3.42Å
1018	S	82.9	Confident	83.6	Confident	74 Å²	74	65.9 Å²	65.9	52%	0.517	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	31.1	-171.9	-69.5	0	0	0	0	113.9	I1014 E1015 Y1020	I1014-S1018 PolarHBondContact O-N 3.31Å; I1014-S1018 VanDerWaalsContact O-N 3.08Å; E1015-S1018 PolarHBondContact O-N 3.13Å; S1018-Y1020 VanDerWaalsContact O-CD2 3.24Å; S1018-Y1020 WeakPolarHBondContact O-CD2 3.35Å; S1018-Y1020 WeakPolarHBondContact O-CE2 3.48Å
1019	L	86.5	Confident	84.3	Confident	47 Å²	47	57.1 Å²	57.1	25%	0.246	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	138.2	174.1	-57.7	177.8	0	0	0	109.6	I1014 L1017 F1021 I1046	I1014-L1019 HydrophobicContact CB-CB 4.34Å; I1014-L1019 PolarHBondContact N-O 3.44Å; I1014-L1019 PolarHBondContact O-N 3.29Å; L1017-L1019 HydrophobicContact CB-CD1 4.12Å; L1017-L1019 HydrophobicContact CB-CG 3.92Å; L1017-L1019 HydrophobicContact CD1-CD1 4.33Å; L1017-L1019 PolarHBondContact O-N 2.95Å; L1017-L1019 VanDerWaalsContact O-N 3.1Å; L1019-F1021 HydrophobicContact CB-CE2 3.67Å; L1019-F1021 HydrophobicContact CB-CZ 4.02Å; L1019-F1021 HydrophobicContact CD1-CZ 4.39Å; L1019-I1046 HydrophobicContact CD1-CD1 3.88Å
1020	Y	87.7	Confident	85	Confident	35 Å²	35	59 Å²	59	14%	0.137	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	140.1	-176.4	-50.2	-91.3	0	0	0	109.4	V993 K997 C999 S1000 L1006 M1012 I1013 S1018	V993-Y1020 HydrophobicContact CG1-CD1 4.46Å; K997-Y1020 HydrophobicContact CB-CD2 4.44Å; K997-Y1020 HydrophobicContact CD-CD2 4.25Å; K997-Y1020 HydrophobicContact CD-CE1 4.47Å; K997-Y1020 HydrophobicContact CD-CE2 3.64Å; K997-Y1020 WeakPolarHBondContact CE-OH 3.46Å; K997-Y1020 HydrophobicContact CG-CE1 4.48Å; K997-Y1020 HydrophobicContact CG-CE2 4.33Å; K997-Y1020 PolarHBondContact NZ-OH 2.74Å; C999-Y1020 CarbonylContact C-O 3.56Å; C999-Y1020 VanDerWaalsContact CA-O 3.3Å; C999-Y1020 WeakPolarHBondContact CA-O 3.36Å; S1000-Y1020 PolarHBondContact N-O 3.16Å; S1000-Y1020 PolarHBondContact OG-N 2.7Å; S1000-Y1020 PolarHBondContact OG-O 3.44Å; L1006-Y1020 VanDerWaalsContact CD1-CB 3.42Å; L1006-Y1020 HydrophobicContact CD1-CG 4.13Å; M1012-Y1020 CarbonylContact O-C 3.48Å; I1013-Y1020 HydrophobicContact CB-CD1 4.49Å; I1013-Y1020 HydrophobicContact CG1-CD1 4.29Å; I1013-Y1020 HydrophobicContact CG2-CD1 3.78Å; I1013-Y1020 HydrophobicContact CG2-CE1 3.79Å; S1018-Y1020 VanDerWaalsContact O-CD2 3.24Å; S1018-Y1020 WeakPolarHBondContact O-CD2 3.35Å; S1018-Y1020 WeakPolarHBondContact O-CE2 3.48Å
1021	F	87.6	Confident	85.5	Confident	11 Å²	11	58.6 Å²	58.6	5%	0.048	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	139.9	-177.1	-55.7	-91.1	0	0	0	110.5	A1011 M1012 I1014 L1019 F1026 L1051	A1011-F1021 CarbonylContact C-O 3.57Å; A1011-F1021 WeakPolarHBondContact CA-O 3.46Å; A1011-F1021 WeakPolarHBondContact CB-O 3.19Å; M1012-F1021 HydrophobicContact CB-CB 4.42Å; M1012-F1021 PolarHBondContact N-O 3.14Å; M1012-F1021 PolarHBondContact O-N 3.02Å; I1014-F1021 HydrophobicContact CD1-CE2 4.28Å; L1019-F1021 HydrophobicContact CB-CE2 3.67Å; L1019-F1021 HydrophobicContact CB-CZ 4.02Å; L1019-F1021 HydrophobicContact CD1-CZ 4.39Å; F1021-F1026 HydrophobicContact CB-CB 4.06Å; F1021-F1026 HydrophobicContact CB-CD2 4.02Å; F1021-F1026 HydrophobicContact CB-CG 4.43Å; F1021-F1026 HydrophobicContact CD1-CD2 4.49Å; F1021-F1026 AromaticContact CD2-CD2 3.55Å; F1021-F1026 HydrophobicContact CD2-CD2 3.55Å; F1021-F1026 AromaticContact CD2-CE2 3.89Å; F1021-F1026 HydrophobicContact CD2-CE2 3.89Å; F1021-F1026 HydrophobicContact CE2-CD2 4.12Å; F1021-F1026 HydrophobicContact CE2-CE2 4.12Å; F1021-F1026 AromaticContact CG-CD2 3.77Å; F1021-F1026 HydrophobicContact CG-CD2 3.77Å; F1021-L1051 HydrophobicContact CD1-CD1 4.19Å; F1021-L1051 HydrophobicContact CD2-CD1 4.4Å; F1021-L1051 HydrophobicContact CE1-CD1 3.74Å; F1021-L1051 HydrophobicContact CE2-CD1 3.97Å; F1021-L1051 HydrophobicContact CE2-CD2 4.47Å; F1021-L1051 HydrophobicContact CZ-CD1 3.63Å; F1021-L1051 HydrophobicContact CZ-CD2 4.39Å; F1021-L1051 HydrophobicContact CZ-CG 4.09Å
1022	H	87.6	Confident	85.6	Confident	40 Å²	40	65.5 Å²	65.5	19%	0.185	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	147	158.6	-52.5	95	0	0	0	108.2	C999 C1002 P1005 H1024 C1025 F1026	C999-H1022 VanDerWaalsContact CB-CE1 3.41Å; C999-H1022 WeakPolarHBondContact CB-CE1 3.46Å; C999-H1022 VanDerWaalsContact CB-ND1 3.29Å; C999-H1022 WeakPolarHBondContact CB-ND1 3.44Å; C999-H1022 PolarHBondContact SG-ND1 3.19Å; C999-H1022 VanDerWaalsContact SG-ND1 3.38Å; C1002-H1022 PolarHBondContact SG-CE1 3.24Å; C1002-H1022 PolarHBondContact SG-ND1 3.08Å; C1002-H1022 VanDerWaalsContact SG-ND1 3.39Å; P1005-H1022 PolarHBondContact O-NE2 3.1Å; H1022-H1024 VanDerWaalsContact C-N 3.26Å; H1022-H1024 PolarHBondContact O-N 2.98Å; H1022-C1025 HydrophobicContact CB-CB 4.29Å; H1022-C1025 WeakPolarHBondContact O-CA 3.4Å; H1022-C1025 WeakPolarHBondContact O-CB 3.34Å; H1022-C1025 PolarHBondContact O-N 3.49Å; H1022-F1026 PolarHBondContact O-N 3.34Å
1023	I	86	Confident	85.5	Confident	50 Å²	50	65.1 Å²	65.1	26%	0.256	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-49.4	-50	179.5	-64.4	166.6	0	0	0	110.9	A1010 M1012 C1025 F1026 Q1034 T1038	A1010-I1023 HydrophobicContact CB-CD1 3.78Å; M1012-I1023 HydrophobicContact CG-CG1 4.42Å; I1023-C1025 PolarHBondContact O-N 3.31Å; I1023-F1026 PolarHBondContact O-N 3.02Å; I1023-Q1034 PolarHBondContact O-NE2 3.28Å; I1023-T1038 HydrophobicContact CD1-CG2 4.36Å
1024	H	81.9	Confident	85.5	Confident	149 Å²	149	65.8 Å²	65.8	69%	0.69	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-61.3	-15.3	177.6	-53.6	104.3	0	0	0	115.8	H1022 K1027	H1022-H1024 VanDerWaalsContact C-N 3.26Å; H1022-H1024 PolarHBondContact O-N 2.98Å; H1024-K1027 WeakPolarHBondContact O-CD 3.36Å; H1024-K1027 VanDerWaalsContact O-CE 3.25Å; H1024-K1027 WeakPolarHBondContact O-CE 3.43Å; H1024-K1027 PolarHBondContact O-NZ 2.88Å
1025	C	86.3	Confident	85.3	Confident	30 Å²	30	65.2 Å²	65.2	20%	0.203	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-102.3	-8.4	178.7	-64.3	0	0	0	0	113	H1022 I1023 K1027	H1022-C1025 HydrophobicContact CB-CB 4.29Å; H1022-C1025 WeakPolarHBondContact O-CA 3.4Å; H1022-C1025 WeakPolarHBondContact O-CB 3.34Å; H1022-C1025 PolarHBondContact O-N 3.49Å; I1023-C1025 PolarHBondContact O-N 3.31Å; C1025-K1027 VanDerWaalsContact C-N 3.3Å; C1025-K1027 PolarHBondContact O-N 3.47Å
1026	F	88.9	Confident	84.7	Confident	7 Å²	7	59.7 Å²	59.7	3%	0.031	33%	0.333	C	S	.	.			trans	-82.4	76.3	-179.1	-163.9	-127.9	0	0	0	110.2	M1012 I1014 F1021 H1022 I1023 Q1034 L1035 V1044 L1051	M1012-F1026 HydrophobicContact CB-CB 4Å; M1012-F1026 HydrophobicContact CB-CD1 3.68Å; M1012-F1026 HydrophobicContact CB-CD2 4Å; M1012-F1026 HydrophobicContact CB-CE1 4.16Å; M1012-F1026 HydrophobicContact CB-CE2 4.43Å; M1012-F1026 HydrophobicContact CB-CG 3.62Å; M1012-F1026 HydrophobicContact CE-CD1 3.64Å; M1012-F1026 HydrophobicContact CE-CE1 3.57Å; M1012-F1026 HydrophobicContact CG-CB 3.88Å; M1012-F1026 HydrophobicContact CG-CD1 3.55Å; M1012-F1026 HydrophobicContact CG-CE1 4.28Å; M1012-F1026 HydrophobicContact CG-CG 3.8Å; M1012-F1026 HydrophobicContact SD-CD1 4.44Å; I1014-F1026 HydrophobicContact CD1-CE2 4.03Å; I1014-F1026 HydrophobicContact CD1-CZ 4.36Å; I1014-F1026 HydrophobicContact CG1-CE2 4.39Å; F1021-F1026 HydrophobicContact CB-CB 4.06Å; F1021-F1026 HydrophobicContact CB-CD2 4.02Å; F1021-F1026 HydrophobicContact CB-CG 4.43Å; F1021-F1026 HydrophobicContact CD1-CD2 4.49Å; F1021-F1026 AromaticContact CD2-CD2 3.55Å; F1021-F1026 HydrophobicContact CD2-CD2 3.55Å; F1021-F1026 AromaticContact CD2-CE2 3.89Å; F1021-F1026 HydrophobicContact CD2-CE2 3.89Å; F1021-F1026 HydrophobicContact CE2-CD2 4.12Å; F1021-F1026 HydrophobicContact CE2-CE2 4.12Å; F1021-F1026 AromaticContact CG-CD2 3.77Å; F1021-F1026 HydrophobicContact CG-CD2 3.77Å; H1022-F1026 PolarHBondContact O-N 3.34Å; I1023-F1026 PolarHBondContact O-N 3.02Å; F1026-Q1034 PolarHBondContact O-NE2 3.08Å; F1026-L1035 HydrophobicContact CD1-CB 4Å; F1026-L1035 WeakPolarHBondContact CD1-O 3.44Å; F1026-L1035 HydrophobicContact CE1-CB 3.98Å; F1026-L1035 PolarHBondContact O-N 2.89Å; F1026-V1044 HydrophobicContact CE1-CG1 4.34Å; F1026-V1044 HydrophobicContact CZ-CG1 3.96Å; F1026-V1044 HydrophobicContact CZ-CG2 4.21Å; F1026-L1051 HydrophobicContact CD2-CD1 3.42Å; F1026-L1051 VanDerWaalsContact CD2-CD1 3.42Å; F1026-L1051 HydrophobicContact CE2-CD1 3.54Å; F1026-L1051 HydrophobicContact CE2-CD2 3.84Å; F1026-L1051 HydrophobicContact CE2-CG 4.37Å; F1026-L1051 HydrophobicContact CG-CD1 4.48Å
1027	K	88.9	Confident	83.8	Confident	88 Å²	88	58.8 Å²	58.8	38%	0.383	32%	0.324	S	S	.	.	B	Isolated β-bridge	trans	-131.6	152.6	-168.9	-78.7	168.8	178.2	158.9	0	112.5	H1024 C1025 G1029 G1033	H1024-K1027 WeakPolarHBondContact O-CD 3.36Å; H1024-K1027 VanDerWaalsContact O-CE 3.25Å; H1024-K1027 WeakPolarHBondContact O-CE 3.43Å; H1024-K1027 PolarHBondContact O-NZ 2.88Å; C1025-K1027 VanDerWaalsContact C-N 3.3Å; C1025-K1027 PolarHBondContact O-N 3.47Å; K1027-G1029 PolarHBondContact O-N 3.19Å; K1027-G1033 WeakPolarHBondContact CA-O 3.39Å
1028	C	89.1	Confident	82.8	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.014	33%	0.332	C	S	.	.			trans	-67.3	120.5	175.3	-178.2	0	0	0	0	110.7	V1030 C1031 K1032 G1033 L1035 L1051 C1053	C1028-V1030 PolarHBondContact O-N 2.87Å; C1028-V1030 VanDerWaalsContact O-N 3.11Å; C1028-C1031 VanDerWaalsContact CB-SG 3.52Å; C1028-C1031 PolarHBondContact SG-SG 3.34Å; C1028-K1032 WeakPolarHBondContact O-CA 3.48Å; C1028-K1032 PolarHBondContact O-N 3.26Å; C1028-G1033 PolarHBondContact N-O 3.36Å; C1028-L1035 HydrophobicContact CB-CD1 4.45Å; C1028-L1035 HydrophobicContact CB-CD2 4.17Å; C1028-L1035 HydrophobicContact CB-CG 4.37Å; C1028-L1051 CarbonylContact C-O 3.57Å; C1028-L1051 WeakPolarHBondContact CA-O 3.47Å; C1028-C1053 HydrophobicContact CB-CB 4.44Å; C1028-C1053 PolarHBondContact SG-N 3.14Å; C1028-C1053 VanDerWaalsContact SG-N 3.36Å
1029	G	84.6	Confident	81.4	Confident	40 Å²	40	62 Å²	62	41%	0.412	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-18.5	178.1	0	0	0	0	0	114.4	K1027 L1051	K1027-G1029 PolarHBondContact O-N 3.19Å; G1029-L1051 PolarHBondContact N-O 3.26Å
1030	V	85.1	Confident	79.9	Confident	88 Å²	88	64.4 Å²	64.4	53%	0.533	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-61.3	178.5	-177.1	0	0	0	0	111.8	C1028 C1056	C1028-V1030 PolarHBondContact O-N 2.87Å; C1028-V1030 VanDerWaalsContact O-N 3.11Å; V1030-C1056 HydrophobicContact CB-CB 3.78Å; V1030-C1056 HydrophobicContact CG1-CB 4.02Å; V1030-C1056 HydrophobicContact CG2-CB 4.16Å
1031	C	86.6	Confident	78.7	Confident	72 Å²	72	67 Å²	67	49%	0.486	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-3.6	-176.1	66.8	0	0	0	0	115	C1028 G1033 C1056	C1028-C1031 VanDerWaalsContact CB-SG 3.52Å; C1028-C1031 PolarHBondContact SG-SG 3.34Å; C1031-G1033 PolarHBondContact O-N 3.16Å; C1031-C1056 VanDerWaalsContact SG-SG 3.68Å
1032	K	86.3	Confident	78	Confident	168 Å²	168	69 Å²	69	73%	0.73	41%	0.411	S	S	*	.			trans	58.9	0.2	-175.8	-58.4	-177.3	-178.8	178.1	0	116.3	C1028	C1028-K1032 WeakPolarHBondContact O-CA 3.48Å; C1028-K1032 PolarHBondContact O-N 3.26Å
1033	G	83.8	Confident	77.6	Confident	33 Å²	33	72.1 Å²	72.1	34%	0.34	43%	0.43	S	S	.	.			trans	-58.7	147.8	171.4	0	0	0	0	0	112.1	K1027 C1028 C1031	K1027-G1033 WeakPolarHBondContact CA-O 3.39Å; C1028-G1033 PolarHBondContact N-O 3.36Å; C1031-G1033 PolarHBondContact O-N 3.16Å
1034	Q	84.4	Confident	77.5	Confident	74 Å²	74	71.1 Å²	71.1	35%	0.346	43%	0.426	S	S	.	.	B	Isolated β-bridge	trans	-57.9	140.1	172.9	-171.4	63.8	25.3	0	0	109.7	I1023 F1026	I1023-Q1034 PolarHBondContact O-NE2 3.28Å; F1026-Q1034 PolarHBondContact O-NE2 3.08Å
1035	L	81.6	Confident	77.8	Confident	12 Å²	12	67.5 Å²	67.5	6%	0.063	41%	0.406	C	S	.	.			trans	-108.1	135.5	164.1	-57.6	171.6	0	0	0	105.4	F1026 C1028 V1044 L1051 C1053	F1026-L1035 HydrophobicContact CD1-CB 4Å; F1026-L1035 WeakPolarHBondContact CD1-O 3.44Å; F1026-L1035 HydrophobicContact CE1-CB 3.98Å; F1026-L1035 PolarHBondContact O-N 2.89Å; C1028-L1035 HydrophobicContact CB-CD1 4.45Å; C1028-L1035 HydrophobicContact CB-CD2 4.17Å; C1028-L1035 HydrophobicContact CB-CG 4.37Å; L1035-V1044 HydrophobicContact CB-CG1 3.95Å; L1035-V1044 HydrophobicContact CD1-CG1 3.88Å; L1035-V1044 HydrophobicContact CD2-CG1 4.34Å; L1035-V1044 HydrophobicContact CG-CG1 4.28Å; L1035-L1051 HydrophobicContact CD1-CB 3.62Å; L1035-L1051 HydrophobicContact CD1-CD1 4.32Å; L1035-L1051 HydrophobicContact CD1-CG 4.44Å; L1035-C1053 HydrophobicContact CD2-CB 3.59Å
1036	G	70.9	Confident	77.7	Confident	7 Å²	7	69 Å²	69	7%	0.072	41%	0.411	C	S	.	.			trans	74.4	105.1	179.5	0	0	0	0	0	114.4	T1042	G1036-T1042 WeakPolarHBondContact CA-OG1 3.4Å; G1036-T1042 PolarHBondContact N-OG1 3.12Å
1037	D	62.2	Low	77.3	Confident	112 Å²	112	74.1 Å²	74.1	60%	0.599	43%	0.431	S	S	*	.			trans	-84.1	145.7	151.1	-55.4	-57.4	0	0	0	107.9	T1039	D1037-T1039 PolarHBondContact O-N 3.25Å
1038	T	60.2	Low	76.5	Confident	112 Å²	112	77.2 Å²	77.2	69%	0.687	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	0.1	-163.6	45.3	0	0	0	0	115.6	I1023	I1023-T1038 HydrophobicContact CD1-CG2 4.36Å
1039	T	52.6	Low	75.7	Confident	125 Å²	125	80.5 Å²	80.5	77%	0.767	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-21.5	-173.9	52.5	0	0	0	0	114.3	D1037	D1037-T1039 PolarHBondContact O-N 3.25Å
1040	T	55.7	Low	75.4	Confident	98 Å²	98	83.2 Å²	83.2	60%	0.601	49%	0.49	S	S	*	.	S	Bend	trans	-137	149.8	-175.5	54.4	0	0	0	0	113.2	T1042	T1040-T1042 PolarHBondContact O-N 3.18Å; T1040-T1042 VanDerWaalsContact O-N 3.1Å
1041	G	63.1	Low	75.6	Confident	89 Å²	89	79.5 Å²	79.5	92%	0.918	47%	0.467	S	S	*	.			trans	-72.4	100.8	-179.3	0	0	0	0	0	112.1
1042	T	72.1	Confident	75.6	Confident	53 Å²	53	76.5 Å²	76.5	33%	0.325	45%	0.446	S	S	.	.			trans	-88.1	130.4	-178	53.1	0	0	0	0	113.8	G1036 T1040	G1036-T1042 WeakPolarHBondContact CA-OG1 3.4Å; G1036-T1042 PolarHBondContact N-OG1 3.12Å; T1040-T1042 PolarHBondContact O-N 3.18Å; T1040-T1042 VanDerWaalsContact O-N 3.1Å
1043	D	78.8	Confident	75.7	Confident	106 Å²	106	70 Å²	70	57%	0.567	42%	0.421	S	S	*	.			trans	-81.7	125.5	179.1	-172.9	20.9	0	0	0	112.3	R1045	D1043-R1045 IonicContact OD1-CZ 3.51Å; D1043-R1045 IonicContact OD1-NH1 3.38Å; D1043-R1045 PolarHBondContact OD1-NH1 3.2Å; D1043-R1045 IonicContact OD1-NH2 3.4Å; D1043-R1045 IonicContact OD2-CZ 2.72Å; D1043-R1045 VanDerWaalsContact OD2-CZ 3.23Å; D1043-R1045 IonicContact OD2-NH1 2.59Å; D1043-R1045 PolarHBondContact OD2-NH1 3.21Å; D1043-R1045 IonicContact OD2-NH2 2.74Å; D1043-R1045 PolarHBondContact OD2-NH2 3.45Å
1044	V	83.8	Confident	75.8	Confident	29 Å²	29	72 Å²	72	18%	0.176	42%	0.424	C	S	.	.			trans	-126.4	145.5	-175.7	-61.7	0	0	0	0	111.2	I1014 F1026 L1035 L1051	I1014-V1044 HydrophobicContact CD1-CG2 3.95Å; F1026-V1044 HydrophobicContact CE1-CG1 4.34Å; F1026-V1044 HydrophobicContact CZ-CG1 3.96Å; F1026-V1044 HydrophobicContact CZ-CG2 4.21Å; L1035-V1044 HydrophobicContact CB-CG1 3.95Å; L1035-V1044 HydrophobicContact CD1-CG1 3.88Å; L1035-V1044 HydrophobicContact CD2-CG1 4.34Å; L1035-V1044 HydrophobicContact CG-CG1 4.28Å; V1044-L1051 HydrophobicContact CB-CD2 4.48Å; V1044-L1051 HydrophobicContact CG2-CD2 4.21Å
1045	R	88.3	Confident	75.7	Confident	72 Å²	72	74.2 Å²	74.2	27%	0.272	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	141.6	176.5	-60.8	-76.2	172.2	-87.4	-8.4	108.6	D1043 L1051 N1052 Y1057	D1043-R1045 IonicContact OD1-CZ 3.51Å; D1043-R1045 IonicContact OD1-NH1 3.38Å; D1043-R1045 PolarHBondContact OD1-NH1 3.2Å; D1043-R1045 IonicContact OD1-NH2 3.4Å; D1043-R1045 IonicContact OD2-CZ 2.72Å; D1043-R1045 VanDerWaalsContact OD2-CZ 3.23Å; D1043-R1045 IonicContact OD2-NH1 2.59Å; D1043-R1045 PolarHBondContact OD2-NH1 3.21Å; D1043-R1045 IonicContact OD2-NH2 2.74Å; D1043-R1045 PolarHBondContact OD2-NH2 3.45Å; R1045-L1051 CarbonylContact O-C 3.59Å; R1045-N1052 HydrophobicContact CB-CB 4.34Å; R1045-N1052 PolarHBondContact N-O 2.92Å; R1045-N1052 PolarHBondContact O-N 2.91Å; R1045-Y1057 HydrophobicContact CB-CD1 4.21Å; R1045-Y1057 HydrophobicContact CB-CD2 3.57Å; R1045-Y1057 HydrophobicContact CB-CE2 4.16Å; R1045-Y1057 HydrophobicContact CB-CG 3.6Å; R1045-Y1057 HydrophobicContact CG-CD1 3.7Å; R1045-Y1057 HydrophobicContact CG-CD2 4.02Å; R1045-Y1057 HydrophobicContact CG-CE1 4.25Å; R1045-Y1057 HydrophobicContact CG-CG 3.56Å
1046	I	85.8	Confident	75.9	Confident	62 Å²	62	74.4 Å²	74.4	32%	0.318	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	130.7	175.3	-71.5	162.3	0	0	0	109.4	I1014 L1017 L1019 L1050 L1051	I1014-I1046 HydrophobicContact CD1-CD1 3.81Å; L1017-I1046 HydrophobicContact CD1-CD1 3.42Å; L1017-I1046 VanDerWaalsContact CD1-CD1 3.42Å; L1019-I1046 HydrophobicContact CD1-CD1 3.88Å; I1046-L1050 VanDerWaalsContact CA-O 3.32Å; I1046-L1050 WeakPolarHBondContact CA-O 3.23Å; I1046-L1051 HydrophobicContact CD1-CD2 4.01Å; I1046-L1051 HydrophobicContact CG1-CD2 3.76Å
1047	R	79.4	Confident	76.6	Confident	115 Å²	115	77.3 Å²	77.3	43%	0.434	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	135.2	176	-165.5	172.8	-176.4	-167.1	-1.1	109.1	G1049 L1050 S1060	R1047-G1049 PolarHBondContact O-N 3.08Å; R1047-L1050 PolarHBondContact N-O 2.91Å; R1047-L1050 PolarHBondContact O-N 3.29Å; R1047-S1060 PolarHBondContact NH1-O 2.94Å; R1047-S1060 VanDerWaalsContact NH1-O 3.11Å
1048	N	72.8	Confident	77.7	Confident	152 Å²	152	76 Å²	76	81%	0.813	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	34.8	-178.6	-55.2	6.5	0	0	0	113.6	L1050	N1048-L1050 PolarHBondContact O-N 2.89Å
1049	G	71.1	Confident	78.7	Confident	71 Å²	71	78.9 Å²	78.9	73%	0.732	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	-2.9	-177.2	0	0	0	0	0	115.7	R1047	R1047-G1049 PolarHBondContact O-N 3.08Å
1050	L	79.8	Confident	79.6	Confident	97 Å²	97	75 Å²	75	51%	0.508	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	149.7	178	-65.2	173.7	0	0	0	111.8	I1046 R1047 N1048	I1046-L1050 VanDerWaalsContact CA-O 3.32Å; I1046-L1050 WeakPolarHBondContact CA-O 3.23Å; R1047-L1050 PolarHBondContact N-O 2.91Å; R1047-L1050 PolarHBondContact O-N 3.29Å; N1048-L1050 PolarHBondContact O-N 2.89Å
1051	L	88.2	Confident	80.4	Confident	11 Å²	11	79 Å²	79	6%	0.058	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	134.9	170.6	-66	163	0	0	0	110.1	I1014 F1021 F1026 C1028 G1029 L1035 V1044 R1045 I1046	I1014-L1051 HydrophobicContact CD1-CD2 3.72Å; F1021-L1051 HydrophobicContact CD1-CD1 4.19Å; F1021-L1051 HydrophobicContact CD2-CD1 4.4Å; F1021-L1051 HydrophobicContact CE1-CD1 3.74Å; F1021-L1051 HydrophobicContact CE2-CD1 3.97Å; F1021-L1051 HydrophobicContact CE2-CD2 4.47Å; F1021-L1051 HydrophobicContact CZ-CD1 3.63Å; F1021-L1051 HydrophobicContact CZ-CD2 4.39Å; F1021-L1051 HydrophobicContact CZ-CG 4.09Å; F1026-L1051 HydrophobicContact CD2-CD1 3.42Å; F1026-L1051 VanDerWaalsContact CD2-CD1 3.42Å; F1026-L1051 HydrophobicContact CE2-CD1 3.54Å; F1026-L1051 HydrophobicContact CE2-CD2 3.84Å; F1026-L1051 HydrophobicContact CE2-CG 4.37Å; F1026-L1051 HydrophobicContact CG-CD1 4.48Å; C1028-L1051 CarbonylContact C-O 3.57Å; C1028-L1051 WeakPolarHBondContact CA-O 3.47Å; G1029-L1051 PolarHBondContact N-O 3.26Å; L1035-L1051 HydrophobicContact CD1-CB 3.62Å; L1035-L1051 HydrophobicContact CD1-CD1 4.32Å; L1035-L1051 HydrophobicContact CD1-CG 4.44Å; V1044-L1051 HydrophobicContact CB-CD2 4.48Å; V1044-L1051 HydrophobicContact CG2-CD2 4.21Å; R1045-L1051 CarbonylContact O-C 3.59Å; I1046-L1051 HydrophobicContact CD1-CD2 4.01Å; I1046-L1051 HydrophobicContact CG1-CD2 3.76Å
1052	N	87.2	Confident	80.3	Confident	8 Å²	8	79.3 Å²	79.3	4%	0.043	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	133.6	177.1	-69.9	31.3	0	0	0	109.5	R1045	R1045-N1052 HydrophobicContact CB-CB 4.34Å; R1045-N1052 PolarHBondContact N-O 2.92Å; R1045-N1052 PolarHBondContact O-N 2.91Å
1053	C	88.5	Confident	79.5	Confident	31 Å²	31	81.1 Å²	81.1	21%	0.209	43%	0.427	C	S	.	.			trans	-65.3	155.2	163.4	69.7	0	0	0	0	109.8	C1028 L1035 Q1055 C1056 Y1057	C1028-C1053 HydrophobicContact CB-CB 4.44Å; C1028-C1053 PolarHBondContact SG-N 3.14Å; C1028-C1053 VanDerWaalsContact SG-N 3.36Å; L1035-C1053 HydrophobicContact CD2-CB 3.59Å; C1053-Q1055 VanDerWaalsContact C-N 3.26Å; C1053-Q1055 PolarHBondContact O-N 3.41Å; C1053-C1056 PolarHBondContact O-N 3.43Å; C1053-C1056 VanDerWaalsContact O-N 3.07Å; C1053-C1056 PolarHBondContact SG-N 3.48Å; C1053-C1056 PolarHBondContact SG-SG 2.74Å; C1053-Y1057 PolarHBondContact O-N 2.87Å
1054	N	84.8	Confident	78.1	Confident	75 Å²	75	78.8 Å²	78.8	40%	0.401	43%	0.428	S	S	.	.	H	α-helix	trans	-51.9	-44.2	-176.8	-168.1	36.9	0	0	0	112.5	C1056 Y1057 I1058	N1054-C1056 PolarHBondContact O-N 3.16Å; N1054-Y1057 WeakPolarHBondContact O-CB 3.4Å; N1054-Y1057 PolarHBondContact O-N 2.96Å; N1054-I1058 VanDerWaalsContact O-CG1 3.3Å; N1054-I1058 WeakPolarHBondContact O-CG1 3.44Å; N1054-I1058 PolarHBondContact O-N 3.17Å
1055	Q	83.2	Confident	75.9	Confident	121 Å²	121	86.3 Å²	86.3	57%	0.565	46%	0.461	S	S	*	.	H	α-helix	trans	-66.2	-38.7	-179.9	-167.2	65.8	-6.8	0	0	113.4	C1053 R1059	C1053-Q1055 VanDerWaalsContact C-N 3.26Å; C1053-Q1055 PolarHBondContact O-N 3.41Å; Q1055-R1059 WeakPolarHBondContact O-CB 3.5Å; Q1055-R1059 VanDerWaalsContact O-CG 3.29Å; Q1055-R1059 WeakPolarHBondContact O-CG 3.3Å; Q1055-R1059 PolarHBondContact O-N 2.89Å
1056	C	85.4	Confident	73.9	Confident	16 Å²	16	88 Å²	88	11%	0.108	48%	0.482	C	S	.	.	H	α-helix	trans	-73.1	-35.9	175.1	-73	0	0	0	0	112.2	V1030 C1031 C1053 N1054 S1060	V1030-C1056 HydrophobicContact CB-CB 3.78Å; V1030-C1056 HydrophobicContact CG1-CB 4.02Å; V1030-C1056 HydrophobicContact CG2-CB 4.16Å; C1031-C1056 VanDerWaalsContact SG-SG 3.68Å; C1053-C1056 PolarHBondContact O-N 3.43Å; C1053-C1056 VanDerWaalsContact O-N 3.07Å; C1053-C1056 PolarHBondContact SG-N 3.48Å; C1053-C1056 PolarHBondContact SG-SG 2.74Å; N1054-C1056 PolarHBondContact O-N 3.16Å; C1056-S1060 VanDerWaalsContact O-CB 3.29Å; C1056-S1060 WeakPolarHBondContact O-CB 3.35Å; C1056-S1060 PolarHBondContact O-N 3.23Å; C1056-S1060 PolarHBondContact O-OG 3.12Å
1057	Y	86.8	Confident	71.7	Confident	69 Å²	69	92 Å²	92	27%	0.271	51%	0.509	S	S	.	.	H	α-helix	trans	-58.5	-51	171.9	179.4	-105.3	0	0	0	111.4	R1045 C1053 N1054 S1060 R1061	R1045-Y1057 HydrophobicContact CB-CD1 4.21Å; R1045-Y1057 HydrophobicContact CB-CD2 3.57Å; R1045-Y1057 HydrophobicContact CB-CE2 4.16Å; R1045-Y1057 HydrophobicContact CB-CG 3.6Å; R1045-Y1057 HydrophobicContact CG-CD1 3.7Å; R1045-Y1057 HydrophobicContact CG-CD2 4.02Å; R1045-Y1057 HydrophobicContact CG-CE1 4.25Å; R1045-Y1057 HydrophobicContact CG-CG 3.56Å; C1053-Y1057 PolarHBondContact O-N 2.87Å; N1054-Y1057 WeakPolarHBondContact O-CB 3.4Å; N1054-Y1057 PolarHBondContact O-N 2.96Å; Y1057-S1060 PolarHBondContact O-N 3.02Å; Y1057-S1060 PolarHBondContact O-OG 3.09Å; Y1057-R1061 PolarHBondContact O-N 3.39Å; Y1057-R1061 VanDerWaalsContact O-N 3.16Å
1058	I	84.6	Confident	69.9	Low	84 Å²	84	92.5 Å²	92.5	43%	0.431	53%	0.525	S	S	.	.	H	α-helix	trans	-59.3	-49.5	176.8	-66.8	164.1	0	0	0	111	N1054 S1060 R1061 S1062	N1054-I1058 VanDerWaalsContact O-CG1 3.3Å; N1054-I1058 WeakPolarHBondContact O-CG1 3.44Å; N1054-I1058 PolarHBondContact O-N 3.17Å; I1058-S1060 VanDerWaalsContact C-N 3.33Å; I1058-S1060 PolarHBondContact O-N 3.09Å; I1058-R1061 WeakPolarHBondContact O-CA 3.35Å; I1058-R1061 WeakPolarHBondContact O-CB 3.4Å; I1058-R1061 PolarHBondContact O-N 3.14Å; I1058-S1062 PolarHBondContact O-N 3.17Å; I1058-S1062 VanDerWaalsContact O-N 3.1Å; I1058-S1062 PolarHBondContact O-OG 3.29Å
1059	R	81.4	Confident	68.1	Low	172 Å²	172	97.2 Å²	97.2	65%	0.649	55%	0.549	S	S	*	.	H	α-helix	trans	-61.8	-37	177.9	-69.7	177.1	77.1	175	6	112.7	Q1055 R1061 S1062 A1063	Q1055-R1059 WeakPolarHBondContact O-CB 3.5Å; Q1055-R1059 VanDerWaalsContact O-CG 3.29Å; Q1055-R1059 WeakPolarHBondContact O-CG 3.3Å; Q1055-R1059 PolarHBondContact O-N 2.89Å; R1059-R1061 PolarHBondContact O-N 3.07Å; R1059-S1062 PolarHBondContact O-N 3.43Å; R1059-S1062 PolarHBondContact O-OG 3.39Å; R1059-A1063 WeakPolarHBondContact O-CB 3.4Å; R1059-A1063 PolarHBondContact O-N 2.97Å; R1059-A1063 VanDerWaalsContact O-N 3.08Å
1060	S	71.4	Confident	67.9	Low	43 Å²	43	98.5 Å²	98.5	30%	0.301	54%	0.54	S	S	.	.	H	α-helix	trans	-70.3	-7.9	172.4	77.9	0	0	0	0	114.7	R1047 C1056 Y1057 I1058	R1047-S1060 PolarHBondContact NH1-O 2.94Å; R1047-S1060 VanDerWaalsContact NH1-O 3.11Å; C1056-S1060 VanDerWaalsContact O-CB 3.29Å; C1056-S1060 WeakPolarHBondContact O-CB 3.35Å; C1056-S1060 PolarHBondContact O-N 3.23Å; C1056-S1060 PolarHBondContact O-OG 3.12Å; Y1057-S1060 PolarHBondContact O-N 3.02Å; Y1057-S1060 PolarHBondContact O-OG 3.09Å; I1058-S1060 VanDerWaalsContact C-N 3.33Å; I1058-S1060 PolarHBondContact O-N 3.09Å
1061	R	71.9	Confident	67.3	Low	183 Å²	183	98.6 Å²	98.6	69%	0.691	54%	0.541	S	S	*	.	H	α-helix	trans	-99.4	-28.4	175.9	-159.3	178.1	-166.8	-93.7	3.3	111.9	Y1057 I1058 R1059	Y1057-R1061 PolarHBondContact O-N 3.39Å; Y1057-R1061 VanDerWaalsContact O-N 3.16Å; I1058-R1061 WeakPolarHBondContact O-CA 3.35Å; I1058-R1061 WeakPolarHBondContact O-CB 3.4Å; I1058-R1061 PolarHBondContact O-N 3.14Å; R1059-R1061 PolarHBondContact O-N 3.07Å
1062	S	61	Low	66.2	Low	95 Å²	95	103.4 Å²	103.4	66%	0.664	57%	0.568	S	S	*	*	H	α-helix	trans	-88.4	-23	175.3	54.3	0	0	0	0	114.4	I1058 R1059 G1064	I1058-S1062 PolarHBondContact O-N 3.17Å; I1058-S1062 VanDerWaalsContact O-N 3.1Å; I1058-S1062 PolarHBondContact O-OG 3.29Å; R1059-S1062 PolarHBondContact O-N 3.43Å; R1059-S1062 PolarHBondContact O-OG 3.39Å; S1062-G1064 VanDerWaalsContact C-N 3.3Å; S1062-G1064 PolarHBondContact O-N 2.66Å
1063	A	55.9	Low	64.9	Low	92 Å²	92	109.1 Å²	109.1	76%	0.76	60%	0.599	S	S	*	*	S	Bend	trans	-81.3	0.9	178.2	0	0	0	0	0	115.2	R1059	R1059-A1063 WeakPolarHBondContact O-CB 3.4Å; R1059-A1063 PolarHBondContact O-N 2.97Å; R1059-A1063 VanDerWaalsContact O-N 3.08Å
1064	G	49.2	Very low	63.4	Low	57 Å²	57	113.9 Å²	113.9	59%	0.588	62%	0.624	S	S	*	*			trans	-123.7	87.3	-176.3	0	0	0	0	0	112.6	S1062	S1062-G1064 VanDerWaalsContact C-N 3.3Å; S1062-G1064 PolarHBondContact O-N 2.66Å
1065	Q	37	Very low	62	Low	186 Å²	186	116.5 Å²	116.5	87%	0.869	64%	0.638	S	S	*	*			trans	-79.6	162.6	164.1	-106	-174.5	-36.4	0	0	110.9
1066	P	47	Very low	60.5	Low	109 Å²	109	116.2 Å²	116.2	71%	0.708	64%	0.644	S	S	*	*			trans	-77.6	138.6	-161.2	30.3	-35.8	0	0	0	113.6	T1068	P1066-T1068 PolarHBondContact O-N 3.06Å
1067	T	38.3	Very low	58.6	Low	144 Å²	144	123.9 Å²	123.9	88%	0.883	69%	0.685	S	S	*	*			trans	-77.5	107.7	159.5	48.1	0	0	0	0	109.1
1068	T	42.7	Very low	56.2	Low	127 Å²	127	128.5 Å²	128.5	78%	0.779	72%	0.719	S	S	*	*			trans	-79.9	114.8	165.4	49.6	0	0	0	0	110	P1066	P1066-T1068 PolarHBondContact O-N 3.06Å
1069	L	34.4	Very low	53.7	Low	250 Å²	250	132.5 Å²	132.5	100%	1.309	75%	0.746	S	S	*	*			trans	-157.6	0	150.8	-102.2	175	0	0	0	108

Retrieved 1,069 of 1,069 residues in 1522 ms (Link to these results)

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