A0A077ZIW6_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZIW6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,011 aa.

						>A0A077ZIW6_TRITR|A0A077ZIW6
MFLQNTARSSRPPRGGGNNDTDPFPLHRKVVEALGSLWQPQGTMPITPVPGHMPSLSETAFQRSTENGDGRYNIWQSYSTLSFLRFRCFCVDDREWLIYTTRLLGTCAARSGLVNVGAPVSGTPRMSASCAKLKDQNIAEFRQALYKNGTYLDVKASSGLLETWMQYLAEWLARNPPNCYDEDVFLRLIQIGMVLPNVDCMKEDRLTYAVNPEFVGGTFSYGPCSPRHVYRVEAMAIPVDGYVDVYRGLGINMGEFSRGHWDDTVAVIPVRTTDHGGWLIPYTFAHLTSRIFNAQTPVLSVTRGRTRLDAVPLASLCAIRGPERVLFVLVDATTRGTGLQSWRCGSSQLGVDVPVCLSSAPLPQPASLEPLFWDWLNGGSADNDVGVAWENLAARSQAGLKPLSAITMAAELFTRKFWPKALPSGSVRDPGVVDLRNFARKDSATVQDDVSTPVNANLTEHVVKMPEIDPRDQWVLFWAKPNLHTKRPYSHLAFLNERSGDIAETFWSPTLPTIVPYIVELRNAPQLKLPDDRAVDVVWAVVVESNYDRHFDVVPCGSREAAYAFLMSSDETGTLISQVEPQEAPSSACKTSMLIKRLHLFDIGTSTTAPTLNKCGKWWTETKAASDVIARRCGCRELYLAYETDLGNDSDAVAAFQPLFVCRSSPHMRMWTAEWSISKNRVTMTEVDDVERSPMLLNGDSERSCNGYSVGTGFHLHRVGNALGFYEPAGGTPDFFSAKQMSMFVRQVACLAGGLFEVLTAFNGFNATMVMGLCKEVAYYNGSDNLYALWKPTFGHIRGWYADRCSWLSCGGLKSPNVLLRGDDRTKWDNLFFGLTPHYEIKILLVKLGIWSDDGWWPRDWSTLFERRGIQIDSANLCLLEMQVGESLSAGDRVPRAIFFHYDGQARWLPRLAVAFVGPWQLFDHCAHYSKQWDRLDGSSEVHMMRIADFGVVVHPICPPRFMLRCSFLSSSALWIDTVVSGDSDFQTEVTSGCVSIGNRPYIFALTQGSR
					

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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	26.1	Very low	25.1	Very low	235 Å²	235	173.1 Å²	173.1	100%	1.158	89%	0.887	S	S	*	*				0	106.9	0	-74.7	177.7	-171.4	0	0	107.5
2	F	25.9	Very low	25.2	Very low	211 Å²	211	168.3 Å²	168.3	93%	0.925	88%	0.876	S	S	*	*			trans	-129.6	122.6	174	-70.3	-78.6	0	0	0	107.1
3	L	25.5	Very low	25.5	Very low	184 Å²	184	165.5 Å²	165.5	96%	0.963	88%	0.875	S	S	*	*			trans	-74.7	131.6	-167	-99	147.4	0	0	0	112.4
4	Q	24.2	Very low	25.7	Very low	170 Å²	170	171.2 Å²	171.2	79%	0.794	88%	0.878	S	S	*	*			trans	-65.1	144.5	170.1	-74	172.5	-25.1	0	0	112.2	T6	Q4-T6 PolarHBondContact O-N 3.44Å
5	N	25.5	Very low	25.5	Very low	165 Å²	165	165.5 Å²	165.5	88%	0.882	88%	0.878	S	S	*	*			trans	20.4	97.3	144.7	-70.4	-21.1	0	0	0	117.1
6	T	27.2	Very low	25.5	Very low	146 Å²	146	159.2 Å²	159.2	90%	0.896	87%	0.865	S	S	*	*			trans	-100	119	153.2	29.4	0	0	0	0	109.5	Q4	Q4-T6 PolarHBondContact O-N 3.44Å
7	A	25.6	Very low	25.4	Very low	97 Å²	97	154.7 Å²	154.7	80%	0.802	87%	0.865	S	S	*	*			trans	-62.3	154.8	-176.8	0	0	0	0	0	113.2	S9	A7-S9 PolarHBondContact O-N 3.15Å; A7-S9 VanDerWaalsContact O-N 3.08Å
8	R	22.6	Very low	25.5	Very low	253 Å²	253	153.3 Å²	153.3	96%	0.955	86%	0.855	S	S	*	*			trans	-53	106.7	170.2	-70.1	174.4	174.6	174.6	-2.5	110.5	S10	R8-S10 PolarHBondContact O-N 3.13Å
9	S	27	Very low	25.6	Very low	110 Å²	110	153.8 Å²	153.8	77%	0.769	86%	0.856	S	S	*	*			trans	-80.9	111.3	165.6	178.2	0	0	0	0	109.2	A7 R11	A7-S9 PolarHBondContact O-N 3.15Å; A7-S9 VanDerWaalsContact O-N 3.08Å; S9-R11 PolarHBondContact O-N 3.04Å
10	S	24.3	Very low	25.6	Very low	112 Å²	112	152.5 Å²	152.5	78%	0.783	85%	0.847	S	S	*	*			trans	-75.3	87.2	173.5	52.5	0	0	0	0	110.7	R8	R8-S10 PolarHBondContact O-N 3.13Å
11	R	22.3	Very low	25.8	Very low	221 Å²	221	151.8 Å²	151.8	83%	0.834	85%	0.847	S	S	*	*			trans	-142.6	118	159.2	-91.9	-174	179.8	175.9	0.3	110.5	S9	S9-R11 PolarHBondContact O-N 3.04Å
12	P	26.5	Very low	26	Very low	115 Å²	115	145.4 Å²	145.4	75%	0.747	82%	0.818	S	S	*	*			trans	-68.5	133.9	173.2	27.7	-30.6	0	0	0	109.3	R14	P12-R14 PolarHBondContact O-N 2.96Å; P12-R14 VanDerWaalsContact O-N 3.1Å
13	P	28.8	Very low	26.1	Very low	133 Å²	133	140 Å²	140	86%	0.864	80%	0.803	S	S	*	*			trans	-68.5	112.2	173.6	17.8	-14.3	0	0	0	108.7
14	R	27.8	Very low	26.2	Very low	245 Å²	245	138 Å²	138	93%	0.925	79%	0.787	S	S	*	*			trans	-64.8	145.6	166.7	-82.2	-179.8	168.4	-177.6	-4.2	109.3	P12	P12-R14 PolarHBondContact O-N 2.96Å; P12-R14 VanDerWaalsContact O-N 3.1Å
15	G	23.9	Very low	26.4	Very low	85 Å²	85	134 Å²	134	88%	0.876	78%	0.776	S	S	*	*			trans	-52.1	146.6	-176.6	0	0	0	0	0	115.2
16	G	24.4	Very low	26.7	Very low	65 Å²	65	132.4 Å²	132.4	67%	0.67	77%	0.767	S	S	*	*			trans	167.8	109.7	175.5	0	0	0	0	0	106.1	N18	G16-N18 VanDerWaalsContact C-N 3.32Å; G16-N18 PolarHBondContact O-N 3.13Å
17	G	24.7	Very low	26.8	Very low	83 Å²	83	128.7 Å²	128.7	86%	0.856	74%	0.739	S	S	*	*			trans	-63.1	93.4	176.9	0	0	0	0	0	109.7
18	N	26.7	Very low	27.1	Very low	130 Å²	130	132.8 Å²	132.8	70%	0.695	73%	0.734	S	S	*	*			trans	-94.6	110.1	164.8	-94.9	14.4	0	0	0	107.5	G16 D20	G16-N18 VanDerWaalsContact C-N 3.32Å; G16-N18 PolarHBondContact O-N 3.13Å; N18-D20 PolarHBondContact O-N 3.38Å
19	N	26.7	Very low	27.6	Very low	162 Å²	162	127.9 Å²	127.9	87%	0.866	72%	0.72	S	S	*	*			trans	-66.5	22.4	167.4	-80.8	-16.8	0	0	0	113.1	T21	N19-T21 PolarHBondContact O-N 3.49Å
20	D	27.1	Very low	27.8	Very low	128 Å²	128	126.1 Å²	126.1	68%	0.684	70%	0.704	S	S	*	*			trans	-96.2	76.1	172.8	-69.4	-31.8	0	0	0	108.2	N18 D22	N18-D20 PolarHBondContact O-N 3.38Å; D20-D22 PolarHBondContact O-N 3.35Å
21	T	29.6	Very low	28.2	Very low	137 Å²	137	124.6 Å²	124.6	84%	0.84	69%	0.69	S	S	*	*			trans	-69.7	75	162.3	42	0	0	0	0	108.6	N19 P23	N19-T21 PolarHBondContact O-N 3.49Å; T21-P23 WeakPolarHBondContact O-CD 3.22Å
22	D	29.9	Very low	28.6	Very low	102 Å²	102	119.7 Å²	119.7	55%	0.545	68%	0.676	S	S	.	*			trans	-61.4	119.9	172.9	-165.8	9.3	0	0	0	108.5	D20 F24 P25	D20-D22 PolarHBondContact O-N 3.35Å; D22-F24 PolarHBondContact O-N 2.89Å; D22-F24 VanDerWaalsContact O-N 3.14Å; D22-F24 WeakPolarHBondContact OD1-CD2 3.34Å; D22-P25 WeakPolarHBondContact O-CD 3.42Å
23	P	27	Very low	28.8	Very low	96 Å²	96	116.5 Å²	116.5	62%	0.623	66%	0.66	S	S	*	*	S	Bend	trans	-73.3	-1	-169.6	25.8	-33.5	0	0	0	115.1	T21 L26	T21-P23 WeakPolarHBondContact O-CD 3.22Å; P23-L26 PolarHBondContact O-N 3.21Å
24	F	28.1	Very low	28.7	Very low	143 Å²	143	115 Å²	115	63%	0.627	64%	0.644	S	S	*	*	H	α-helix	trans	-59.2	-31.5	-179.7	-82.7	-79.3	0	0	0	117	D22 L26 H27 R28	D22-F24 PolarHBondContact O-N 2.89Å; D22-F24 VanDerWaalsContact O-N 3.14Å; D22-F24 WeakPolarHBondContact OD1-CD2 3.34Å; F24-L26 VanDerWaalsContact C-N 3.29Å; F24-L26 PolarHBondContact O-N 2.98Å; F24-H27 PolarHBondContact O-N 2.64Å; F24-R28 PolarHBondContact O-N 3.17Å; F24-R28 VanDerWaalsContact O-N 3.16Å
25	P	29.3	Very low	28.5	Very low	87 Å²	87	105 Å²	105	57%	0.565	62%	0.616	S	S	*	*	H	α-helix	trans	-64.8	-33.7	177.7	-18.6	30.5	0	0	0	112.5	D22 K29	D22-P25 WeakPolarHBondContact O-CD 3.42Å; P25-K29 PolarHBondContact O-N 2.74Å
26	L	31.1	Very low	28.6	Very low	130 Å²	130	104.2 Å²	104.2	68%	0.681	60%	0.598	S	S	*	*	H	α-helix	trans	-69.9	-42.4	178.1	-146	89.8	0	0	0	110.1	P23 F24 R28 K29 V30	P23-L26 PolarHBondContact O-N 3.21Å; F24-L26 VanDerWaalsContact C-N 3.29Å; F24-L26 PolarHBondContact O-N 2.98Å; L26-R28 VanDerWaalsContact C-N 3.34Å; L26-R28 PolarHBondContact O-N 3.13Å; L26-K29 PolarHBondContact O-N 3.44Å; L26-V30 VanDerWaalsContact O-CG2 3.31Å; L26-V30 WeakPolarHBondContact O-CG2 3.05Å; L26-V30 PolarHBondContact O-N 2.81Å
27	H	28.5	Very low	28.6	Very low	69 Å²	69	106.7 Å²	106.7	32%	0.319	60%	0.595	S	S	.	*	H	α-helix	trans	-60.7	-42.8	179	-166.8	-2	0	0	0	112.1	F24 V30 V31 R205	F24-H27 PolarHBondContact O-N 2.64Å; H27-V30 PolarHBondContact O-N 3.3Å; H27-V31 WeakPolarHBondContact ND1-CG2 3.36Å; H27-V31 VanDerWaalsContact O-CG2 3.3Å; H27-V31 WeakPolarHBondContact O-CG2 3.47Å; H27-V31 PolarHBondContact O-N 3.01Å; H27-R205 PolarHBondContact CE1-NH1 2.86Å; H27-R205 VanDerWaalsContact CE1-NH1 3.34Å; H27-R205 PolarHBondContact NE2-NH1 2.86Å; H27-R205 PolarHBondContact NE2-NH2 2.86Å
28	R	33	Very low	28.5	Very low	183 Å²	183	114.2 Å²	114.2	69%	0.691	60%	0.598	S	S	*	*	H	α-helix	trans	-64.4	-43.6	177.4	-164.1	179.8	-164.5	156.6	8.1	112.1	F24 L26 V30 V31 E32	F24-R28 PolarHBondContact O-N 3.17Å; F24-R28 VanDerWaalsContact O-N 3.16Å; L26-R28 VanDerWaalsContact C-N 3.34Å; L26-R28 PolarHBondContact O-N 3.13Å; R28-V30 PolarHBondContact O-N 2.92Å; R28-V31 PolarHBondContact O-N 3.49Å; R28-E32 IonicContact NE-OE1 2.74Å; R28-E32 WeakPolarHBondContact O-CB 3.33Å; R28-E32 WeakPolarHBondContact O-CG 3.32Å; R28-E32 PolarHBondContact O-N 3.37Å
29	K	33.7	Very low	28.2	Very low	150 Å²	150	114 Å²	114	65%	0.652	59%	0.593	S	S	*	*	H	α-helix	trans	-64.2	-38.5	177.1	-76.3	-174.9	176.9	-177	0	112.8	P25 L26 A33	P25-K29 PolarHBondContact O-N 2.74Å; L26-K29 PolarHBondContact O-N 3.44Å; K29-A33 WeakPolarHBondContact O-CB 3.44Å; K29-A33 PolarHBondContact O-N 2.85Å
30	V	30.8	Very low	28	Very low	73 Å²	73	111.9 Å²	111.9	44%	0.442	59%	0.588	S	S	.	*	H	α-helix	trans	-69.1	-41	176.8	173	0	0	0	0	111.1	L26 H27 R28 A33 L34	L26-V30 VanDerWaalsContact O-CG2 3.31Å; L26-V30 WeakPolarHBondContact O-CG2 3.05Å; L26-V30 PolarHBondContact O-N 2.81Å; H27-V30 PolarHBondContact O-N 3.3Å; R28-V30 PolarHBondContact O-N 2.92Å; V30-A33 PolarHBondContact O-N 2.65Å; V30-L34 HydrophobicContact CG1-CD1 3.99Å; V30-L34 WeakPolarHBondContact O-CB 3.31Å; V30-L34 WeakPolarHBondContact O-CG 3.42Å; V30-L34 PolarHBondContact O-N 3.07Å
31	V	31.3	Very low	27.7	Very low	80 Å²	80	113.5 Å²	113.5	49%	0.485	59%	0.591	S	S	.	*	H	α-helix	trans	-67.8	-37.8	175.5	172.8	0	0	0	0	111.5	H27 R28 G35	H27-V31 WeakPolarHBondContact ND1-CG2 3.36Å; H27-V31 VanDerWaalsContact O-CG2 3.3Å; H27-V31 WeakPolarHBondContact O-CG2 3.47Å; H27-V31 PolarHBondContact O-N 3.01Å; R28-V31 PolarHBondContact O-N 3.49Å; V31-G35 WeakPolarHBondContact O-CA 3.39Å; V31-G35 PolarHBondContact O-N 2.95Å
32	E	32.4	Very low	27.3	Very low	117 Å²	117	109.6 Å²	109.6	55%	0.547	58%	0.578	S	S	.	*	H	α-helix	trans	-65.6	-38.9	172.4	-78.9	173.9	-178.1	0	0	111.7	R28 G35 S36	R28-E32 IonicContact NE-OE1 2.74Å; R28-E32 WeakPolarHBondContact O-CB 3.33Å; R28-E32 WeakPolarHBondContact O-CG 3.32Å; R28-E32 PolarHBondContact O-N 3.37Å; E32-G35 PolarHBondContact O-N 2.87Å; E32-S36 WeakPolarHBondContact O-CB 3.25Å; E32-S36 PolarHBondContact O-N 2.73Å; E32-S36 PolarHBondContact O-OG 2.96Å
33	A	29.6	Very low	26.8	Very low	49 Å²	49	109.2 Å²	109.2	41%	0.405	58%	0.58	S	S	.	*	H	α-helix	trans	-66.4	-45.7	175.1	0	0	0	0	0	112.1	K29 V30 S36 L37	K29-A33 WeakPolarHBondContact O-CB 3.44Å; K29-A33 PolarHBondContact O-N 2.85Å; V30-A33 PolarHBondContact O-N 2.65Å; A33-S36 WeakPolarHBondContact CA-OG 3.41Å; A33-S36 PolarHBondContact O-N 2.73Å; A33-S36 PolarHBondContact O-OG 3.23Å; A33-L37 PolarHBondContact O-N 3.16Å
34	L	27.2	Very low	26.5	Very low	102 Å²	102	110.4 Å²	110.4	53%	0.534	58%	0.578	S	S	.	*	H	α-helix	trans	-64.2	-41	173.9	-75.5	168.6	0	0	0	111.7	V30 S36 L37 W38	V30-L34 HydrophobicContact CG1-CD1 3.99Å; V30-L34 WeakPolarHBondContact O-CB 3.31Å; V30-L34 WeakPolarHBondContact O-CG 3.42Å; V30-L34 PolarHBondContact O-N 3.07Å; L34-S36 VanDerWaalsContact C-N 3.3Å; L34-S36 PolarHBondContact O-N 3.27Å; L34-L37 WeakPolarHBondContact O-CB 3.35Å; L34-L37 PolarHBondContact O-N 2.92Å; L34-W38 PolarHBondContact O-N 2.78Å
35	G	24.1	Very low	26	Very low	33 Å²	33	109 Å²	109	34%	0.34	58%	0.584	S	S	.	*	H	α-helix	trans	-61.7	-37.7	173.2	0	0	0	0	0	112.1	V31 E32 W38 Q39	V31-G35 WeakPolarHBondContact O-CA 3.39Å; V31-G35 PolarHBondContact O-N 2.95Å; E32-G35 PolarHBondContact O-N 2.87Å; G35-W38 CarbonylContact O-C 3.43Å; G35-W38 PolarHBondContact O-N 2.83Å; G35-Q39 WeakPolarHBondContact O-CG 3.15Å; G35-Q39 PolarHBondContact O-N 2.81Å
36	S	26.1	Very low	25.7	Very low	69 Å²	69	111.1 Å²	111.1	48%	0.483	59%	0.589	S	S	.	*	H	α-helix	trans	-70.8	-31.6	175.3	75.3	0	0	0	0	112.9	E32 A33 L34 W38 Q39	E32-S36 WeakPolarHBondContact O-CB 3.25Å; E32-S36 PolarHBondContact O-N 2.73Å; E32-S36 PolarHBondContact O-OG 2.96Å; A33-S36 WeakPolarHBondContact CA-OG 3.41Å; A33-S36 PolarHBondContact O-N 2.73Å; A33-S36 PolarHBondContact O-OG 3.23Å; L34-S36 VanDerWaalsContact C-N 3.3Å; L34-S36 PolarHBondContact O-N 3.27Å; S36-W38 VanDerWaalsContact C-N 3.28Å; S36-Q39 PolarHBondContact O-N 2.83Å
37	L	24.3	Very low	25.1	Very low	118 Å²	118	110.5 Å²	110.5	62%	0.618	59%	0.59	S	S	*	*	H	α-helix	trans	-69.4	-27.4	169.6	-78.1	161.5	0	0	0	112.2	A33 L34 I74	A33-L37 PolarHBondContact O-N 3.16Å; L34-L37 WeakPolarHBondContact O-CB 3.35Å; L34-L37 PolarHBondContact O-N 2.92Å; L37-I74 HydrophobicContact CD2-CD1 4.19Å
38	W	21.8	Very low	24.8	Very low	240 Å²	240	110.8 Å²	110.8	91%	0.909	60%	0.598	S	S	*	*	S	Bend	trans	-88.5	-6.6	173.7	-87.5	5.4	0	0	0	114.5	L34 G35 S36	L34-W38 PolarHBondContact O-N 2.78Å; G35-W38 CarbonylContact O-C 3.43Å; G35-W38 PolarHBondContact O-N 2.83Å; S36-W38 VanDerWaalsContact C-N 3.28Å
39	Q	21.2	Very low	24.3	Very low	127 Å²	127	106.5 Å²	106.5	59%	0.593	59%	0.592	S	S	*	*	S	Bend	trans	-85.2	126.6	170.4	-74.9	-156.3	-4.7	0	0	109.9	G35 S36 Q41	G35-Q39 WeakPolarHBondContact O-CG 3.15Å; G35-Q39 PolarHBondContact O-N 2.81Å; S36-Q39 PolarHBondContact O-N 2.83Å; Q39-Q41 PolarHBondContact O-N 2.77Å
40	P	21.5	Very low	23.8	Very low	117 Å²	117	105.6 Å²	105.6	76%	0.76	60%	0.602	S	S	*	*			trans	-71.9	77.5	-178.6	30.5	-33.6	0	0	0	109.6	G42	P40-G42 PolarHBondContact O-N 3.01Å
41	Q	20.6	Very low	23.4	Very low	162 Å²	162	105.4 Å²	105.4	76%	0.757	61%	0.614	S	S	*	*			trans	-87.1	94.1	171.5	-71.7	-163.4	-1	0	0	108.8	Q39	Q39-Q41 PolarHBondContact O-N 2.77Å
42	G	21.6	Very low	23	Very low	54 Å²	54	108.9 Å²	108.9	56%	0.557	63%	0.625	S	S	*	*			trans	116	60.2	168.1	0	0	0	0	0	114.4	P40	P40-G42 PolarHBondContact O-N 3.01Å
43	T	20.2	Very low	22.4	Very low	95 Å²	95	108.9 Å²	108.9	58%	0.583	63%	0.626	S	S	*	*			trans	-72.7	117	151.1	31.9	0	0	0	0	107.9	P45	T43-P45 WeakPolarHBondContact O-CD 3.12Å
44	M	19.1	Very low	22	Very low	120 Å²	120	110.5 Å²	110.5	59%	0.591	63%	0.633	S	S	*	*			trans	-63.9	125.4	170.5	-129.1	-165.8	-140.5	0	0	108.3	I46	M44-I46 PolarHBondContact O-N 3.08Å; M44-I46 VanDerWaalsContact O-N 3.11Å; M44-I46 HydrophobicContact SD-CD1 4.1Å; M44-I46 HydrophobicContact SD-CG1 4.37Å
45	P	19.4	Very low	21.8	Very low	115 Å²	115	108.1 Å²	108.1	75%	0.747	63%	0.625	S	S	*	*			trans	-83.9	82.3	176	33.3	-30.3	0	0	0	108.6	T43	T43-P45 WeakPolarHBondContact O-CD 3.12Å
46	I	21.2	Very low	21.8	Very low	130 Å²	130	109.8 Å²	109.8	67%	0.667	63%	0.626	S	S	*	*			trans	-99.3	79.5	160.2	-51.7	179.1	0	0	0	105.8	M44 P48	M44-I46 PolarHBondContact O-N 3.08Å; M44-I46 VanDerWaalsContact O-N 3.11Å; M44-I46 HydrophobicContact SD-CD1 4.1Å; M44-I46 HydrophobicContact SD-CG1 4.37Å; I46-P48 WeakPolarHBondContact O-CD 3.35Å; I46-P48 VanDerWaalsContact O-N 3.15Å
47	T	20	Very low	21.6	Very low	117 Å²	117	110.7 Å²	110.7	72%	0.718	63%	0.632	S	S	*	*			trans	-61.1	109.3	164	-17.5	0	0	0	0	106	V49	T47-V49 PolarHBondContact O-N 3.48Å
48	P	21.7	Very low	21.4	Very low	75 Å²	75	109.8 Å²	109.8	49%	0.487	62%	0.624	S	S	.	*			trans	-71.4	102.1	-178.2	26.1	-25	0	0	0	107.4	I46	I46-P48 WeakPolarHBondContact O-CD 3.35Å; I46-P48 VanDerWaalsContact O-N 3.15Å
49	V	22.5	Very low	21.3	Very low	93 Å²	93	100.2 Å²	100.2	56%	0.564	59%	0.593	S	S	*	*			trans	-65.5	132.5	171.1	-172.5	0	0	0	0	106.9	T47 G51 H52	T47-V49 PolarHBondContact O-N 3.48Å; V49-G51 PolarHBondContact O-N 2.63Å; V49-H52 PolarHBondContact O-N 2.86Å
50	P	23.1	Very low	21.4	Very low	132 Å²	132	97.6 Å²	97.6	86%	0.857	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	104	177.2	21.1	-30.9	0	0	0	109.3
51	G	22.6	Very low	21.3	Very low	68 Å²	68	96.5 Å²	96.5	70%	0.701	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	137.6	-13.1	-170	0	0	0	0	0	114.3	V49	V49-G51 PolarHBondContact O-N 2.63Å
52	H	22.1	Very low	21.4	Very low	154 Å²	154	95 Å²	95	71%	0.713	57%	0.569	S	S	*	*			trans	-119.1	16	175.3	-65.5	-3.2	0	0	0	113.3	V49 P54	V49-H52 PolarHBondContact O-N 2.86Å; H52-P54 VanDerWaalsContact O-CD 3.28Å; H52-P54 WeakPolarHBondContact O-CD 3.46Å
53	M	19.9	Very low	21.4	Very low	116 Å²	116	100.4 Å²	100.4	57%	0.571	57%	0.573	S	S	*	*	S	Bend	trans	-65.6	120.3	164.9	-109.5	-167.8	170.6	0	0	107	S55 V353	M53-S55 PolarHBondContact O-N 3.07Å; M53-V353 HydrophobicContact CE-CG1 4.4Å
54	P	21.9	Very low	21.5	Very low	83 Å²	83	100.3 Å²	100.3	54%	0.539	58%	0.576	S	S	.	*			trans	-51.6	115.6	174.1	-25.4	35.2	0	0	0	107.3	H52 L56 E58	H52-P54 VanDerWaalsContact O-CD 3.28Å; H52-P54 WeakPolarHBondContact O-CD 3.46Å; P54-L56 PolarHBondContact O-N 2.93Å; P54-L56 VanDerWaalsContact O-N 3.15Å; P54-E58 VanDerWaalsContact CA-CD 3.49Å; P54-E58 WeakPolarHBondContact CA-OE1 3.3Å; P54-E58 WeakPolarHBondContact CA-OE2 3.09Å; P54-E58 HydrophobicContact CB-CB 4.42Å; P54-E58 VanDerWaalsContact CB-OE2 3.27Å; P54-E58 WeakPolarHBondContact CB-OE2 3.39Å
55	S	22.4	Very low	21.6	Very low	53 Å²	53	100.8 Å²	100.8	37%	0.371	59%	0.586	S	S	.	*			trans	-56.1	126.4	167.3	59.6	0	0	0	0	105.1	M53 S57 E58	M53-S55 PolarHBondContact O-N 3.07Å; S55-S57 PolarHBondContact O-N 2.82Å; S55-S57 PolarHBondContact OG-OG 3.25Å; S55-E58 PolarHBondContact N-OE1 2.85Å; S55-E58 WeakPolarHBondContact O-CA 3.04Å; S55-E58 WeakPolarHBondContact O-CB 3.35Å; S55-E58 WeakPolarHBondContact O-CG 3.33Å; S55-E58 PolarHBondContact O-N 2.84Å; S55-E58 PolarHBondContact OG-OE1 3.44Å
56	L	24.6	Very low	21.8	Very low	68 Å²	68	101.6 Å²	101.6	36%	0.356	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.5	-13.2	-169	-83.9	148.1	0	0	0	113.6	P54 E58 A234 A236 W342	P54-L56 PolarHBondContact O-N 2.93Å; P54-L56 VanDerWaalsContact O-N 3.15Å; L56-E58 PolarHBondContact O-N 3.36Å; L56-A234 CarbonylContact C-O 3.47Å; L56-A236 HydrophobicContact CD1-CB 3.66Å; L56-A236 HydrophobicContact CD2-CB 3.66Å; L56-A236 HydrophobicContact CG-CB 4.31Å; L56-W342 HydrophobicContact CD1-CH2 3.96Å
57	S	21.1	Very low	21.9	Very low	88 Å²	88	100 Å²	100	62%	0.615	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-4.3	165.2	50.1	0	0	0	0	115.3	S55 T59	S55-S57 PolarHBondContact O-N 2.82Å; S55-S57 PolarHBondContact OG-OG 3.25Å; S57-T59 PolarHBondContact O-N 3.16Å
58	E	20.4	Very low	22	Very low	98 Å²	98	95.8 Å²	95.8	46%	0.458	55%	0.552	S	S	.	*	S	Bend	trans	-68.8	100.6	170.7	-80.5	170.7	-141.9	0	0	108	P54 S55 L56 A60	P54-E58 VanDerWaalsContact CA-CD 3.49Å; P54-E58 WeakPolarHBondContact CA-OE1 3.3Å; P54-E58 WeakPolarHBondContact CA-OE2 3.09Å; P54-E58 HydrophobicContact CB-CB 4.42Å; P54-E58 VanDerWaalsContact CB-OE2 3.27Å; P54-E58 WeakPolarHBondContact CB-OE2 3.39Å; S55-E58 PolarHBondContact N-OE1 2.85Å; S55-E58 WeakPolarHBondContact O-CA 3.04Å; S55-E58 WeakPolarHBondContact O-CB 3.35Å; S55-E58 WeakPolarHBondContact O-CG 3.33Å; S55-E58 PolarHBondContact O-N 2.84Å; S55-E58 PolarHBondContact OG-OE1 3.44Å; L56-E58 PolarHBondContact O-N 3.36Å; E58-A60 PolarHBondContact O-N 3.23Å
59	T	21.2	Very low	22.1	Very low	39 Å²	39	97.3 Å²	97.3	24%	0.239	56%	0.556	C	S	.	*			trans	-36.9	109.6	155.4	36.3	0	0	0	0	108.3	S57 F61 R231	S57-T59 PolarHBondContact O-N 3.16Å; T59-F61 VanDerWaalsContact C-N 3.29Å; T59-F61 WeakPolarHBondContact O-CD2 3.32Å; T59-F61 PolarHBondContact O-N 2.99Å; T59-F61 VanDerWaalsContact OG1-CE2 3.24Å; T59-F61 WeakPolarHBondContact OG1-CE2 3.29Å; T59-R231 HydrophobicContact CG2-CB 3.9Å; T59-R231 HydrophobicContact CG2-CG 3.69Å
60	A	21.8	Very low	22.1	Very low	73 Å²	73	93.2 Å²	93.2	60%	0.603	53%	0.533	S	S	*	.			trans	-63.4	90.5	-176	0	0	0	0	0	109.2	E58 Q62	E58-A60 PolarHBondContact O-N 3.23Å; A60-Q62 PolarHBondContact O-N 3.37Å
61	F	20.4	Very low	22	Very low	94 Å²	94	97.3 Å²	97.3	41%	0.412	53%	0.531	S	S	.	.			trans	-80.4	96.5	172.3	-82	-84.5	0	0	0	107.6	T59 R63 V229	T59-F61 VanDerWaalsContact C-N 3.29Å; T59-F61 WeakPolarHBondContact O-CD2 3.32Å; T59-F61 PolarHBondContact O-N 2.99Å; T59-F61 VanDerWaalsContact OG1-CE2 3.24Å; T59-F61 WeakPolarHBondContact OG1-CE2 3.29Å; F61-R63 PolarHBondContact O-N 3.1Å; F61-V229 HydrophobicContact CD1-CG1 3.74Å; F61-V229 HydrophobicContact CE1-CG1 3.9Å
62	Q	21.6	Very low	22	Very low	130 Å²	130	96.5 Å²	96.5	61%	0.607	51%	0.507	S	S	*	.			trans	-61.3	91.6	157.6	-92.2	-174.7	-15.1	0	0	107.9	A60	A60-Q62 PolarHBondContact O-N 3.37Å
63	R	22.1	Very low	22	Very low	168 Å²	168	93.8 Å²	93.8	63%	0.634	50%	0.498	S	S	*	.			trans	-124.3	-3.3	175.4	-93	-170.5	175.3	-171.9	-1.2	115.1	F61 T65	F61-R63 PolarHBondContact O-N 3.1Å; R63-T65 PolarHBondContact O-N 3.28Å
64	S	22.2	Very low	22.2	Very low	92 Å²	92	92.4 Å²	92.4	64%	0.643	49%	0.492	S	S	*	.			trans	-88.5	99.6	171.1	59.2	0	0	0	0	110.3	E66	S64-E66 PolarHBondContact O-N 2.99Å
65	T	22.2	Very low	22.1	Very low	130 Å²	130	96.6 Å²	96.6	80%	0.798	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-63.4	5.7	172.3	32.3	0	0	0	0	114.9	R63 N67 G68	R63-T65 PolarHBondContact O-N 3.28Å; T65-N67 PolarHBondContact O-N 3.39Å; T65-G68 PolarHBondContact O-N 3.41Å; T65-G68 VanDerWaalsContact O-N 3.09Å
66	E	23.1	Very low	22.2	Very low	132 Å²	132	98.7 Å²	98.7	62%	0.617	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-74.2	4.8	175.8	-69.8	-168.5	159.5	0	0	114.6	S64	S64-E66 PolarHBondContact O-N 2.99Å
67	N	23.8	Very low	22.1	Very low	98 Å²	98	98.8 Å²	98.8	52%	0.524	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-111.6	9.3	166.3	-75.3	-26	0	0	0	112.3	T65	T65-N67 PolarHBondContact O-N 3.39Å
68	G	22.1	Very low	22.1	Very low	27 Å²	27	101.5 Å²	101.5	28%	0.278	51%	0.505	S	S	.	.			trans	-87	-8.8	177.8	0	0	0	0	0	113.9	T65 G70	T65-G68 PolarHBondContact O-N 3.41Å; T65-G68 VanDerWaalsContact O-N 3.09Å; G68-G70 PolarHBondContact O-N 3.22Å
69	D	23.9	Very low	22.2	Very low	108 Å²	108	98.7 Å²	98.7	58%	0.578	50%	0.496	S	S	*	.	S	Bend	trans	-82.4	16.3	-174.5	37.6	-46.3	0	0	0	113.6	R71	D69-R71 PolarHBondContact O-N 3.34Å
70	G	21.3	Very low	22.3	Very low	7 Å²	7	101.4 Å²	101.4	7%	0.072	51%	0.513	C	S	.	.	S	Bend	trans	71.8	-0.3	165.3	0	0	0	0	0	114.8	G68 Y72 Y221	G68-G70 PolarHBondContact O-N 3.22Å; G70-Y72 PolarHBondContact O-N 2.97Å; G70-Y72 VanDerWaalsContact O-N 3.11Å; G70-Y221 WeakPolarHBondContact O-CD2 2.89Å; G70-Y221 WeakPolarHBondContact O-CE2 3.2Å; G70-Y221 VanDerWaalsContact O-CG 3.26Å
71	R	21.4	Very low	22.4	Very low	217 Å²	217	102.8 Å²	102.8	82%	0.819	51%	0.51	S	S	*	.			trans	-88.6	65.3	173.5	-63.5	-174.9	-177.3	-171	0.9	109.5	D69 N73	D69-R71 PolarHBondContact O-N 3.34Å; R71-N73 PolarHBondContact O-N 2.81Å; R71-N73 VanDerWaalsContact O-N 3.11Å
72	Y	23.3	Very low	22.5	Very low	52 Å²	52	99 Å²	99	20%	0.204	50%	0.495	C	S	.	.			trans	-68.7	108.7	164.7	-70.7	-78	0	0	0	107.3	G70 I74 P297	G70-Y72 PolarHBondContact O-N 2.97Å; G70-Y72 VanDerWaalsContact O-N 3.11Å; Y72-I74 PolarHBondContact O-N 2.77Å; Y72-I74 VanDerWaalsContact O-N 3.09Å; Y72-P297 HydrophobicContact CE2-CB 4.49Å; Y72-P297 HydrophobicContact CE2-CG 4.05Å
73	N	22.3	Very low	22.5	Very low	97 Å²	97	97.6 Å²	97.6	52%	0.519	49%	0.487	S	S	.	.			trans	-56.4	122	166.6	-71.4	-15.3	0	0	0	106.5	R71 W75 Q76	R71-N73 PolarHBondContact O-N 2.81Å; R71-N73 VanDerWaalsContact O-N 3.11Å; N73-W75 PolarHBondContact O-N 3.49Å; N73-Q76 PolarHBondContact O-N 2.85Å
74	I	22.2	Very low	22.7	Very low	87 Å²	87	90.6 Å²	90.6	45%	0.446	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-33.4	-37.5	-173.5	-76.5	171.9	0	0	0	113	L37 Y72 Q76 S77 Y78	L37-I74 HydrophobicContact CD2-CD1 4.19Å; Y72-I74 PolarHBondContact O-N 2.77Å; Y72-I74 VanDerWaalsContact O-N 3.09Å; I74-Q76 VanDerWaalsContact C-N 3.33Å; I74-Q76 PolarHBondContact O-N 2.74Å; I74-S77 PolarHBondContact O-N 3.17Å; I74-S77 PolarHBondContact O-OG 3.23Å; I74-Y78 HydrophobicContact CB-CE2 4.41Å; I74-Y78 HydrophobicContact CG2-CD2 4.2Å; I74-Y78 HydrophobicContact CG2-CE2 3.36Å; I74-Y78 WeakPolarHBondContact O-CD2 3.28Å; I74-Y78 WeakPolarHBondContact O-CE2 3.46Å
75	W	21.5	Very low	22.7	Very low	171 Å²	171	88.9 Å²	88.9	65%	0.648	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-48.3	-36.2	173.8	-67.6	79.4	0	0	0	117	N73 Y78	N73-W75 PolarHBondContact O-N 3.49Å; W75-Y78 PolarHBondContact O-N 3.13Å
76	Q	23.2	Very low	22.9	Very low	96 Å²	96	86.2 Å²	86.2	45%	0.449	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-77.8	-21	-177.6	-78.4	-176.7	-13.7	0	0	114	N73 I74 Y78	N73-Q76 PolarHBondContact O-N 2.85Å; I74-Q76 VanDerWaalsContact C-N 3.33Å; I74-Q76 PolarHBondContact O-N 2.74Å; Q76-Y78 VanDerWaalsContact C-N 3.34Å
77	S	22.7	Very low	22.9	Very low	70 Å²	70	84.8 Å²	84.8	49%	0.49	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-76	-18.3	174	30.5	0	0	0	0	114	I74 T80	I74-S77 PolarHBondContact O-N 3.17Å; I74-S77 PolarHBondContact O-OG 3.23Å; S77-T80 PolarHBondContact O-OG1 3.23Å
78	Y	22.5	Very low	22.9	Very low	145 Å²	145	83.3 Å²	83.3	57%	0.569	40%	0.404	S	S	*	.	S	Bend	trans	-90.8	-9	-177.5	-64.6	-88.1	0	0	0	114.1	I74 W75 Q76 T80	I74-Y78 HydrophobicContact CB-CE2 4.41Å; I74-Y78 HydrophobicContact CG2-CD2 4.2Å; I74-Y78 HydrophobicContact CG2-CE2 3.36Å; I74-Y78 WeakPolarHBondContact O-CD2 3.28Å; I74-Y78 WeakPolarHBondContact O-CE2 3.46Å; W75-Y78 PolarHBondContact O-N 3.13Å; Q76-Y78 VanDerWaalsContact C-N 3.34Å; Y78-T80 PolarHBondContact O-N 3.28Å
79	S	21.9	Very low	23	Very low	39 Å²	39	89.1 Å²	89.1	27%	0.273	42%	0.423	S	S	.	.			trans	-77.3	29.6	178.2	93.9	0	0	0	0	112.9	L81 Y282	S79-L81 PolarHBondContact O-N 3.47Å; S79-Y282 WeakPolarHBondContact OG-CB 3.21Å; S79-Y282 PolarHBondContact OG-N 3.49Å
80	T	22.7	Very low	23.2	Very low	96 Å²	96	88.5 Å²	88.5	59%	0.589	43%	0.426	S	S	*	.			trans	-67.4	-1.6	-173.2	-10	0	0	0	0	113.8	S77 Y78	S77-T80 PolarHBondContact O-OG1 3.23Å; Y78-T80 PolarHBondContact O-N 3.28Å
81	L	23.1	Very low	23.2	Very low	102 Å²	102	90.6 Å²	90.6	53%	0.534	44%	0.437	S	S	.	.			trans	-118.3	71.5	-179.7	-68.3	168.5	0	0	0	111	S79 T101 V184	S79-L81 PolarHBondContact O-N 3.47Å; L81-T101 WeakPolarHBondContact CD2-OG1 3.42Å; L81-V184 HydrophobicContact CD1-CG2 4.24Å
82	S	22.8	Very low	23.4	Very low	15 Å²	15	87.4 Å²	87.4	11%	0.105	44%	0.436	C	S	.	.			trans	-83.6	122.7	165.1	-25.7	0	0	0	0	108.8	L84 P281 T283	S82-L84 PolarHBondContact O-N 3.4Å; S82-P281 WeakPolarHBondContact OG-CB 3.34Å; S82-T283 VanDerWaalsContact OG-CB 3.29Å; S82-T283 WeakPolarHBondContact OG-CB 3.49Å; S82-T283 PolarHBondContact OG-OG1 2.9Å
83	F	22.9	Very low	23.4	Very low	101 Å²	101	90.9 Å²	90.9	44%	0.443	46%	0.458	S	S	.	.			trans	-64.3	107.4	170	-60.7	-92	0	0	0	108.9	T100 P269	F83-T100 HydrophobicContact CD1-CG2 4.49Å; F83-P269 HydrophobicContact CB-CG 3.96Å; F83-P269 HydrophobicContact CD2-CG 3.76Å; F83-P269 HydrophobicContact CG-CG 4.28Å
84	L	24.9	Very low	23.4	Very low	21 Å²	21	95 Å²	95	11%	0.11	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	112.1	175.9	-101	139.5	0	0	0	109.4	S82 F86 Y99 T283 L287	S82-L84 PolarHBondContact O-N 3.4Å; L84-F86 HydrophobicContact CB-CD1 4.05Å; L84-F86 HydrophobicContact CB-CE1 3.84Å; L84-F86 HydrophobicContact CD2-CD1 3.87Å; L84-F86 HydrophobicContact CD2-CE1 4.13Å; L84-Y99 PolarHBondContact O-N 3.33Å; L84-T283 HydrophobicContact CD1-CG2 3.72Å; L84-L287 HydrophobicContact CD1-CD1 3.43Å; L84-L287 VanDerWaalsContact CD1-CD1 3.43Å; L84-L287 HydrophobicContact CD2-CD1 3.31Å; L84-L287 HydrophobicContact CG-CD1 3.95Å
85	R	23.1	Very low	23.5	Very low	55 Å²	55	96.9 Å²	96.9	21%	0.208	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	112.3	168.9	-122.3	-175.5	178.5	174.9	-1	107.6	W96 I98 Y242	R85-W96 HydrophobicContact CB-CE3 4.41Å; R85-W96 HydrophobicContact CG-CB 4.42Å; R85-W96 HydrophobicContact CG-CE3 4.06Å; R85-I98 HydrophobicContact CG-CG1 4.15Å; R85-Y242 PolarHBondContact NH1-OH 3.05Å
86	F	25.4	Very low	23.6	Very low	75 Å²	75	92.2 Å²	92.2	33%	0.329	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	140.2	167.5	40.6	-96.5	0	0	0	110.4	L84 Y99	L84-F86 HydrophobicContact CB-CD1 4.05Å; L84-F86 HydrophobicContact CB-CE1 3.84Å; L84-F86 HydrophobicContact CD2-CD1 3.87Å; L84-F86 HydrophobicContact CD2-CE1 4.13Å; F86-Y99 HydrophobicContact CE1-CD2 4.38Å; F86-Y99 AromaticContact CE2-CD2 3.99Å; F86-Y99 HydrophobicContact CE2-CD2 3.99Å; F86-Y99 HydrophobicContact CE2-CE2 4.07Å; F86-Y99 AromaticContact CZ-CD2 3.5Å; F86-Y99 HydrophobicContact CZ-CD2 3.5Å; F86-Y99 AromaticContact CZ-CE2 3.87Å; F86-Y99 HydrophobicContact CZ-CE2 3.87Å; F86-Y99 HydrophobicContact CZ-CG 4.41Å
87	R	24.5	Very low	23.6	Very low	101 Å²	101	90.8 Å²	90.8	38%	0.381	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	124.8	172.9	-175.2	-178.9	-179.5	-177.1	-2.4	107.8	D93	R87-D93 IonicContact NH2-OD1 3.1Å; R87-D93 PolarHBondContact NH2-OD1 2.78Å; R87-D93 VanDerWaalsContact NH2-OD1 3.1Å
88	C	22.9	Very low	23.7	Very low	67 Å²	67	90.8 Å²	90.8	45%	0.453	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-96	127.2	177.7	-156.7	0	0	0	0	109.8	L97	C88-L97 HydrophobicContact CB-CD1 4.06Å
89	F	25	Very low	23.7	Very low	150 Å²	150	89.7 Å²	89.7	66%	0.658	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	142.3	166.1	-105.9	-96.6	0	0	0	109.4	D263	F89-D263 HydrophobicContact CD2-CB 4.4Å; F89-D263 VanDerWaalsContact CD2-OD2 3.29Å; F89-D263 WeakPolarHBondContact CD2-OD2 3.49Å; F89-D263 WeakPolarHBondContact CE2-OD2 3.43Å
90	C	26.8	Very low	23.8	Very low	95 Å²	95	90.7 Å²	90.7	64%	0.642	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.3	14.1	174.2	-42.2	0	0	0	0	118.1	K791	C90-K791 PolarHBondContact O-NZ 3.41Å
91	V	22.7	Very low	23.7	Very low	51 Å²	51	91.4 Å²	91.4	31%	0.309	45%	0.449	S	S	.	.	S	Bend	trans	-118.3	134.8	167.1	-168.3	0	0	0	0	108.7	D93 E95	V91-D93 PolarHBondContact O-N 3.28Å; V91-E95 HydrophobicContact CG1-CB 4.34Å
92	D	25	Very low	23.6	Very low	150 Å²	150	96.8 Å²	96.8	80%	0.802	46%	0.463	S	S	*	.			trans	-53.2	105.4	-179.9	-75.3	-47.7	0	0	0	111.1	R94	D92-R94 VanDerWaalsContact C-N 3.31Å; D92-R94 PolarHBondContact O-N 3.29Å
93	D	22.6	Very low	23.6	Very low	125 Å²	125	101.7 Å²	101.7	67%	0.668	49%	0.487	S	S	*	.	S	Bend	trans	32.6	-0.2	162.7	-85.1	-22.9	0	0	0	124.7	R87 V91	R87-D93 IonicContact NH2-OD1 3.1Å; R87-D93 PolarHBondContact NH2-OD1 2.78Å; R87-D93 VanDerWaalsContact NH2-OD1 3.1Å; V91-D93 PolarHBondContact O-N 3.28Å
94	R	24	Very low	23.5	Very low	182 Å²	182	102.6 Å²	102.6	69%	0.687	50%	0.496	S	S	*	.			trans	-141.5	4.1	-175.3	-68.5	-171.7	175.1	-174.9	0.1	118.5	D92	D92-R94 VanDerWaalsContact C-N 3.31Å; D92-R94 PolarHBondContact O-N 3.29Å
95	E	22.5	Very low	23.2	Very low	128 Å²	128	104.3 Å²	104.3	60%	0.598	52%	0.518	S	S	*	.			trans	-104.7	118.6	-173.8	-65.4	-170.3	161.4	0	0	113.9	V91	V91-E95 HydrophobicContact CG1-CB 4.34Å
96	W	25	Very low	23.1	Very low	73 Å²	73	108.3 Å²	108.3	28%	0.277	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	112.5	173.1	-68.1	82.3	0	0	0	108.6	R85 I98 W261	R85-W96 HydrophobicContact CB-CE3 4.41Å; R85-W96 HydrophobicContact CG-CB 4.42Å; R85-W96 HydrophobicContact CG-CE3 4.06Å; W96-I98 PolarHBondContact O-N 2.8Å; W96-W261 HydrophobicContact CH2-CB 4.07Å; W96-W261 AromaticContact CH2-CE3 3.93Å; W96-W261 HydrophobicContact CH2-CE3 3.93Å; W96-W261 HydrophobicContact CZ2-CE3 4.17Å
97	L	23.2	Very low	22.9	Very low	65 Å²	65	110.3 Å²	110.3	34%	0.34	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.2	112	175	-79.8	156.8	0	0	0	108.8	C88	C88-L97 HydrophobicContact CB-CD1 4.06Å
98	I	24.2	Very low	22.7	Very low	71 Å²	71	109.2 Å²	109.2	36%	0.364	58%	0.584	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.3	109.5	165.5	-50.8	179	0	0	0	105.9	R85 W96 T100	R85-I98 HydrophobicContact CG-CG1 4.15Å; W96-I98 PolarHBondContact O-N 2.8Å; I98-T100 HydrophobicContact CB-CG2 4.45Å; I98-T100 HydrophobicContact CG2-CG2 3.55Å; I98-T100 PolarHBondContact O-N 3.23Å
99	Y	22.9	Very low	22.6	Very low	121 Å²	121	109.9 Å²	109.9	48%	0.475	59%	0.594	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.3	89.1	166.3	-101.3	-91.9	0	0	0	108.1	L84 F86 H796	L84-Y99 PolarHBondContact O-N 3.33Å; F86-Y99 HydrophobicContact CE1-CD2 4.38Å; F86-Y99 AromaticContact CE2-CD2 3.99Å; F86-Y99 HydrophobicContact CE2-CD2 3.99Å; F86-Y99 HydrophobicContact CE2-CE2 4.07Å; F86-Y99 AromaticContact CZ-CD2 3.5Å; F86-Y99 HydrophobicContact CZ-CD2 3.5Å; F86-Y99 AromaticContact CZ-CE2 3.87Å; F86-Y99 HydrophobicContact CZ-CE2 3.87Å; F86-Y99 HydrophobicContact CZ-CG 4.41Å; Y99-H796 PolarHBondContact OH-CE1 2.9Å; Y99-H796 PolarHBondContact OH-NE2 2.76Å
100	T	22.7	Very low	22.5	Very low	60 Å²	60	111.9 Å²	111.9	37%	0.368	60%	0.597	S	S	.	*			trans	-99.9	130.9	161.7	57.3	0	0	0	0	107.1	F83 I98 R102	F83-T100 HydrophobicContact CD1-CG2 4.49Å; I98-T100 HydrophobicContact CB-CG2 4.45Å; I98-T100 HydrophobicContact CG2-CG2 3.55Å; I98-T100 PolarHBondContact O-N 3.23Å; T100-R102 PolarHBondContact O-N 3.28Å
101	T	22	Very low	22.3	Very low	112 Å²	112	113 Å²	113	69%	0.687	61%	0.606	S	S	*	*	S	Bend	trans	-68.9	68.7	148.9	23.2	0	0	0	0	108.1	L81 L103	L81-T101 WeakPolarHBondContact CD2-OG1 3.42Å; T101-L103 PolarHBondContact O-N 3.48Å
102	R	21.2	Very low	22.2	Very low	215 Å²	215	113.2 Å²	113.2	81%	0.811	62%	0.619	S	S	*	*	S	Bend	trans	71	2.8	146.8	-125.4	-175.3	-175.3	-178.4	1.7	123.7	T100	T100-R102 PolarHBondContact O-N 3.28Å
103	L	21.9	Very low	22.1	Very low	117 Å²	117	114.2 Å²	114.2	61%	0.613	62%	0.623	S	S	*	*	S	Bend	trans	-144.9	2	-175.7	-107.2	134.9	0	0	0	123.2	T101	T101-L103 PolarHBondContact O-N 3.48Å
104	L	20.9	Very low	22	Very low	120 Å²	120	114.5 Å²	114.5	63%	0.628	63%	0.629	S	S	*	*	S	Bend	trans	-139.3	96.2	170.1	-74.8	169.5	0	0	0	110.4	Y180	L104-Y180 HydrophobicContact CD1-CE1 4.43Å
105	G	19.6	Very low	21.9	Very low	57 Å²	57	113 Å²	113	59%	0.588	63%	0.634	S	S	*	*			trans	166.6	72	-179.4	0	0	0	0	0	110.1	C107	G105-C107 PolarHBondContact O-N 3.36Å
106	T	20	Very low	21.8	Very low	139 Å²	139	113.3 Å²	113.3	85%	0.853	65%	0.645	S	S	*	*			trans	-33	100.8	150.8	41.2	0	0	0	0	109.9	A108	T106-A108 PolarHBondContact O-N 2.99Å
107	C	21	Very low	21.6	Very low	117 Å²	117	112.3 Å²	112.3	79%	0.791	66%	0.658	S	S	*	*			trans	-60.7	100.4	151.2	-97.2	0	0	0	0	104.1	G105 A109	G105-C107 PolarHBondContact O-N 3.36Å; C107-A109 PolarHBondContact O-N 2.87Å
108	A	21.1	Very low	21.5	Very low	79 Å²	79	113.4 Å²	113.4	65%	0.653	68%	0.676	S	S	*	*			trans	-56.4	99.6	167	0	0	0	0	0	105.9	T106 R110	T106-A108 PolarHBondContact O-N 2.99Å; A108-R110 PolarHBondContact O-N 3.18Å
109	A	20	Very low	21.3	Very low	80 Å²	80	115.8 Å²	115.8	66%	0.661	70%	0.696	S	S	*	*			trans	-54.6	129.2	176.8	0	0	0	0	0	107	C107 S111	C107-A109 PolarHBondContact O-N 2.87Å; A109-S111 PolarHBondContact O-N 2.95Å
110	R	23.3	Very low	21.3	Very low	192 Å²	192	116.8 Å²	116.8	73%	0.725	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-3	-160.3	-149.7	174.7	-179.9	166.3	1.9	114.9	A108	A108-R110 PolarHBondContact O-N 3.18Å
111	S	22.9	Very low	21.3	Very low	118 Å²	118	119.2 Å²	119.2	83%	0.825	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-169.9	17.9	-180	56.5	0	0	0	0	117	A109	A109-S111 PolarHBondContact O-N 2.95Å
112	G	21.3	Very low	21.2	Very low	56 Å²	56	117 Å²	117	58%	0.577	73%	0.734	S	S	*	*			trans	-104.4	114.6	-172.1	0	0	0	0	0	113.9	V114	G112-V114 PolarHBondContact O-N 2.74Å
113	L	21.6	Very low	21.3	Very low	172 Å²	172	113.6 Å²	113.6	90%	0.901	74%	0.737	S	S	*	*			trans	-51.6	117	172.3	-78.1	108.5	0	0	0	111.8	N115	L113-N115 PolarHBondContact O-N 3.38Å
114	V	21.4	Very low	21.5	Very low	130 Å²	130	113.6 Å²	113.6	79%	0.788	74%	0.744	S	S	*	*			trans	-72.5	107.3	161.4	-179.5	0	0	0	0	107.1	G112 V116	G112-V114 PolarHBondContact O-N 2.74Å; V114-V116 HydrophobicContact CG1-CG2 4.32Å; V114-V116 WeakPolarHBondContact O-CG2 3.25Å; V114-V116 PolarHBondContact O-N 3.18Å; V114-V116 VanDerWaalsContact O-N 3.12Å
115	N	20.8	Very low	21.5	Very low	150 Å²	150	120 Å²	120	80%	0.802	76%	0.759	S	S	*	*			trans	-80.9	87.7	-176.7	-164.9	-2.5	0	0	0	110.2	L113 G117	L113-N115 PolarHBondContact O-N 3.38Å; N115-G117 PolarHBondContact O-N 3.35Å
116	V	21.9	Very low	21.7	Very low	136 Å²	136	125.2 Å²	125.2	82%	0.824	77%	0.77	S	S	*	*			trans	-76.3	19.8	-175.3	-147.1	0	0	0	0	113.6	V114	V114-V116 HydrophobicContact CG1-CG2 4.32Å; V114-V116 WeakPolarHBondContact O-CG2 3.25Å; V114-V116 PolarHBondContact O-N 3.18Å; V114-V116 VanDerWaalsContact O-N 3.12Å
117	G	20.8	Very low	21.9	Very low	52 Å²	52	122.2 Å²	122.2	54%	0.536	76%	0.755	S	S	.	*			trans	-88.8	-0.1	-166.5	0	0	0	0	0	117.6	N115 P119	N115-G117 PolarHBondContact O-N 3.35Å; G117-P119 WeakPolarHBondContact O-CD 3.16Å
118	A	19.5	Very low	22	Very low	88 Å²	88	120.8 Å²	120.8	73%	0.727	75%	0.752	S	S	*	*			trans	-75.1	107.9	-177.1	0	0	0	0	0	111.4	V120	A118-V120 PolarHBondContact O-N 2.79Å
119	P	20.4	Very low	22.2	Very low	121 Å²	121	121.6 Å²	121.6	79%	0.786	75%	0.753	S	S	*	*			trans	-79.8	118.3	-175.3	2.1	16.9	0	0	0	109.5	G117 S121	G117-P119 WeakPolarHBondContact O-CD 3.16Å; P119-S121 PolarHBondContact O-N 3.35Å; P119-S121 VanDerWaalsContact O-N 3.14Å
120	V	24	Very low	22.3	Very low	142 Å²	142	120.8 Å²	120.8	86%	0.861	74%	0.741	S	S	*	*			trans	-81.2	95.3	176.5	-173.5	0	0	0	0	109	A118	A118-V120 PolarHBondContact O-N 2.79Å
121	S	20.9	Very low	22.3	Very low	111 Å²	111	114.2 Å²	114.2	78%	0.776	73%	0.729	S	S	*	*			trans	-70.8	146.8	169.4	47.5	0	0	0	0	111.5	P119	P119-S121 PolarHBondContact O-N 3.35Å; P119-S121 VanDerWaalsContact O-N 3.14Å
122	G	21.5	Very low	22.4	Very low	66 Å²	66	117 Å²	117	68%	0.68	73%	0.726	S	S	*	*			trans	-59.8	160.8	-163.6	0	0	0	0	0	116.9
123	T	23.5	Very low	22.5	Very low	143 Å²	143	120.7 Å²	120.7	88%	0.877	73%	0.731	S	S	*	*				-176.2	163.2	74.7	27.6	0	0	0	0	110.9
124	P	24.7	Very low	22.6	Very low	117 Å²	117	118.4 Å²	118.4	76%	0.76	71%	0.714	S	S	*	*			trans	-107.8	132	-153.6	36.5	-26	0	0	0	114.5
125	R	21.9	Very low	22.9	Very low	254 Å²	254	117.8 Å²	117.8	96%	0.958	71%	0.706	S	S	*	*			trans	-142.8	76.7	154.8	-79.1	-170.3	176.5	175.9	-0.9	108.9
126	M	22.7	Very low	23	Very low	166 Å²	166	118.4 Å²	118.4	82%	0.818	70%	0.704	S	S	*	*			trans	-130	143.5	170	-94.5	-167.4	179.7	0	0	110.3
127	S	24	Very low	23.2	Very low	77 Å²	77	117.8 Å²	117.8	54%	0.538	70%	0.696	S	S	.	*			trans	-64.9	152.1	-170.8	61.4	0	0	0	0	113.3	S129 C130	S127-S129 PolarHBondContact O-N 3.18Å; S127-C130 PolarHBondContact O-N 3.26Å
128	A	25	Very low	23.5	Very low	87 Å²	87	118.5 Å²	118.5	72%	0.719	69%	0.688	S	S	*	*	H	α-helix	trans	-56.4	-22.3	-176.8	0	0	0	0	0	114.4	C130 A131	A128-C130 VanDerWaalsContact C-N 3.3Å; A128-C130 PolarHBondContact O-N 2.99Å; A128-A131 WeakPolarHBondContact O-CB 3.45Å; A128-A131 PolarHBondContact O-N 3.29Å
129	S	23.7	Very low	23.8	Very low	95 Å²	95	117 Å²	117	66%	0.664	68%	0.675	S	S	*	*	H	α-helix	trans	-64.4	-34.8	176.6	-40.4	0	0	0	0	112.2	S127 A131	S127-S129 PolarHBondContact O-N 3.18Å; S129-A131 VanDerWaalsContact C-N 3.34Å
130	C	23.1	Very low	24.1	Very low	63 Å²	63	119 Å²	119	43%	0.426	67%	0.674	S	S	.	*	H	α-helix	trans	-76.8	-19.5	176.4	-74.6	0	0	0	0	113.1	S127 A128 K134	S127-C130 PolarHBondContact O-N 3.26Å; A128-C130 VanDerWaalsContact C-N 3.3Å; A128-C130 PolarHBondContact O-N 2.99Å; C130-K134 PolarHBondContact O-N 2.86Å
131	A	23.4	Very low	24.4	Very low	55 Å²	55	116.9 Å²	116.9	46%	0.455	65%	0.653	S	S	.	*	H	α-helix	trans	-67.3	-40.7	178.8	0	0	0	0	0	111.6	A128 S129 L133 K134	A128-A131 WeakPolarHBondContact O-CB 3.45Å; A128-A131 PolarHBondContact O-N 3.29Å; S129-A131 VanDerWaalsContact C-N 3.34Å; A131-L133 PolarHBondContact O-N 3.43Å; A131-K134 PolarHBondContact O-N 3Å
132	K	23.7	Very low	24.6	Very low	177 Å²	177	118.8 Å²	118.8	77%	0.77	64%	0.643	S	S	*	*	H	α-helix	trans	-68.3	-34.1	-178.4	-87.9	-175.8	173.4	-179.1	0	114.2	K134	K132-K134 VanDerWaalsContact C-N 3.34Å
133	L	24.3	Very low	24.9	Very low	132 Å²	132	120.8 Å²	120.8	69%	0.691	64%	0.635	S	S	*	*	H	α-helix	trans	-76.8	-22.5	178.5	-81.8	161.9	0	0	0	112.9	A131 D135	A131-L133 PolarHBondContact O-N 3.43Å; L133-D135 VanDerWaalsContact C-N 3.3Å
134	K	23.6	Very low	25.1	Very low	125 Å²	125	117.6 Å²	117.6	54%	0.543	62%	0.623	S	S	.	*	H	α-helix	trans	-68.6	-31.1	174.7	-148.5	179	-175	179.3	0	112.2	C130 A131 K132 I138	C130-K134 PolarHBondContact O-N 2.86Å; A131-K134 PolarHBondContact O-N 3Å; K132-K134 VanDerWaalsContact C-N 3.34Å; K134-I138 HydrophobicContact CG-CD1 4.1Å; K134-I138 WeakPolarHBondContact O-CB 3.42Å
135	D	27.1	Very low	25.2	Very low	116 Å²	116	117.3 Å²	117.3	62%	0.62	61%	0.614	S	S	*	*	H	α-helix	trans	-82.9	-30.2	-168.4	-73	-17.2	0	0	0	114.2	L133 A139	L133-D135 VanDerWaalsContact C-N 3.3Å; D135-A139 WeakPolarHBondContact O-CB 3.46Å
136	Q	24.2	Very low	25.5	Very low	163 Å²	163	114.5 Å²	114.5	76%	0.762	61%	0.605	S	S	*	*	H	α-helix	trans	-85.9	-45.1	-176.3	-85.2	-179	-24.6	0	0	114.4
137	N	25.1	Very low	25.8	Very low	123 Å²	123	113.7 Å²	113.7	66%	0.658	60%	0.597	S	S	*	*	H	α-helix	trans	-90	-23	-174.5	-74.7	-15.4	0	0	0	114.2
138	I	26.3	Very low	26.2	Very low	68 Å²	68	116 Å²	116	35%	0.349	60%	0.603	S	S	.	*	H	α-helix	trans	-93.6	-28.1	-177.6	-58.6	179.5	0	0	0	112	K134 F141 R142	K134-I138 HydrophobicContact CG-CD1 4.1Å; K134-I138 WeakPolarHBondContact O-CB 3.42Å; I138-F141 PolarHBondContact O-N 3.43Å; I138-R142 HydrophobicContact CG2-CG 3.75Å; I138-R142 WeakPolarHBondContact O-CB 3.47Å; I138-R142 PolarHBondContact O-N 2.78Å
139	A	26	Very low	26.4	Very low	55 Å²	55	115.3 Å²	115.3	46%	0.455	61%	0.605	S	S	.	*	H	α-helix	trans	-67.1	-42.7	-177	0	0	0	0	0	112.7	D135	D135-A139 WeakPolarHBondContact O-CB 3.46Å
140	E	28.2	Very low	26.8	Very low	164 Å²	164	115.5 Å²	115.5	77%	0.766	60%	0.602	S	S	*	*	H	α-helix	trans	-70.5	-39.3	174.8	-73.1	-169.9	161.1	0	0	111.7	Q143 A144	E140-Q143 PolarHBondContact O-N 3.28Å; E140-A144 PolarHBondContact O-N 3.33Å
141	F	29.6	Very low	27	Very low	97 Å²	97	118.5 Å²	118.5	43%	0.425	61%	0.605	S	S	.	*	H	α-helix	trans	-72.4	-39	-176.9	-108	-81.2	0	0	0	114.2	I138 Q143 A144 L145 Y167	I138-F141 PolarHBondContact O-N 3.43Å; F141-Q143 VanDerWaalsContact C-N 3.29Å; F141-Q143 PolarHBondContact O-N 2.87Å; F141-A144 PolarHBondContact O-N 2.92Å; F141-L145 PolarHBondContact O-N 2.83Å; F141-Y167 AromaticContact CE1-CE2 3.86Å; F141-Y167 HydrophobicContact CE1-CE2 3.86Å; F141-Y167 AromaticContact CE1-CZ 3.89Å; F141-Y167 WeakPolarHBondContact CE1-OH 3.41Å; F141-Y167 HydrophobicContact CZ-CE2 4.45Å; F141-Y167 WeakPolarHBondContact CZ-OH 3.49Å
142	R	25.4	Very low	27.3	Very low	152 Å²	152	122.8 Å²	122.8	57%	0.574	62%	0.62	S	S	*	*	H	α-helix	trans	-66.7	-31.5	175.6	-84.6	-173.9	-174.2	-173.3	-0.5	112.2	I138 L145 Y146	I138-R142 HydrophobicContact CG2-CG 3.75Å; I138-R142 WeakPolarHBondContact O-CB 3.47Å; I138-R142 PolarHBondContact O-N 2.78Å; R142-L145 PolarHBondContact O-N 2.86Å; R142-Y146 PolarHBondContact O-N 3.22Å
143	Q	27.7	Very low	27.8	Very low	108 Å²	108	121.2 Å²	121.2	51%	0.505	62%	0.62	S	S	.	*	H	α-helix	trans	-67.1	-37.1	178.4	-81.4	-163.6	17.5	0	0	112.1	E140 F141 K147	E140-Q143 PolarHBondContact O-N 3.28Å; F141-Q143 VanDerWaalsContact C-N 3.29Å; F141-Q143 PolarHBondContact O-N 2.87Å; Q143-K147 HydrophobicContact CB-CD 4.46Å; Q143-K147 WeakPolarHBondContact O-CB 3.43Å; Q143-K147 WeakPolarHBondContact O-CG 3.32Å; Q143-K147 PolarHBondContact O-N 3.15Å
144	A	27.2	Very low	28.3	Very low	75 Å²	75	118.1 Å²	118.1	62%	0.62	61%	0.606	S	S	*	*	H	α-helix	trans	-65.4	-39.3	176.2	0	0	0	0	0	112.3	E140 F141	E140-A144 PolarHBondContact O-N 3.33Å; F141-A144 PolarHBondContact O-N 2.92Å
145	L	28.1	Very low	28.6	Very low	111 Å²	111	120.7 Å²	120.7	58%	0.581	62%	0.618	S	S	*	*	H	α-helix	trans	-74.3	-31	179.8	-87.7	153.8	0	0	0	114	F141 R142	F141-L145 PolarHBondContact O-N 2.83Å; R142-L145 PolarHBondContact O-N 2.86Å
146	Y	27.9	Very low	29	Very low	196 Å²	196	117.8 Å²	117.8	77%	0.769	61%	0.61	S	S	*	*	H	α-helix	trans	-94.5	-23.3	179.5	-90.7	-81.5	0	0	0	115	R142 N148	R142-Y146 PolarHBondContact O-N 3.22Å; Y146-N148 VanDerWaalsContact C-N 3.31Å; Y146-N148 PolarHBondContact O-N 2.88Å
147	K	28	Very low	29.5	Very low	148 Å²	148	115 Å²	115	64%	0.643	61%	0.608	S	S	*	*	H	α-helix	trans	-72.2	-20.3	-172.8	-88.5	-179.5	168.8	167.6	0	114.8	Q143 G149	Q143-K147 HydrophobicContact CB-CD 4.46Å; Q143-K147 WeakPolarHBondContact O-CB 3.43Å; Q143-K147 WeakPolarHBondContact O-CG 3.32Å; Q143-K147 PolarHBondContact O-N 3.15Å; K147-G149 PolarHBondContact O-N 3.05Å
148	N	32.3	Very low	29.9	Very low	125 Å²	125	111.8 Å²	111.8	67%	0.668	60%	0.595	S	S	*	*	S	Bend	trans	-93.2	80.5	170.5	-73.2	-6	0	0	0	109.1	Y146 T150	Y146-N148 VanDerWaalsContact C-N 3.31Å; Y146-N148 PolarHBondContact O-N 2.88Å; N148-T150 PolarHBondContact O-N 2.94Å
149	G	30.5	Very low	30.4	Very low	73 Å²	73	109.4 Å²	109.4	75%	0.753	59%	0.588	S	S	*	*			trans	-63	37.2	-179.4	0	0	0	0	0	116.2	K147	K147-G149 PolarHBondContact O-N 3.05Å
150	T	30.7	Very low	30.8	Very low	100 Å²	100	109.9 Å²	109.9	61%	0.613	58%	0.582	S	S	*	*			trans	-138.3	31.5	-178.5	43.5	0	0	0	0	112.2	N148 L152 D153	N148-T150 PolarHBondContact O-N 2.94Å; T150-L152 PolarHBondContact O-N 3.34Å; T150-D153 PolarHBondContact O-N 3.27Å; T150-D153 VanDerWaalsContact O-N 3.16Å
151	Y	28.7	Very low	31.2	Very low	125 Å²	125	105.6 Å²	105.6	49%	0.49	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.2	-8	174.2	-126.8	-84	0	0	0	114	D153	Y151-D153 VanDerWaalsContact C-N 3.27Å; Y151-D153 PolarHBondContact O-N 3.12Å
152	L	29.4	Very low	31.5	Very low	145 Å²	145	105.3 Å²	105.3	76%	0.759	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-18.2	173.5	-87.9	155.2	0	0	0	113.8	T150	T150-L152 PolarHBondContact O-N 3.34Å
153	D	34.1	Very low	32.2	Very low	145 Å²	145	101.4 Å²	101.4	78%	0.775	56%	0.557	S	S	*	*	S	Bend	trans	-103.8	-7.4	-177.4	-93.5	-13.6	0	0	0	115.4	T150 Y151 K155	T150-D153 PolarHBondContact O-N 3.27Å; T150-D153 VanDerWaalsContact O-N 3.16Å; Y151-D153 VanDerWaalsContact C-N 3.27Å; Y151-D153 PolarHBondContact O-N 3.12Å; D153-K155 PolarHBondContact O-N 2.99Å
154	V	33.5	Very low	32.7	Very low	67 Å²	67	104.4 Å²	104.4	41%	0.406	56%	0.564	S	S	.	*			trans	-83.1	50.1	168.2	-161.8	0	0	0	0	109.7	A156	V154-A156 PolarHBondContact O-N 3.03Å
155	K	31.4	Very low	33.1	Very low	179 Å²	179	105.1 Å²	105.1	78%	0.778	56%	0.556	S	S	*	*			trans	-74.5	-10.5	176.5	-90.3	179.7	179.4	175.9	0	113.4	D153 S157	D153-K155 PolarHBondContact O-N 2.99Å; K155-S157 PolarHBondContact O-N 3.35Å
156	A	34.8	Very low	33.7	Very low	55 Å²	55	105.2 Å²	105.2	46%	0.455	55%	0.553	S	S	.	*	S	Bend	trans	-80.7	112.7	171.2	0	0	0	0	0	108.9	V154 S158 G159	V154-A156 PolarHBondContact O-N 3.03Å; A156-S158 WeakPolarHBondContact CB-OG 3.49Å; A156-S158 PolarHBondContact O-N 2.91Å; A156-G159 PolarHBondContact O-N 3Å
157	S	35.6	Very low	34.4	Very low	105 Å²	105	101.1 Å²	101.1	73%	0.734	54%	0.537	S	S	*	.	H	α-helix	trans	-49.1	-17.4	174.3	54.6	0	0	0	0	114.4	K155 L161	K155-S157 PolarHBondContact O-N 3.35Å; S157-L161 PolarHBondContact O-N 2.73Å
158	S	33	Very low	34.9	Very low	54 Å²	54	98.3 Å²	98.3	38%	0.378	53%	0.529	S	S	.	.	H	α-helix	trans	-62.5	-44.7	173.5	52.5	0	0	0	0	113.2	A156 L161 E162 R247	A156-S158 WeakPolarHBondContact CB-OG 3.49Å; A156-S158 PolarHBondContact O-N 2.91Å; S158-L161 PolarHBondContact O-N 3.3Å; S158-E162 PolarHBondContact O-N 3.38Å; S158-E162 VanDerWaalsContact O-N 3.09Å; S158-R247 PolarHBondContact O-NH2 3.06Å; S158-R247 VanDerWaalsContact O-NH2 3.1Å
159	G	35.6	Very low	34.9	Very low	19 Å²	19	93.5 Å²	93.5	20%	0.196	51%	0.506	C	S	.	.	H	α-helix	trans	-65.6	-43.6	-175.7	0	0	0	0	0	112.1	A156 L161 E162 T163	A156-G159 PolarHBondContact O-N 3Å; G159-L161 PolarHBondContact O-N 2.91Å; G159-E162 PolarHBondContact O-N 2.85Å; G159-T163 PolarHBondContact O-N 2.82Å; G159-T163 PolarHBondContact O-OG1 3.36Å
160	L	36	Very low	35.4	Very low	65 Å²	65	93 Å²	93	34%	0.34	48%	0.484	S	S	.	.	H	α-helix	trans	-61.9	-43.6	176.9	-91.9	152.9	0	0	0	112.4	E162 T163 W164	L160-E162 VanDerWaalsContact C-N 3.34Å; L160-T163 PolarHBondContact O-N 3.39Å; L160-W164 WeakPolarHBondContact O-CB 3.18Å; L160-W164 PolarHBondContact O-N 3.43Å
161	L	35.3	Very low	35.6	Very low	73 Å²	73	94.1 Å²	94.1	38%	0.382	48%	0.477	S	S	.	.	H	α-helix	trans	-64.9	-40.6	177.6	-167.7	80.6	0	0	0	111.5	S157 S158 G159 W164 M165	S157-L161 PolarHBondContact O-N 2.73Å; S158-L161 PolarHBondContact O-N 3.3Å; G159-L161 PolarHBondContact O-N 2.91Å; L161-W164 PolarHBondContact O-N 3.05Å; L161-M165 HydrophobicContact CG-CG 4.45Å; L161-M165 WeakPolarHBondContact O-CB 3.07Å; L161-M165 WeakPolarHBondContact O-CG 3.43Å; L161-M165 PolarHBondContact O-N 2.91Å
162	E	36.8	Very low	35.9	Very low	91 Å²	91	89 Å²	89	43%	0.425	46%	0.459	S	S	.	.	H	α-helix	trans	-61.7	-46.2	175.1	-127.4	161	130.7	0	0	111.1	S158 G159 L160 W164 M165 Q166 R247	S158-E162 PolarHBondContact O-N 3.38Å; S158-E162 VanDerWaalsContact O-N 3.09Å; G159-E162 PolarHBondContact O-N 2.85Å; L160-E162 VanDerWaalsContact C-N 3.34Å; E162-W164 PolarHBondContact O-N 2.92Å; E162-M165 PolarHBondContact O-N 3.19Å; E162-Q166 VanDerWaalsContact O-CB 3.25Å; E162-Q166 WeakPolarHBondContact O-CB 3.48Å; E162-Q166 WeakPolarHBondContact O-CG 3.17Å; E162-Q166 PolarHBondContact O-N 3.18Å; E162-R247 IonicContact OE2-CZ 3.76Å; E162-R247 IonicContact OE2-NH1 2.92Å; E162-R247 PolarHBondContact OE2-NH1 3.44Å; E162-R247 IonicContact OE2-NH2 3.62Å
163	T	40.1	Very low	36.2	Very low	70 Å²	70	84.5 Å²	84.5	43%	0.429	44%	0.442	S	S	.	.	H	α-helix	trans	-63.1	-43.2	177.4	-44.9	0	0	0	0	110.5	G159 L160 Y167	G159-T163 PolarHBondContact O-N 2.82Å; G159-T163 PolarHBondContact O-OG1 3.36Å; L160-T163 PolarHBondContact O-N 3.39Å; T163-Y167 WeakPolarHBondContact O-CB 3.49Å; T163-Y167 PolarHBondContact O-N 2.92Å
164	W	38.6	Very low	36.3	Very low	172 Å²	172	85.9 Å²	85.9	65%	0.652	44%	0.436	S	S	*	.	H	α-helix	trans	-67	-41.4	178.4	-87.8	106.2	0	0	0	113.1	L160 L161 E162 Y167 L168	L160-W164 WeakPolarHBondContact O-CB 3.18Å; L160-W164 PolarHBondContact O-N 3.43Å; L161-W164 PolarHBondContact O-N 3.05Å; E162-W164 PolarHBondContact O-N 2.92Å; W164-Y167 PolarHBondContact O-N 3.27Å; W164-L168 WeakPolarHBondContact O-CB 3.07Å; W164-L168 PolarHBondContact O-N 3.2Å
165	M	34.5	Very low	36.2	Very low	90 Å²	90	84.9 Å²	84.9	44%	0.443	43%	0.428	S	S	.	.	H	α-helix	trans	-70.7	-41.2	178	-76.2	-78.1	173.3	0	0	111.5	L161 E162 Y167 L168 A169	L161-M165 HydrophobicContact CG-CG 4.45Å; L161-M165 WeakPolarHBondContact O-CB 3.07Å; L161-M165 WeakPolarHBondContact O-CG 3.43Å; L161-M165 PolarHBondContact O-N 2.91Å; E162-M165 PolarHBondContact O-N 3.19Å; M165-Y167 VanDerWaalsContact C-N 3.31Å; M165-L168 PolarHBondContact O-N 2.92Å; M165-A169 WeakPolarHBondContact O-CB 3.46Å; M165-A169 PolarHBondContact O-N 2.75Å
166	Q	40.8	Very low	36.2	Very low	112 Å²	112	80.1 Å²	80.1	52%	0.523	42%	0.416	S	S	.	.	H	α-helix	trans	-62.5	-40.5	171.1	-77.9	176.3	-12.4	0	0	111.1	E162 A169 E170	E162-Q166 VanDerWaalsContact O-CB 3.25Å; E162-Q166 WeakPolarHBondContact O-CB 3.48Å; E162-Q166 WeakPolarHBondContact O-CG 3.17Å; E162-Q166 PolarHBondContact O-N 3.18Å; Q166-A169 PolarHBondContact O-N 2.93Å; Q166-E170 WeakPolarHBondContact O-CB 3.34Å; Q166-E170 WeakPolarHBondContact O-CG 3.47Å; Q166-E170 PolarHBondContact O-N 3.2Å
167	Y	41.7	Very low	36	Very low	111 Å²	111	81.2 Å²	81.2	44%	0.435	42%	0.419	S	S	.	.	H	α-helix	trans	-64.3	-41.4	175.7	-160.9	-86.6	0	0	0	111.6	F141 T163 W164 M165 W171	F141-Y167 AromaticContact CE1-CE2 3.86Å; F141-Y167 HydrophobicContact CE1-CE2 3.86Å; F141-Y167 AromaticContact CE1-CZ 3.89Å; F141-Y167 WeakPolarHBondContact CE1-OH 3.41Å; F141-Y167 HydrophobicContact CZ-CE2 4.45Å; F141-Y167 WeakPolarHBondContact CZ-OH 3.49Å; T163-Y167 WeakPolarHBondContact O-CB 3.49Å; T163-Y167 PolarHBondContact O-N 2.92Å; W164-Y167 PolarHBondContact O-N 3.27Å; M165-Y167 VanDerWaalsContact C-N 3.31Å; Y167-W171 WeakPolarHBondContact O-CB 3.29Å; Y167-W171 PolarHBondContact O-N 3.2Å
168	L	38.8	Very low	35.6	Very low	89 Å²	89	80.3 Å²	80.3	47%	0.466	41%	0.405	S	S	.	.	H	α-helix	trans	-63.2	-46.9	175.3	-155	94.4	0	0	0	110	W164 M165 W171 L172	W164-L168 WeakPolarHBondContact O-CB 3.07Å; W164-L168 PolarHBondContact O-N 3.2Å; M165-L168 PolarHBondContact O-N 2.92Å; L168-W171 PolarHBondContact O-N 2.89Å; L168-L172 HydrophobicContact CD2-CD1 3.87Å; L168-L172 HydrophobicContact CG-CD1 4.08Å; L168-L172 HydrophobicContact CG-CG 4.42Å; L168-L172 WeakPolarHBondContact O-CB 3.45Å; L168-L172 WeakPolarHBondContact O-CG 3.32Å; L168-L172 PolarHBondContact O-N 2.83Å
169	A	33.7	Very low	35.2	Very low	23 Å²	23	80.8 Å²	80.8	19%	0.19	41%	0.408	C	S	.	.	H	α-helix	trans	-62.4	-45	177.3	0	0	0	0	0	112	M165 Q166 L172 A173	M165-A169 WeakPolarHBondContact O-CB 3.46Å; M165-A169 PolarHBondContact O-N 2.75Å; Q166-A169 PolarHBondContact O-N 2.93Å; A169-L172 PolarHBondContact O-N 3.39Å; A169-A173 WeakPolarHBondContact O-CB 3.38Å; A169-A173 PolarHBondContact O-N 3.19Å
170	E	39.7	Very low	34.6	Very low	64 Å²	64	84.9 Å²	84.9	30%	0.299	42%	0.418	S	S	.	.	H	α-helix	trans	-64.9	-41.4	176	-78.4	-165	170.6	0	0	112.1	Q166 A173 R174 S347	Q166-E170 WeakPolarHBondContact O-CB 3.34Å; Q166-E170 WeakPolarHBondContact O-CG 3.47Å; Q166-E170 PolarHBondContact O-N 3.2Å; E170-A173 PolarHBondContact O-N 3.07Å; E170-R174 WeakPolarHBondContact O-CB 3.45Å; E170-R174 WeakPolarHBondContact O-CG 3.41Å; E170-R174 PolarHBondContact O-N 3.05Å; E170-R174 IonicContact OE2-NH2 3.63Å; E170-S347 PolarHBondContact OE1-OG 3.02Å
171	W	36.3	Very low	34.2	Very low	122 Å²	122	85.4 Å²	85.4	46%	0.462	42%	0.421	S	S	.	.	H	α-helix	trans	-63.5	-48.3	174.7	-178.8	80.7	0	0	0	110.6	Y167 L168 A173 R174 N175	Y167-W171 WeakPolarHBondContact O-CB 3.29Å; Y167-W171 PolarHBondContact O-N 3.2Å; L168-W171 PolarHBondContact O-N 2.89Å; W171-A173 VanDerWaalsContact C-N 3.28Å; W171-A173 PolarHBondContact O-N 2.93Å; W171-R174 PolarHBondContact O-N 2.98Å; W171-R174 VanDerWaalsContact O-N 3.09Å; W171-N175 WeakPolarHBondContact CZ2-ND2 3.41Å; W171-N175 PolarHBondContact NE1-ND2 3.38Å; W171-N175 PolarHBondContact O-N 3.35Å; W171-N175 PolarHBondContact O-ND2 2.87Å
172	L	33.9	Very low	33.6	Very low	19 Å²	19	89.9 Å²	89.9	10%	0.099	44%	0.44	C	S	.	.	H	α-helix	trans	-60.5	-35.7	178.2	-81.9	179.1	0	0	0	112.7	L168 A169 Y180 R271	L168-L172 HydrophobicContact CD2-CD1 3.87Å; L168-L172 HydrophobicContact CG-CD1 4.08Å; L168-L172 HydrophobicContact CG-CG 4.42Å; L168-L172 WeakPolarHBondContact O-CB 3.45Å; L168-L172 WeakPolarHBondContact O-CG 3.32Å; L168-L172 PolarHBondContact O-N 2.83Å; A169-L172 PolarHBondContact O-N 3.39Å; L172-Y180 HydrophobicContact CD2-CE2 4.48Å; L172-R271 PolarHBondContact O-NH1 2.66Å; L172-R271 PolarHBondContact O-NH2 2.89Å; L172-R271 VanDerWaalsContact O-NH2 3.12Å
173	A	35.6	Very low	33.1	Very low	49 Å²	49	90.3 Å²	90.3	41%	0.405	45%	0.446	S	S	.	.	H	α-helix	trans	-77.2	-24.7	175.3	0	0	0	0	0	113.5	A169 E170 W171	A169-A173 WeakPolarHBondContact O-CB 3.38Å; A169-A173 PolarHBondContact O-N 3.19Å; E170-A173 PolarHBondContact O-N 3.07Å; W171-A173 VanDerWaalsContact C-N 3.28Å; W171-A173 PolarHBondContact O-N 2.93Å
174	R	36.2	Very low	32.6	Very low	174 Å²	174	89.8 Å²	89.8	66%	0.657	44%	0.442	S	S	*	.	H	α-helix	trans	-85.3	-21.5	176.5	-74.7	177.6	-165.8	-163.9	9.4	113.4	E170 W171	E170-R174 WeakPolarHBondContact O-CB 3.45Å; E170-R174 WeakPolarHBondContact O-CG 3.41Å; E170-R174 PolarHBondContact O-N 3.05Å; E170-R174 IonicContact OE2-NH2 3.63Å; W171-R174 PolarHBondContact O-N 2.98Å; W171-R174 VanDerWaalsContact O-N 3.09Å
175	N	30.8	Very low	32	Very low	46 Å²	46	85.4 Å²	85.4	25%	0.246	43%	0.428	C	S	.	.	S	Bend	trans	-83.5	138.1	177.6	-74.1	-72.3	0	0	0	111	W171	W171-N175 WeakPolarHBondContact CZ2-ND2 3.41Å; W171-N175 PolarHBondContact NE1-ND2 3.38Å; W171-N175 PolarHBondContact O-N 3.35Å; W171-N175 PolarHBondContact O-ND2 2.87Å
176	P	32.4	Very low	31.6	Very low	80 Å²	80	86.3 Å²	86.3	52%	0.519	43%	0.434	S	S	.	.			trans	-58.7	145.4	173.6	23.1	-30.2	0	0	0	109.9	N178 C179	P176-N178 PolarHBondContact O-N 3.49Å; P176-C179 PolarHBondContact O-N 3.33Å
177	P	30.5	Very low	31	Very low	78 Å²	78	85.5 Å²	85.5	51%	0.506	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-20.1	-176	-25.7	32.4	0	0	0	115
178	N	27.4	Very low	30.3	Very low	85 Å²	85	83.1 Å²	83.1	46%	0.455	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-4.1	-167.3	-33	-1	0	0	0	113.5	P176 Y180 D181	P176-N178 PolarHBondContact O-N 3.49Å; N178-Y180 PolarHBondContact O-N 2.93Å; N178-D181 PolarHBondContact O-N 3.16Å
179	C	24.1	Very low	29.6	Very low	65 Å²	65	82.2 Å²	82.2	44%	0.439	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-0.7	-171.7	65.5	0	0	0	0	115.2	P176	P176-C179 PolarHBondContact O-N 3.33Å
180	Y	24.3	Very low	29.2	Very low	105 Å²	105	88.9 Å²	88.9	41%	0.412	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-4.9	179.4	-88.8	-86	0	0	0	114.5	L104 L172 N178	L104-Y180 HydrophobicContact CD1-CE1 4.43Å; L172-Y180 HydrophobicContact CD2-CE2 4.48Å; N178-Y180 PolarHBondContact O-N 2.93Å
181	D	26.9	Very low	28.6	Very low	75 Å²	75	91.7 Å²	91.7	40%	0.401	46%	0.459	S	S	.	.	S	Bend	trans	-85.2	-34.6	-163.6	-74.6	-33.4	0	0	0	115.8	N178	N178-D181 PolarHBondContact O-N 3.16Å
182	E	23.2	Very low	27.8	Very low	167 Å²	167	88 Å²	88	78%	0.78	46%	0.459	S	S	*	.	H	α-helix	trans	-78.4	-33.1	-173.5	-78.7	-175.1	156.8	0	0	114.1	V184 F185 L186	E182-V184 PolarHBondContact O-N 3.27Å; E182-F185 PolarHBondContact O-N 3.15Å; E182-L186 PolarHBondContact O-N 2.89Å
183	D	25.4	Very low	27.3	Very low	101 Å²	101	94 Å²	94	54%	0.54	49%	0.487	S	S	.	.	H	α-helix	trans	-70.6	-20.1	-174.3	-133.8	35.7	0	0	0	112.5	R187	D183-R187 WeakPolarHBondContact O-CG 3.44Å; D183-R187 IonicContact OD2-NH2 2.7Å
184	V	29.8	Very low	26.7	Very low	59 Å²	59	93.8 Å²	93.8	36%	0.358	48%	0.481	S	S	.	.	H	α-helix	trans	-83.5	-34.6	177.3	-179.1	0	0	0	0	111.3	L81 E182 L186 R187 L188	L81-V184 HydrophobicContact CD1-CG2 4.24Å; E182-V184 PolarHBondContact O-N 3.27Å; V184-L186 PolarHBondContact O-N 2.67Å; V184-R187 PolarHBondContact O-N 3.01Å; V184-R187 VanDerWaalsContact O-N 3.12Å; V184-L188 HydrophobicContact CG1-CD1 4.27Å; V184-L188 HydrophobicContact CG1-CG 4.49Å; V184-L188 PolarHBondContact O-N 3.43Å
185	F	26.9	Very low	25.9	Very low	79 Å²	79	92.7 Å²	92.7	35%	0.346	49%	0.488	S	S	.	.	H	α-helix	trans	-62.3	-44.3	177.6	-159.9	-96.4	0	0	0	111.4	E182 R187 L188 I189 Y208	E182-F185 PolarHBondContact O-N 3.15Å; F185-R187 PolarHBondContact O-N 2.81Å; F185-L188 PolarHBondContact O-N 3.19Å; F185-I189 HydrophobicContact CD1-CD1 4.35Å; F185-I189 HydrophobicContact CE1-CD1 4.41Å; F185-I189 WeakPolarHBondContact O-CG1 3.48Å; F185-I189 PolarHBondContact O-N 3.43Å; F185-Y208 HydrophobicContact CE1-CE1 4.01Å; F185-Y208 HydrophobicContact CE2-CE1 4.5Å; F185-Y208 HydrophobicContact CZ-CD1 4.46Å; F185-Y208 AromaticContact CZ-CE1 3.43Å; F185-Y208 HydrophobicContact CZ-CE1 3.43Å; F185-Y208 VanDerWaalsContact CZ-CE1 3.43Å; F185-Y208 AromaticContact CZ-CZ 3.61Å; F185-Y208 VanDerWaalsContact CZ-OH 3.26Å; F185-Y208 WeakPolarHBondContact CZ-OH 3.42Å
186	L	26.2	Very low	25.4	Very low	109 Å²	109	94.8 Å²	94.8	57%	0.571	50%	0.504	S	S	*	.	H	α-helix	trans	-64.1	-27.2	175.1	-70.5	172	0	0	0	113.2	E182 V184 I189 Q190	E182-L186 PolarHBondContact O-N 2.89Å; V184-L186 PolarHBondContact O-N 2.67Å; L186-I189 HydrophobicContact CD2-CD1 4.42Å; L186-I189 WeakPolarHBondContact O-CB 3.03Å; L186-Q190 PolarHBondContact O-N 3.34Å
187	R	27.2	Very low	25	Very low	96 Å²	96	95.9 Å²	95.9	36%	0.362	51%	0.505	S	S	.	.	H	α-helix	trans	-85.3	-32.3	178.7	-70.3	-173.8	-163.6	-160.2	8	112.9	D183 V184 F185 I189 Q190 I191	D183-R187 WeakPolarHBondContact O-CG 3.44Å; D183-R187 IonicContact OD2-NH2 2.7Å; V184-R187 PolarHBondContact O-N 3.01Å; V184-R187 VanDerWaalsContact O-N 3.12Å; F185-R187 PolarHBondContact O-N 2.81Å; R187-I189 PolarHBondContact O-N 3.4Å; R187-Q190 WeakPolarHBondContact O-CB 3.37Å; R187-Q190 PolarHBondContact O-N 3.09Å; R187-I191 WeakPolarHBondContact O-CG1 3.34Å; R187-I191 PolarHBondContact O-N 3.08Å; R187-I191 VanDerWaalsContact O-N 3.13Å
188	L	26.9	Very low	24.6	Very low	60 Å²	60	97.7 Å²	97.7	31%	0.314	51%	0.514	S	S	.	.	H	α-helix	trans	-63	-28.9	170.6	-73.1	169.1	0	0	0	112.1	V184 F185 I191 G192 M193 V194	V184-L188 HydrophobicContact CG1-CD1 4.27Å; V184-L188 HydrophobicContact CG1-CG 4.49Å; V184-L188 PolarHBondContact O-N 3.43Å; F185-L188 PolarHBondContact O-N 3.19Å; L188-I191 HydrophobicContact CD2-CD1 4.14Å; L188-G192 PolarHBondContact O-N 3.11Å; L188-M193 HydrophobicContact CD2-CB 4.34Å; L188-M193 HydrophobicContact CD2-SD 4.3Å; L188-M193 PolarHBondContact O-N 2.96Å; L188-M193 VanDerWaalsContact O-N 3.15Å; L188-V194 HydrophobicContact CB-CG2 4.13Å; L188-V194 PolarHBondContact O-N 3.48Å
189	I	24.9	Very low	24.5	Very low	70 Å²	70	101 Å²	101	36%	0.359	53%	0.532	S	S	.	.	H	α-helix	trans	-63	-46.3	166.7	-65	171.3	0	0	0	110.9	F185 L186 R187 I191 G192	F185-I189 HydrophobicContact CD1-CD1 4.35Å; F185-I189 HydrophobicContact CE1-CD1 4.41Å; F185-I189 WeakPolarHBondContact O-CG1 3.48Å; F185-I189 PolarHBondContact O-N 3.43Å; L186-I189 HydrophobicContact CD2-CD1 4.42Å; L186-I189 WeakPolarHBondContact O-CB 3.03Å; R187-I189 PolarHBondContact O-N 3.4Å; I189-I191 VanDerWaalsContact C-N 3.33Å; I189-I191 PolarHBondContact O-N 3.25Å; I189-G192 PolarHBondContact O-N 3.49Å; I189-G192 VanDerWaalsContact O-N 3.12Å
190	Q	25.6	Very low	24.4	Very low	164 Å²	164	101 Å²	101	77%	0.766	53%	0.532	S	S	*	.	H	α-helix	trans	-66.2	-28.9	-178.3	-83.5	-174.5	-17	0	0	114.6	L186 R187	L186-Q190 PolarHBondContact O-N 3.34Å; R187-Q190 WeakPolarHBondContact O-CB 3.37Å; R187-Q190 PolarHBondContact O-N 3.09Å
191	I	25.5	Very low	24.3	Very low	123 Å²	123	104.5 Å²	104.5	63%	0.631	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	11	174.7	33.6	165.7	0	0	0	113.4	R187 L188 I189 M193	R187-I191 WeakPolarHBondContact O-CG1 3.34Å; R187-I191 PolarHBondContact O-N 3.08Å; R187-I191 VanDerWaalsContact O-N 3.13Å; L188-I191 HydrophobicContact CD2-CD1 4.14Å; I189-I191 VanDerWaalsContact C-N 3.33Å; I189-I191 PolarHBondContact O-N 3.25Å; I191-M193 PolarHBondContact O-N 3.28Å
192	G	20.6	Very low	24.2	Very low	45 Å²	45	110.9 Å²	110.9	46%	0.464	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	69.6	14.4	170.1	0	0	0	0	0	114.7	L188 I189 V194	L188-G192 PolarHBondContact O-N 3.11Å; I189-G192 PolarHBondContact O-N 3.49Å; I189-G192 VanDerWaalsContact O-N 3.12Å; G192-V194 VanDerWaalsContact C-N 3.28Å
193	M	22.5	Very low	24.1	Very low	143 Å²	143	110 Å²	110	70%	0.704	58%	0.575	S	S	*	*	S	Bend	trans	-80.6	-13.4	176.2	-75.2	-169.8	67.7	0	0	112.6	L188 I191	L188-M193 HydrophobicContact CD2-CB 4.34Å; L188-M193 HydrophobicContact CD2-SD 4.3Å; L188-M193 PolarHBondContact O-N 2.96Å; L188-M193 VanDerWaalsContact O-N 3.15Å; I191-M193 PolarHBondContact O-N 3.28Å
194	V	22.5	Very low	23.9	Very low	45 Å²	45	113.8 Å²	113.8	27%	0.273	60%	0.595	S	S	.	*	S	Bend	trans	-131.5	108.1	172	-173	0	0	0	0	107.5	L188 G192	L188-V194 HydrophobicContact CB-CG2 4.13Å; L188-V194 PolarHBondContact O-N 3.48Å; G192-V194 VanDerWaalsContact C-N 3.28Å
195	L	21.2	Very low	23.5	Very low	152 Å²	152	118 Å²	118	80%	0.796	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-88.4	119.8	177.5	-79.7	159.1	0	0	0	109.4	N197	L195-N197 PolarHBondContact O-N 3.16Å
196	P	20	Very low	23.2	Very low	89 Å²	89	120.9 Å²	120.9	58%	0.578	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-67.9	127.4	168.8	26.1	-29.6	0	0	0	109.3
197	N	23.3	Very low	22.9	Very low	104 Å²	104	121.2 Å²	121.2	56%	0.556	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-77.7	131.9	171.6	-164.1	3.1	0	0	0	109.4	L195 D199 A209	L195-N197 PolarHBondContact O-N 3.16Å; N197-D199 PolarHBondContact O-N 2.88Å; N197-A209 HydrophobicContact CB-CB 4.46Å
198	V	23.2	Very low	22.8	Very low	115 Å²	115	123.5 Å²	123.5	70%	0.697	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-84.3	-9.2	-158.7	-169.9	0	0	0	0	113.1	C200	V198-C200 PolarHBondContact O-N 2.82Å
199	D	23.7	Very low	22.5	Very low	155 Å²	155	124 Å²	124	83%	0.829	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-84.3	-2.8	-171.7	-85.4	-21.6	0	0	0	116.3	N197	N197-D199 PolarHBondContact O-N 2.88Å
200	C	22	Very low	22.4	Very low	65 Å²	65	123.7 Å²	123.7	44%	0.439	65%	0.653	S	S	.	*	G	3₁₀ helix	trans	-102.8	25.5	-178.6	60.8	0	0	0	0	114.8	V198 K202 E203	V198-C200 PolarHBondContact O-N 2.82Å; C200-K202 PolarHBondContact O-N 3.29Å; C200-E203 PolarHBondContact O-N 2.89Å
201	M	23.3	Very low	22.6	Very low	179 Å²	179	120 Å²	120	88%	0.882	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.9	14.1	169.5	-80.5	-99.7	-80.3	0	0	115.1
202	K	23.8	Very low	22.9	Very low	208 Å²	208	119 Å²	119	90%	0.904	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.2	-4.1	175.3	-73.6	-170.9	178.1	177.6	0	116	C200	C200-K202 PolarHBondContact O-N 3.29Å
203	E	21.1	Very low	23.4	Very low	150 Å²	150	122 Å²	122	70%	0.701	64%	0.642	S	S	*	*			trans	-131.4	128	179.2	-66.1	-170.1	178.1	0	0	111.7	C200 R205	C200-E203 PolarHBondContact O-N 2.89Å; E203-R205 PolarHBondContact O-N 3.44Å
204	D	22.5	Very low	23.8	Very low	180 Å²	180	115.6 Å²	115.6	96%	0.963	61%	0.61	S	S	*	*	S	Bend	trans	-64.3	33.3	-179	-77.9	-36.9	0	0	0	114.4
205	R	20.4	Very low	24.3	Very low	147 Å²	147	117.7 Å²	117.7	56%	0.555	62%	0.622	S	S	*	*			trans	-134.5	97.8	-176.5	-63.6	-175.9	179.1	-160.1	-3.5	110.5	H27 E203 T207	H27-R205 PolarHBondContact CE1-NH1 2.86Å; H27-R205 VanDerWaalsContact CE1-NH1 3.34Å; H27-R205 PolarHBondContact NE2-NH1 2.86Å; H27-R205 PolarHBondContact NE2-NH2 2.86Å; E203-R205 PolarHBondContact O-N 3.44Å; R205-T207 PolarHBondContact O-N 3.12Å; R205-T207 PolarHBondContact O-OG1 3.45Å; R205-T207 VanDerWaalsContact O-OG1 3.05Å
206	L	20.2	Very low	25	Very low	139 Å²	139	114.1 Å²	114.1	73%	0.728	62%	0.622	S	S	*	*			trans	-57.4	100	167.1	-89.8	150.3	0	0	0	109.3
207	T	19.9	Very low	25.8	Very low	116 Å²	116	110.5 Å²	110.5	71%	0.712	60%	0.601	S	S	*	*			trans	-114.1	119.1	177	-36.4	0	0	0	0	108.1	R205	R205-T207 PolarHBondContact O-N 3.12Å; R205-T207 PolarHBondContact O-OG1 3.45Å; R205-T207 VanDerWaalsContact O-OG1 3.05Å
208	Y	25	Very low	26.6	Very low	145 Å²	145	110.5 Å²	110.5	57%	0.569	61%	0.605	S	S	*	*			trans	-79.5	133	-171.9	-52.3	-73.3	0	0	0	111.9	F185 V210	F185-Y208 HydrophobicContact CE1-CE1 4.01Å; F185-Y208 HydrophobicContact CE2-CE1 4.5Å; F185-Y208 HydrophobicContact CZ-CD1 4.46Å; F185-Y208 AromaticContact CZ-CE1 3.43Å; F185-Y208 HydrophobicContact CZ-CE1 3.43Å; F185-Y208 VanDerWaalsContact CZ-CE1 3.43Å; F185-Y208 AromaticContact CZ-CZ 3.61Å; F185-Y208 VanDerWaalsContact CZ-OH 3.26Å; F185-Y208 WeakPolarHBondContact CZ-OH 3.42Å; Y208-V210 PolarHBondContact O-N 3.45Å
209	A	21.2	Very low	27.2	Very low	71 Å²	71	110.4 Å²	110.4	59%	0.587	60%	0.596	S	S	*	*			trans	-85.7	99.7	174.5	0	0	0	0	0	110.4	N197	N197-A209 HydrophobicContact CB-CB 4.46Å
210	V	23.4	Very low	27.9	Very low	63 Å²	63	105.1 Å²	105.1	38%	0.382	57%	0.571	S	S	.	*			trans	-60.8	139.2	147.2	178.9	0	0	0	0	105.9	Y208 P212 F214	Y208-V210 PolarHBondContact O-N 3.45Å; V210-P212 VanDerWaalsContact O-N 3.09Å; V210-F214 HydrophobicContact CG1-CB 3.59Å
211	N	30.1	Very low	28.6	Very low	87 Å²	87	106.7 Å²	106.7	47%	0.465	57%	0.568	S	S	.	*			trans	-38.5	124.6	172.1	177.5	-15.7	0	0	0	108.3	E213 F214	N211-E213 PolarHBondContact O-N 3.43Å; N211-E213 PolarHBondContact OD1-N 3.14Å; N211-F214 HydrophobicContact CB-CD2 4.28Å; N211-F214 PolarHBondContact O-N 3.44Å
212	P	30.4	Very low	29.2	Very low	100 Å²	100	98.9 Å²	98.9	65%	0.649	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-48.7	-29.7	-172.4	-28.9	32.8	0	0	0	113.5	V210 F214 V215 R303	V210-P212 VanDerWaalsContact O-N 3.09Å; P212-F214 PolarHBondContact O-N 3.05Å; P212-V215 PolarHBondContact O-N 3.28Å; P212-R303 PolarHBondContact O-NH1 2.81Å
213	E	31.3	Very low	29.6	Very low	108 Å²	108	93.8 Å²	93.8	51%	0.505	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-63.3	-21.8	175.3	-66.8	-168.7	161.2	0	0	114.6	N211 R303	N211-E213 PolarHBondContact O-N 3.43Å; N211-E213 PolarHBondContact OD1-N 3.14Å; E213-R303 WeakPolarHBondContact O-CD 3.38Å; E213-R303 PolarHBondContact O-NH1 2.66Å
214	F	30.5	Very low	30.2	Very low	10 Å²	10	88.2 Å²	88.2	4%	0.044	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-110.4	6.1	178.4	-67.3	-84	0	0	0	113.7	V210 N211 P212 G216 G217 V301 R303 T306 L308	V210-F214 HydrophobicContact CG1-CB 3.59Å; N211-F214 HydrophobicContact CB-CD2 4.28Å; N211-F214 PolarHBondContact O-N 3.44Å; P212-F214 PolarHBondContact O-N 3.05Å; F214-G216 PolarHBondContact O-N 3.28Å; F214-G216 VanDerWaalsContact O-N 3.14Å; F214-G217 PolarHBondContact O-N 2.91Å; F214-V301 HydrophobicContact CB-CG1 3.92Å; F214-V301 HydrophobicContact CD1-CB 4.1Å; F214-V301 HydrophobicContact CD1-CG1 3.76Å; F214-V301 VanDerWaalsContact CE1-O 3.32Å; F214-V301 WeakPolarHBondContact CE1-O 3.23Å; F214-V301 HydrophobicContact CG-CG1 4.15Å; F214-R303 HydrophobicContact CD1-CB 4.19Å; F214-T306 HydrophobicContact CE1-CG2 4.29Å; F214-T306 HydrophobicContact CZ-CG2 3.85Å; F214-L308 HydrophobicContact CE1-CB 3.99Å; F214-L308 HydrophobicContact CE2-CB 4.09Å; F214-L308 HydrophobicContact CE2-CD1 4.47Å; F214-L308 HydrophobicContact CZ-CB 3.68Å
215	V	34.5	Very low	30.6	Very low	88 Å²	88	83.2 Å²	83.2	53%	0.533	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	118.4	168.6	176.2	0	0	0	0	108.7	P212 R303	P212-V215 PolarHBondContact O-N 3.28Å; V215-R303 PolarHBondContact O-NE 2.93Å; V215-R303 PolarHBondContact O-NH1 3.31Å
216	G	35.9	Very low	31.2	Very low	77 Å²	77	79 Å²	79	79%	0.794	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	7.6	-172.5	0	0	0	0	0	115.3	F214	F214-G216 PolarHBondContact O-N 3.28Å; F214-G216 VanDerWaalsContact O-N 3.14Å
217	G	36.4	Very low	31.7	Very low	13 Å²	13	82.6 Å²	82.6	13%	0.134	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-68.1	150.9	171	0	0	0	0	0	112.9	F214 T302	F214-G217 PolarHBondContact O-N 2.91Å; G217-T302 CarbonylContact C-O 3.52Å; G217-T302 WeakPolarHBondContact CA-O 3.44Å
218	T	40.1	Very low	32.4	Very low	105 Å²	105	81.1 Å²	81.1	64%	0.644	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	120.6	175.1	-6.6	0	0	0	0	109.6	T302	T218-T302 PolarHBondContact N-O 2.91Å; T218-T302 PolarHBondContact O-N 3.49Å; T218-T302 PolarHBondContact OG1-O 2.8Å; T218-T302 VanDerWaalsContact OG1-O 3.1Å
219	F	36.8	Very low	32.9	Very low	112 Å²	112	77.8 Å²	77.8	49%	0.491	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	138.3	174	-66.9	-101.7	0	0	0	110	S300 V301	F219-S300 CarbonylContact C-O 3.53Å; F219-S300 WeakPolarHBondContact CA-O 3.05Å; F219-V301 HydrophobicContact CD1-CB 4.42Å; F219-V301 HydrophobicContact CD1-CG1 4.42Å; F219-V301 HydrophobicContact CD1-CG2 3.45Å; F219-V301 VanDerWaalsContact CD1-CG2 3.45Å; F219-V301 HydrophobicContact CE1-CB 4.33Å; F219-V301 HydrophobicContact CE1-CG1 4.17Å; F219-V301 HydrophobicContact CE1-CG2 3.25Å; F219-V301 HydrophobicContact CE2-CG1 4.3Å; F219-V301 HydrophobicContact CG-CG2 4.3Å; F219-V301 HydrophobicContact CZ-CG1 4.1Å; F219-V301 HydrophobicContact CZ-CG2 3.98Å
220	S	38.1	Very low	33.7	Very low	45 Å²	45	77.6 Å²	77.6	32%	0.315	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	148.7	172.4	60.7	0	0	0	0	109.6	S300	S220-S300 PolarHBondContact N-O 2.84Å; S220-S300 WeakPolarHBondContact O-CA 3.07Å; S220-S300 WeakPolarHBondContact O-CB 3.05Å; S220-S300 PolarHBondContact O-N 3.31Å; S220-S300 VanDerWaalsContact O-O 3.08Å; S220-S300 WeakPolarHBondContact OG-CB 3.47Å
221	Y	36.4	Very low	34.6	Very low	97 Å²	97	83.6 Å²	83.6	38%	0.38	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	130	176.4	-60.3	-103.4	0	0	0	108.4	G70 L299	G70-Y221 WeakPolarHBondContact O-CD2 2.89Å; G70-Y221 WeakPolarHBondContact O-CE2 3.2Å; G70-Y221 VanDerWaalsContact O-CG 3.26Å; Y221-L299 HydrophobicContact CD1-CD1 3.63Å; Y221-L299 HydrophobicContact CE1-CD1 3.19Å; Y221-L299 HydrophobicContact CE2-CD1 4.3Å; Y221-L299 HydrophobicContact CG-CD1 4.36Å
222	G	35.7	Very low	35.2	Very low	15 Å²	15	80 Å²	80	16%	0.155	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-67.6	131.2	171.5	0	0	0	0	0	110.3	C224 V298	G222-C224 PolarHBondContact O-N 3.12Å; G222-V298 PolarHBondContact N-O 3.31Å
223	P	32.1	Very low	36.2	Very low	101 Å²	101	79.8 Å²	79.8	66%	0.656	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-62.6	128.4	178.5	23.9	-32	0	0	0	110.6	S225	P223-S225 PolarHBondContact O-N 2.76Å
224	C	33.1	Very low	37.2	Very low	33 Å²	33	75.3 Å²	75.3	22%	0.223	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-65.6	128.6	166	-79	0	0	0	0	109.3	G222 P226 Q295 P297	G222-C224 PolarHBondContact O-N 3.12Å; C224-P226 VanDerWaalsContact C-CD 3.42Å; C224-P226 VanDerWaalsContact O-CD 3.23Å; C224-P226 WeakPolarHBondContact O-CD 3.31Å; C224-Q295 PolarHBondContact SG-O 2.98Å; C224-P297 WeakPolarHBondContact SG-CD 3.27Å; C224-P297 VanDerWaalsContact SG-CG 3.54Å; C224-P297 VanDerWaalsContact SG-N 3.37Å
225	S	31.5	Very low	38.5	Very low	75 Å²	75	77.4 Å²	77.4	52%	0.524	42%	0.417	S	S	.	.			trans	-113.4	80.7	170.3	-123.7	0	0	0	0	109	P223 R227	P223-S225 PolarHBondContact O-N 2.76Å; S225-R227 VanDerWaalsContact C-N 3.26Å; S225-R227 PolarHBondContact O-N 3.15Å
226	P	32.2	Very low	39.5	Very low	59 Å²	59	73.7 Å²	73.7	38%	0.383	40%	0.396	S	S	.	.			trans	-67	89.2	172.2	27.9	-31.8	0	0	0	108.8	C224 H228	C224-P226 VanDerWaalsContact C-CD 3.42Å; C224-P226 VanDerWaalsContact O-CD 3.23Å; C224-P226 WeakPolarHBondContact O-CD 3.31Å; P226-H228 PolarHBondContact O-N 2.83Å
227	R	32	Very low	40.6	Very low	215 Å²	215	70.5 Å²	70.5	81%	0.811	36%	0.36	S	S	*	.			trans	-71.4	-7.3	177.9	-76.2	-169.5	175	-171.5	0.1	113.2	S225	S225-R227 VanDerWaalsContact C-N 3.26Å; S225-R227 PolarHBondContact O-N 3.15Å
228	H	33.3	Very low	41.8	Very low	85 Å²	85	70 Å²	70	39%	0.394	36%	0.355	S	S	.	.			trans	-124	106.9	-176.5	-57.3	-52.5	0	0	0	110.5	P226 Y230	P226-H228 PolarHBondContact O-N 2.83Å; H228-Y230 HydrophobicContact CB-CD2 4.2Å; H228-Y230 HydrophobicContact CB-CE2 3.37Å
229	V	36.6	Very low	42.4	Very low	74 Å²	74	66.2 Å²	66.2	45%	0.448	33%	0.331	S	S	.	.			trans	-88.4	122.6	167.6	-178.1	0	0	0	0	107.3	F61	F61-V229 HydrophobicContact CD1-CG1 3.74Å; F61-V229 HydrophobicContact CE1-CG1 3.9Å
230	Y	38.6	Very low	43.4	Very low	67 Å²	67	62.8 Å²	62.8	26%	0.263	32%	0.318	S	S	.	.			trans	-110.1	137.6	171.4	-62.4	-83.9	0	0	0	109	H228 V232 R290	H228-Y230 HydrophobicContact CB-CD2 4.2Å; H228-Y230 HydrophobicContact CB-CE2 3.37Å; Y230-V232 PolarHBondContact O-N 3.16Å; Y230-R290 HydrophobicContact CD1-CG 4.05Å; Y230-R290 HydrophobicContact CD2-CB 4.33Å; Y230-R290 HydrophobicContact CD2-CG 4.39Å; Y230-R290 VanDerWaalsContact CD2-N 3.27Å; Y230-R290 HydrophobicContact CE1-CB 4.11Å; Y230-R290 VanDerWaalsContact CE1-CD 3.48Å; Y230-R290 HydrophobicContact CE1-CG 3.63Å; Y230-R290 HydrophobicContact CE2-CB 3.58Å; Y230-R290 HydrophobicContact CE2-CG 3.94Å; Y230-R290 HydrophobicContact CG-CG 4.42Å; Y230-R290 VanDerWaalsContact CZ-CB 3.48Å
231	R	40.4	Very low	44.5	Very low	190 Å²	190	61.1 Å²	61.1	72%	0.717	31%	0.308	S	S	*	.			trans	-73.2	125.7	173.3	-78	-175.7	170	-180	-1.2	108.4	T59	T59-R231 HydrophobicContact CG2-CB 3.9Å; T59-R231 HydrophobicContact CG2-CG 3.69Å
232	V	43	Very low	45.2	Very low	10 Å²	10	58 Å²	58	6%	0.061	30%	0.296	C	S	.	.			trans	-123	130.4	171.3	-178.2	0	0	0	0	106.5	Y230 T288 E323 V325	Y230-V232 PolarHBondContact O-N 3.16Å; V232-T288 HydrophobicContact CG2-CG2 4Å; V232-E323 WeakPolarHBondContact CA-O 3.33Å; V232-V325 HydrophobicContact CG1-CB 4.21Å; V232-V325 HydrophobicContact CG1-CG2 3.37Å
233	E	53	Low	46	Very low	96 Å²	96	58.3 Å²	58.3	45%	0.449	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	130.2	172.4	-65.9	-175.4	172.6	0	0	108.7	F256 E323 R324 V325	E233-F256 HydrophobicContact CB-CZ 4.22Å; E233-E323 PolarHBondContact N-O 3.22Å; E233-R324 HydrophobicContact CB-CG 4.12Å; E233-R324 CarbonylContact O-C 3.58Å; E233-R324 WeakPolarHBondContact O-CA 3.45Å; E233-V325 PolarHBondContact O-N 2.85Å
234	A	51.4	Low	47.2	Very low	14 Å²	14	56.4 Å²	56.4	12%	0.116	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	150.9	-179.2	0	0	0	0	0	111.4	L56 V325 F327	L56-A234 CarbonylContact C-O 3.47Å; A234-V325 CarbonylContact C-O 3.5Å; A234-V325 WeakPolarHBondContact CA-O 3.46Å; A234-V325 HydrophobicContact CB-CB 4.4Å; A234-F327 HydrophobicContact CB-CD2 4.34Å; A234-F327 HydrophobicContact CB-CE2 3.97Å
235	M	57	Low	48.4	Very low	54 Å²	54	55.3 Å²	55.3	27%	0.266	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	140.5	168.4	179.8	175.8	-83.9	0	0	108	I237 M253 F256 V325 L326 F327	M235-I237 HydrophobicContact CG-CG2 4.18Å; M235-I237 HydrophobicContact SD-CG2 4.27Å; M235-M253 HydrophobicContact SD-CB 4.23Å; M235-M253 HydrophobicContact SD-CE 4.34Å; M235-M253 HydrophobicContact SD-SD 4.12Å; M235-F256 HydrophobicContact CB-CD1 3.91Å; M235-F256 HydrophobicContact CB-CD2 3.65Å; M235-F256 HydrophobicContact CB-CE1 3.91Å; M235-F256 HydrophobicContact CB-CE2 3.66Å; M235-F256 HydrophobicContact CB-CG 3.78Å; M235-F256 HydrophobicContact CB-CZ 3.79Å; M235-F256 HydrophobicContact CE-CD2 3.84Å; M235-F256 HydrophobicContact CE-CE2 4.42Å; M235-F256 HydrophobicContact CG-CD2 4.34Å; M235-F256 HydrophobicContact CG-CG 4.46Å; M235-F256 HydrophobicContact SD-CB 3.88Å; M235-F256 HydrophobicContact SD-CD2 3.82Å; M235-F256 HydrophobicContact SD-CG 3.95Å; M235-V325 PolarHBondContact N-O 2.83Å; M235-L326 HydrophobicContact CB-CD1 4.08Å; M235-L326 HydrophobicContact CG-CD1 4.25Å; M235-L326 CarbonylContact O-C 3.51Å; M235-L326 VanDerWaalsContact O-CA 3.3Å; M235-L326 WeakPolarHBondContact O-CA 2.82Å; M235-F327 PolarHBondContact O-N 3.23Å
236	A	57.2	Low	49.4	Very low	10 Å²	10	55.8 Å²	55.8	8%	0.083	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	138.6	172.1	0	0	0	0	0	109.4	L56 F327 L329 W342	L56-A236 HydrophobicContact CD1-CB 3.66Å; L56-A236 HydrophobicContact CD2-CB 3.66Å; L56-A236 HydrophobicContact CG-CB 4.31Å; A236-F327 CarbonylContact C-O 3.41Å; A236-F327 WeakPolarHBondContact CA-O 3.22Å; A236-F327 HydrophobicContact CB-CB 3.93Å; A236-L329 HydrophobicContact CB-CD1 4.17Å; A236-L329 HydrophobicContact CB-CD2 4.05Å; A236-L329 HydrophobicContact CB-CG 4.25Å; A236-W342 HydrophobicContact CB-CH2 4.17Å; A236-W342 HydrophobicContact CB-CZ3 4.44Å; A236-W342 WeakPolarHBondContact O-CH2 3.44Å; A236-W342 WeakPolarHBondContact O-CZ2 3Å
237	I	58.9	Low	50.5	Low	11 Å²	11	56.1 Å²	56.1	6%	0.056	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	145.4	176.4	61.9	176.1	0	0	0	110.4	M235 Y242 M253 L326 F327 V328 L329	M235-I237 HydrophobicContact CG-CG2 4.18Å; M235-I237 HydrophobicContact SD-CG2 4.27Å; I237-Y242 HydrophobicContact CD1-CD2 4.15Å; I237-Y242 HydrophobicContact CD1-CG 4.4Å; I237-M253 HydrophobicContact CD1-CE 4.11Å; I237-M253 HydrophobicContact CG2-CE 4.2Å; I237-M253 HydrophobicContact CG2-SD 3.83Å; I237-L326 HydrophobicContact CD1-CD1 3.87Å; I237-L326 HydrophobicContact CD1-CD2 3.74Å; I237-L326 HydrophobicContact CD1-CG 3.98Å; I237-L326 HydrophobicContact CG1-CD1 3.96Å; I237-L326 HydrophobicContact CG1-CD2 4.43Å; I237-L326 HydrophobicContact CG1-CG 4.15Å; I237-L326 HydrophobicContact CG2-CD1 4.11Å; I237-F327 PolarHBondContact N-O 3.44Å; I237-V328 WeakPolarHBondContact O-CA 3.42Å; I237-L329 PolarHBondContact O-N 3.41Å
238	P	60.3	Low	51.6	Low	3 Å²	3	48.5 Å²	48.5	2%	0.019	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	158.4	169.7	-25.9	38.3	0	0	0	112.6	D240 G241 Y242 A332 T334 W342	P238-D240 VanDerWaalsContact C-N 3.32Å; P238-D240 WeakPolarHBondContact CB-OD1 3.06Å; P238-D240 PolarHBondContact O-N 2.71Å; P238-G241 PolarHBondContact O-N 3.1Å; P238-G241 VanDerWaalsContact O-N 3.12Å; P238-Y242 PolarHBondContact O-N 2.9Å; P238-A332 HydrophobicContact CB-CB 4.38Å; P238-A332 WeakPolarHBondContact CB-O 3.11Å; P238-T334 HydrophobicContact CB-CG2 3.91Å; P238-T334 HydrophobicContact CG-CG2 3.68Å; P238-W342 HydrophobicContact CG-CB 4.15Å; P238-W342 VanDerWaalsContact CG-CD1 3.44Å; P238-W342 HydrophobicContact CG-CD2 3.69Å; P238-W342 HydrophobicContact CG-CG 3.49Å; P238-W342 VanDerWaalsContact CG-CG 3.49Å
239	V	53.9	Low	52.7	Low	24 Å²	24	50.5 Å²	50.5	15%	0.145	26%	0.257	C	S	.	.	H	α-helix	trans	-62.1	-36.8	-172.9	71.1	0	0	0	0	113.4	Y242 V243 V328 L329 V330 A332 T333	V239-Y242 WeakPolarHBondContact O-CB 3.3Å; V239-Y242 PolarHBondContact O-N 3.31Å; V239-V243 VanDerWaalsContact O-CG2 3.31Å; V239-V243 WeakPolarHBondContact O-CG2 3.28Å; V239-V243 PolarHBondContact O-N 2.81Å; V239-V328 HydrophobicContact CB-CG1 4.27Å; V239-V328 HydrophobicContact CG2-CG1 4.19Å; V239-L329 PolarHBondContact N-O 2.91Å; V239-V330 HydrophobicContact CG2-CG1 4.45Å; V239-A332 PolarHBondContact N-O 3.37Å; V239-T333 HydrophobicContact CG1-CG2 4.16Å
240	D	56.7	Low	53.6	Low	40 Å²	40	48.4 Å²	48.4	21%	0.214	25%	0.25	C	S	.	.	H	α-helix	trans	-68.7	-41.9	173.9	59.1	-27.3	0	0	0	111.8	P238 Y242 V243 D244 T333 T334	P238-D240 VanDerWaalsContact C-N 3.32Å; P238-D240 WeakPolarHBondContact CB-OD1 3.06Å; P238-D240 PolarHBondContact O-N 2.71Å; D240-Y242 VanDerWaalsContact C-N 3.27Å; D240-Y242 PolarHBondContact O-N 2.81Å; D240-V243 CarbonylContact O-C 3.54Å; D240-V243 WeakPolarHBondContact O-CA 3.44Å; D240-V243 WeakPolarHBondContact O-CB 3.38Å; D240-V243 PolarHBondContact O-N 3.05Å; D240-D244 PolarHBondContact O-N 3.13Å; D240-T333 VanDerWaalsContact OD1-CA 3.26Å; D240-T333 WeakPolarHBondContact OD1-CA 3.47Å; D240-T334 PolarHBondContact OD1-N 2.97Å; D240-T334 WeakPolarHBondContact OD2-CB 2.87Å; D240-T334 PolarHBondContact OD2-N 3.49Å; D240-T334 PolarHBondContact OD2-OG1 3.33Å
241	G	60.4	Low	54.4	Low	10 Å²	10	50.7 Å²	50.7	10%	0.103	27%	0.266	C	S	.	.	H	α-helix	trans	-58	-39.4	171.7	0	0	0	0	0	112.4	P238 D244 V245	P238-G241 PolarHBondContact O-N 3.1Å; P238-G241 VanDerWaalsContact O-N 3.12Å; G241-D244 PolarHBondContact O-N 3.41Å; G241-V245 WeakPolarHBondContact O-CG2 3.1Å; G241-V245 PolarHBondContact O-N 3.38Å
242	Y	53.1	Low	55.2	Low	31 Å²	31	47.7 Å²	47.7	12%	0.122	26%	0.264	C	S	.	.	H	α-helix	trans	-63.3	-44.3	171.9	174	-104.8	0	0	0	112.2	R85 I237 P238 V239 D240 D244 V245 Y246 W261 V267 L326 V328	R85-Y242 PolarHBondContact NH1-OH 3.05Å; I237-Y242 HydrophobicContact CD1-CD2 4.15Å; I237-Y242 HydrophobicContact CD1-CG 4.4Å; P238-Y242 PolarHBondContact O-N 2.9Å; V239-Y242 WeakPolarHBondContact O-CB 3.3Å; V239-Y242 PolarHBondContact O-N 3.31Å; D240-Y242 VanDerWaalsContact C-N 3.27Å; D240-Y242 PolarHBondContact O-N 2.81Å; Y242-D244 VanDerWaalsContact C-N 3.3Å; Y242-D244 PolarHBondContact O-N 3.46Å; Y242-V245 PolarHBondContact O-N 3.16Å; Y242-Y246 WeakPolarHBondContact O-CB 3.1Å; Y242-Y246 PolarHBondContact O-N 3.23Å; Y242-W261 AromaticContact CD2-CH2 3.91Å; Y242-W261 HydrophobicContact CD2-CH2 3.91Å; Y242-W261 HydrophobicContact CD2-CZ2 4.46Å; Y242-W261 AromaticContact CE2-CH2 3.37Å; Y242-W261 HydrophobicContact CE2-CH2 3.37Å; Y242-W261 HydrophobicContact CE2-CZ2 4.2Å; Y242-W261 AromaticContact CE2-CZ3 3.95Å; Y242-W261 HydrophobicContact CE2-CZ3 3.95Å; Y242-V267 HydrophobicContact CD2-CG1 4.09Å; Y242-V267 HydrophobicContact CE2-CB 4.46Å; Y242-V267 HydrophobicContact CE2-CG1 3.47Å; Y242-V267 VanDerWaalsContact CE2-CG1 3.47Å; Y242-V267 HydrophobicContact CE2-CG2 4.25Å; Y242-L326 HydrophobicContact CD2-CD2 3.97Å; Y242-L326 HydrophobicContact CE2-CD2 4.31Å; Y242-V328 HydrophobicContact CD1-CG1 4.28Å; Y242-V328 HydrophobicContact CD1-CG2 4.3Å; Y242-V328 HydrophobicContact CD2-CG2 3.59Å; Y242-V328 HydrophobicContact CE2-CG2 4.16Å; Y242-V328 HydrophobicContact CG-CG1 4.03Å; Y242-V328 HydrophobicContact CG-CG2 3.67Å
243	V	51.4	Low	56	Low	23 Å²	23	48.9 Å²	48.9	14%	0.139	27%	0.269	C	S	.	.	H	α-helix	trans	-60.3	-41	176.8	170.1	0	0	0	0	110.8	V239 D240 Y246 R247	V239-V243 VanDerWaalsContact O-CG2 3.31Å; V239-V243 WeakPolarHBondContact O-CG2 3.28Å; V239-V243 PolarHBondContact O-N 2.81Å; D240-V243 CarbonylContact O-C 3.54Å; D240-V243 WeakPolarHBondContact O-CA 3.44Å; D240-V243 WeakPolarHBondContact O-CB 3.38Å; D240-V243 PolarHBondContact O-N 3.05Å; V243-Y246 PolarHBondContact O-N 3.27Å; V243-R247 HydrophobicContact CG1-CG 4.29Å; V243-R247 WeakPolarHBondContact O-CB 3.34Å; V243-R247 WeakPolarHBondContact O-CG 3.23Å; V243-R247 PolarHBondContact O-N 3.28Å
244	D	56.6	Low	56.6	Low	61 Å²	61	46.1 Å²	46.1	33%	0.326	27%	0.267	S	S	.	.	H	α-helix	trans	-66.8	-45.8	178.4	-75.5	-17.8	0	0	0	112.6	D240 G241 Y242 Y246 R247 G248 L249 G250	D240-D244 PolarHBondContact O-N 3.13Å; G241-D244 PolarHBondContact O-N 3.41Å; Y242-D244 VanDerWaalsContact C-N 3.3Å; Y242-D244 PolarHBondContact O-N 3.46Å; D244-Y246 VanDerWaalsContact C-N 3.3Å; D244-Y246 PolarHBondContact O-N 3.21Å; D244-R247 PolarHBondContact O-N 2.95Å; D244-G248 PolarHBondContact O-N 2.85Å; D244-L249 PolarHBondContact O-N 3.48Å; D244-G250 PolarHBondContact O-N 3.31Å
245	V	58.1	Low	56.9	Low	10 Å²	10	50 Å²	50	6%	0.061	28%	0.282	C	S	.	.	H	α-helix	trans	-62	-42.4	175.4	176.2	0	0	0	0	110.1	G241 Y242 R247 G248 M253 R258 W261	G241-V245 WeakPolarHBondContact O-CG2 3.1Å; G241-V245 PolarHBondContact O-N 3.38Å; Y242-V245 PolarHBondContact O-N 3.16Å; V245-R247 PolarHBondContact O-N 3.14Å; V245-G248 PolarHBondContact O-N 3.14Å; V245-G248 VanDerWaalsContact O-N 3.1Å; V245-M253 HydrophobicContact CB-CE 4.17Å; V245-M253 HydrophobicContact CG1-CE 3.91Å; V245-M253 HydrophobicContact CG2-CE 3.35Å; V245-M253 HydrophobicContact CG2-CG 4.33Å; V245-M253 HydrophobicContact CG2-SD 3.72Å; V245-R258 HydrophobicContact CG1-CB 4.3Å; V245-R258 WeakPolarHBondContact O-CD 3.04Å; V245-W261 HydrophobicContact CB-CZ2 4.38Å; V245-W261 HydrophobicContact CG1-CH2 4.08Å; V245-W261 HydrophobicContact CG1-CZ2 3.47Å; V245-W261 VanDerWaalsContact CG1-CZ2 3.47Å
246	Y	54.5	Low	56.8	Low	85 Å²	85	48.1 Å²	48.1	33%	0.333	27%	0.273	S	S	.	.	H	α-helix	trans	-63.7	-39.9	175.8	-177.5	-101.1	0	0	0	112.3	Y242 V243 D244 G248 R258 W261	Y242-Y246 WeakPolarHBondContact O-CB 3.1Å; Y242-Y246 PolarHBondContact O-N 3.23Å; V243-Y246 PolarHBondContact O-N 3.27Å; D244-Y246 VanDerWaalsContact C-N 3.3Å; D244-Y246 PolarHBondContact O-N 3.21Å; Y246-G248 PolarHBondContact O-N 3.4Å; Y246-R258 WeakPolarHBondContact O-CD 3.39Å; Y246-R258 PolarHBondContact O-NE 3.15Å; Y246-R258 PolarHBondContact O-NH1 2.93Å; Y246-W261 HydrophobicContact CD2-CZ3 4.04Å
247	R	54.4	Low	57.2	Low	66 Å²	66	48.4 Å²	48.4	25%	0.249	27%	0.274	C	S	.	.	H	α-helix	trans	-69.9	-14.7	175	-74.1	173.6	177.5	-175.4	-1.7	112.5	S158 E162 V243 D244 V245 L249	S158-R247 PolarHBondContact O-NH2 3.06Å; S158-R247 VanDerWaalsContact O-NH2 3.1Å; E162-R247 IonicContact OE2-CZ 3.76Å; E162-R247 IonicContact OE2-NH1 2.92Å; E162-R247 PolarHBondContact OE2-NH1 3.44Å; E162-R247 IonicContact OE2-NH2 3.62Å; V243-R247 HydrophobicContact CG1-CG 4.29Å; V243-R247 WeakPolarHBondContact O-CB 3.34Å; V243-R247 WeakPolarHBondContact O-CG 3.23Å; V243-R247 PolarHBondContact O-N 3.28Å; D244-R247 PolarHBondContact O-N 2.95Å; V245-R247 PolarHBondContact O-N 3.14Å; R247-L249 HydrophobicContact CB-CB 4.37Å; R247-L249 HydrophobicContact CB-CD1 3.82Å; R247-L249 HydrophobicContact CB-CG 3.88Å; R247-L249 HydrophobicContact CG-CD1 4.46Å
248	G	54.3	Low	57.2	Low	54 Å²	54	53.7 Å²	53.7	56%	0.557	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.2	16.6	-171.9	0	0	0	0	0	113	D244 V245 Y246	D244-G248 PolarHBondContact O-N 2.85Å; V245-G248 PolarHBondContact O-N 3.14Å; V245-G248 VanDerWaalsContact O-N 3.1Å; Y246-G248 PolarHBondContact O-N 3.4Å
249	L	56.2	Low	57.3	Low	128 Å²	128	57.3 Å²	57.3	67%	0.67	33%	0.332	S	S	*	.			trans	-93.2	-17.8	176	-63.1	172.1	0	0	0	111.7	D244 R247	D244-L249 PolarHBondContact O-N 3.48Å; R247-L249 HydrophobicContact CB-CB 4.37Å; R247-L249 HydrophobicContact CB-CD1 3.82Å; R247-L249 HydrophobicContact CB-CG 3.88Å; R247-L249 HydrophobicContact CG-CD1 4.46Å
250	G	56.3	Low	57.6	Low	30 Å²	30	60.2 Å²	60.2	31%	0.309	34%	0.344	S	S	.	.	S	Bend	trans	-69.7	156.3	-175.6	0	0	0	0	0	114.5	D244	D244-G250 PolarHBondContact O-N 3.31Å
251	I	55.8	Low	57.7	Low	115 Å²	115	58.9 Å²	58.9	59%	0.59	34%	0.335	S	S	*	.			trans	-58.2	145.5	171.6	-63	162.1	0	0	0	109.3	M253 L339	I251-M253 WeakPolarHBondContact O-CG 3.47Å; I251-M253 PolarHBondContact O-N 3.22Å; I251-L339 HydrophobicContact CD1-CD1 3.66Å; I251-L339 HydrophobicContact CD1-CG 4.22Å
252	N	57.8	Low	57.5	Low	126 Å²	126	60.8 Å²	60.8	67%	0.674	34%	0.343	S	S	*	.			trans	-60.7	106.9	174	-171.7	4.9	0	0	0	109.9	G254 S257	N252-G254 PolarHBondContact O-N 3.33Å; N252-G254 PolarHBondContact OD1-N 3.2Å; N252-S257 WeakPolarHBondContact CA-OG 3.3Å; N252-S257 PolarHBondContact OD1-OG 2.89Å
253	M	58.7	Low	57.1	Low	36 Å²	36	63.2 Å²	63.2	18%	0.177	36%	0.358	C	S	.	.			trans	-91.5	30.2	179.4	-56.5	-163.8	-52	0	0	112.3	M235 I237 V245 I251 E255 F256 S257 L326	M235-M253 HydrophobicContact SD-CB 4.23Å; M235-M253 HydrophobicContact SD-CE 4.34Å; M235-M253 HydrophobicContact SD-SD 4.12Å; I237-M253 HydrophobicContact CD1-CE 4.11Å; I237-M253 HydrophobicContact CG2-CE 4.2Å; I237-M253 HydrophobicContact CG2-SD 3.83Å; V245-M253 HydrophobicContact CB-CE 4.17Å; V245-M253 HydrophobicContact CG1-CE 3.91Å; V245-M253 HydrophobicContact CG2-CE 3.35Å; V245-M253 HydrophobicContact CG2-CG 4.33Å; V245-M253 HydrophobicContact CG2-SD 3.72Å; I251-M253 WeakPolarHBondContact O-CG 3.47Å; I251-M253 PolarHBondContact O-N 3.22Å; M253-E255 PolarHBondContact O-N 2.83Å; M253-F256 HydrophobicContact CB-CB 4.2Å; M253-F256 HydrophobicContact CE-CB 4.05Å; M253-F256 WeakPolarHBondContact CE-O 3.44Å; M253-F256 PolarHBondContact O-N 2.8Å; M253-F256 VanDerWaalsContact O-N 3.12Å; M253-S257 PolarHBondContact N-OG 3.32Å; M253-L326 HydrophobicContact CE-CD1 4.42Å
254	G	65.4	Low	57.1	Low	38 Å²	38	63.3 Å²	63.3	39%	0.392	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	57.9	-122.9	-176.6	0	0	0	0	0	111.7	N252 F256 S257 H260	N252-G254 PolarHBondContact O-N 3.33Å; N252-G254 PolarHBondContact OD1-N 3.2Å; G254-F256 PolarHBondContact O-N 2.99Å; G254-S257 VanDerWaalsContact O-CB 3.27Å; G254-S257 WeakPolarHBondContact O-CB 3.43Å; G254-S257 PolarHBondContact O-N 3.39Å; G254-S257 VanDerWaalsContact O-N 3.13Å; G254-S257 PolarHBondContact O-OG 3.24Å; G254-H260 PolarHBondContact O-CE1 2.75Å; G254-H260 VanDerWaalsContact O-CE1 3.3Å; G254-H260 PolarHBondContact O-ND1 3.1Å
255	E	57.5	Low	56.8	Low	95 Å²	95	60.7 Å²	60.7	44%	0.444	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-68.7	-13.3	-178.9	-60	-154.4	-169	0	0	114.5	M253 H260 R324	M253-E255 PolarHBondContact O-N 2.83Å; E255-H260 WeakPolarHBondContact O-CB 3.38Å; E255-R324 IonicContact OE2-NH1 3.04Å
256	F	55.8	Low	56.3	Low	14 Å²	14	60.4 Å²	60.4	6%	0.061	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-97.3	3.9	174.6	-63.5	-83.9	0	0	0	113	E233 M235 M253 G254 W261 R324 V325 L326	E233-F256 HydrophobicContact CB-CZ 4.22Å; M235-F256 HydrophobicContact CB-CD1 3.91Å; M235-F256 HydrophobicContact CB-CD2 3.65Å; M235-F256 HydrophobicContact CB-CE1 3.91Å; M235-F256 HydrophobicContact CB-CE2 3.66Å; M235-F256 HydrophobicContact CB-CG 3.78Å; M235-F256 HydrophobicContact CB-CZ 3.79Å; M235-F256 HydrophobicContact CE-CD2 3.84Å; M235-F256 HydrophobicContact CE-CE2 4.42Å; M235-F256 HydrophobicContact CG-CD2 4.34Å; M235-F256 HydrophobicContact CG-CG 4.46Å; M235-F256 HydrophobicContact SD-CB 3.88Å; M235-F256 HydrophobicContact SD-CD2 3.82Å; M235-F256 HydrophobicContact SD-CG 3.95Å; M253-F256 HydrophobicContact CB-CB 4.2Å; M253-F256 HydrophobicContact CE-CB 4.05Å; M253-F256 WeakPolarHBondContact CE-O 3.44Å; M253-F256 PolarHBondContact O-N 2.8Å; M253-F256 VanDerWaalsContact O-N 3.12Å; G254-F256 PolarHBondContact O-N 2.99Å; F256-W261 PolarHBondContact O-NE1 3.28Å; F256-R324 HydrophobicContact CE1-CB 4.15Å; F256-V325 WeakPolarHBondContact CE1-O 3.42Å; F256-L326 HydrophobicContact CB-CD1 4.31Å; F256-L326 HydrophobicContact CD1-CB 4.4Å; F256-L326 HydrophobicContact CD1-CD1 4.06Å; F256-L326 HydrophobicContact CG-CD1 4.42Å
257	S	64.6	Low	56.1	Low	17 Å²	17	56.9 Å²	56.9	12%	0.119	33%	0.331	C	S	.	.	S	Bend	trans	-64.2	147.9	170.2	-72.2	0	0	0	0	111	N252 M253 G254 G259 H260	N252-S257 WeakPolarHBondContact CA-OG 3.3Å; N252-S257 PolarHBondContact OD1-OG 2.89Å; M253-S257 PolarHBondContact N-OG 3.32Å; G254-S257 VanDerWaalsContact O-CB 3.27Å; G254-S257 WeakPolarHBondContact O-CB 3.43Å; G254-S257 PolarHBondContact O-N 3.39Å; G254-S257 VanDerWaalsContact O-N 3.13Å; G254-S257 PolarHBondContact O-OG 3.24Å; S257-G259 PolarHBondContact O-N 3.45Å; S257-H260 PolarHBondContact O-N 2.76Å
258	R	59	Low	55.6	Low	121 Å²	121	53.9 Å²	53.9	46%	0.457	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-50.6	-29.4	-179.1	-172.7	179.3	174.5	-166.6	-0.6	114.2	V245 Y246 H260 W261	V245-R258 HydrophobicContact CG1-CB 4.3Å; V245-R258 WeakPolarHBondContact O-CD 3.04Å; Y246-R258 WeakPolarHBondContact O-CD 3.39Å; Y246-R258 PolarHBondContact O-NE 3.15Å; Y246-R258 PolarHBondContact O-NH1 2.93Å; R258-H260 VanDerWaalsContact C-N 3.27Å; R258-H260 PolarHBondContact O-N 3.28Å; R258-W261 HydrophobicContact CG-CE3 4.44Å; R258-W261 PolarHBondContact O-N 3.27Å
259	G	62.9	Low	55.2	Low	80 Å²	80	53 Å²	53	83%	0.825	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-66.2	-22.6	176.5	0	0	0	0	0	115	S257	S257-G259 PolarHBondContact O-N 3.45Å
260	H	60.4	Low	54.6	Low	85 Å²	85	47 Å²	47	39%	0.394	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-97.9	-1.2	178.5	-62.5	92.4	0	0	0	112.9	G254 E255 S257 R258 D262 R324	G254-H260 PolarHBondContact O-CE1 2.75Å; G254-H260 VanDerWaalsContact O-CE1 3.3Å; G254-H260 PolarHBondContact O-ND1 3.1Å; E255-H260 WeakPolarHBondContact O-CB 3.38Å; S257-H260 PolarHBondContact O-N 2.76Å; R258-H260 VanDerWaalsContact C-N 3.27Å; R258-H260 PolarHBondContact O-N 3.28Å; H260-D262 PolarHBondContact O-N 3.03Å; H260-R324 PolarHBondContact O-NH2 2.72Å
261	W	58	Low	54.1	Low	11 Å²	11	48.3 Å²	48.3	4%	0.042	27%	0.269	C	S	.	.			trans	-72.3	92.3	-179.7	-67	9.5	0	0	0	110.5	W96 Y242 V245 Y246 F256 R258 L326	W96-W261 HydrophobicContact CH2-CB 4.07Å; W96-W261 AromaticContact CH2-CE3 3.93Å; W96-W261 HydrophobicContact CH2-CE3 3.93Å; W96-W261 HydrophobicContact CZ2-CE3 4.17Å; Y242-W261 AromaticContact CD2-CH2 3.91Å; Y242-W261 HydrophobicContact CD2-CH2 3.91Å; Y242-W261 HydrophobicContact CD2-CZ2 4.46Å; Y242-W261 AromaticContact CE2-CH2 3.37Å; Y242-W261 HydrophobicContact CE2-CH2 3.37Å; Y242-W261 HydrophobicContact CE2-CZ2 4.2Å; Y242-W261 AromaticContact CE2-CZ3 3.95Å; Y242-W261 HydrophobicContact CE2-CZ3 3.95Å; V245-W261 HydrophobicContact CB-CZ2 4.38Å; V245-W261 HydrophobicContact CG1-CH2 4.08Å; V245-W261 HydrophobicContact CG1-CZ2 3.47Å; V245-W261 VanDerWaalsContact CG1-CZ2 3.47Å; Y246-W261 HydrophobicContact CD2-CZ3 4.04Å; F256-W261 PolarHBondContact O-NE1 3.28Å; R258-W261 HydrophobicContact CG-CE3 4.44Å; R258-W261 PolarHBondContact O-N 3.27Å; W261-L326 HydrophobicContact CH2-CD2 4.33Å; W261-L326 HydrophobicContact CZ2-CD2 3.62Å
262	D	56.2	Low	53.5	Low	51 Å²	51	44.6 Å²	44.6	27%	0.273	25%	0.252	S	S	.	.	S	Bend	trans	-110	-163.9	174.4	62.2	24.6	0	0	0	111.3	H260 T264 V265 R324	H260-D262 PolarHBondContact O-N 3.03Å; D262-T264 PolarHBondContact O-N 3.4Å; D262-T264 WeakPolarHBondContact OD1-CA 3.16Å; D262-T264 WeakPolarHBondContact OD1-CB 3.44Å; D262-T264 PolarHBondContact OD1-N 2.97Å; D262-T264 PolarHBondContact OD1-OG1 2.71Å; D262-V265 PolarHBondContact O-N 2.87Å; D262-R324 IonicContact OD1-NH2 2.79Å; D262-R324 PolarHBondContact OD1-NH2 2.69Å; D262-R324 IonicContact OD2-NH2 3.85Å; D262-R324 PolarHBondContact OD2-NH2 2.77Å
263	D	44.7	Very low	52.6	Low	81 Å²	81	40.8 Å²	40.8	43%	0.433	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-8.7	179.4	60.4	-34.5	0	0	0	114	F89	F89-D263 HydrophobicContact CD2-CB 4.4Å; F89-D263 VanDerWaalsContact CD2-OD2 3.29Å; F89-D263 WeakPolarHBondContact CD2-OD2 3.49Å; F89-D263 WeakPolarHBondContact CE2-OD2 3.43Å
264	T	51.4	Low	51.6	Low	25 Å²	25	46 Å²	46	15%	0.153	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-8.3	174.5	72.9	0	0	0	0	112.9	D262 P322 E323 R324	D262-T264 PolarHBondContact O-N 3.4Å; D262-T264 WeakPolarHBondContact OD1-CA 3.16Å; D262-T264 WeakPolarHBondContact OD1-CB 3.44Å; D262-T264 PolarHBondContact OD1-N 2.97Å; D262-T264 PolarHBondContact OD1-OG1 2.71Å; T264-P322 CarbonylContact O-C 3.48Å; T264-P322 VanDerWaalsContact O-CA 3.26Å; T264-P322 WeakPolarHBondContact O-CA 3.42Å; T264-P322 WeakPolarHBondContact O-CB 3.28Å; T264-E323 HydrophobicContact CG2-CG 4.28Å; T264-E323 PolarHBondContact O-N 2.78Å; T264-R324 PolarHBondContact O-N 3.15Å; T264-R324 PolarHBondContact OG1-NE 3.15Å; T264-R324 PolarHBondContact OG1-NH2 2.92Å
265	V	50.7	Low	50.2	Low	6 Å²	6	50.9 Å²	50.9	4%	0.036	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	120.4	-178.5	-175.3	0	0	0	0	111	D262 R324	D262-V265 PolarHBondContact O-N 2.87Å; V265-R324 CarbonylContact C-O 3.51Å; V265-R324 VanDerWaalsContact CA-O 3.23Å; V265-R324 WeakPolarHBondContact CA-O 3.31Å; V265-R324 HydrophobicContact CG2-CB 3.97Å
266	A	48.5	Very low	49.1	Very low	5 Å²	5	48.6 Å²	48.6	4%	0.041	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	129.7	170.5	0	0	0	0	0	111.4	I268 P322 R324 V325 L326	A266-I268 HydrophobicContact CB-CD1 4.48Å; A266-I268 HydrophobicContact CB-CG1 4.43Å; A266-P322 HydrophobicContact CB-CB 3.64Å; A266-P322 HydrophobicContact CB-CG 3.75Å; A266-R324 PolarHBondContact N-O 2.59Å; A266-V325 HydrophobicContact CB-CG2 4.34Å; A266-V325 CarbonylContact O-C 3.58Å; A266-V325 VanDerWaalsContact O-CA 3.3Å; A266-V325 WeakPolarHBondContact O-CA 3.33Å; A266-L326 PolarHBondContact O-N 3.46Å
267	V	48.7	Very low	48.1	Very low	10 Å²	10	49.6 Å²	49.6	6%	0.061	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	123.1	173.6	-176.1	0	0	0	0	109	Y242 L326 V328	Y242-V267 HydrophobicContact CD2-CG1 4.09Å; Y242-V267 HydrophobicContact CE2-CB 4.46Å; Y242-V267 HydrophobicContact CE2-CG1 3.47Å; Y242-V267 VanDerWaalsContact CE2-CG1 3.47Å; Y242-V267 HydrophobicContact CE2-CG2 4.25Å; V267-L326 CarbonylContact C-O 3.48Å; V267-L326 WeakPolarHBondContact CA-O 3.35Å; V267-L326 HydrophobicContact CG2-CB 4.27Å; V267-L326 HydrophobicContact CG2-CD2 4.32Å; V267-V328 HydrophobicContact CG1-CG2 3.48Å; V267-V328 VanDerWaalsContact CG1-CG2 3.48Å
268	I	45.9	Very low	47	Very low	3 Å²	3	53 Å²	53	2%	0.015	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	119	-169.7	-56.8	179.3	0	0	0	109.6	A266 V270 P281 F284 V325 L326 F327 V328	A266-I268 HydrophobicContact CB-CD1 4.48Å; A266-I268 HydrophobicContact CB-CG1 4.43Å; I268-V270 HydrophobicContact CG2-CG2 4.27Å; I268-P281 HydrophobicContact CG2-CG 4.1Å; I268-F284 HydrophobicContact CD1-CB 3.94Å; I268-F284 HydrophobicContact CD1-CD1 4.44Å; I268-F284 HydrophobicContact CD1-CD2 3.06Å; I268-F284 HydrophobicContact CD1-CE2 3.55Å; I268-F284 HydrophobicContact CD1-CG 3.55Å; I268-F284 HydrophobicContact CD1-CZ 4.38Å; I268-V325 HydrophobicContact CD1-CG1 3.73Å; I268-V325 HydrophobicContact CG1-CG1 4.27Å; I268-L326 PolarHBondContact N-O 3.19Å; I268-F327 HydrophobicContact CB-CD1 3.9Å; I268-F327 HydrophobicContact CB-CE1 4.18Å; I268-F327 HydrophobicContact CD1-CE1 4.05Å; I268-F327 HydrophobicContact CG2-CD1 4.16Å; I268-F327 HydrophobicContact CG2-CE1 4.25Å; I268-F327 CarbonylContact O-C 3.48Å; I268-F327 VanDerWaalsContact O-CA 3.31Å; I268-F327 WeakPolarHBondContact O-CA 3.43Å; I268-V328 PolarHBondContact O-N 3.02Å
269	P	43.9	Very low	45.9	Very low	35 Å²	35	51.6 Å²	51.6	23%	0.227	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	135	172.2	29.5	-31.5	0	0	0	110.4	F83 V328 V330	F83-P269 HydrophobicContact CB-CG 3.96Å; F83-P269 HydrophobicContact CD2-CG 3.76Å; F83-P269 HydrophobicContact CG-CG 4.28Å; P269-V328 CarbonylContact C-O 3.49Å; P269-V328 VanDerWaalsContact CA-O 3.32Å; P269-V328 WeakPolarHBondContact CA-O 3.42Å; P269-V330 HydrophobicContact CB-CG1 4.29Å; P269-V330 HydrophobicContact CB-CG2 4.19Å
270	V	45.4	Very low	44.7	Very low	2 Å²	2	51.7 Å²	51.7	1%	0.012	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	135.8	-177.6	-170.6	0	0	0	0	109	I268 W278 L279 I280 F327 V328 L329 V330	I268-V270 HydrophobicContact CG2-CG2 4.27Å; V270-W278 HydrophobicContact CB-CE3 4.45Å; V270-W278 HydrophobicContact CG1-CB 3.7Å; V270-W278 HydrophobicContact CG1-CD2 4.31Å; V270-W278 HydrophobicContact CG1-CE3 3.82Å; V270-W278 HydrophobicContact CG1-CG 4.31Å; V270-L279 WeakPolarHBondContact CG1-O 3.36Å; V270-I280 HydrophobicContact CG1-CG1 4.32Å; V270-F327 HydrophobicContact CG2-CB 3.74Å; V270-F327 HydrophobicContact CG2-CD1 3.26Å; V270-F327 HydrophobicContact CG2-CE1 4.11Å; V270-F327 HydrophobicContact CG2-CG 3.81Å; V270-V328 PolarHBondContact N-O 3.05Å; V270-L329 HydrophobicContact CB-CD2 4.27Å; V270-L329 WeakPolarHBondContact O-CA 2.91Å; V270-V330 WeakPolarHBondContact O-CG2 3.25Å; V270-V330 PolarHBondContact O-N 3.36Å; V270-V330 VanDerWaalsContact O-N 3.08Å
271	R	43.9	Very low	43.6	Very low	58 Å²	58	48.4 Å²	48.4	22%	0.219	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	151.1	173.9	-77.2	-156	174.8	-176.6	3.9	111.9	L172 W278 L279 V330 D331	L172-R271 PolarHBondContact O-NH1 2.66Å; L172-R271 PolarHBondContact O-NH2 2.89Å; L172-R271 VanDerWaalsContact O-NH2 3.12Å; R271-W278 WeakPolarHBondContact O-CA 3.42Å; R271-L279 HydrophobicContact CB-CB 4.49Å; R271-L279 PolarHBondContact O-N 2.7Å; R271-V330 HydrophobicContact CG-CG2 3.74Å; R271-D331 VanDerWaalsContact CA-OD2 3.23Å; R271-D331 WeakPolarHBondContact CA-OD2 3.2Å; R271-D331 WeakPolarHBondContact CB-OD2 3.43Å; R271-D331 WeakPolarHBondContact CG-OD1 3.46Å; R271-D331 VanDerWaalsContact CG-OD2 3.23Å; R271-D331 WeakPolarHBondContact CG-OD2 3.21Å; R271-D331 IonicContact NE-OD1 3.99Å; R271-D331 PolarHBondContact NE-OD1 2.95Å
272	T	43.9	Very low	42.3	Very low	38 Å²	38	51 Å²	51	23%	0.233	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	135.4	164.7	43	0	0	0	0	109.7	W278 D331	T272-W278 HydrophobicContact CG2-CD2 4.1Å; T272-W278 HydrophobicContact CG2-CE3 3.57Å; T272-W278 HydrophobicContact CG2-CH2 3.3Å; T272-W278 HydrophobicContact CG2-CZ2 3.88Å; T272-W278 HydrophobicContact CG2-CZ3 3.14Å; T272-D331 PolarHBondContact N-OD2 3.01Å
273	T	39.4	Very low	41.2	Very low	45 Å²	45	50.9 Å²	50.9	28%	0.276	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-73.1	159.4	160	59.7	0	0	0	0	110.2	H275 G276 G277 L279	T273-H275 PolarHBondContact O-N 3.44Å; T273-G276 PolarHBondContact O-N 3.36Å; T273-G277 PolarHBondContact N-O 2.99Å; T273-G277 WeakPolarHBondContact OG1-CA 3.19Å; T273-G277 PolarHBondContact OG1-N 2.88Å; T273-G277 VanDerWaalsContact OG1-N 3.14Å; T273-G277 PolarHBondContact OG1-O 3.45Å; T273-L279 HydrophobicContact CG2-CD1 3.7Å; T273-L279 HydrophobicContact CG2-CD2 4.3Å; T273-L279 HydrophobicContact CG2-CG 3.54Å
274	D	37.9	Very low	40.7	Very low	145 Å²	145	47.9 Å²	47.9	78%	0.775	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-19.7	175	-55.3	-11.9	0	0	0	113.4
275	H	36.1	Very low	39.8	Very low	142 Å²	142	48.4 Å²	48.4	66%	0.657	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	11.2	-178.9	-56.7	-46.8	0	0	0	113.8	T273 G277	T273-H275 PolarHBondContact O-N 3.44Å; H275-G277 VanDerWaalsContact C-N 3.27Å; H275-G277 PolarHBondContact O-N 2.84Å
276	G	33.8	Very low	38.8	Very low	46 Å²	46	50 Å²	50	47%	0.474	28%	0.276	S	S	.	.	S	Bend	trans	79.8	1.1	176.4	0	0	0	0	0	115.2	T273	T273-G276 PolarHBondContact O-N 3.36Å
277	G	35.8	Very low	38.2	Very low	36 Å²	36	51.1 Å²	51.1	37%	0.371	28%	0.282	S	S	.	.			trans	-79.9	151.7	169	0	0	0	0	0	111.6	T273 H275	T273-G277 PolarHBondContact N-O 2.99Å; T273-G277 WeakPolarHBondContact OG1-CA 3.19Å; T273-G277 PolarHBondContact OG1-N 2.88Å; T273-G277 VanDerWaalsContact OG1-N 3.14Å; T273-G277 PolarHBondContact OG1-O 3.45Å; H275-G277 VanDerWaalsContact C-N 3.27Å; H275-G277 PolarHBondContact O-N 2.84Å
278	W	40.4	Very low	37.5	Very low	89 Å²	89	52 Å²	52	34%	0.337	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	127	177.5	-64.8	102.9	0	0	0	111.5	V270 R271 T272 I280 L329	V270-W278 HydrophobicContact CB-CE3 4.45Å; V270-W278 HydrophobicContact CG1-CB 3.7Å; V270-W278 HydrophobicContact CG1-CD2 4.31Å; V270-W278 HydrophobicContact CG1-CE3 3.82Å; V270-W278 HydrophobicContact CG1-CG 4.31Å; R271-W278 WeakPolarHBondContact O-CA 3.42Å; T272-W278 HydrophobicContact CG2-CD2 4.1Å; T272-W278 HydrophobicContact CG2-CE3 3.57Å; T272-W278 HydrophobicContact CG2-CH2 3.3Å; T272-W278 HydrophobicContact CG2-CZ2 3.88Å; T272-W278 HydrophobicContact CG2-CZ3 3.14Å; W278-I280 PolarHBondContact O-N 2.82Å; W278-I280 VanDerWaalsContact O-N 3.08Å; W278-L329 HydrophobicContact CD2-CD2 3.97Å; W278-L329 HydrophobicContact CE3-CD2 3.42Å; W278-L329 VanDerWaalsContact CE3-CD2 3.42Å; W278-L329 HydrophobicContact CH2-CB 3.96Å; W278-L329 HydrophobicContact CH2-CD1 3.45Å; W278-L329 VanDerWaalsContact CH2-CD1 3.45Å; W278-L329 HydrophobicContact CH2-CD2 3.37Å; W278-L329 HydrophobicContact CH2-CG 3.71Å; W278-L329 HydrophobicContact CZ2-CD1 3.89Å; W278-L329 HydrophobicContact CZ2-CD2 3.9Å; W278-L329 HydrophobicContact CZ2-CG 4.42Å; W278-L329 HydrophobicContact CZ3-CB 3.81Å; W278-L329 HydrophobicContact CZ3-CD1 4.05Å; W278-L329 HydrophobicContact CZ3-CD2 3.07Å; W278-L329 HydrophobicContact CZ3-CG 3.76Å
279	L	36.1	Very low	36.8	Very low	91 Å²	91	52.2 Å²	52.2	48%	0.476	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	88.4	170.1	-84.3	159.1	0	0	0	109.3	V270 R271 T273	V270-L279 WeakPolarHBondContact CG1-O 3.36Å; R271-L279 HydrophobicContact CB-CB 4.49Å; R271-L279 PolarHBondContact O-N 2.7Å; T273-L279 HydrophobicContact CG2-CD1 3.7Å; T273-L279 HydrophobicContact CG2-CD2 4.3Å; T273-L279 HydrophobicContact CG2-CG 3.54Å
280	I	38.2	Very low	36.2	Very low	82 Å²	82	57.1 Å²	57.1	42%	0.421	30%	0.303	S	S	.	.			trans	-79.5	125.6	170	-58	176.4	0	0	0	108.1	V270 W278 F284 F327	V270-I280 HydrophobicContact CG1-CG1 4.32Å; W278-I280 PolarHBondContact O-N 2.82Å; W278-I280 VanDerWaalsContact O-N 3.08Å; I280-F284 HydrophobicContact CG2-CB 4.04Å; I280-F284 HydrophobicContact CG2-CD1 3.71Å; I280-F284 HydrophobicContact CG2-CG 4.23Å; I280-F327 HydrophobicContact CD1-CE1 4.4Å; I280-F327 HydrophobicContact CD1-CZ 4.06Å; I280-F327 HydrophobicContact CG1-CE1 4.41Å; I280-F327 HydrophobicContact CG2-CE1 4.07Å; I280-F327 HydrophobicContact CG2-CZ 4.45Å
281	P	36.4	Very low	35.5	Very low	16 Å²	16	58.4 Å²	58.4	10%	0.104	31%	0.31	C	S	.	.			trans	-64.3	137.5	-179.1	-23.4	34.5	0	0	0	113.6	S82 I268 T283 F284	S82-P281 WeakPolarHBondContact OG-CB 3.34Å; I268-P281 HydrophobicContact CG2-CG 4.1Å; P281-T283 PolarHBondContact O-N 3.18Å; P281-T283 VanDerWaalsContact O-N 3.07Å; P281-F284 WeakPolarHBondContact O-CB 3.29Å; P281-F284 PolarHBondContact O-N 3.1Å
282	Y	31.5	Very low	34.6	Very low	64 Å²	64	62.5 Å²	62.5	25%	0.251	33%	0.329	S	S	.	.	H	α-helix	trans	-52.1	-32	-176.5	-169.1	-101	0	0	0	114.5	S79 F284 A285 H286	S79-Y282 WeakPolarHBondContact OG-CB 3.21Å; S79-Y282 PolarHBondContact OG-N 3.49Å; Y282-F284 PolarHBondContact O-N 2.96Å; Y282-A285 PolarHBondContact O-N 3.02Å; Y282-H286 AromaticContact CD1-CD2 3.91Å; Y282-H286 AromaticContact CD1-NE2 3.92Å; Y282-H286 AromaticContact CE1-CD2 3.62Å; Y282-H286 AromaticContact CE1-NE2 3.16Å; Y282-H286 WeakPolarHBondContact CE1-NE2 3.3Å; Y282-H286 AromaticContact CZ-NE2 3.35Å; Y282-H286 PolarHBondContact O-CD2 3.32Å; Y282-H286 PolarHBondContact OH-NE2 3.18Å
283	T	32.4	Very low	33.9	Very low	49 Å²	49	63.3 Å²	63.3	30%	0.301	33%	0.332	S	S	.	.	H	α-helix	trans	-60.5	-28.6	178.1	-31.2	0	0	0	0	112.2	S82 L84 P281 H286 L287	S82-T283 VanDerWaalsContact OG-CB 3.29Å; S82-T283 WeakPolarHBondContact OG-CB 3.49Å; S82-T283 PolarHBondContact OG-OG1 2.9Å; L84-T283 HydrophobicContact CD1-CG2 3.72Å; P281-T283 PolarHBondContact O-N 3.18Å; P281-T283 VanDerWaalsContact O-N 3.07Å; T283-H286 PolarHBondContact O-N 2.84Å; T283-L287 WeakPolarHBondContact O-CG 3.4Å; T283-L287 PolarHBondContact O-N 2.85Å
284	F	33.9	Very low	33.2	Very low	19 Å²	19	65.6 Å²	65.6	8%	0.083	36%	0.356	C	S	.	.	H	α-helix	trans	-73.1	-36.2	178.2	-178.2	-109.7	0	0	0	113.7	I268 I280 P281 Y282 H286 L287 T288 P322 V325 F327	I268-F284 HydrophobicContact CD1-CB 3.94Å; I268-F284 HydrophobicContact CD1-CD1 4.44Å; I268-F284 HydrophobicContact CD1-CD2 3.06Å; I268-F284 HydrophobicContact CD1-CE2 3.55Å; I268-F284 HydrophobicContact CD1-CG 3.55Å; I268-F284 HydrophobicContact CD1-CZ 4.38Å; I280-F284 HydrophobicContact CG2-CB 4.04Å; I280-F284 HydrophobicContact CG2-CD1 3.71Å; I280-F284 HydrophobicContact CG2-CG 4.23Å; P281-F284 WeakPolarHBondContact O-CB 3.29Å; P281-F284 PolarHBondContact O-N 3.1Å; Y282-F284 PolarHBondContact O-N 2.96Å; F284-H286 PolarHBondContact O-N 2.84Å; F284-H286 VanDerWaalsContact O-N 3.09Å; F284-L287 PolarHBondContact O-N 3.17Å; F284-T288 HydrophobicContact CD1-CG2 4.02Å; F284-T288 HydrophobicContact CD2-CG2 4.02Å; F284-T288 HydrophobicContact CE1-CG2 3.35Å; F284-T288 HydrophobicContact CE2-CG2 3.36Å; F284-T288 HydrophobicContact CG-CG2 4.35Å; F284-T288 HydrophobicContact CZ-CG2 3Å; F284-T288 PolarHBondContact O-N 2.72Å; F284-T288 VanDerWaalsContact O-N 3.16Å; F284-P322 HydrophobicContact CE2-CG 4.38Å; F284-V325 HydrophobicContact CE2-CB 4.18Å; F284-V325 HydrophobicContact CE2-CG1 3.76Å; F284-V325 HydrophobicContact CE2-CG2 3.39Å; F284-V325 HydrophobicContact CZ-CB 4.11Å; F284-V325 HydrophobicContact CZ-CG1 3.78Å; F284-V325 HydrophobicContact CZ-CG2 3.59Å; F284-F327 HydrophobicContact CD1-CE1 4.33Å; F284-F327 HydrophobicContact CD1-CZ 4.14Å; F284-F327 HydrophobicContact CE1-CE1 4.22Å; F284-F327 AromaticContact CE1-CZ 3.64Å; F284-F327 HydrophobicContact CE1-CZ 3.64Å; F284-F327 AromaticContact CZ-CZ 3.98Å; F284-F327 HydrophobicContact CZ-CZ 3.98Å
285	A	32.7	Very low	32.9	Very low	35 Å²	35	59.8 Å²	59.8	29%	0.289	32%	0.324	S	S	.	.	H	α-helix	trans	-56.1	-30	176.4	0	0	0	0	0	111.4	Y282	Y282-A285 PolarHBondContact O-N 3.02Å
286	H	30.4	Very low	32.8	Very low	39 Å²	39	54.4 Å²	54.4	18%	0.181	30%	0.301	C	S	.	.	H	α-helix	trans	-83.3	-35.3	174.4	-68.8	-74.1	0	0	0	113.5	Y282 T283 F284 S289 I291	Y282-H286 AromaticContact CD1-CD2 3.91Å; Y282-H286 AromaticContact CD1-NE2 3.92Å; Y282-H286 AromaticContact CE1-CD2 3.62Å; Y282-H286 AromaticContact CE1-NE2 3.16Å; Y282-H286 WeakPolarHBondContact CE1-NE2 3.3Å; Y282-H286 AromaticContact CZ-NE2 3.35Å; Y282-H286 PolarHBondContact O-CD2 3.32Å; Y282-H286 PolarHBondContact OH-NE2 3.18Å; T283-H286 PolarHBondContact O-N 2.84Å; F284-H286 PolarHBondContact O-N 2.84Å; F284-H286 VanDerWaalsContact O-N 3.09Å; H286-S289 PolarHBondContact O-N 3.17Å; H286-S289 PolarHBondContact O-OG 2.89Å; H286-I291 WeakPolarHBondContact O-CG1 3.49Å
287	L	36.1	Very low	32.8	Very low	29 Å²	29	53 Å²	53	15%	0.152	28%	0.284	C	S	.	.	H	α-helix	trans	-73.8	-28.5	-175.6	-75.8	167.9	0	0	0	114.8	L84 T283 F284 S289 I291 G321 P322	L84-L287 HydrophobicContact CD1-CD1 3.43Å; L84-L287 VanDerWaalsContact CD1-CD1 3.43Å; L84-L287 HydrophobicContact CD2-CD1 3.31Å; L84-L287 HydrophobicContact CG-CD1 3.95Å; T283-L287 WeakPolarHBondContact O-CG 3.4Å; T283-L287 PolarHBondContact O-N 2.85Å; F284-L287 PolarHBondContact O-N 3.17Å; L287-S289 PolarHBondContact O-N 3.26Å; L287-I291 HydrophobicContact CD2-CD1 4.42Å; L287-G321 WeakPolarHBondContact O-CA 3.41Å; L287-P322 WeakPolarHBondContact O-CD 3.15Å
288	T	32.9	Very low	32.8	Very low	29 Å²	29	53.2 Å²	53.2	18%	0.178	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-17.3	176.6	54.5	0	0	0	0	113	V232 F284	V232-T288 HydrophobicContact CG2-CG2 4Å; F284-T288 HydrophobicContact CD1-CG2 4.02Å; F284-T288 HydrophobicContact CD2-CG2 4.02Å; F284-T288 HydrophobicContact CE1-CG2 3.35Å; F284-T288 HydrophobicContact CE2-CG2 3.36Å; F284-T288 HydrophobicContact CG-CG2 4.35Å; F284-T288 HydrophobicContact CZ-CG2 3Å; F284-T288 PolarHBondContact O-N 2.72Å; F284-T288 VanDerWaalsContact O-N 3.16Å
289	S	31.5	Very low	32.5	Very low	7 Å²	7	51.9 Å²	51.9	5%	0.049	28%	0.276	C	S	.	.	S	Bend	trans	-81.7	136.5	168.4	77.4	0	0	0	0	109.3	H286 L287 I291	H286-S289 PolarHBondContact O-N 3.17Å; H286-S289 PolarHBondContact O-OG 2.89Å; L287-S289 PolarHBondContact O-N 3.26Å; S289-I291 VanDerWaalsContact C-N 3.26Å; S289-I291 WeakPolarHBondContact O-CG1 3.37Å; S289-I291 PolarHBondContact O-N 3.27Å
290	R	30.6	Very low	32.8	Very low	139 Å²	139	47.5 Å²	47.5	53%	0.525	25%	0.254	S	S	.	.			trans	-55.6	109.1	148.8	-67.6	-176.3	177.5	173.2	-2.7	104.2	Y230 F292	Y230-R290 HydrophobicContact CD1-CG 4.05Å; Y230-R290 HydrophobicContact CD2-CB 4.33Å; Y230-R290 HydrophobicContact CD2-CG 4.39Å; Y230-R290 VanDerWaalsContact CD2-N 3.27Å; Y230-R290 HydrophobicContact CE1-CB 4.11Å; Y230-R290 VanDerWaalsContact CE1-CD 3.48Å; Y230-R290 HydrophobicContact CE1-CG 3.63Å; Y230-R290 HydrophobicContact CE2-CB 3.58Å; Y230-R290 HydrophobicContact CE2-CG 3.94Å; Y230-R290 HydrophobicContact CG-CG 4.42Å; Y230-R290 VanDerWaalsContact CZ-CB 3.48Å; R290-F292 VanDerWaalsContact C-N 3.29Å; R290-F292 PolarHBondContact O-N 2.85Å
291	I	30.6	Very low	32.7	Very low	29 Å²	29	44.2 Å²	44.2	15%	0.149	24%	0.237	C	C	.	.			trans	-67.6	92.9	-168.7	-57.5	178.2	0	0	0	108.3	H286 L287 S289 N293	H286-I291 WeakPolarHBondContact O-CG1 3.49Å; L287-I291 HydrophobicContact CD2-CD1 4.42Å; S289-I291 VanDerWaalsContact C-N 3.26Å; S289-I291 WeakPolarHBondContact O-CG1 3.37Å; S289-I291 PolarHBondContact O-N 3.27Å; I291-N293 HydrophobicContact CG2-CB 4.18Å; I291-N293 WeakPolarHBondContact CG2-OD1 3.42Å
292	F	26.4	Very low	32.9	Very low	144 Å²	144	45.2 Å²	45.2	63%	0.632	24%	0.243	S	C	*	.			trans	-82.5	99.6	149	-101.2	-88.5	0	0	0	104.6	R290 A294	R290-F292 VanDerWaalsContact C-N 3.29Å; R290-F292 PolarHBondContact O-N 2.85Å; F292-A294 PolarHBondContact O-N 3.18Å
293	N	28.8	Very low	33.2	Very low	55 Å²	55	47.5 Å²	47.5	29%	0.294	25%	0.251	S	S	.	.	S	Bend	trans	-58.1	13.1	-173.3	-93.3	-44.2	0	0	0	116.3	I291 Q295 A314	I291-N293 HydrophobicContact CG2-CB 4.18Å; I291-N293 WeakPolarHBondContact CG2-OD1 3.42Å; N293-Q295 PolarHBondContact O-N 3.04Å; N293-A314 PolarHBondContact ND2-O 3.24Å; N293-A314 PolarHBondContact OD1-O 3.11Å
294	A	25.4	Very low	34.3	Very low	93 Å²	93	48.8 Å²	48.8	77%	0.769	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	11.2	169.1	0	0	0	0	0	113.1	F292	F292-A294 PolarHBondContact O-N 3.18Å
295	Q	31	Very low	34.7	Very low	22 Å²	22	59.9 Å²	59.9	10%	0.103	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	6.8	-171.1	-63.1	-174.9	8.6	0	0	114.5	C224 N293	C224-Q295 PolarHBondContact SG-O 2.98Å; N293-Q295 PolarHBondContact O-N 3.04Å
296	T	34.2	Very low	34.8	Very low	29 Å²	29	61.5 Å²	61.5	18%	0.178	32%	0.323	C	S	.	.	S	Bend	trans	-84.8	134	172	8.9	0	0	0	0	110.3	V298 P312	T296-V298 PolarHBondContact O-N 2.86Å; T296-P312 HydrophobicContact CG2-CB 4.19Å; T296-P312 HydrophobicContact CG2-CG 3.84Å
297	P	32.9	Very low	35.2	Very low	18 Å²	18	65.9 Å²	65.9	12%	0.117	34%	0.337	C	S	.	.			trans	-59.6	134	176.8	-11	20.1	0	0	0	109.7	Y72 C224	Y72-P297 HydrophobicContact CE2-CB 4.49Å; Y72-P297 HydrophobicContact CE2-CG 4.05Å; C224-P297 WeakPolarHBondContact SG-CD 3.27Å; C224-P297 VanDerWaalsContact SG-CG 3.54Å; C224-P297 VanDerWaalsContact SG-N 3.37Å
298	V	35.4	Very low	35.2	Very low	39 Å²	39	69.1 Å²	69.1	24%	0.236	35%	0.354	C	S	.	.			trans	-83.5	114.5	169.6	-177.4	0	0	0	0	107	G222 T296 D309 V311	G222-V298 PolarHBondContact N-O 3.31Å; T296-V298 PolarHBondContact O-N 2.86Å; V298-D309 HydrophobicContact CG1-CB 3.42Å; V298-D309 VanDerWaalsContact CG1-CB 3.42Å; V298-V311 HydrophobicContact CG1-CG2 4.44Å; V298-V311 HydrophobicContact CG2-CG2 4.3Å
299	L	35.6	Very low	35.4	Very low	61 Å²	61	71.7 Å²	71.7	32%	0.319	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	122.9	169.2	-175.5	83.8	0	0	0	107.4	Y221 D309 A310	Y221-L299 HydrophobicContact CD1-CD1 3.63Å; Y221-L299 HydrophobicContact CE1-CD1 3.19Å; Y221-L299 HydrophobicContact CE2-CD1 4.3Å; Y221-L299 HydrophobicContact CG-CD1 4.36Å; L299-D309 CarbonylContact O-C 3.52Å; L299-D309 WeakPolarHBondContact O-CA 3.36Å; L299-A310 HydrophobicContact CB-CB 4.39Å; L299-A310 PolarHBondContact N-O 3.47Å; L299-A310 PolarHBondContact O-N 3.16Å
300	S	41	Very low	35.5	Very low	0 Å²	0	73.9 Å²	73.9	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	133.5	-176	-56.2	0	0	0	0	110.9	F219 S220 R307 L308 D309	F219-S300 CarbonylContact C-O 3.53Å; F219-S300 WeakPolarHBondContact CA-O 3.05Å; S220-S300 PolarHBondContact N-O 2.84Å; S220-S300 WeakPolarHBondContact O-CA 3.07Å; S220-S300 WeakPolarHBondContact O-CB 3.05Å; S220-S300 PolarHBondContact O-N 3.31Å; S220-S300 VanDerWaalsContact O-O 3.08Å; S220-S300 WeakPolarHBondContact OG-CB 3.47Å; S300-R307 VanDerWaalsContact CB-NE 3.34Å; S300-R307 PolarHBondContact OG-NE 3.14Å; S300-R307 PolarHBondContact OG-NH2 2.82Å; S300-L308 CarbonylContact C-O 3.54Å; S300-L308 WeakPolarHBondContact CA-O 3.4Å; S300-D309 WeakPolarHBondContact CB-OD1 3.45Å; S300-D309 PolarHBondContact OG-OD1 3.49Å
301	V	37.6	Very low	35.5	Very low	12 Å²	12	71.8 Å²	71.8	7%	0.073	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	120.3	172.6	-169.5	0	0	0	0	109.1	F214 F219 R307 L308	F214-V301 HydrophobicContact CB-CG1 3.92Å; F214-V301 HydrophobicContact CD1-CB 4.1Å; F214-V301 HydrophobicContact CD1-CG1 3.76Å; F214-V301 VanDerWaalsContact CE1-O 3.32Å; F214-V301 WeakPolarHBondContact CE1-O 3.23Å; F214-V301 HydrophobicContact CG-CG1 4.15Å; F219-V301 HydrophobicContact CD1-CB 4.42Å; F219-V301 HydrophobicContact CD1-CG1 4.42Å; F219-V301 HydrophobicContact CD1-CG2 3.45Å; F219-V301 VanDerWaalsContact CD1-CG2 3.45Å; F219-V301 HydrophobicContact CE1-CB 4.33Å; F219-V301 HydrophobicContact CE1-CG1 4.17Å; F219-V301 HydrophobicContact CE1-CG2 3.25Å; F219-V301 HydrophobicContact CE2-CG1 4.3Å; F219-V301 HydrophobicContact CG-CG2 4.3Å; F219-V301 HydrophobicContact CZ-CG1 4.1Å; F219-V301 HydrophobicContact CZ-CG2 3.98Å; V301-R307 CarbonylContact O-C 3.53Å; V301-R307 VanDerWaalsContact O-CA 3.26Å; V301-R307 WeakPolarHBondContact O-CA 3.03Å; V301-L308 PolarHBondContact N-O 3.34Å; V301-L308 PolarHBondContact O-N 3Å
302	T	40.4	Very low	35.4	Very low	38 Å²	38	73.5 Å²	73.5	23%	0.233	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	118.9	-176.7	-45.2	0	0	0	0	111.3	G217 T218 T306 R307	G217-T302 CarbonylContact C-O 3.52Å; G217-T302 WeakPolarHBondContact CA-O 3.44Å; T218-T302 PolarHBondContact N-O 2.91Å; T218-T302 PolarHBondContact O-N 3.49Å; T218-T302 PolarHBondContact OG1-O 2.8Å; T218-T302 VanDerWaalsContact OG1-O 3.1Å; T302-T306 CarbonylContact C-O 3.56Å; T302-T306 WeakPolarHBondContact CA-O 3.21Å; T302-T306 WeakPolarHBondContact CG2-O 3.5Å; T302-R307 HydrophobicContact CG2-CB 4.25Å
303	R	38.4	Very low	35.3	Very low	111 Å²	111	72.2 Å²	72.2	42%	0.419	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	123	170.9	-168.3	-167.3	-178.2	174.3	-0	109.6	P212 E213 F214 V215 R305 T306	P212-R303 PolarHBondContact O-NH1 2.81Å; E213-R303 WeakPolarHBondContact O-CD 3.38Å; E213-R303 PolarHBondContact O-NH1 2.66Å; F214-R303 HydrophobicContact CD1-CB 4.19Å; V215-R303 PolarHBondContact O-NE 2.93Å; V215-R303 PolarHBondContact O-NH1 3.31Å; R303-R305 PolarHBondContact O-N 2.89Å; R303-R305 VanDerWaalsContact O-N 3.14Å; R303-T306 PolarHBondContact N-O 2.95Å; R303-T306 PolarHBondContact O-N 3.35Å
304	G	53.8	Low	35.1	Very low	77 Å²	77	72.7 Å²	72.7	79%	0.794	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	-117.5	-173.5	0	0	0	0	0	110.4
305	R	43.5	Very low	34.9	Very low	252 Å²	252	71.6 Å²	71.6	95%	0.951	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-3.3	176.9	-64.8	-175.8	178	176.6	-0.5	113.6	R303	R303-R305 PolarHBondContact O-N 2.89Å; R303-R305 VanDerWaalsContact O-N 3.14Å
306	T	34.3	Very low	34.6	Very low	69 Å²	69	78 Å²	78	42%	0.423	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	129.8	-175.3	-32.5	0	0	0	0	110.1	F214 T302 R303	F214-T306 HydrophobicContact CE1-CG2 4.29Å; F214-T306 HydrophobicContact CZ-CG2 3.85Å; T302-T306 CarbonylContact C-O 3.56Å; T302-T306 WeakPolarHBondContact CA-O 3.21Å; T302-T306 WeakPolarHBondContact CG2-O 3.5Å; R303-T306 PolarHBondContact N-O 2.95Å; R303-T306 PolarHBondContact O-N 3.35Å
307	R	39.9	Very low	34.1	Very low	131 Å²	131	80.5 Å²	80.5	49%	0.494	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	127.4	175.8	177.9	178.7	173	165.7	6.5	109.9	S300 V301 T302 D309	S300-R307 VanDerWaalsContact CB-NE 3.34Å; S300-R307 PolarHBondContact OG-NE 3.14Å; S300-R307 PolarHBondContact OG-NH2 2.82Å; V301-R307 CarbonylContact O-C 3.53Å; V301-R307 VanDerWaalsContact O-CA 3.26Å; V301-R307 WeakPolarHBondContact O-CA 3.03Å; T302-R307 HydrophobicContact CG2-CB 4.25Å; R307-D309 WeakPolarHBondContact CG-OD1 3.25Å; R307-D309 IonicContact CZ-OD1 3.77Å; R307-D309 IonicContact NE-OD1 3.47Å; R307-D309 PolarHBondContact NE-OD1 2.82Å; R307-D309 IonicContact NE-OD2 2.83Å; R307-D309 IonicContact NH2-OD1 3.38Å
308	L	35.2	Very low	34	Very low	97 Å²	97	84.5 Å²	84.5	51%	0.508	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	120.8	173.3	-170.7	86.7	0	0	0	109.7	F214 S300 V301	F214-L308 HydrophobicContact CE1-CB 3.99Å; F214-L308 HydrophobicContact CE2-CB 4.09Å; F214-L308 HydrophobicContact CE2-CD1 4.47Å; F214-L308 HydrophobicContact CZ-CB 3.68Å; S300-L308 CarbonylContact C-O 3.54Å; S300-L308 WeakPolarHBondContact CA-O 3.4Å; V301-L308 PolarHBondContact N-O 3.34Å; V301-L308 PolarHBondContact O-N 3Å
309	D	37.6	Very low	33.9	Very low	83 Å²	83	87.3 Å²	87.3	44%	0.444	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	118.2	179.4	-76.1	-11.8	0	0	0	110.7	V298 L299 S300 R307	V298-D309 HydrophobicContact CG1-CB 3.42Å; V298-D309 VanDerWaalsContact CG1-CB 3.42Å; L299-D309 CarbonylContact O-C 3.52Å; L299-D309 WeakPolarHBondContact O-CA 3.36Å; S300-D309 WeakPolarHBondContact CB-OD1 3.45Å; S300-D309 PolarHBondContact OG-OD1 3.49Å; R307-D309 WeakPolarHBondContact CG-OD1 3.25Å; R307-D309 IonicContact CZ-OD1 3.77Å; R307-D309 IonicContact NE-OD1 3.47Å; R307-D309 PolarHBondContact NE-OD1 2.82Å; R307-D309 IonicContact NE-OD2 2.83Å; R307-D309 IonicContact NH2-OD1 3.38Å
310	A	34	Very low	34.1	Very low	53 Å²	53	94.1 Å²	94.1	44%	0.438	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	113.1	172.1	0	0	0	0	0	109.8	L299	L299-A310 HydrophobicContact CB-CB 4.39Å; L299-A310 PolarHBondContact N-O 3.47Å; L299-A310 PolarHBondContact O-N 3.16Å
311	V	28.9	Very low	34.2	Very low	94 Å²	94	95 Å²	95	57%	0.57	53%	0.528	S	S	*	.			trans	-100.6	126.8	173.6	-170.1	0	0	0	0	108.6	V298 L313	V298-V311 HydrophobicContact CG1-CG2 4.44Å; V298-V311 HydrophobicContact CG2-CG2 4.3Å; V311-L313 PolarHBondContact O-N 3.19Å
312	P	29.2	Very low	34.6	Very low	65 Å²	65	95.2 Å²	95.2	42%	0.422	53%	0.529	S	S	.	.			trans	-60	126.7	174.4	-21.5	32.2	0	0	0	111.2	T296 A314	T296-P312 HydrophobicContact CG2-CB 4.19Å; T296-P312 HydrophobicContact CG2-CG 3.84Å; P312-A314 PolarHBondContact O-N 2.78Å
313	L	23.9	Very low	35.2	Very low	117 Å²	117	98.6 Å²	98.6	61%	0.613	54%	0.543	S	S	*	.	S	Bend	trans	-62.4	14.2	-173.1	-88.3	165.9	0	0	0	117.1	V311 S315	V311-L313 PolarHBondContact O-N 3.19Å; L313-S315 PolarHBondContact O-N 2.79Å
314	A	24.6	Very low	36	Very low	66 Å²	66	94.5 Å²	94.5	55%	0.545	53%	0.527	S	S	.	.			trans	-74.7	56.9	173.1	0	0	0	0	0	110.4	N293 P312	N293-A314 PolarHBondContact ND2-O 3.24Å; N293-A314 PolarHBondContact OD1-O 3.11Å; P312-A314 PolarHBondContact O-N 2.78Å
315	S	22.4	Very low	35.9	Very low	69 Å²	69	90.9 Å²	90.9	48%	0.483	49%	0.489	S	S	.	.			trans	-85.7	128.2	-174.9	60.9	0	0	0	0	110.9	L313	L313-S315 PolarHBondContact O-N 2.79Å
316	L	23.8	Very low	36.3	Very low	157 Å²	157	78.9 Å²	78.9	82%	0.822	44%	0.444	S	S	*	.	S	Bend	trans	86.1	20.5	150.7	-56.7	165.4	0	0	0	121.1
317	C	24.5	Very low	37.3	Very low	81 Å²	81	76.6 Å²	76.6	55%	0.547	43%	0.429	S	S	.	.			trans	-119.6	123.9	169.9	-57.5	0	0	0	0	112.6	I319	C317-I319 HydrophobicContact CB-CG1 4.37Å; C317-I319 PolarHBondContact O-N 3.34Å
318	A	30.8	Very low	37.9	Very low	102 Å²	102	70.7 Å²	70.7	84%	0.843	41%	0.407	S	S	*	.			trans	-78	105.7	168.9	0	0	0	0	0	109
319	I	33.6	Very low	38.9	Very low	99 Å²	99	66.2 Å²	66.2	51%	0.508	38%	0.383	S	S	.	.			trans	-107.2	125.3	174.8	-54.2	177.1	0	0	0	106.8	C317 G321	C317-I319 HydrophobicContact CB-CG1 4.37Å; C317-I319 PolarHBondContact O-N 3.34Å; I319-G321 PolarHBondContact O-N 3.47Å
320	R	38.4	Very low	39.6	Very low	204 Å²	204	63.9 Å²	63.9	77%	0.77	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-64.4	124.1	171.2	-77.5	-171.7	-178.6	-176.3	1.4	107.8
321	G	44.2	Very low	40.4	Very low	18 Å²	18	62.4 Å²	62.4	19%	0.186	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-66.2	164.8	172	0	0	0	0	0	112.3	L287 I319	L287-G321 WeakPolarHBondContact O-CA 3.41Å; I319-G321 PolarHBondContact O-N 3.47Å
322	P	45.4	Very low	41.6	Very low	16 Å²	16	58 Å²	58	10%	0.104	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-64.4	139.7	171.4	28.7	-33.5	0	0	0	110.7	T264 A266 F284 L287 V325	T264-P322 CarbonylContact O-C 3.48Å; T264-P322 VanDerWaalsContact O-CA 3.26Å; T264-P322 WeakPolarHBondContact O-CA 3.42Å; T264-P322 WeakPolarHBondContact O-CB 3.28Å; A266-P322 HydrophobicContact CB-CB 3.64Å; A266-P322 HydrophobicContact CB-CG 3.75Å; F284-P322 HydrophobicContact CE2-CG 4.38Å; L287-P322 WeakPolarHBondContact O-CD 3.15Å; P322-V325 HydrophobicContact CB-CG2 4.18Å; P322-V325 HydrophobicContact CG-CG2 4Å
323	E	53.9	Low	42.9	Very low	110 Å²	110	57.2 Å²	57.2	51%	0.514	33%	0.325	S	S	.	.	S	Bend	trans	-88.3	-23.1	173	-56.6	-176	168.8	0	0	110.9	V232 E233 T264	V232-E323 WeakPolarHBondContact CA-O 3.33Å; E233-E323 PolarHBondContact N-O 3.22Å; T264-E323 HydrophobicContact CG2-CG 4.28Å; T264-E323 PolarHBondContact O-N 2.78Å
324	R	53.1	Low	44.7	Very low	25 Å²	25	53.4 Å²	53.4	9%	0.094	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	139.5	-179.6	-72	172.4	-63.8	-176	4.6	111.1	E233 E255 F256 H260 D262 T264 V265 A266	E233-R324 HydrophobicContact CB-CG 4.12Å; E233-R324 CarbonylContact O-C 3.58Å; E233-R324 WeakPolarHBondContact O-CA 3.45Å; E255-R324 IonicContact OE2-NH1 3.04Å; F256-R324 HydrophobicContact CE1-CB 4.15Å; H260-R324 PolarHBondContact O-NH2 2.72Å; D262-R324 IonicContact OD1-NH2 2.79Å; D262-R324 PolarHBondContact OD1-NH2 2.69Å; D262-R324 IonicContact OD2-NH2 3.85Å; D262-R324 PolarHBondContact OD2-NH2 2.77Å; T264-R324 PolarHBondContact O-N 3.15Å; T264-R324 PolarHBondContact OG1-NE 3.15Å; T264-R324 PolarHBondContact OG1-NH2 2.92Å; V265-R324 CarbonylContact C-O 3.51Å; V265-R324 VanDerWaalsContact CA-O 3.23Å; V265-R324 WeakPolarHBondContact CA-O 3.31Å; V265-R324 HydrophobicContact CG2-CB 3.97Å; A266-R324 PolarHBondContact N-O 2.59Å
325	V	52.3	Low	45.8	Very low	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	126.7	-173.6	178.3	0	0	0	0	111.6	V232 E233 A234 M235 F256 A266 I268 F284 P322 F327	V232-V325 HydrophobicContact CG1-CB 4.21Å; V232-V325 HydrophobicContact CG1-CG2 3.37Å; E233-V325 PolarHBondContact O-N 2.85Å; A234-V325 CarbonylContact C-O 3.5Å; A234-V325 WeakPolarHBondContact CA-O 3.46Å; A234-V325 HydrophobicContact CB-CB 4.4Å; M235-V325 PolarHBondContact N-O 2.83Å; F256-V325 WeakPolarHBondContact CE1-O 3.42Å; A266-V325 HydrophobicContact CB-CG2 4.34Å; A266-V325 CarbonylContact O-C 3.58Å; A266-V325 VanDerWaalsContact O-CA 3.3Å; A266-V325 WeakPolarHBondContact O-CA 3.33Å; I268-V325 HydrophobicContact CD1-CG1 3.73Å; I268-V325 HydrophobicContact CG1-CG1 4.27Å; F284-V325 HydrophobicContact CE2-CB 4.18Å; F284-V325 HydrophobicContact CE2-CG1 3.76Å; F284-V325 HydrophobicContact CE2-CG2 3.39Å; F284-V325 HydrophobicContact CZ-CB 4.11Å; F284-V325 HydrophobicContact CZ-CG1 3.78Å; F284-V325 HydrophobicContact CZ-CG2 3.59Å; P322-V325 HydrophobicContact CB-CG2 4.18Å; P322-V325 HydrophobicContact CG-CG2 4Å; V325-F327 HydrophobicContact CG1-CD1 4.15Å; V325-F327 HydrophobicContact CG1-CD2 4.4Å; V325-F327 HydrophobicContact CG1-CE1 3.83Å; V325-F327 HydrophobicContact CG1-CE2 4.08Å; V325-F327 HydrophobicContact CG1-CG 4.45Å; V325-F327 HydrophobicContact CG1-CZ 3.79Å
326	L	52.1	Low	46.9	Very low	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	104.7	176.7	-169.8	66.6	0	0	0	110.1	M235 I237 Y242 M253 F256 W261 A266 V267 I268	M235-L326 HydrophobicContact CB-CD1 4.08Å; M235-L326 HydrophobicContact CG-CD1 4.25Å; M235-L326 CarbonylContact O-C 3.51Å; M235-L326 VanDerWaalsContact O-CA 3.3Å; M235-L326 WeakPolarHBondContact O-CA 2.82Å; I237-L326 HydrophobicContact CD1-CD1 3.87Å; I237-L326 HydrophobicContact CD1-CD2 3.74Å; I237-L326 HydrophobicContact CD1-CG 3.98Å; I237-L326 HydrophobicContact CG1-CD1 3.96Å; I237-L326 HydrophobicContact CG1-CD2 4.43Å; I237-L326 HydrophobicContact CG1-CG 4.15Å; I237-L326 HydrophobicContact CG2-CD1 4.11Å; Y242-L326 HydrophobicContact CD2-CD2 3.97Å; Y242-L326 HydrophobicContact CE2-CD2 4.31Å; M253-L326 HydrophobicContact CE-CD1 4.42Å; F256-L326 HydrophobicContact CB-CD1 4.31Å; F256-L326 HydrophobicContact CD1-CB 4.4Å; F256-L326 HydrophobicContact CD1-CD1 4.06Å; F256-L326 HydrophobicContact CG-CD1 4.42Å; W261-L326 HydrophobicContact CH2-CD2 4.33Å; W261-L326 HydrophobicContact CZ2-CD2 3.62Å; A266-L326 PolarHBondContact O-N 3.46Å; V267-L326 CarbonylContact C-O 3.48Å; V267-L326 WeakPolarHBondContact CA-O 3.35Å; V267-L326 HydrophobicContact CG2-CB 4.27Å; V267-L326 HydrophobicContact CG2-CD2 4.32Å; I268-L326 PolarHBondContact N-O 3.19Å
327	F	55.1	Low	47.8	Very low	22 Å²	22	54.5 Å²	54.5	10%	0.096	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	118.4	173.3	-66.5	-58.9	0	0	0	110.5	A234 M235 A236 I237 I268 V270 I280 F284 V325	A234-F327 HydrophobicContact CB-CD2 4.34Å; A234-F327 HydrophobicContact CB-CE2 3.97Å; M235-F327 PolarHBondContact O-N 3.23Å; A236-F327 CarbonylContact C-O 3.41Å; A236-F327 WeakPolarHBondContact CA-O 3.22Å; A236-F327 HydrophobicContact CB-CB 3.93Å; I237-F327 PolarHBondContact N-O 3.44Å; I268-F327 HydrophobicContact CB-CD1 3.9Å; I268-F327 HydrophobicContact CB-CE1 4.18Å; I268-F327 HydrophobicContact CD1-CE1 4.05Å; I268-F327 HydrophobicContact CG2-CD1 4.16Å; I268-F327 HydrophobicContact CG2-CE1 4.25Å; I268-F327 CarbonylContact O-C 3.48Å; I268-F327 VanDerWaalsContact O-CA 3.31Å; I268-F327 WeakPolarHBondContact O-CA 3.43Å; V270-F327 HydrophobicContact CG2-CB 3.74Å; V270-F327 HydrophobicContact CG2-CD1 3.26Å; V270-F327 HydrophobicContact CG2-CE1 4.11Å; V270-F327 HydrophobicContact CG2-CG 3.81Å; I280-F327 HydrophobicContact CD1-CE1 4.4Å; I280-F327 HydrophobicContact CD1-CZ 4.06Å; I280-F327 HydrophobicContact CG1-CE1 4.41Å; I280-F327 HydrophobicContact CG2-CE1 4.07Å; I280-F327 HydrophobicContact CG2-CZ 4.45Å; F284-F327 HydrophobicContact CD1-CE1 4.33Å; F284-F327 HydrophobicContact CD1-CZ 4.14Å; F284-F327 HydrophobicContact CE1-CE1 4.22Å; F284-F327 AromaticContact CE1-CZ 3.64Å; F284-F327 HydrophobicContact CE1-CZ 3.64Å; F284-F327 AromaticContact CZ-CZ 3.98Å; F284-F327 HydrophobicContact CZ-CZ 3.98Å; V325-F327 HydrophobicContact CG1-CD1 4.15Å; V325-F327 HydrophobicContact CG1-CD2 4.4Å; V325-F327 HydrophobicContact CG1-CE1 3.83Å; V325-F327 HydrophobicContact CG1-CE2 4.08Å; V325-F327 HydrophobicContact CG1-CG 4.45Å; V325-F327 HydrophobicContact CG1-CZ 3.79Å
328	V	52.5	Low	48.8	Very low	7 Å²	7	53.2 Å²	53.2	4%	0.042	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	110.3	177.7	-176.4	0	0	0	0	108.6	I237 V239 Y242 V267 I268 P269 V270 V330	I237-V328 WeakPolarHBondContact O-CA 3.42Å; V239-V328 HydrophobicContact CB-CG1 4.27Å; V239-V328 HydrophobicContact CG2-CG1 4.19Å; Y242-V328 HydrophobicContact CD1-CG1 4.28Å; Y242-V328 HydrophobicContact CD1-CG2 4.3Å; Y242-V328 HydrophobicContact CD2-CG2 3.59Å; Y242-V328 HydrophobicContact CE2-CG2 4.16Å; Y242-V328 HydrophobicContact CG-CG1 4.03Å; Y242-V328 HydrophobicContact CG-CG2 3.67Å; V267-V328 HydrophobicContact CG1-CG2 3.48Å; V267-V328 VanDerWaalsContact CG1-CG2 3.48Å; I268-V328 PolarHBondContact O-N 3.02Å; P269-V328 CarbonylContact C-O 3.49Å; P269-V328 VanDerWaalsContact CA-O 3.32Å; P269-V328 WeakPolarHBondContact CA-O 3.42Å; V270-V328 PolarHBondContact N-O 3.05Å; V328-V330 PolarHBondContact O-N 3.31Å
329	L	56.7	Low	49.4	Very low	2 Å²	2	50.8 Å²	50.8	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	93.7	-177.5	-49.5	173	0	0	0	108.2	A236 I237 V239 V270 W278 D331 A332 W342	A236-L329 HydrophobicContact CB-CD1 4.17Å; A236-L329 HydrophobicContact CB-CD2 4.05Å; A236-L329 HydrophobicContact CB-CG 4.25Å; I237-L329 PolarHBondContact O-N 3.41Å; V239-L329 PolarHBondContact N-O 2.91Å; V270-L329 HydrophobicContact CB-CD2 4.27Å; V270-L329 WeakPolarHBondContact O-CA 2.91Å; W278-L329 HydrophobicContact CD2-CD2 3.97Å; W278-L329 HydrophobicContact CE3-CD2 3.42Å; W278-L329 VanDerWaalsContact CE3-CD2 3.42Å; W278-L329 HydrophobicContact CH2-CB 3.96Å; W278-L329 HydrophobicContact CH2-CD1 3.45Å; W278-L329 VanDerWaalsContact CH2-CD1 3.45Å; W278-L329 HydrophobicContact CH2-CD2 3.37Å; W278-L329 HydrophobicContact CH2-CG 3.71Å; W278-L329 HydrophobicContact CZ2-CD1 3.89Å; W278-L329 HydrophobicContact CZ2-CD2 3.9Å; W278-L329 HydrophobicContact CZ2-CG 4.42Å; W278-L329 HydrophobicContact CZ3-CB 3.81Å; W278-L329 HydrophobicContact CZ3-CD1 4.05Å; W278-L329 HydrophobicContact CZ3-CD2 3.07Å; W278-L329 HydrophobicContact CZ3-CG 3.76Å; L329-D331 PolarHBondContact O-N 3.4Å; L329-A332 HydrophobicContact CB-CB 3.77Å; L329-A332 HydrophobicContact CD1-CB 4.45Å; L329-A332 PolarHBondContact O-N 2.86Å; L329-A332 VanDerWaalsContact O-N 3.08Å; L329-A332 VanDerWaalsContact O-O 3.11Å; L329-W342 HydrophobicContact CD1-CD2 4.38Å; L329-W342 HydrophobicContact CD1-CE3 3.5Å; L329-W342 VanDerWaalsContact CD1-CE3 3.5Å; L329-W342 HydrophobicContact CD1-CH2 4.13Å; L329-W342 HydrophobicContact CD1-CZ3 3.35Å
330	V	51.2	Low	50.1	Low	35 Å²	35	53.1 Å²	53.1	21%	0.212	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-25.6	-171.3	-106.6	0	0	0	0	112.8	V239 P269 V270 R271 V328	V239-V330 HydrophobicContact CG2-CG1 4.45Å; P269-V330 HydrophobicContact CB-CG1 4.29Å; P269-V330 HydrophobicContact CB-CG2 4.19Å; V270-V330 WeakPolarHBondContact O-CG2 3.25Å; V270-V330 PolarHBondContact O-N 3.36Å; V270-V330 VanDerWaalsContact O-N 3.08Å; R271-V330 HydrophobicContact CG-CG2 3.74Å; V328-V330 PolarHBondContact O-N 3.31Å
331	D	50.9	Low	50.7	Low	22 Å²	22	44.8 Å²	44.8	12%	0.118	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	6.3	-180	-40.4	-35.2	0	0	0	111.9	R271 T272 L329 G345	R271-D331 VanDerWaalsContact CA-OD2 3.23Å; R271-D331 WeakPolarHBondContact CA-OD2 3.2Å; R271-D331 WeakPolarHBondContact CB-OD2 3.43Å; R271-D331 WeakPolarHBondContact CG-OD1 3.46Å; R271-D331 VanDerWaalsContact CG-OD2 3.23Å; R271-D331 WeakPolarHBondContact CG-OD2 3.21Å; R271-D331 IonicContact NE-OD1 3.99Å; R271-D331 PolarHBondContact NE-OD1 2.95Å; T272-D331 PolarHBondContact N-OD2 3.01Å; L329-D331 PolarHBondContact O-N 3.4Å; D331-G345 PolarHBondContact O-N 3.46Å
332	A	55.5	Low	51.4	Low	1 Å²	1	45.3 Å²	45.3	1%	0.008	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	142.7	-179.1	0	0	0	0	0	112.5	P238 V239 L329 R343	P238-A332 HydrophobicContact CB-CB 4.38Å; P238-A332 WeakPolarHBondContact CB-O 3.11Å; V239-A332 PolarHBondContact N-O 3.37Å; L329-A332 HydrophobicContact CB-CB 3.77Å; L329-A332 HydrophobicContact CD1-CB 4.45Å; L329-A332 PolarHBondContact O-N 2.86Å; L329-A332 VanDerWaalsContact O-N 3.08Å; L329-A332 VanDerWaalsContact O-O 3.11Å; A332-R343 CarbonylContact C-O 3.44Å; A332-R343 WeakPolarHBondContact CA-O 3.39Å
333	T	56.5	Low	51.7	Low	49 Å²	49	46.6 Å²	46.6	30%	0.301	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	154.1	171	53.8	0	0	0	0	111.4	V239 D240 W342 R343	V239-T333 HydrophobicContact CG1-CG2 4.16Å; D240-T333 VanDerWaalsContact OD1-CA 3.26Å; D240-T333 WeakPolarHBondContact OD1-CA 3.47Å; T333-W342 CarbonylContact O-C 3.53Å; T333-R343 PolarHBondContact N-O 2.8Å; T333-R343 PolarHBondContact O-N 2.91Å
334	T	61	Low	51.6	Low	36 Å²	36	42.4 Å²	42.4	22%	0.221	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	137.4	172.1	61.8	0	0	0	0	110.2	P238 D240 L339	P238-T334 HydrophobicContact CB-CG2 3.91Å; P238-T334 HydrophobicContact CG-CG2 3.68Å; D240-T334 PolarHBondContact OD1-N 2.97Å; D240-T334 WeakPolarHBondContact OD2-CB 2.87Å; D240-T334 PolarHBondContact OD2-N 3.49Å; D240-T334 PolarHBondContact OD2-OG1 3.33Å; T334-L339 HydrophobicContact CG2-CD2 3.35Å
335	R	47.6	Very low	51	Low	116 Å²	116	42.8 Å²	42.8	44%	0.438	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	128.5	174.6	-155.1	-176	-170	-150.3	-1.3	110.5	S341 R343 D352	R335-S341 PolarHBondContact N-O 2.69Å; R335-S341 PolarHBondContact O-OG 3.32Å; R335-R343 HydrophobicContact CB-CB 4.28Å; R335-D352 WeakPolarHBondContact CD-OD1 3.48Å; R335-D352 IonicContact CZ-OD2 3.95Å; R335-D352 IonicContact NH1-OD1 2.78Å; R335-D352 IonicContact NH1-OD2 3.48Å; R335-D352 PolarHBondContact NH1-OD2 3.08Å
336	G	45.2	Very low	50.6	Low	61 Å²	61	44.5 Å²	44.5	63%	0.629	27%	0.269	S	S	*	.	S	Bend	trans	90.8	154.3	178.3	0	0	0	0	0	113.8	G338	G336-G338 PolarHBondContact O-N 3.42Å
337	T	43.5	Very low	50.2	Low	139 Å²	139	47.7 Å²	47.7	85%	0.853	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	121.8	173.6	42.5	0	0	0	0	109.9
338	G	44.6	Very low	49.7	Very low	53 Å²	53	54.8 Å²	54.8	55%	0.546	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.6	24.1	172.2	0	0	0	0	0	116.9	G336 Q340	G336-G338 PolarHBondContact O-N 3.42Å; G338-Q340 PolarHBondContact O-N 3.34Å; G338-Q340 VanDerWaalsContact O-N 3.08Å
339	L	44.9	Very low	49.2	Very low	51 Å²	51	61.7 Å²	61.7	27%	0.267	36%	0.36	S	S	.	.	S	Bend	trans	60	20.1	171	-63.5	168.5	0	0	0	115.4	I251 T334 S341	I251-L339 HydrophobicContact CD1-CD1 3.66Å; I251-L339 HydrophobicContact CD1-CG 4.22Å; T334-L339 HydrophobicContact CG2-CD2 3.35Å; L339-S341 VanDerWaalsContact C-N 3.28Å; L339-S341 PolarHBondContact O-N 3.44Å
340	Q	48.1	Very low	48.4	Very low	149 Å²	149	62.3 Å²	62.3	70%	0.696	37%	0.367	S	S	*	.			trans	-68.3	-25.1	-175.1	-66.7	-172.2	-5.9	0	0	113.8	G338 V355	G338-Q340 PolarHBondContact O-N 3.34Å; G338-Q340 VanDerWaalsContact O-N 3.08Å; Q340-V355 PolarHBondContact O-N 3.22Å
341	S	51.4	Low	48.1	Very low	28 Å²	28	65.5 Å²	65.5	20%	0.196	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	147.4	179.1	60.5	0	0	0	0	112.3	R335 L339 V353	R335-S341 PolarHBondContact N-O 2.69Å; R335-S341 PolarHBondContact O-OG 3.32Å; L339-S341 VanDerWaalsContact C-N 3.28Å; L339-S341 PolarHBondContact O-N 3.44Å; S341-V353 CarbonylContact C-O 3.52Å; S341-V353 VanDerWaalsContact CA-O 3.27Å; S341-V353 WeakPolarHBondContact CA-O 2.98Å
342	W	56.8	Low	48.1	Very low	30 Å²	30	67.4 Å²	67.4	11%	0.114	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	135.3	170.5	-61.8	-9.4	0	0	0	109.1	L56 A236 P238 L329 T333 D352 V353 V355	L56-W342 HydrophobicContact CD1-CH2 3.96Å; A236-W342 HydrophobicContact CB-CH2 4.17Å; A236-W342 HydrophobicContact CB-CZ3 4.44Å; A236-W342 WeakPolarHBondContact O-CH2 3.44Å; A236-W342 WeakPolarHBondContact O-CZ2 3Å; P238-W342 HydrophobicContact CG-CB 4.15Å; P238-W342 VanDerWaalsContact CG-CD1 3.44Å; P238-W342 HydrophobicContact CG-CD2 3.69Å; P238-W342 HydrophobicContact CG-CG 3.49Å; P238-W342 VanDerWaalsContact CG-CG 3.49Å; L329-W342 HydrophobicContact CD1-CD2 4.38Å; L329-W342 HydrophobicContact CD1-CE3 3.5Å; L329-W342 VanDerWaalsContact CD1-CE3 3.5Å; L329-W342 HydrophobicContact CD1-CH2 4.13Å; L329-W342 HydrophobicContact CD1-CZ3 3.35Å; T333-W342 CarbonylContact O-C 3.53Å; W342-D352 CarbonylContact O-C 3.6Å; W342-D352 WeakPolarHBondContact O-CA 3.35Å; W342-V353 PolarHBondContact N-O 2.8Å; W342-V353 PolarHBondContact O-N 2.82Å; W342-V355 HydrophobicContact CB-CG2 4.35Å; W342-V355 HydrophobicContact CD2-CG2 3.48Å; W342-V355 VanDerWaalsContact CD2-CG2 3.48Å; W342-V355 HydrophobicContact CE3-CG2 3.99Å; W342-V355 HydrophobicContact CG-CG2 3.62Å; W342-V355 HydrophobicContact CH2-CG1 4.49Å; W342-V355 HydrophobicContact CZ2-CG1 4.01Å; W342-V355 HydrophobicContact CZ2-CG2 4.14Å; W342-V355 HydrophobicContact CZ3-CG2 4.49Å
343	R	53.8	Low	47.6	Very low	43 Å²	43	69.2 Å²	69.2	16%	0.162	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	112.6	172.5	173.2	163	-82.1	-154.5	-21.5	108.9	A332 T333 R335 S347 V351 D352	A332-R343 CarbonylContact C-O 3.44Å; A332-R343 WeakPolarHBondContact CA-O 3.39Å; T333-R343 PolarHBondContact N-O 2.8Å; T333-R343 PolarHBondContact O-N 2.91Å; R335-R343 HydrophobicContact CB-CB 4.28Å; R343-S347 PolarHBondContact NH1-O 2.85Å; R343-V351 WeakPolarHBondContact CA-O 3.32Å; R343-D352 WeakPolarHBondContact CB-OD1 3.46Å; R343-D352 IonicContact CZ-OD1 3Å; R343-D352 IonicContact NE-OD1 3.83Å; R343-D352 PolarHBondContact NE-OD1 3.49Å; R343-D352 IonicContact NE-OD2 2.75Å; R343-D352 IonicContact NH2-OD1 3.51Å; R343-D352 PolarHBondContact NH2-OD1 3.09Å; R343-D352 IonicContact NH2-OD2 3.41Å; R343-D352 PolarHBondContact NH2-OD2 3.27Å
344	C	50.2	Low	46.9	Very low	22 Å²	22	72 Å²	72	15%	0.149	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	124.3	176.3	-60.7	0	0	0	0	110.2	G350 V351	C344-G350 CarbonylContact O-C 3.57Å; C344-G350 WeakPolarHBondContact O-CA 3.47Å; C344-V351 PolarHBondContact N-O 2.84Å; C344-V351 PolarHBondContact O-N 3.3Å
345	G	41.9	Very low	46	Very low	33 Å²	33	72.3 Å²	72.3	34%	0.34	43%	0.428	S	S	.	.	S	Bend	trans	109.4	-169	-177.9	0	0	0	0	0	113.6	D331	D331-G345 PolarHBondContact O-N 3.46Å
346	S	42.7	Very low	45.5	Very low	36 Å²	36	72.7 Å²	72.7	25%	0.252	45%	0.448	S	S	.	.			trans	-65.5	159.2	-179.6	76.1	0	0	0	0	112.1	Q348 L349 G350	S346-Q348 PolarHBondContact O-N 2.88Å; S346-L349 PolarHBondContact O-N 2.78Å; S346-L349 PolarHBondContact OG-N 2.78Å; S346-L349 VanDerWaalsContact OG-N 3.12Å; S346-G350 WeakPolarHBondContact O-CA 3.35Å; S346-G350 PolarHBondContact O-N 2.8Å
347	S	44.7	Very low	45	Very low	66 Å²	66	76.4 Å²	76.4	46%	0.462	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-29.3	177.5	56.4	0	0	0	0	113.6	E170 R343	E170-S347 PolarHBondContact OE1-OG 3.02Å; R343-S347 PolarHBondContact NH1-O 2.85Å
348	Q	43.3	Very low	44.5	Very low	171 Å²	171	74 Å²	74	80%	0.799	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-33.4	-177.3	-64.4	-179.1	-4.1	0	0	114.5	S346	S346-Q348 PolarHBondContact O-N 2.88Å
349	L	41.7	Very low	43.7	Very low	152 Å²	152	77.8 Å²	77.8	80%	0.796	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117	6	-172	-66.5	166.3	0	0	0	113.6	S346	S346-L349 PolarHBondContact O-N 2.78Å; S346-L349 PolarHBondContact OG-N 2.78Å; S346-L349 VanDerWaalsContact OG-N 3.12Å
350	G	40.6	Very low	42.9	Very low	15 Å²	15	78.4 Å²	78.4	16%	0.155	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-72.1	149.7	-176.8	0	0	0	0	0	114.6	C344 S346	C344-G350 CarbonylContact O-C 3.57Å; C344-G350 WeakPolarHBondContact O-CA 3.47Å; S346-G350 WeakPolarHBondContact O-CA 3.35Å; S346-G350 PolarHBondContact O-N 2.8Å
351	V	46.1	Very low	41.9	Very low	102 Å²	102	77.4 Å²	77.4	62%	0.618	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94	130.5	175.3	-178.6	0	0	0	0	109.1	R343 C344	R343-V351 WeakPolarHBondContact CA-O 3.32Å; C344-V351 PolarHBondContact N-O 2.84Å; C344-V351 PolarHBondContact O-N 3.3Å
352	D	49.8	Very low	40.7	Very low	63 Å²	63	83.2 Å²	83.2	34%	0.337	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	123.6	176	-63.9	-25.9	0	0	0	109.9	R335 W342 R343	R335-D352 WeakPolarHBondContact CD-OD1 3.48Å; R335-D352 IonicContact CZ-OD2 3.95Å; R335-D352 IonicContact NH1-OD1 2.78Å; R335-D352 IonicContact NH1-OD2 3.48Å; R335-D352 PolarHBondContact NH1-OD2 3.08Å; W342-D352 CarbonylContact O-C 3.6Å; W342-D352 WeakPolarHBondContact O-CA 3.35Å; R343-D352 WeakPolarHBondContact CB-OD1 3.46Å; R343-D352 IonicContact CZ-OD1 3Å; R343-D352 IonicContact NE-OD1 3.83Å; R343-D352 PolarHBondContact NE-OD1 3.49Å; R343-D352 IonicContact NE-OD2 2.75Å; R343-D352 IonicContact NH2-OD1 3.51Å; R343-D352 PolarHBondContact NH2-OD1 3.09Å; R343-D352 IonicContact NH2-OD2 3.41Å; R343-D352 PolarHBondContact NH2-OD2 3.27Å
353	V	45	Very low	39.2	Very low	39 Å²	39	87.2 Å²	87.2	24%	0.236	54%	0.536	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	117.4	-178.9	-174.8	0	0	0	0	108.7	M53 S341 W342	M53-V353 HydrophobicContact CE-CG1 4.4Å; S341-V353 CarbonylContact C-O 3.52Å; S341-V353 VanDerWaalsContact CA-O 3.27Å; S341-V353 WeakPolarHBondContact CA-O 2.98Å; W342-V353 PolarHBondContact N-O 2.8Å; W342-V353 PolarHBondContact O-N 2.82Å
354	P	42.6	Very low	37.9	Very low	108 Å²	108	94.1 Å²	94.1	70%	0.701	57%	0.57	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70	138.3	177.1	27.3	-31.8	0	0	0	110.9
355	V	42.6	Very low	36.6	Very low	41 Å²	41	99.2 Å²	99.2	25%	0.248	60%	0.603	C	S	.	*			trans	-117.5	109	-179.1	-174.2	0	0	0	0	109.4	Q340 W342 L357	Q340-V355 PolarHBondContact O-N 3.22Å; W342-V355 HydrophobicContact CB-CG2 4.35Å; W342-V355 HydrophobicContact CD2-CG2 3.48Å; W342-V355 VanDerWaalsContact CD2-CG2 3.48Å; W342-V355 HydrophobicContact CE3-CG2 3.99Å; W342-V355 HydrophobicContact CG-CG2 3.62Å; W342-V355 HydrophobicContact CH2-CG1 4.49Å; W342-V355 HydrophobicContact CZ2-CG1 4.01Å; W342-V355 HydrophobicContact CZ2-CG2 4.14Å; W342-V355 HydrophobicContact CZ3-CG2 4.49Å; V355-L357 PolarHBondContact O-N 3.42Å
356	C	35.5	Very low	35.8	Very low	125 Å²	125	102.1 Å²	102.1	85%	0.845	62%	0.624	S	S	*	*			trans	-77.7	103.3	174.4	-105.5	0	0	0	0	110	S358	C356-S358 PolarHBondContact O-N 3.08Å
357	L	35.3	Very low	35.1	Very low	139 Å²	139	103.9 Å²	103.9	73%	0.728	64%	0.636	S	S	*	*			trans	-70.2	78.3	158	-83.6	152.8	0	0	0	108.3	V355 S359	V355-L357 PolarHBondContact O-N 3.42Å; L357-S359 PolarHBondContact O-N 2.93Å
358	S	32.1	Very low	34.3	Very low	87 Å²	87	106.2 Å²	106.2	61%	0.608	64%	0.643	S	S	*	*			trans	-71.2	108.5	177.7	157.4	0	0	0	0	110	C356 A360	C356-S358 PolarHBondContact O-N 3.08Å; S358-A360 PolarHBondContact O-N 3.02Å; S358-A360 PolarHBondContact OG-N 3.27Å
359	S	28.6	Very low	33.8	Very low	133 Å²	133	104.6 Å²	104.6	93%	0.93	64%	0.635	S	S	*	*			trans	-80.7	19.3	165.5	48.7	0	0	0	0	113.2	L357	L357-S359 PolarHBondContact O-N 2.93Å
360	A	27.2	Very low	33.3	Very low	65 Å²	65	101 Å²	101	54%	0.537	62%	0.621	S	S	.	*	S	Bend	trans	-100.1	158.4	-177	0	0	0	0	0	113.3	S358	S358-A360 PolarHBondContact O-N 3.02Å; S358-A360 PolarHBondContact OG-N 3.27Å
361	P	28.5	Very low	33.1	Very low	127 Å²	127	105.4 Å²	105.4	83%	0.825	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-68.6	144.5	-166.4	-12.5	27.5	0	0	0	114
362	L	26.1	Very low	32.6	Very low	150 Å²	150	106.1 Å²	106.1	79%	0.785	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-54	131.9	-175.5	-79.5	101.1	0	0	0	113.8
363	P	26	Very low	32.1	Very low	114 Å²	114	107.5 Å²	107.5	74%	0.74	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-62.7	143.4	170.5	-18.3	30.2	0	0	0	112.7
364	Q	24.6	Very low	32	Very low	188 Å²	188	109.6 Å²	109.6	88%	0.879	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-72.9	136.9	175.2	-77.3	-176.1	-7.5	0	0	111.8
365	P	24.7	Very low	31.8	Very low	130 Å²	130	112 Å²	112	84%	0.844	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-73.9	127.8	-179.6	27.1	-32.2	0	0	0	112.7
366	A	25.2	Very low	31.5	Very low	94 Å²	94	111.4 Å²	111.4	78%	0.777	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-82.4	138.7	173.5	0	0	0	0	0	111.9
367	S	27.4	Very low	31.6	Very low	72 Å²	72	105.6 Å²	105.6	50%	0.503	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-83.4	136.2	173.8	176.4	0	0	0	0	110.8	E369 P370	S367-E369 PolarHBondContact OG-N 2.82Å; S367-P370 WeakPolarHBondContact O-CD 3.18Å
368	L	28.2	Very low	31.9	Very low	116 Å²	116	102.2 Å²	102.2	61%	0.607	60%	0.596	S	S	*	*	H	α-helix	trans	-77	-20	178.4	-100.1	149.2	0	0	0	113.7	L371 F372	L368-L371 PolarHBondContact O-N 3.42Å; L368-F372 PolarHBondContact O-N 3.42Å; L368-F372 VanDerWaalsContact O-N 3.16Å
369	E	32.1	Very low	32.5	Very low	136 Å²	136	100.7 Å²	100.7	64%	0.636	59%	0.593	S	S	*	*	H	α-helix	trans	-66.5	-42.8	-173.1	-159.9	173.8	-165.6	0	0	113.6	S367 F372 W373	S367-E369 PolarHBondContact OG-N 2.82Å; E369-F372 PolarHBondContact O-N 2.81Å; E369-W373 PolarHBondContact O-N 3.06Å
370	P	31.4	Very low	33.2	Very low	77 Å²	77	96.6 Å²	96.6	50%	0.5	57%	0.565	S	S	.	*	H	α-helix	trans	-65	-38.7	173.5	-18.5	32	0	0	0	112.6	S367 F372 W373 D374	S367-P370 WeakPolarHBondContact O-CD 3.18Å; P370-F372 VanDerWaalsContact C-N 3.29Å; P370-F372 PolarHBondContact O-N 3.25Å; P370-W373 PolarHBondContact O-N 3.26Å; P370-D374 WeakPolarHBondContact O-CB 3.3Å; P370-D374 PolarHBondContact O-N 2.94Å
371	L	35.6	Very low	34.1	Very low	108 Å²	108	97.6 Å²	97.6	57%	0.565	57%	0.573	S	S	*	*	H	α-helix	trans	-63.6	-35.1	-179.6	-72.9	164.5	0	0	0	112.2	L368 W375	L368-L371 PolarHBondContact O-N 3.42Å; L371-W375 WeakPolarHBondContact O-CB 3.41Å; L371-W375 PolarHBondContact O-N 2.9Å; L371-W375 VanDerWaalsContact O-N 3.13Å
372	F	36.3	Very low	34.9	Very low	116 Å²	116	98.1 Å²	98.1	51%	0.509	57%	0.569	S	S	.	*	H	α-helix	trans	-71.1	-43	177.7	-178.2	-105.9	0	0	0	112.3	L368 E369 P370 W375 L376	L368-F372 PolarHBondContact O-N 3.42Å; L368-F372 VanDerWaalsContact O-N 3.16Å; E369-F372 PolarHBondContact O-N 2.81Å; P370-F372 VanDerWaalsContact C-N 3.29Å; P370-F372 PolarHBondContact O-N 3.25Å; F372-W375 PolarHBondContact O-N 3.49Å; F372-L376 HydrophobicContact CD1-CD1 3.82Å; F372-L376 HydrophobicContact CE1-CD1 3.25Å; F372-L376 HydrophobicContact CE2-CD1 4.12Å; F372-L376 HydrophobicContact CG-CD1 4.47Å; F372-L376 HydrophobicContact CZ-CD1 3.43Å; F372-L376 VanDerWaalsContact CZ-CD1 3.43Å; F372-L376 PolarHBondContact O-N 3.26Å; F372-L376 VanDerWaalsContact O-N 3.08Å
373	W	39.6	Very low	35.6	Very low	93 Å²	93	95 Å²	95	35%	0.352	55%	0.553	S	S	.	*	H	α-helix	trans	-68.6	-39.9	176.4	-80.1	112.1	0	0	0	112.4	E369 P370 W375 L376 N377	E369-W373 PolarHBondContact O-N 3.06Å; P370-W373 PolarHBondContact O-N 3.26Å; W373-W375 VanDerWaalsContact C-N 3.28Å; W373-W375 PolarHBondContact O-N 2.78Å; W373-L376 PolarHBondContact O-N 2.94Å; W373-N377 WeakPolarHBondContact O-CB 3.28Å; W373-N377 PolarHBondContact O-N 2.99Å; W373-N377 PolarHBondContact O-ND2 3.35Å
374	D	42.6	Very low	36.3	Very low	83 Å²	83	93.6 Å²	93.6	44%	0.444	54%	0.539	S	S	.	.	H	α-helix	trans	-58.6	-41.2	172.4	-86.6	-11.1	0	0	0	111.6	P370 G378 G379	P370-D374 WeakPolarHBondContact O-CB 3.3Å; P370-D374 PolarHBondContact O-N 2.94Å; D374-G378 PolarHBondContact O-N 2.92Å; D374-G378 VanDerWaalsContact O-N 3.09Å; D374-G379 PolarHBondContact O-N 3.44Å
375	W	37.9	Very low	36.9	Very low	159 Å²	159	89.3 Å²	89.3	60%	0.602	53%	0.526	S	S	*	.	H	α-helix	trans	-66.3	-41.8	177.8	-179.4	82.3	0	0	0	112.9	L371 F372 W373 R395	L371-W375 WeakPolarHBondContact O-CB 3.41Å; L371-W375 PolarHBondContact O-N 2.9Å; L371-W375 VanDerWaalsContact O-N 3.13Å; F372-W375 PolarHBondContact O-N 3.49Å; W373-W375 VanDerWaalsContact C-N 3.28Å; W373-W375 PolarHBondContact O-N 2.78Å; W375-R395 VanDerWaalsContact CZ2-NH1 3.35Å
376	L	35.9	Very low	37.7	Very low	27 Å²	27	85.3 Å²	85.3	14%	0.141	51%	0.508	C	S	.	.	H	α-helix	trans	-68.7	-40.2	178.5	-95.4	156.5	0	0	0	112.8	F372 W373 G378 A388 N391 L392	F372-L376 HydrophobicContact CD1-CD1 3.82Å; F372-L376 HydrophobicContact CE1-CD1 3.25Å; F372-L376 HydrophobicContact CE2-CD1 4.12Å; F372-L376 HydrophobicContact CG-CD1 4.47Å; F372-L376 HydrophobicContact CZ-CD1 3.43Å; F372-L376 VanDerWaalsContact CZ-CD1 3.43Å; F372-L376 PolarHBondContact O-N 3.26Å; F372-L376 VanDerWaalsContact O-N 3.08Å; W373-L376 PolarHBondContact O-N 2.94Å; L376-G378 VanDerWaalsContact C-N 3.29Å; L376-G378 PolarHBondContact O-N 3.11Å; L376-A388 HydrophobicContact CB-CB 4.44Å; L376-A388 HydrophobicContact CD2-CB 4.31Å; L376-N391 PolarHBondContact O-ND2 3.12Å; L376-N391 VanDerWaalsContact O-ND2 3.15Å; L376-L392 HydrophobicContact CD2-CD1 3.7Å
377	N	38.6	Very low	38.6	Very low	4 Å²	4	83 Å²	83	2%	0.021	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	2.3	-178	-63.4	-43.9	0	0	0	113.2	W373 G379 S380 N383 D384	W373-N377 WeakPolarHBondContact O-CB 3.28Å; W373-N377 PolarHBondContact O-N 2.99Å; W373-N377 PolarHBondContact O-ND2 3.35Å; N377-G379 PolarHBondContact O-N 3.3Å; N377-S380 WeakPolarHBondContact O-CB 3.39Å; N377-S380 PolarHBondContact O-N 3.4Å; N377-S380 VanDerWaalsContact O-N 3.08Å; N377-N383 WeakPolarHBondContact ND2-CA 3.45Å; N377-N383 PolarHBondContact ND2-OD1 3.13Å; N377-D384 PolarHBondContact OD1-O 2.79Å
378	G	41	Very low	39.1	Very low	68 Å²	68	80 Å²	80	70%	0.701	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	29.2	-177.8	0	0	0	0	0	113.3	D374 L376	D374-G378 PolarHBondContact O-N 2.92Å; D374-G378 VanDerWaalsContact O-N 3.09Å; L376-G378 VanDerWaalsContact C-N 3.29Å; L376-G378 PolarHBondContact O-N 3.11Å
379	G	45	Very low	39.5	Very low	54 Å²	54	82.8 Å²	82.8	56%	0.557	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.6	11	-175.2	0	0	0	0	0	114.9	D374 N377	D374-G379 PolarHBondContact O-N 3.44Å; N377-G379 PolarHBondContact O-N 3.3Å
380	S	42.5	Very low	39.8	Very low	48 Å²	48	83.2 Å²	83.2	34%	0.336	47%	0.468	S	S	.	.			trans	-72.1	125.5	168.2	175.4	0	0	0	0	110.3	N377 D382	N377-S380 WeakPolarHBondContact O-CB 3.39Å; N377-S380 PolarHBondContact O-N 3.4Å; N377-S380 VanDerWaalsContact O-N 3.08Å; S380-D382 PolarHBondContact O-N 2.87Å
381	A	47.4	Very low	40.1	Very low	85 Å²	85	82.6 Å²	82.6	70%	0.702	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-17.4	-172.9	0	0	0	0	0	114.4	N383	A381-N383 PolarHBondContact O-N 3.06Å
382	D	44.3	Very low	40.1	Very low	138 Å²	138	81.5 Å²	81.5	74%	0.738	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	6.4	-163.9	-75.6	-22.9	0	0	0	115.4	S380 D384	S380-D382 PolarHBondContact O-N 2.87Å; D382-D384 PolarHBondContact O-N 3.45Å
383	N	40.8	Very low	40	Very low	84 Å²	84	78.7 Å²	78.7	45%	0.449	45%	0.453	S	S	.	.			trans	48.4	34.8	179.1	-68.7	-34.6	0	0	0	113.8	N377 A381 V385	N377-N383 WeakPolarHBondContact ND2-CA 3.45Å; N377-N383 PolarHBondContact ND2-OD1 3.13Å; A381-N383 PolarHBondContact O-N 3.06Å; N383-V385 PolarHBondContact O-N 2.78Å; N383-V385 VanDerWaalsContact O-N 3.17Å
384	D	41.7	Very low	39.8	Very low	85 Å²	85	77.9 Å²	77.9	46%	0.455	47%	0.466	S	S	.	.			trans	-74.7	108.1	-175	-168.4	-24.3	0	0	0	110.3	N377 D382 G386 V387 A388	N377-D384 PolarHBondContact OD1-O 2.79Å; D382-D384 PolarHBondContact O-N 3.45Å; D384-G386 PolarHBondContact O-N 3.23Å; D384-G386 VanDerWaalsContact O-N 3.16Å; D384-G386 WeakPolarHBondContact OD1-CA 3.41Å; D384-G386 PolarHBondContact OD1-N 3.3Å; D384-V387 HydrophobicContact CB-CB 4.32Å; D384-V387 HydrophobicContact CB-CG2 4.02Å; D384-V387 PolarHBondContact O-N 3.38Å; D384-A388 PolarHBondContact O-N 3.03Å
385	V	37.9	Very low	39.2	Very low	99 Å²	99	81.4 Å²	81.4	60%	0.6	47%	0.473	S	S	*	.	H	α-helix	trans	-56.5	-30.2	178.3	-177.4	0	0	0	0	111.6	N383 W389	N383-V385 PolarHBondContact O-N 2.78Å; N383-V385 VanDerWaalsContact O-N 3.17Å; V385-W389 WeakPolarHBondContact O-CB 3.36Å; V385-W389 PolarHBondContact O-N 3.26Å
386	G	40.4	Very low	38.6	Very low	45 Å²	45	78.5 Å²	78.5	46%	0.464	48%	0.477	S	S	.	.	H	α-helix	trans	-63.7	-45.7	175.4	0	0	0	0	0	112.2	D384 W389 E390	D384-G386 PolarHBondContact O-N 3.23Å; D384-G386 VanDerWaalsContact O-N 3.16Å; D384-G386 WeakPolarHBondContact OD1-CA 3.41Å; D384-G386 PolarHBondContact OD1-N 3.3Å; G386-W389 PolarHBondContact O-N 2.81Å; G386-E390 PolarHBondContact O-N 3.41Å
387	V	43.8	Very low	38.1	Very low	46 Å²	46	86.4 Å²	86.4	28%	0.279	51%	0.513	S	S	.	.	H	α-helix	trans	-68	-41.1	177.2	177.7	0	0	0	0	111	D384 W389 E390 N391	D384-V387 HydrophobicContact CB-CB 4.32Å; D384-V387 HydrophobicContact CB-CG2 4.02Å; D384-V387 PolarHBondContact O-N 3.38Å; V387-W389 VanDerWaalsContact C-N 3.26Å; V387-W389 PolarHBondContact O-N 3.42Å; V387-E390 PolarHBondContact O-N 3.02Å; V387-N391 WeakPolarHBondContact O-CB 3.41Å; V387-N391 PolarHBondContact O-N 2.91Å; V387-N391 PolarHBondContact O-ND2 3.1Å
388	A	37.4	Very low	37.4	Very low	10 Å²	10	88.7 Å²	88.7	8%	0.083	53%	0.533	C	S	.	.	H	α-helix	trans	-58.2	-40.6	173.9	0	0	0	0	0	111.5	L376 D384 L392	L376-A388 HydrophobicContact CB-CB 4.44Å; L376-A388 HydrophobicContact CD2-CB 4.31Å; D384-A388 PolarHBondContact O-N 3.03Å; A388-L392 WeakPolarHBondContact O-CB 3.21Å; A388-L392 PolarHBondContact O-N 2.76Å
389	W	37	Very low	36.5	Very low	174 Å²	174	88.4 Å²	88.4	66%	0.659	53%	0.53	S	S	*	.	H	α-helix	trans	-70.1	-42.8	177.6	-159.5	-103.9	0	0	0	112.5	V385 G386 V387 L392 A393	V385-W389 WeakPolarHBondContact O-CB 3.36Å; V385-W389 PolarHBondContact O-N 3.26Å; G386-W389 PolarHBondContact O-N 2.81Å; V387-W389 VanDerWaalsContact C-N 3.26Å; V387-W389 PolarHBondContact O-N 3.42Å; W389-L392 PolarHBondContact O-N 2.74Å; W389-A393 WeakPolarHBondContact O-CB 3.3Å; W389-A393 PolarHBondContact O-N 3.18Å
390	E	38.2	Very low	35.5	Very low	144 Å²	144	94.2 Å²	94.2	67%	0.673	55%	0.547	S	S	*	.	H	α-helix	trans	-61.3	-44.3	175.3	-124.8	-177.8	-178.6	0	0	111.5	G386 V387 L392 A393 A394	G386-E390 PolarHBondContact O-N 3.41Å; V387-E390 PolarHBondContact O-N 3.02Å; E390-L392 VanDerWaalsContact C-N 3.33Å; E390-L392 PolarHBondContact O-N 3.28Å; E390-A393 PolarHBondContact O-N 2.74Å; E390-A394 VanDerWaalsContact O-CB 3.25Å; E390-A394 WeakPolarHBondContact O-CB 3.26Å; E390-A394 PolarHBondContact O-N 3.21Å
391	N	39.3	Very low	34.7	Very low	65 Å²	65	99 Å²	99	35%	0.348	56%	0.562	S	S	.	*	H	α-helix	trans	-63.1	-37.9	175.5	-77.7	-24.6	0	0	0	112.4	L376 V387 R395	L376-N391 PolarHBondContact O-ND2 3.12Å; L376-N391 VanDerWaalsContact O-ND2 3.15Å; V387-N391 WeakPolarHBondContact O-CB 3.41Å; V387-N391 PolarHBondContact O-N 2.91Å; V387-N391 PolarHBondContact O-ND2 3.1Å; N391-R395 WeakPolarHBondContact O-CG 3.22Å; N391-R395 PolarHBondContact O-N 3.44Å
392	L	35.3	Very low	33.5	Very low	85 Å²	85	98.6 Å²	98.6	45%	0.445	55%	0.553	S	S	.	*	H	α-helix	trans	-67	-44.8	175.7	-134.7	105.7	0	0	0	111	L376 A388 W389 E390 R395 A405	L376-L392 HydrophobicContact CD2-CD1 3.7Å; A388-L392 WeakPolarHBondContact O-CB 3.21Å; A388-L392 PolarHBondContact O-N 2.76Å; W389-L392 PolarHBondContact O-N 2.74Å; E390-L392 VanDerWaalsContact C-N 3.33Å; E390-L392 PolarHBondContact O-N 3.28Å; L392-R395 PolarHBondContact O-N 3.22Å; L392-A405 HydrophobicContact CD2-CB 4.42Å
393	A	33.2	Very low	32.6	Very low	57 Å²	57	98.5 Å²	98.5	47%	0.471	55%	0.551	S	S	.	*	H	α-helix	trans	-69	-37.1	-179.5	0	0	0	0	0	112.5	W389 E390 R395 S396	W389-A393 WeakPolarHBondContact O-CB 3.3Å; W389-A393 PolarHBondContact O-N 3.18Å; E390-A393 PolarHBondContact O-N 2.74Å; A393-R395 PolarHBondContact O-N 3.2Å; A393-S396 WeakPolarHBondContact O-CB 3.41Å; A393-S396 PolarHBondContact O-N 3.34Å; A393-S396 VanDerWaalsContact O-N 3.16Å; A393-S396 PolarHBondContact O-OG 2.95Å
394	A	35.4	Very low	31.9	Very low	75 Å²	75	97.7 Å²	97.7	62%	0.62	55%	0.552	S	S	*	*	H	α-helix	trans	-64.5	-22.7	176.6	0	0	0	0	0	112.7	E390 S396	E390-A394 VanDerWaalsContact O-CB 3.25Å; E390-A394 WeakPolarHBondContact O-CB 3.26Å; E390-A394 PolarHBondContact O-N 3.21Å; A394-S396 PolarHBondContact O-N 2.96Å
395	R	30.4	Very low	31.2	Very low	158 Å²	158	95.5 Å²	95.5	60%	0.596	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	13	175.6	-70.9	-176.6	177.9	-177.7	4.1	114.3	W375 N391 L392 A393 Q397 A398	W375-R395 VanDerWaalsContact CZ2-NH1 3.35Å; N391-R395 WeakPolarHBondContact O-CG 3.22Å; N391-R395 PolarHBondContact O-N 3.44Å; L392-R395 PolarHBondContact O-N 3.22Å; A393-R395 PolarHBondContact O-N 3.2Å; R395-Q397 PolarHBondContact O-N 2.98Å; R395-A398 PolarHBondContact O-N 2.94Å
396	S	25	Very low	30.8	Very low	98 Å²	98	96.5 Å²	96.5	69%	0.685	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-7.7	177.8	50.4	0	0	0	0	116	A393 A394 A398	A393-S396 WeakPolarHBondContact O-CB 3.41Å; A393-S396 PolarHBondContact O-N 3.34Å; A393-S396 VanDerWaalsContact O-N 3.16Å; A393-S396 PolarHBondContact O-OG 2.95Å; A394-S396 PolarHBondContact O-N 2.96Å; S396-A398 VanDerWaalsContact C-N 3.28Å; S396-A398 PolarHBondContact O-N 3.4Å
397	Q	25	Very low	30.2	Very low	193 Å²	193	98 Å²	98	90%	0.902	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-1.4	172.4	-68.7	-158.8	-9.5	0	0	115.1	R395 G399	R395-Q397 PolarHBondContact O-N 2.98Å; Q397-G399 VanDerWaalsContact C-N 3.35Å; Q397-G399 PolarHBondContact O-N 3.05Å; Q397-G399 VanDerWaalsContact O-N 3.11Å
398	A	25.4	Very low	29.5	Very low	51 Å²	51	101.2 Å²	101.2	42%	0.421	56%	0.56	S	S	.	*	S	Bend	trans	-83.8	79.7	167.8	0	0	0	0	0	110.6	R395 S396 L400 K401	R395-A398 PolarHBondContact O-N 2.94Å; S396-A398 VanDerWaalsContact C-N 3.28Å; S396-A398 PolarHBondContact O-N 3.4Å; A398-L400 PolarHBondContact O-N 3.43Å; A398-K401 HydrophobicContact CB-CD 4.15Å; A398-K401 PolarHBondContact O-N 3.39Å
399	G	22	Very low	29	Very low	63 Å²	63	102 Å²	102	65%	0.649	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-45.3	138	174.5	0	0	0	0	0	112.5	Q397 K401	Q397-G399 VanDerWaalsContact C-N 3.35Å; Q397-G399 PolarHBondContact O-N 3.05Å; Q397-G399 VanDerWaalsContact O-N 3.11Å; G399-K401 PolarHBondContact O-N 3.31Å
400	L	23.9	Very low	28.7	Very low	175 Å²	175	96 Å²	96	92%	0.916	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	74.8	5.1	176.6	-56.4	161.5	0	0	0	117.5	A398 P402	A398-L400 PolarHBondContact O-N 3.43Å; L400-P402 WeakPolarHBondContact O-CD 3.45Å
401	K	24.5	Very low	28.2	Very low	148 Å²	148	93.4 Å²	93.4	64%	0.643	54%	0.542	S	S	*	.			trans	-91.3	10.6	169.8	-68.4	-170.2	178.8	-177.4	0	118.3	A398 G399 L403 S404	A398-K401 HydrophobicContact CB-CD 4.15Å; A398-K401 PolarHBondContact O-N 3.39Å; G399-K401 PolarHBondContact O-N 3.31Å; K401-L403 PolarHBondContact O-N 3.33Å; K401-S404 PolarHBondContact O-N 3.11Å; K401-S404 PolarHBondContact O-OG 3.26Å
402	P	23	Very low	27.7	Very low	78 Å²	78	95.9 Å²	95.9	51%	0.506	56%	0.555	S	S	.	*	H	α-helix	trans	-68.8	-23.6	-176.3	27.8	-30.3	0	0	0	112.7	L400 S404 A405 I406	L400-P402 WeakPolarHBondContact O-CD 3.45Å; P402-S404 PolarHBondContact O-N 3.33Å; P402-A405 PolarHBondContact O-N 3.43Å; P402-I406 WeakPolarHBondContact O-CG1 3.42Å; P402-I406 PolarHBondContact O-N 2.99Å; P402-I406 VanDerWaalsContact O-N 3.12Å
403	L	25.4	Very low	27.4	Very low	136 Å²	136	99.9 Å²	99.9	71%	0.712	57%	0.569	S	S	*	*	H	α-helix	trans	-62.4	-41.3	178.5	-108.1	102.4	0	0	0	112.1	K401 A405 I406 T407	K401-L403 PolarHBondContact O-N 3.33Å; L403-A405 PolarHBondContact O-N 2.82Å; L403-I406 PolarHBondContact O-N 3.11Å; L403-T407 WeakPolarHBondContact O-CB 3.31Å; L403-T407 PolarHBondContact O-N 2.82Å; L403-T407 PolarHBondContact O-OG1 3.18Å
404	S	26.3	Very low	27.2	Very low	66 Å²	66	102.3 Å²	102.3	46%	0.462	58%	0.578	S	S	.	*	H	α-helix	trans	-68.8	-34.2	-176.7	60.7	0	0	0	0	113.1	K401 P402 M408	K401-S404 PolarHBondContact O-N 3.11Å; K401-S404 PolarHBondContact O-OG 3.26Å; P402-S404 PolarHBondContact O-N 3.33Å; S404-M408 WeakPolarHBondContact O-CB 3.17Å; S404-M408 PolarHBondContact O-N 3.34Å
405	A	27.1	Very low	26.8	Very low	40 Å²	40	105.6 Å²	105.6	33%	0.331	57%	0.574	S	S	.	*	H	α-helix	trans	-72.8	-41.8	178.1	0	0	0	0	0	111.8	L392 P402 L403 M408 A409	L392-A405 HydrophobicContact CD2-CB 4.42Å; P402-A405 PolarHBondContact O-N 3.43Å; L403-A405 PolarHBondContact O-N 2.82Å; A405-M408 PolarHBondContact O-N 2.83Å; A405-A409 VanDerWaalsContact O-CB 3.29Å; A405-A409 WeakPolarHBondContact O-CB 3.5Å; A405-A409 PolarHBondContact O-N 2.48Å
406	I	29	Very low	26.6	Very low	120 Å²	120	107 Å²	107	62%	0.615	59%	0.585	S	S	*	*	H	α-helix	trans	-64.1	-41.7	174.8	-66	169.6	0	0	0	110.3	P402 L403 A409 A410	P402-I406 WeakPolarHBondContact O-CG1 3.42Å; P402-I406 PolarHBondContact O-N 2.99Å; P402-I406 VanDerWaalsContact O-N 3.12Å; L403-I406 PolarHBondContact O-N 3.11Å; I406-A409 PolarHBondContact O-N 3.19Å; I406-A410 WeakPolarHBondContact O-CB 3.33Å; I406-A410 PolarHBondContact O-N 3.38Å
407	T	28.3	Very low	26.7	Very low	77 Å²	77	109.7 Å²	109.7	47%	0.472	58%	0.584	S	S	.	*	H	α-helix	trans	-68.2	-40.6	178.2	-44.5	0	0	0	0	111.8	L403 A410 E411	L403-T407 WeakPolarHBondContact O-CB 3.31Å; L403-T407 PolarHBondContact O-N 2.82Å; L403-T407 PolarHBondContact O-OG1 3.18Å; T407-A410 PolarHBondContact O-N 3.36Å; T407-E411 WeakPolarHBondContact O-CB 3.47Å; T407-E411 PolarHBondContact O-N 3.13Å
408	M	27.8	Very low	26.6	Very low	113 Å²	113	110.2 Å²	110.2	56%	0.557	58%	0.578	S	S	*	*	H	α-helix	trans	-65.4	-42	173.9	-96.4	-174.9	-74.5	0	0	112.6	S404 A405 A410 E411 L412	S404-M408 WeakPolarHBondContact O-CB 3.17Å; S404-M408 PolarHBondContact O-N 3.34Å; A405-M408 PolarHBondContact O-N 2.83Å; M408-A410 VanDerWaalsContact C-N 3.35Å; M408-E411 PolarHBondContact O-N 2.78Å; M408-L412 PolarHBondContact O-N 3.33Å
409	A	28.5	Very low	26.6	Very low	27 Å²	27	112.3 Å²	112.3	22%	0.223	59%	0.588	C	S	.	*	H	α-helix	trans	-61.9	-45.5	174.3	0	0	0	0	0	110.4	A405 I406 E411 L412 F413	A405-A409 VanDerWaalsContact O-CB 3.29Å; A405-A409 WeakPolarHBondContact O-CB 3.5Å; A405-A409 PolarHBondContact O-N 2.48Å; I406-A409 PolarHBondContact O-N 3.19Å; A409-E411 PolarHBondContact O-N 2.79Å; A409-L412 PolarHBondContact O-N 3.37Å; A409-F413 WeakPolarHBondContact O-CB 3.45Å; A409-F413 VanDerWaalsContact O-CD2 3.23Å; A409-F413 WeakPolarHBondContact O-CD2 3.33Å; A409-F413 PolarHBondContact O-N 3.36Å
410	A	29.5	Very low	26.6	Very low	47 Å²	47	119.8 Å²	119.8	39%	0.388	60%	0.602	S	S	.	*	H	α-helix	trans	-59.9	-34.2	174.2	0	0	0	0	0	112	I406 T407 M408 T414	I406-A410 WeakPolarHBondContact O-CB 3.33Å; I406-A410 PolarHBondContact O-N 3.38Å; T407-A410 PolarHBondContact O-N 3.36Å; M408-A410 VanDerWaalsContact C-N 3.35Å; A410-T414 WeakPolarHBondContact O-CB 3.44Å; A410-T414 VanDerWaalsContact O-CG2 3.32Å; A410-T414 WeakPolarHBondContact O-CG2 3.3Å; A410-T414 PolarHBondContact O-N 2.76Å; A410-T414 PolarHBondContact O-OG1 3.16Å
411	E	28.5	Very low	26.6	Very low	90 Å²	90	115.1 Å²	115.1	42%	0.421	59%	0.589	S	S	.	*	H	α-helix	trans	-72.8	-36.8	175.6	-133.6	173.8	150.8	0	0	112.7	T407 M408 A409 T414 R415	T407-E411 WeakPolarHBondContact O-CB 3.47Å; T407-E411 PolarHBondContact O-N 3.13Å; M408-E411 PolarHBondContact O-N 2.78Å; A409-E411 PolarHBondContact O-N 2.79Å; E411-T414 WeakPolarHBondContact CA-OG1 3.33Å; E411-T414 PolarHBondContact O-OG1 3.46Å; E411-R415 WeakPolarHBondContact O-CB 3.46Å; E411-R415 VanDerWaalsContact O-CG 3.23Å; E411-R415 WeakPolarHBondContact O-CG 3.49Å; E411-R415 PolarHBondContact O-N 3.2Å; E411-R415 IonicContact OE1-CZ 3.26Å; E411-R415 IonicContact OE1-NE 3.57Å; E411-R415 IonicContact OE1-NH2 3.55Å; E411-R415 PolarHBondContact OE1-NH2 2.9Å
412	L	28.8	Very low	26.5	Very low	117 Å²	117	114.8 Å²	114.8	61%	0.613	59%	0.593	S	S	*	*	H	α-helix	trans	-66.7	-41.2	171.2	-74.5	167.6	0	0	0	111.5	M408 A409	M408-L412 PolarHBondContact O-N 3.33Å; A409-L412 PolarHBondContact O-N 3.37Å
413	F	29.1	Very low	26.5	Very low	168 Å²	168	116.5 Å²	116.5	74%	0.737	60%	0.604	S	S	*	*	H	α-helix	trans	-64.9	-44.9	175.3	-90	-73.9	0	0	0	112.3	A409	A409-F413 WeakPolarHBondContact O-CB 3.45Å; A409-F413 VanDerWaalsContact O-CD2 3.23Å; A409-F413 WeakPolarHBondContact O-CD2 3.33Å; A409-F413 PolarHBondContact O-N 3.36Å
414	T	28.3	Very low	26.4	Very low	109 Å²	109	116.3 Å²	116.3	67%	0.669	61%	0.614	S	S	*	*	H	α-helix	trans	-72.3	-29.4	-178.6	46.2	0	0	0	0	113	A410 E411 K416	A410-T414 WeakPolarHBondContact O-CB 3.44Å; A410-T414 VanDerWaalsContact O-CG2 3.32Å; A410-T414 WeakPolarHBondContact O-CG2 3.3Å; A410-T414 PolarHBondContact O-N 2.76Å; A410-T414 PolarHBondContact O-OG1 3.16Å; E411-T414 WeakPolarHBondContact CA-OG1 3.33Å; E411-T414 PolarHBondContact O-OG1 3.46Å; T414-K416 VanDerWaalsContact C-N 3.26Å; T414-K416 PolarHBondContact O-N 3.43Å
415	R	26.4	Very low	26.2	Very low	144 Å²	144	115.6 Å²	115.6	54%	0.543	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80	2.7	-179.5	-70.2	-174.5	-176.4	-159.7	6.6	115	E411 F417	E411-R415 WeakPolarHBondContact O-CB 3.46Å; E411-R415 VanDerWaalsContact O-CG 3.23Å; E411-R415 WeakPolarHBondContact O-CG 3.49Å; E411-R415 PolarHBondContact O-N 3.2Å; E411-R415 IonicContact OE1-CZ 3.26Å; E411-R415 IonicContact OE1-NE 3.57Å; E411-R415 IonicContact OE1-NH2 3.55Å; E411-R415 PolarHBondContact OE1-NH2 2.9Å; R415-F417 HydrophobicContact CB-CD2 3.44Å; R415-F417 VanDerWaalsContact CB-CD2 3.44Å; R415-F417 HydrophobicContact CB-CE2 3.84Å; R415-F417 HydrophobicContact CG-CD2 4.45Å; R415-F417 HydrophobicContact CG-CE2 4.49Å; R415-F417 PolarHBondContact O-N 3.35Å
416	K	27.3	Very low	26.1	Very low	188 Å²	188	119.4 Å²	119.4	82%	0.817	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	47.4	29.7	-179.3	-64.6	-174.7	178.3	-179.3	0	112.8	T414 W418	T414-K416 VanDerWaalsContact C-N 3.26Å; T414-K416 PolarHBondContact O-N 3.43Å; K416-W418 PolarHBondContact O-N 2.83Å
417	F	27.1	Very low	26	Very low	153 Å²	153	119.9 Å²	119.9	67%	0.671	65%	0.65	S	S	*	*			trans	-76.2	65.6	171.5	-82.2	-72.9	0	0	0	108.2	R415	R415-F417 HydrophobicContact CB-CD2 3.44Å; R415-F417 VanDerWaalsContact CB-CD2 3.44Å; R415-F417 HydrophobicContact CB-CE2 3.84Å; R415-F417 HydrophobicContact CG-CD2 4.45Å; R415-F417 HydrophobicContact CG-CE2 4.49Å; R415-F417 PolarHBondContact O-N 3.35Å
418	W	22.7	Very low	25.9	Very low	205 Å²	205	127.6 Å²	127.6	78%	0.777	67%	0.67	S	S	*	*			trans	-70.1	127.1	149.9	-128.3	-78.9	0	0	0	105.9	K416 K420	K416-W418 PolarHBondContact O-N 2.83Å; W418-K420 PolarHBondContact O-N 3.09Å
419	P	24.9	Very low	25.9	Very low	95 Å²	95	129.5 Å²	129.5	62%	0.617	68%	0.683	S	S	*	*			trans	-56.4	113.4	169.7	-17.2	28.5	0	0	0	107.2	A421	P419-A421 PolarHBondContact O-N 3.39Å
420	K	22.8	Very low	25.8	Very low	220 Å²	220	133.7 Å²	133.7	96%	0.957	71%	0.708	S	S	*	*	S	Bend	trans	-65.5	6	179.6	-97.8	-173.7	176.5	-178.4	0	113.8	W418	W418-K420 PolarHBondContact O-N 3.09Å
421	A	22.9	Very low	25.5	Very low	76 Å²	76	134.3 Å²	134.3	63%	0.628	72%	0.719	S	S	*	*			trans	-149.8	76.3	178.6	0	0	0	0	0	108.7	P419 P423	P419-A421 PolarHBondContact O-N 3.39Å; A421-P423 WeakPolarHBondContact O-CD 3.41Å
422	L	22.4	Very low	25.2	Very low	142 Å²	142	136.5 Å²	136.5	74%	0.743	74%	0.738	S	S	*	*			trans	-63.9	118.4	143.7	-83	163.8	0	0	0	104.8	S424	L422-S424 PolarHBondContact O-N 3.23Å; L422-S424 VanDerWaalsContact O-N 3.15Å
423	P	23.3	Very low	25.1	Very low	113 Å²	113	135.9 Å²	135.9	73%	0.734	74%	0.738	S	S	*	*			trans	-55.6	125.5	-175.2	20.8	-30.8	0	0	0	108.4	A421 G425	A421-P423 WeakPolarHBondContact O-CD 3.41Å; P423-G425 PolarHBondContact O-N 2.93Å
424	S	23.9	Very low	24.9	Very low	133 Å²	133	132 Å²	132	93%	0.93	73%	0.726	S	S	*	*			trans	-69.8	31.6	-179.3	45.9	0	0	0	0	113.2	L422 S426	L422-S424 PolarHBondContact O-N 3.23Å; L422-S424 VanDerWaalsContact O-N 3.15Å; S424-S426 PolarHBondContact O-N 3.36Å
425	G	21.8	Very low	24.8	Very low	50 Å²	50	133.4 Å²	133.4	52%	0.515	73%	0.728	S	S	.	*			trans	-95.4	87.1	-179.5	0	0	0	0	0	112.3	P423 V427	P423-G425 PolarHBondContact O-N 2.93Å; G425-V427 VanDerWaalsContact C-N 3.33Å; G425-V427 PolarHBondContact O-N 2.84Å
426	S	26	Very low	24.8	Very low	121 Å²	121	135.7 Å²	135.7	85%	0.846	74%	0.737	S	S	*	*			trans	45.6	20.4	140.5	64.5	0	0	0	0	122.5	S424	S424-S426 PolarHBondContact O-N 3.36Å
427	V	26.3	Very low	24.7	Very low	130 Å²	130	132.1 Å²	132.1	79%	0.788	73%	0.727	S	S	*	*			trans	-91.7	116	167.1	-172.2	0	0	0	0	109.9	G425	G425-V427 VanDerWaalsContact C-N 3.33Å; G425-V427 PolarHBondContact O-N 2.84Å
428	R	25.5	Very low	24.6	Very low	238 Å²	238	133 Å²	133	90%	0.898	73%	0.731	S	S	*	*	S	Bend	trans	-51.6	127.8	-172.6	-66.5	169.3	172.8	-178.3	-3.5	113
429	D	27.2	Very low	24.7	Very low	154 Å²	154	127 Å²	127	82%	0.824	72%	0.724	S	S	*	*			trans	52.7	65.1	164.9	-85.2	-28.5	0	0	0	118	G431	D429-G431 PolarHBondContact O-N 2.85Å
430	P	26.1	Very low	24.7	Very low	115 Å²	115	131.7 Å²	131.7	75%	0.747	73%	0.73	S	S	*	*			trans	-70.5	102.8	156.5	30.2	-26.1	0	0	0	106.7	V432	P430-V432 PolarHBondContact O-N 3.02Å; P430-V432 VanDerWaalsContact O-N 3.09Å
431	G	23.4	Very low	24.8	Very low	60 Å²	60	130.2 Å²	130.2	62%	0.619	72%	0.723	S	S	*	*			trans	-32.3	114.8	-177.9	0	0	0	0	0	112.3	D429 V433	D429-G431 PolarHBondContact O-N 2.85Å; G431-V433 VanDerWaalsContact C-N 3.27Å; G431-V433 PolarHBondContact O-N 2.84Å
432	V	24	Very low	25	Very low	135 Å²	135	134 Å²	134	82%	0.818	73%	0.733	S	S	*	*			trans	-51.5	100	160.9	176.9	0	0	0	0	105.8	P430 D434	P430-V432 PolarHBondContact O-N 3.02Å; P430-V432 VanDerWaalsContact O-N 3.09Å; V432-D434 PolarHBondContact O-N 3.2Å
433	V	26.1	Very low	25	Very low	104 Å²	104	130.9 Å²	130.9	63%	0.63	72%	0.723	S	S	*	*			trans	-69.9	93.2	172.7	179	0	0	0	0	105.4	G431 L435 F438	G431-V433 VanDerWaalsContact C-N 3.27Å; G431-V433 PolarHBondContact O-N 2.84Å; V433-L435 VanDerWaalsContact C-N 3.34Å; V433-L435 PolarHBondContact O-N 3.1Å; V433-F438 HydrophobicContact CG1-CD2 4.47Å
434	D	25.2	Very low	24.9	Very low	87 Å²	87	129.1 Å²	129.1	47%	0.465	72%	0.718	S	S	.	*			trans	-63.6	98.3	171.6	-173.6	-4.4	0	0	0	107.6	V432 R436 N437	V432-D434 PolarHBondContact O-N 3.2Å; D434-R436 PolarHBondContact O-N 3.31Å; D434-R436 WeakPolarHBondContact OD1-CB 3.42Å; D434-R436 WeakPolarHBondContact OD1-CG 3.35Å; D434-R436 PolarHBondContact OD1-N 3.13Å; D434-N437 PolarHBondContact O-N 3.13Å
435	L	26.5	Very low	24.8	Very low	138 Å²	138	128.8 Å²	128.8	72%	0.723	71%	0.71	S	S	*	*	H	α-helix	trans	-53.6	-16.4	-179.2	-72.8	162.9	0	0	0	112.6	V433 N437 F438	V433-L435 VanDerWaalsContact C-N 3.34Å; V433-L435 PolarHBondContact O-N 3.1Å; L435-N437 VanDerWaalsContact C-N 3.26Å; L435-N437 PolarHBondContact O-N 3.03Å; L435-F438 PolarHBondContact O-N 3.28Å
436	R	24.9	Very low	24.8	Very low	193 Å²	193	132.1 Å²	132.1	73%	0.728	72%	0.72	S	S	*	*	H	α-helix	trans	-63.6	-28	173.8	-70.2	-177.9	174.9	-177.5	0.5	113.6	D434	D434-R436 PolarHBondContact O-N 3.31Å; D434-R436 WeakPolarHBondContact OD1-CB 3.42Å; D434-R436 WeakPolarHBondContact OD1-CG 3.35Å; D434-R436 PolarHBondContact OD1-N 3.13Å
437	N	25.6	Very low	24.5	Very low	113 Å²	113	133 Å²	133	60%	0.604	71%	0.711	S	S	*	*	H	α-helix	trans	-83.1	-26	179.2	-81.5	-21.6	0	0	0	113.3	D434 L435 A439 R440	D434-N437 PolarHBondContact O-N 3.13Å; L435-N437 VanDerWaalsContact C-N 3.26Å; L435-N437 PolarHBondContact O-N 3.03Å; N437-A439 VanDerWaalsContact C-N 3.29Å; N437-A439 PolarHBondContact O-N 3.01Å; N437-R440 PolarHBondContact O-N 2.87Å
438	F	24.7	Very low	24.4	Very low	172 Å²	172	133.5 Å²	133.5	75%	0.754	71%	0.709	S	S	*	*	H	α-helix	trans	-69.3	-29.7	173.7	-114.2	-83.8	0	0	0	112	V433 L435 R440	V433-F438 HydrophobicContact CG1-CD2 4.47Å; L435-F438 PolarHBondContact O-N 3.28Å; F438-R440 PolarHBondContact O-N 3.41Å
439	A	25.5	Very low	24.2	Very low	77 Å²	77	127.9 Å²	127.9	64%	0.636	70%	0.697	S	S	*	*	H	α-helix	trans	-73	-8	175.3	0	0	0	0	0	114.4	N437	N437-A439 VanDerWaalsContact C-N 3.29Å; N437-A439 PolarHBondContact O-N 3.01Å
440	R	25.5	Very low	24	Very low	195 Å²	195	125.8 Å²	125.8	74%	0.736	69%	0.69	S	S	*	*	H	α-helix	trans	-112.2	-13.6	-171.2	-80.5	-171.3	176.7	-173.9	-0.5	116.7	N437 F438 S443	N437-R440 PolarHBondContact O-N 2.87Å; F438-R440 PolarHBondContact O-N 3.41Å; R440-S443 PolarHBondContact O-OG 3.25Å
441	K	24.9	Very low	23.9	Very low	188 Å²	188	124.7 Å²	124.7	82%	0.817	69%	0.685	S	S	*	*	H	α-helix	trans	-100.1	-15.9	-171.4	-90.9	-172	173.7	-176.2	0	117.2
442	D	25.4	Very low	23.9	Very low	157 Å²	157	127.8 Å²	127.8	84%	0.84	69%	0.692	S	S	*	*	S	Bend	trans	-123.9	26	166.6	-70.9	-41.3	0	0	0	112.4	A444	D442-A444 PolarHBondContact O-N 3.46Å
443	S	22.4	Very low	23.9	Very low	76 Å²	76	125 Å²	125	53%	0.531	68%	0.677	S	S	.	*			trans	-71.1	54	149.6	61.2	0	0	0	0	109.1	R440 T445	R440-S443 PolarHBondContact O-OG 3.25Å; S443-T445 PolarHBondContact O-N 2.74Å
444	A	22.7	Very low	24.2	Very low	75 Å²	75	127.2 Å²	127.2	62%	0.62	69%	0.69	S	S	*	*			trans	-62.1	93.8	143	0	0	0	0	0	103.6	D442 V446	D442-A444 PolarHBondContact O-N 3.46Å; A444-V446 PolarHBondContact O-N 3.34Å
445	T	21	Very low	24.5	Very low	126 Å²	126	127.6 Å²	127.6	77%	0.773	69%	0.692	S	S	*	*			trans	-22.4	73.9	157.4	33.4	0	0	0	0	112.5	S443 Q447	S443-T445 PolarHBondContact O-N 2.74Å; T445-Q447 PolarHBondContact O-N 3.1Å
446	V	21.5	Very low	24.9	Very low	120 Å²	120	124.9 Å²	124.9	73%	0.727	69%	0.69	S	S	*	*			trans	-68.9	96.9	141.4	-177.3	0	0	0	0	101.4	A444 D448	A444-V446 PolarHBondContact O-N 3.34Å; V446-D448 PolarHBondContact O-N 3.11Å
447	Q	20.7	Very low	25.6	Very low	140 Å²	140	122 Å²	122	65%	0.654	69%	0.689	S	S	*	*			trans	-50.2	101.6	167	-72.7	177.6	-80.4	0	0	106.2	T445 D449	T445-Q447 PolarHBondContact O-N 3.1Å; Q447-D449 HydrophobicContact CB-CB 4.18Å; Q447-D449 PolarHBondContact NE2-OD2 3.47Å; Q447-D449 PolarHBondContact O-N 2.76Å
448	D	23.2	Very low	26.8	Very low	141 Å²	141	118.6 Å²	118.6	75%	0.754	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	37.4	159.5	-76.9	-27.9	0	0	0	109.6	V446 V450 S451	V446-D448 PolarHBondContact O-N 3.11Å; D448-V450 CarbonylContact O-C 3.44Å; D448-V450 PolarHBondContact O-N 3.49Å; D448-S451 PolarHBondContact O-N 2.88Å
449	D	21.6	Very low	28.2	Very low	119 Å²	119	113.4 Å²	113.4	64%	0.636	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-7.6	166.3	-79.4	-26.7	0	0	0	110.7	Q447 S451	Q447-D449 HydrophobicContact CB-CB 4.18Å; Q447-D449 PolarHBondContact NE2-OD2 3.47Å; Q447-D449 PolarHBondContact O-N 2.76Å; D449-S451 PolarHBondContact O-N 3.09Å
450	V	23.2	Very low	29.9	Very low	110 Å²	110	114.8 Å²	114.8	67%	0.667	65%	0.646	S	S	*	*			trans	-82.1	67.1	157	-161.5	0	0	0	0	108	D448 T452	D448-V450 CarbonylContact O-C 3.44Å; D448-V450 PolarHBondContact O-N 3.49Å; V450-T452 PolarHBondContact O-N 3.31Å
451	S	23.5	Very low	31.9	Very low	92 Å²	92	105.8 Å²	105.8	64%	0.643	61%	0.612	S	S	*	*			trans	-31.7	110.8	142.5	44.7	0	0	0	0	107.1	D448 D449 P453	D448-S451 PolarHBondContact O-N 2.88Å; D449-S451 PolarHBondContact O-N 3.09Å; S451-P453 WeakPolarHBondContact O-CD 3.4Å
452	T	23.2	Very low	34.2	Very low	126 Å²	126	99 Å²	99	77%	0.773	59%	0.587	S	S	*	*			trans	-46.2	107.5	176.5	23	0	0	0	0	105.7	V450 V454	V450-T452 PolarHBondContact O-N 3.31Å; T452-V454 PolarHBondContact O-N 3.5Å
453	P	25.3	Very low	36.6	Very low	76 Å²	76	92.2 Å²	92.2	49%	0.494	55%	0.551	S	S	.	*			trans	-60.4	128.8	-173.3	-20	30.7	0	0	0	104.8	S451 N455 A456	S451-P453 WeakPolarHBondContact O-CD 3.4Å; P453-N455 PolarHBondContact O-N 2.78Å; P453-A456 PolarHBondContact O-N 2.82Å
454	V	31.7	Very low	38.9	Very low	151 Å²	151	93.8 Å²	93.8	92%	0.915	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-3.5	172.5	177.4	0	0	0	0	111.6	T452	T452-V454 PolarHBondContact O-N 3.5Å
455	N	31.9	Very low	41.1	Very low	95 Å²	95	93.4 Å²	93.4	51%	0.508	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	28.5	178.9	-68.3	-21.3	0	0	0	114.4	P453 N457 L458	P453-N455 PolarHBondContact O-N 2.78Å; N455-N457 PolarHBondContact O-N 3.35Å; N455-L458 HydrophobicContact CB-CB 4.39Å; N455-L458 HydrophobicContact CB-CD1 3.85Å; N455-L458 HydrophobicContact CB-CG 4.46Å; N455-L458 PolarHBondContact O-N 3.47Å
456	A	33.6	Very low	43.2	Very low	81 Å²	81	88 Å²	88	67%	0.669	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-3.3	-172.8	0	0	0	0	0	117.6	P453	P453-A456 PolarHBondContact O-N 2.82Å
457	N	41.3	Very low	45.4	Very low	133 Å²	133	90.2 Å²	90.2	71%	0.711	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	4.4	171.4	-81.4	-10.6	0	0	0	114.5	N455 T459	N455-N457 PolarHBondContact O-N 3.35Å; N457-T459 PolarHBondContact O-N 3.06Å
458	L	49.3	Very low	47.4	Very low	40 Å²	40	88 Å²	88	21%	0.209	50%	0.495	C	S	.	.			trans	-93.8	85.7	177.9	-63	171.6	0	0	0	108.5	N455 E460 K596 R597	N455-L458 HydrophobicContact CB-CB 4.39Å; N455-L458 HydrophobicContact CB-CD1 3.85Å; N455-L458 HydrophobicContact CB-CG 4.46Å; N455-L458 PolarHBondContact O-N 3.47Å; L458-E460 PolarHBondContact O-N 3.2Å; L458-E460 VanDerWaalsContact O-N 3.13Å; L458-K596 HydrophobicContact CD1-CD 4.18Å; L458-K596 HydrophobicContact CD1-CG 3.97Å; L458-K596 HydrophobicContact CD2-CD 4.4Å; L458-K596 HydrophobicContact CD2-CG 3.6Å; L458-K596 HydrophobicContact CG-CG 4.2Å; L458-R597 VanDerWaalsContact CD2-O 3.31Å; L458-R597 WeakPolarHBondContact CD2-O 3.05Å
459	T	54.7	Low	49.2	Very low	64 Å²	64	87.2 Å²	87.2	39%	0.393	49%	0.491	S	S	.	.			trans	-69.3	108.5	166.9	-49.1	0	0	0	0	107.5	N457 H461 P509	N457-T459 PolarHBondContact O-N 3.06Å; T459-H461 PolarHBondContact O-CD2 3.3Å; T459-H461 PolarHBondContact O-N 3.06Å; T459-P509 HydrophobicContact CG2-CG 3.75Å
460	E	61.7	Low	51.3	Low	106 Å²	106	84 Å²	84	50%	0.495	48%	0.476	S	S	.	.			trans	-75.3	114.6	174.9	-71.6	-175.5	167.4	0	0	108.9	L458 P509 L594	L458-E460 PolarHBondContact O-N 3.2Å; L458-E460 VanDerWaalsContact O-N 3.13Å; E460-P509 WeakPolarHBondContact O-CD 3.3Å; E460-L594 HydrophobicContact CB-CD2 3.61Å; E460-L594 HydrophobicContact CG-CD2 3.75Å; E460-L594 WeakPolarHBondContact OE2-CD2 3.48Å
461	H	67.1	Low	53.3	Low	5 Å²	5	85.1 Å²	85.1	2%	0.023	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	132.2	172.8	-58.3	-95.5	0	0	0	109.3	T459 W507 P509 T510 L511 I595	T459-H461 PolarHBondContact O-CD2 3.3Å; T459-H461 PolarHBondContact O-N 3.06Å; H461-W507 HydrophobicContact CB-CE3 3.97Å; H461-P509 PolarHBondContact ND1-O 3.16Å; H461-T510 PolarHBondContact CE1-O 3.24Å; H461-T510 PolarHBondContact ND1-O 3.5Å; H461-L511 HydrophobicContact CB-CD2 3.86Å; H461-I595 HydrophobicContact CB-CB 4.2Å; H461-I595 PolarHBondContact O-N 3.3Å
462	V	73.6	Confident	55.5	Low	47 Å²	47	87 Å²	87	29%	0.285	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	132.1	-177.3	176.7	0	0	0	0	109.7	K464 W507 S508 S592	V462-K464 PolarHBondContact O-N 3.35Å; V462-W507 CarbonylContact O-C 3.39Å; V462-W507 WeakPolarHBondContact O-CA 3.46Å; V462-S508 PolarHBondContact N-O 3.48Å; V462-S508 PolarHBondContact O-N 2.85Å; V462-S592 VanDerWaalsContact CG2-CB 3.48Å
463	V	74.5	Confident	57.9	Low	14 Å²	14	82.5 Å²	82.5	9%	0.085	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	122.4	171.7	-173.7	0	0	0	0	109.5	L476 L492 F494 T505 F506 W507 M593	V463-L476 HydrophobicContact CB-CD1 4.3Å; V463-L476 HydrophobicContact CG1-CD1 4.19Å; V463-L476 HydrophobicContact CG1-CD2 4.3Å; V463-L476 HydrophobicContact CG2-CD2 4.48Å; V463-L492 HydrophobicContact CG2-CD2 4.09Å; V463-F494 HydrophobicContact CG1-CE2 3.51Å; V463-F494 HydrophobicContact CG1-CZ 3.39Å; V463-T505 HydrophobicContact CG1-CG2 3.98Å; V463-F506 CarbonylContact C-O 3.47Å; V463-F506 WeakPolarHBondContact CA-O 3.32Å; V463-W507 HydrophobicContact CG2-CD2 4.15Å; V463-W507 HydrophobicContact CG2-CE3 3.79Å; V463-W507 HydrophobicContact CG2-CH2 3.36Å; V463-W507 HydrophobicContact CG2-CZ2 3.72Å; V463-W507 HydrophobicContact CG2-CZ3 3.39Å; V463-M593 HydrophobicContact CG2-CB 3.96Å; V463-M593 HydrophobicContact CG2-SD 4.31Å
464	K	71.6	Confident	60.3	Low	109 Å²	109	79.6 Å²	79.6	47%	0.474	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	127.6	170.8	-68	-168.7	178.2	-176.8	0	109.2	V462 F494 F506 S508	V462-K464 PolarHBondContact O-N 3.35Å; K464-F494 VanDerWaalsContact O-CE2 3.29Å; K464-F494 WeakPolarHBondContact O-CE2 3.33Å; K464-F494 WeakPolarHBondContact O-CZ 3.19Å; K464-F506 HydrophobicContact CB-CB 4.42Å; K464-F506 PolarHBondContact N-O 3.09Å; K464-S508 WeakPolarHBondContact CE-OG 3.26Å
465	M	68.8	Low	62.4	Low	66 Å²	66	73.2 Å²	73.2	33%	0.325	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-57.8	141.4	165.6	-80.3	-68.7	-179.2	0	0	110.1	F494 C589	M465-F494 HydrophobicContact CE-CE1 4.06Å; M465-F494 HydrophobicContact SD-CD1 4.25Å; M465-F494 HydrophobicContact SD-CE1 3.44Å; M465-F494 WeakPolarHBondContact SD-CE1 3.32Å; M465-F494 HydrophobicContact SD-CZ 4Å; M465-C589 HydrophobicContact CE-CB 3.61Å; M465-C589 VanDerWaalsContact CE-O 3.25Å; M465-C589 WeakPolarHBondContact CE-O 3.16Å
466	P	66.2	Low	64.6	Low	13 Å²	13	69.6 Å²	69.6	8%	0.084	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-54.7	142.2	175	-20.4	30.8	0	0	0	110.1	I468 W474 F494	P466-I468 HydrophobicContact CB-CB 4.32Å; P466-I468 HydrophobicContact CB-CD1 4.47Å; P466-I468 HydrophobicContact CB-CG1 4.28Å; P466-I468 PolarHBondContact O-N 3.2Å; P466-I468 VanDerWaalsContact O-N 3.17Å; P466-W474 HydrophobicContact CG-CB 4.43Å; P466-W474 HydrophobicContact CG-CD2 4.23Å; P466-W474 HydrophobicContact CG-CG 4.2Å; P466-F494 HydrophobicContact CG-CB 4.17Å; P466-F494 HydrophobicContact CG-CD1 4.26Å; P466-F494 HydrophobicContact CG-CD2 3.76Å; P466-F494 HydrophobicContact CG-CE2 4.14Å; P466-F494 HydrophobicContact CG-CG 3.82Å
467	E	65.9	Low	66.8	Low	166 Å²	166	67.1 Å²	67.1	78%	0.776	34%	0.337	S	S	*	.	S	Bend	trans	-74.1	3.1	172.3	-66.6	-171.6	168.7	0	0	112.6	D469	E467-D469 PolarHBondContact O-N 3.37Å
468	I	63.5	Low	68.7	Low	94 Å²	94	60.9 Å²	60.9	48%	0.482	30%	0.304	S	S	.	.			trans	-79.4	114.3	-178.1	-53.1	173.1	0	0	0	109.5	P466 W474	P466-I468 HydrophobicContact CB-CB 4.32Å; P466-I468 HydrophobicContact CB-CD1 4.47Å; P466-I468 HydrophobicContact CB-CG1 4.28Å; P466-I468 PolarHBondContact O-N 3.2Å; P466-I468 VanDerWaalsContact O-N 3.17Å; I468-W474 HydrophobicContact CB-CZ2 4.24Å; I468-W474 HydrophobicContact CD1-CZ2 4.23Å; I468-W474 HydrophobicContact CG2-CZ2 4.04Å; I468-W474 PolarHBondContact O-NE1 2.74Å
469	D	61	Low	70.1	Confident	125 Å²	125	59.2 Å²	59.2	67%	0.668	30%	0.296	S	S	*	.	S	Bend	trans	-74	145.7	170.9	-81.1	-35.7	0	0	0	111.3	E467	E467-D469 PolarHBondContact O-N 3.37Å
470	P	65.4	Low	71.2	Confident	50 Å²	50	61.4 Å²	61.4	33%	0.325	30%	0.3	S	S	.	.			cis	-86.2	121.4	1.3	33.3	-34.8	0	0	0	112.2	D472 Q473	P470-D472 WeakPolarHBondContact CB-OD1 3.32Å; P470-D472 PolarHBondContact O-N 2.93Å; P470-D472 VanDerWaalsContact O-N 3.15Å; P470-Q473 HydrophobicContact CG-CB 4.34Å; P470-Q473 HydrophobicContact CG-CG 3.83Å; P470-Q473 VanDerWaalsContact CG-OE1 3.31Å; P470-Q473 PolarHBondContact O-N 3.36Å; P470-Q473 VanDerWaalsContact O-N 3.13Å
471	R	65.7	Low	71.8	Confident	134 Å²	134	57.9 Å²	57.9	51%	0.506	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-60.2	-26.1	-173.2	-69	-179.2	-175.8	-165.7	-3.6	114.6	Q473 W474	R471-Q473 PolarHBondContact O-N 3.29Å; R471-W474 PolarHBondContact O-N 2.97Å
472	D	70.3	Confident	72.1	Confident	133 Å²	133	60.7 Å²	60.7	71%	0.711	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-72	-10.2	179.6	58.2	-52.5	0	0	0	114	P470	P470-D472 WeakPolarHBondContact CB-OD1 3.32Å; P470-D472 PolarHBondContact O-N 2.93Å; P470-D472 VanDerWaalsContact O-N 3.15Å
473	Q	73.3	Confident	71.8	Confident	31 Å²	31	65.1 Å²	65.1	15%	0.145	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-94.1	-8.2	178.5	-66.2	177.3	10.9	0	0	113.6	P470 R471 N496 E497 R498	P470-Q473 HydrophobicContact CG-CB 4.34Å; P470-Q473 HydrophobicContact CG-CG 3.83Å; P470-Q473 VanDerWaalsContact CG-OE1 3.31Å; P470-Q473 PolarHBondContact O-N 3.36Å; P470-Q473 VanDerWaalsContact O-N 3.13Å; R471-Q473 PolarHBondContact O-N 3.29Å; Q473-N496 CarbonylContact O-C 3.5Å; Q473-N496 VanDerWaalsContact O-CA 3.32Å; Q473-N496 WeakPolarHBondContact O-CA 3.32Å; Q473-E497 PolarHBondContact O-N 2.75Å; Q473-R498 HydrophobicContact CG-CG 4.28Å
474	W	74.9	Confident	71.4	Confident	15 Å²	15	73.1 Å²	73.1	6%	0.057	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	124.8	-177.3	-65.2	94.6	0	0	0	111.4	P466 I468 R471 F494 L495 N496 D501 A503	P466-W474 HydrophobicContact CG-CB 4.43Å; P466-W474 HydrophobicContact CG-CD2 4.23Å; P466-W474 HydrophobicContact CG-CG 4.2Å; I468-W474 HydrophobicContact CB-CZ2 4.24Å; I468-W474 HydrophobicContact CD1-CZ2 4.23Å; I468-W474 HydrophobicContact CG2-CZ2 4.04Å; I468-W474 PolarHBondContact O-NE1 2.74Å; R471-W474 PolarHBondContact O-N 2.97Å; W474-F494 HydrophobicContact CB-CD1 4.4Å; W474-F494 HydrophobicContact CE3-CB 3.88Å; W474-F494 HydrophobicContact CZ3-CB 4.45Å; W474-L495 CarbonylContact C-O 3.56Å; W474-L495 WeakPolarHBondContact CA-O 3.28Å; W474-N496 HydrophobicContact CD2-CB 4.02Å; W474-N496 HydrophobicContact CE3-CB 3.82Å; W474-N496 HydrophobicContact CH2-CB 3.88Å; W474-N496 HydrophobicContact CZ2-CB 4.05Å; W474-N496 HydrophobicContact CZ3-CB 3.75Å; W474-D501 HydrophobicContact CH2-CB 4.02Å; W474-D501 WeakPolarHBondContact CZ3-O 3.4Å; W474-A503 HydrophobicContact CE3-CB 4.2Å; W474-A503 HydrophobicContact CH2-CB 3.85Å; W474-A503 HydrophobicContact CZ3-CB 3.52Å
475	V	76.1	Confident	71.1	Confident	17 Å²	17	71.5 Å²	71.5	10%	0.103	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	143	177.2	-65.2	0	0	0	0	111.4	F494 L495 E497	V475-F494 CarbonylContact O-C 3.58Å; V475-F494 WeakPolarHBondContact O-CA 3.38Å; V475-L495 HydrophobicContact CG2-CB 4.27Å; V475-L495 PolarHBondContact N-O 3.23Å; V475-L495 PolarHBondContact O-N 3.49Å; V475-E497 HydrophobicContact CG1-CG 4.06Å; V475-E497 WeakPolarHBondContact CG1-OE1 3.49Å; V475-E497 HydrophobicContact CG2-CG 3.72Å
476	L	79.2	Confident	71	Confident	18 Å²	18	76 Å²	76	9%	0.094	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	128.9	174.5	-99.7	141.7	0	0	0	110.2	V463 L492 F494 T505	V463-L476 HydrophobicContact CB-CD1 4.3Å; V463-L476 HydrophobicContact CG1-CD1 4.19Å; V463-L476 HydrophobicContact CG1-CD2 4.3Å; V463-L476 HydrophobicContact CG2-CD2 4.48Å; L476-L492 HydrophobicContact CD2-CD1 3.69Å; L476-L492 HydrophobicContact CD2-CD2 3.56Å; L476-L492 HydrophobicContact CD2-CG 3.54Å; L476-F494 HydrophobicContact CD1-CE1 3.67Å; L476-F494 HydrophobicContact CD1-CZ 3.92Å; L476-F494 HydrophobicContact CD2-CE1 4.46Å; L476-F494 HydrophobicContact CG-CD1 3.98Å; L476-F494 HydrophobicContact CG-CE1 3.53Å; L476-F494 HydrophobicContact CG-CZ 3.98Å; L476-T505 HydrophobicContact CD2-CG2 4.04Å
477	F	79	Confident	71.3	Confident	29 Å²	29	76.5 Å²	76.5	13%	0.127	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	168.6	179.4	84.6	-64.5	0	0	0	111.6	A479 A493 L495 I502 P581	F477-A479 HydrophobicContact CE2-CB 4.13Å; F477-A479 HydrophobicContact CZ-CB 3.92Å; F477-A493 HydrophobicContact CD1-CB 4.22Å; F477-A493 WeakPolarHBondContact CD1-O 3.49Å; F477-A493 HydrophobicContact CE1-CB 3.59Å; F477-A493 HydrophobicContact CZ-CB 4.17Å; F477-A493 PolarHBondContact N-O 3.34Å; F477-A493 PolarHBondContact O-N 3.15Å; F477-A493 VanDerWaalsContact O-O 3.14Å; F477-L495 HydrophobicContact CD1-CB 3.48Å; F477-L495 VanDerWaalsContact CD1-CB 3.48Å; F477-L495 HydrophobicContact CE1-CB 3.53Å; F477-L495 HydrophobicContact CG-CB 4.08Å; F477-L495 HydrophobicContact CZ-CB 4.14Å; F477-I502 HydrophobicContact CE1-CG1 4.49Å; F477-I502 HydrophobicContact CE1-CG2 4.17Å; F477-I502 HydrophobicContact CZ-CD1 4.06Å; F477-I502 HydrophobicContact CZ-CG1 4.03Å; F477-I502 HydrophobicContact CZ-CG2 4.13Å; F477-P581 HydrophobicContact CD2-CG 4.41Å
478	W	80.7	Confident	71.7	Confident	2 Å²	2	69.9 Å²	69.9	1%	0.008	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	109.2	172.2	-66.4	108.6	0	0	0	109.7	H491 L492 L521 A524 P525 L527 V537 V553 P555 P581	W478-H491 CarbonylContact C-O 3.52Å; W478-H491 WeakPolarHBondContact CA-O 3.42Å; W478-L492 HydrophobicContact CD2-CD1 4.31Å; W478-L492 HydrophobicContact CE3-CB 4.26Å; W478-L492 HydrophobicContact CE3-CD1 4.21Å; W478-L492 HydrophobicContact CH2-CB 4.44Å; W478-L492 HydrophobicContact CH2-CD1 4.05Å; W478-L492 HydrophobicContact CZ2-CD1 4.15Å; W478-L492 HydrophobicContact CZ3-CB 3.89Å; W478-L492 HydrophobicContact CZ3-CD1 4.08Å; W478-L521 HydrophobicContact CH2-CD1 3.93Å; W478-L521 HydrophobicContact CZ2-CD1 4.24Å; W478-A524 HydrophobicContact CZ2-CB 4.2Å; W478-P525 PolarHBondContact NE1-O 3.22Å; W478-L527 HydrophobicContact CB-CD1 3.37Å; W478-L527 HydrophobicContact CD2-CD1 4.28Å; W478-L527 HydrophobicContact CG-CB 4.47Å; W478-L527 HydrophobicContact CG-CD1 3.46Å; W478-L527 VanDerWaalsContact CG-CD1 3.46Å; W478-V537 HydrophobicContact CH2-CG1 4.07Å; W478-V537 HydrophobicContact CZ2-CB 3.72Å; W478-V537 HydrophobicContact CZ2-CG1 3.67Å; W478-V537 HydrophobicContact CZ2-CG2 3.88Å; W478-V553 WeakPolarHBondContact CZ3-O 3.46Å; W478-P555 HydrophobicContact CD2-CB 4.35Å; W478-P555 HydrophobicContact CD2-CG 4.24Å; W478-P555 HydrophobicContact CE3-CB 4.05Å; W478-P555 HydrophobicContact CE3-CG 3.74Å; W478-P555 HydrophobicContact CH2-CB 3.75Å; W478-P555 HydrophobicContact CH2-CG 4.32Å; W478-P555 HydrophobicContact CZ2-CB 4.05Å; W478-P555 HydrophobicContact CZ3-CB 3.74Å; W478-P555 HydrophobicContact CZ3-CG 3.79Å; W478-P581 WeakPolarHBondContact O-CG 3.23Å
479	A	79.4	Confident	72.3	Confident	6 Å²	6	66.7 Å²	66.7	5%	0.05	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	143.7	174.7	0	0	0	0	0	111.1	F477 S490 H491 A493	F477-A479 HydrophobicContact CE2-CB 4.13Å; F477-A479 HydrophobicContact CZ-CB 3.92Å; A479-S490 WeakPolarHBondContact O-CA 3.32Å; A479-S490 WeakPolarHBondContact O-CB 3.45Å; A479-H491 PolarHBondContact N-O 3.5Å; A479-H491 PolarHBondContact O-N 3.07Å; A479-A493 HydrophobicContact CB-CB 3.93Å
480	K	77.2	Confident	73	Confident	110 Å²	110	60.8 Å²	60.8	48%	0.478	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-66.6	153	174.9	66.5	-175.4	175.3	-167.4	0	111.4	N482 E580	K480-N482 PolarHBondContact O-N 3.46Å; K480-E580 IonicContact NZ-OE1 3.15Å
481	P	75.4	Confident	73.8	Confident	31 Å²	31	59 Å²	59	20%	0.201	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-51.3	131.6	168.6	-26.4	35.3	0	0	0	111.2	R487 P488 I576 S577	P481-R487 CarbonylContact C-O 3.47Å; P481-R487 WeakPolarHBondContact CA-O 3.42Å; P481-P488 WeakPolarHBondContact CB-O 3.02Å; P481-I576 HydrophobicContact CG-CG2 4.01Å; P481-S577 WeakPolarHBondContact CD-O 3.38Å
482	N	73.5	Confident	74.6	Confident	65 Å²	65	52.7 Å²	52.7	35%	0.348	26%	0.262	S	S	.	.	B	Isolated β-bridge	trans	-128.2	101.4	174.8	-171.6	-9.8	0	0	0	110	K480 H484 T485 K486 R487	K480-N482 PolarHBondContact O-N 3.46Å; N482-H484 PolarHBondContact O-N 3.39Å; N482-H484 WeakPolarHBondContact OD1-CB 3.28Å; N482-H484 PolarHBondContact OD1-N 3.48Å; N482-T485 WeakPolarHBondContact CB-OG1 3.23Å; N482-T485 PolarHBondContact O-N 3.35Å; N482-T485 PolarHBondContact O-OG1 3.37Å; N482-K486 PolarHBondContact O-N 2.8Å; N482-R487 CarbonylContact C-O 3.55Å; N482-R487 PolarHBondContact N-O 3.11Å; N482-R487 PolarHBondContact O-N 2.67Å
483	L	65.4	Low	75.1	Confident	139 Å²	139	46.4 Å²	46.4	73%	0.728	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-62.7	-27.6	178	-68.1	170.5	0	0	0	112.3	K486 P488	L483-K486 PolarHBondContact O-N 2.94Å; L483-P488 HydrophobicContact CD2-CB 4.1Å
484	H	66	Low	75.5	Confident	182 Å²	182	45 Å²	45	84%	0.843	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-68.1	-34.9	178.4	-67.5	-31.5	0	0	0	112.7	N482 K486	N482-H484 PolarHBondContact O-N 3.39Å; N482-H484 WeakPolarHBondContact OD1-CB 3.28Å; N482-H484 PolarHBondContact OD1-N 3.48Å; H484-K486 VanDerWaalsContact C-N 3.27Å
485	T	66.1	Low	75.7	Confident	76 Å²	76	45.5 Å²	45.5	47%	0.466	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-90.3	12.1	175.4	57.9	0	0	0	0	112.5	N482 R487	N482-T485 WeakPolarHBondContact CB-OG1 3.23Å; N482-T485 PolarHBondContact O-N 3.35Å; N482-T485 PolarHBondContact O-OG1 3.37Å; T485-R487 PolarHBondContact O-N 3.43Å
486	K	66.5	Low	75.9	Confident	161 Å²	161	45 Å²	45	70%	0.7	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.5	33.6	-174.3	-57.7	-177	177.6	-177.8	0	113.4	N482 L483 H484 P488	N482-K486 PolarHBondContact O-N 2.8Å; L483-K486 PolarHBondContact O-N 2.94Å; H484-K486 VanDerWaalsContact C-N 3.27Å; K486-P488 VanDerWaalsContact O-CD 3.28Å; K486-P488 WeakPolarHBondContact O-CD 3.36Å
487	R	73.9	Confident	75.7	Confident	22 Å²	22	48.6 Å²	48.6	8%	0.083	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-111.4	83.4	174.1	-70.2	-173.9	173.3	151.9	14	109.3	P481 N482 T485 Y489 H491 E504 S545 D552	P481-R487 CarbonylContact C-O 3.47Å; P481-R487 WeakPolarHBondContact CA-O 3.42Å; N482-R487 CarbonylContact C-O 3.55Å; N482-R487 PolarHBondContact N-O 3.11Å; N482-R487 PolarHBondContact O-N 2.67Å; T485-R487 PolarHBondContact O-N 3.43Å; R487-Y489 PolarHBondContact O-N 2.93Å; R487-H491 VanDerWaalsContact CD-CE1 3.49Å; R487-H491 WeakPolarHBondContact CD-CE1 3.37Å; R487-H491 PolarHBondContact NH1-NE2 2.75Å; R487-H491 VanDerWaalsContact NH1-NE2 3.18Å; R487-E504 IonicContact CZ-OE1 3.63Å; R487-E504 IonicContact NH1-OE1 3.66Å; R487-E504 PolarHBondContact NH1-OE1 2.72Å; R487-E504 IonicContact NH2-OE1 2.82Å; R487-E504 PolarHBondContact NH2-OE1 2.95Å; R487-S545 PolarHBondContact NH2-OG 3.18Å; R487-D552 WeakPolarHBondContact CD-OD2 2.96Å; R487-D552 IonicContact CZ-OD1 3.04Å; R487-D552 IonicContact CZ-OD2 3.39Å; R487-D552 IonicContact NE-OD1 3.52Å; R487-D552 PolarHBondContact NE-OD1 2.77Å; R487-D552 IonicContact NE-OD2 3.98Å; R487-D552 PolarHBondContact NE-OD2 3.48Å; R487-D552 IonicContact NH1-OD1 3.84Å; R487-D552 IonicContact NH2-OD1 3.99Å; R487-D552 IonicContact NH2-OD2 3.57Å
488	P	73.4	Confident	75.5	Confident	27 Å²	27	56.9 Å²	56.9	18%	0.175	27%	0.269	C	S	.	.			trans	-78.2	-0.4	-173.5	34.4	-38.5	0	0	0	114.2	P481 L483 K486 E571	P481-P488 WeakPolarHBondContact CB-O 3.02Å; L483-P488 HydrophobicContact CD2-CB 4.1Å; K486-P488 VanDerWaalsContact O-CD 3.28Å; K486-P488 WeakPolarHBondContact O-CD 3.36Å; P488-E571 WeakPolarHBondContact CB-OE1 3.17Å; P488-E571 HydrophobicContact CG-CG 4.44Å; P488-E571 WeakPolarHBondContact CG-OE1 3.42Å
489	Y	76.5	Confident	75.3	Confident	27 Å²	27	59.9 Å²	59.9	11%	0.106	29%	0.29	C	S	.	.	S	Bend	trans	-117.9	160.2	178.6	39.7	-103.2	0	0	0	111.8	R487 H491 V543 D552 V554 F565	R487-Y489 PolarHBondContact O-N 2.93Å; Y489-H491 HydrophobicContact CD2-CB 4.48Å; Y489-V543 HydrophobicContact CE2-CG2 4.13Å; Y489-V543 WeakPolarHBondContact OH-CG2 3.27Å; Y489-D552 HydrophobicContact CE2-CB 4.25Å; Y489-V554 HydrophobicContact CD2-CB 4.38Å; Y489-V554 HydrophobicContact CD2-CG1 4.05Å; Y489-V554 HydrophobicContact CD2-CG2 3.46Å; Y489-V554 VanDerWaalsContact CD2-CG2 3.46Å; Y489-V554 HydrophobicContact CE2-CG2 3.54Å; Y489-V554 HydrophobicContact CG-CG1 3.94Å; Y489-V554 HydrophobicContact CG-CG2 4.03Å; Y489-F565 HydrophobicContact CD1-CZ 4.34Å
490	S	76.2	Confident	75.1	Confident	2 Å²	2	61.9 Å²	61.9	1%	0.014	31%	0.311	C	S	.	.			trans	-65.8	142.5	168	-62.3	0	0	0	0	109.7	A479 P555 S577	A479-S490 WeakPolarHBondContact O-CA 3.32Å; A479-S490 WeakPolarHBondContact O-CB 3.45Å; S490-P555 WeakPolarHBondContact O-CD 3.23Å; S490-S577 PolarHBondContact OG-N 3.19Å
491	H	81.6	Confident	75.2	Confident	11 Å²	11	61.1 Å²	61.1	5%	0.051	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	158.9	-178.4	62.3	-75	0	0	0	111.6	W478 A479 R487 Y489 D552 V553	W478-H491 CarbonylContact C-O 3.52Å; W478-H491 WeakPolarHBondContact CA-O 3.42Å; A479-H491 PolarHBondContact N-O 3.5Å; A479-H491 PolarHBondContact O-N 3.07Å; R487-H491 VanDerWaalsContact CD-CE1 3.49Å; R487-H491 WeakPolarHBondContact CD-CE1 3.37Å; R487-H491 PolarHBondContact NH1-NE2 2.75Å; R487-H491 VanDerWaalsContact NH1-NE2 3.18Å; Y489-H491 HydrophobicContact CD2-CB 4.48Å; H491-D552 HydrophobicContact CB-CB 4.14Å; H491-D552 IonicContact CD2-OD1 3.37Å; H491-V553 WeakPolarHBondContact CA-O 3.47Å
492	L	82.3	Confident	75.3	Confident	2 Å²	2	65 Å²	65	1%	0.01	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	124.4	-178	-165.9	79.1	0	0	0	112.1	V463 L476 W478 T505 W507 P525 V553 M593	V463-L492 HydrophobicContact CG2-CD2 4.09Å; L476-L492 HydrophobicContact CD2-CD1 3.69Å; L476-L492 HydrophobicContact CD2-CD2 3.56Å; L476-L492 HydrophobicContact CD2-CG 3.54Å; W478-L492 HydrophobicContact CD2-CD1 4.31Å; W478-L492 HydrophobicContact CE3-CB 4.26Å; W478-L492 HydrophobicContact CE3-CD1 4.21Å; W478-L492 HydrophobicContact CH2-CB 4.44Å; W478-L492 HydrophobicContact CH2-CD1 4.05Å; W478-L492 HydrophobicContact CZ2-CD1 4.15Å; W478-L492 HydrophobicContact CZ3-CB 3.89Å; W478-L492 HydrophobicContact CZ3-CD1 4.08Å; L492-T505 HydrophobicContact CD2-CG2 4.1Å; L492-T505 HydrophobicContact CG-CG2 4.12Å; L492-T505 PolarHBondContact O-OG1 3.45Å; L492-W507 HydrophobicContact CD2-CH2 4.05Å; L492-W507 HydrophobicContact CD2-CZ2 3.89Å; L492-P525 HydrophobicContact CD1-CG 3.93Å; L492-V553 HydrophobicContact CB-CB 4.16Å; L492-V553 PolarHBondContact N-O 3.38Å; L492-M593 HydrophobicContact CD1-CE 4.41Å; L492-M593 HydrophobicContact CD1-SD 4.08Å; L492-M593 HydrophobicContact CD2-CE 3.71Å; L492-M593 HydrophobicContact CD2-SD 3.32Å; L492-M593 WeakPolarHBondContact CD2-SD 3.19Å; L492-M593 HydrophobicContact CG-SD 4.33Å
493	A	81.2	Confident	75.4	Confident	2 Å²	2	62.8 Å²	62.8	2%	0.017	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	171.5	-179.1	0	0	0	0	0	112	F477 A479 I502	F477-A493 HydrophobicContact CD1-CB 4.22Å; F477-A493 WeakPolarHBondContact CD1-O 3.49Å; F477-A493 HydrophobicContact CE1-CB 3.59Å; F477-A493 HydrophobicContact CZ-CB 4.17Å; F477-A493 PolarHBondContact N-O 3.34Å; F477-A493 PolarHBondContact O-N 3.15Å; F477-A493 VanDerWaalsContact O-O 3.14Å; A479-A493 HydrophobicContact CB-CB 3.93Å; A493-I502 HydrophobicContact CB-CG2 3.98Å
494	F	81	Confident	75.9	Confident	1 Å²	1	58.6 Å²	58.6	0%	0.004	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	133.8	169.4	-77.2	-73.8	0	0	0	110.3	V463 K464 M465 P466 W474 V475 L476 I502 A503 T505	V463-F494 HydrophobicContact CG1-CE2 3.51Å; V463-F494 HydrophobicContact CG1-CZ 3.39Å; K464-F494 VanDerWaalsContact O-CE2 3.29Å; K464-F494 WeakPolarHBondContact O-CE2 3.33Å; K464-F494 WeakPolarHBondContact O-CZ 3.19Å; M465-F494 HydrophobicContact CE-CE1 4.06Å; M465-F494 HydrophobicContact SD-CD1 4.25Å; M465-F494 HydrophobicContact SD-CE1 3.44Å; M465-F494 WeakPolarHBondContact SD-CE1 3.32Å; M465-F494 HydrophobicContact SD-CZ 4Å; P466-F494 HydrophobicContact CG-CB 4.17Å; P466-F494 HydrophobicContact CG-CD1 4.26Å; P466-F494 HydrophobicContact CG-CD2 3.76Å; P466-F494 HydrophobicContact CG-CE2 4.14Å; P466-F494 HydrophobicContact CG-CG 3.82Å; W474-F494 HydrophobicContact CB-CD1 4.4Å; W474-F494 HydrophobicContact CE3-CB 3.88Å; W474-F494 HydrophobicContact CZ3-CB 4.45Å; V475-F494 CarbonylContact O-C 3.58Å; V475-F494 WeakPolarHBondContact O-CA 3.38Å; L476-F494 HydrophobicContact CD1-CE1 3.67Å; L476-F494 HydrophobicContact CD1-CZ 3.92Å; L476-F494 HydrophobicContact CD2-CE1 4.46Å; L476-F494 HydrophobicContact CG-CD1 3.98Å; L476-F494 HydrophobicContact CG-CE1 3.53Å; L476-F494 HydrophobicContact CG-CZ 3.98Å; F494-I502 CarbonylContact O-C 3.45Å; F494-I502 VanDerWaalsContact O-CA 3.3Å; F494-I502 WeakPolarHBondContact O-CA 3.28Å; F494-A503 HydrophobicContact CB-CB 4.16Å; F494-A503 PolarHBondContact N-O 3.29Å; F494-A503 PolarHBondContact O-N 3.24Å; F494-T505 HydrophobicContact CD2-CG2 3.74Å; F494-T505 HydrophobicContact CE2-CG2 3.75Å
495	L	79.2	Confident	76.4	Confident	25 Å²	25	50.3 Å²	50.3	13%	0.131	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	132.9	173	177.6	66.5	0	0	0	109.1	W474 V475 F477 D501 I502 E583	W474-L495 CarbonylContact C-O 3.56Å; W474-L495 WeakPolarHBondContact CA-O 3.28Å; V475-L495 HydrophobicContact CG2-CB 4.27Å; V475-L495 PolarHBondContact N-O 3.23Å; V475-L495 PolarHBondContact O-N 3.49Å; F477-L495 HydrophobicContact CD1-CB 3.48Å; F477-L495 VanDerWaalsContact CD1-CB 3.48Å; F477-L495 HydrophobicContact CE1-CB 3.53Å; F477-L495 HydrophobicContact CG-CB 4.08Å; F477-L495 HydrophobicContact CZ-CB 4.14Å; L495-D501 CarbonylContact C-O 3.58Å; L495-D501 WeakPolarHBondContact CA-O 2.92Å; L495-I502 HydrophobicContact CD1-CG1 4.04Å; L495-E583 HydrophobicContact CD2-CG 4.49Å
496	N	81.1	Confident	76.7	Confident	8 Å²	8	51.9 Å²	51.9	4%	0.043	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	111.7	166.9	-172.9	-54.9	0	0	0	109.4	Q473 W474 R498 S499 G500 D501	Q473-N496 CarbonylContact O-C 3.5Å; Q473-N496 VanDerWaalsContact O-CA 3.32Å; Q473-N496 WeakPolarHBondContact O-CA 3.32Å; W474-N496 HydrophobicContact CD2-CB 4.02Å; W474-N496 HydrophobicContact CE3-CB 3.82Å; W474-N496 HydrophobicContact CH2-CB 3.88Å; W474-N496 HydrophobicContact CZ2-CB 4.05Å; W474-N496 HydrophobicContact CZ3-CB 3.75Å; N496-R498 PolarHBondContact O-N 3.4Å; N496-R498 VanDerWaalsContact O-N 3.13Å; N496-R498 PolarHBondContact OD1-N 2.94Å; N496-S499 VanDerWaalsContact CB-OG 3.31Å; N496-S499 WeakPolarHBondContact CB-OG 3.13Å; N496-S499 PolarHBondContact OD1-N 2.86Å; N496-S499 PolarHBondContact OD1-OG 3.21Å; N496-G500 WeakPolarHBondContact O-CA 3.38Å; N496-G500 PolarHBondContact O-N 2.83Å; N496-D501 HydrophobicContact CB-CB 4.25Å; N496-D501 PolarHBondContact N-O 2.7Å
497	E	74.5	Confident	77.1	Confident	93 Å²	93	45 Å²	45	44%	0.435	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-24.2	-176	-67	-172.3	156.1	0	0	113.3	Q473 V475	Q473-E497 PolarHBondContact O-N 2.75Å; V475-E497 HydrophobicContact CG1-CG 4.06Å; V475-E497 WeakPolarHBondContact CG1-OE1 3.49Å; V475-E497 HydrophobicContact CG2-CG 3.72Å
498	R	74.3	Confident	76.7	Confident	203 Å²	203	46.3 Å²	46.3	77%	0.766	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-45.7	-179.3	-76.5	-157.8	-175.7	179	-0.1	113.8	Q473 N496	Q473-R498 HydrophobicContact CG-CG 4.28Å; N496-R498 PolarHBondContact O-N 3.4Å; N496-R498 VanDerWaalsContact O-N 3.13Å; N496-R498 PolarHBondContact OD1-N 2.94Å
499	S	77.1	Confident	76.5	Confident	64 Å²	64	48.2 Å²	48.2	45%	0.448	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-20.9	-176.3	62.8	0	0	0	0	113	N496 D501	N496-S499 VanDerWaalsContact CB-OG 3.31Å; N496-S499 WeakPolarHBondContact CB-OG 3.13Å; N496-S499 PolarHBondContact OD1-N 2.86Å; N496-S499 PolarHBondContact OD1-OG 3.21Å; S499-D501 WeakPolarHBondContact CB-OD2 3.27Å; S499-D501 WeakPolarHBondContact OG-CB 2.98Å; S499-D501 PolarHBondContact OG-N 2.79Å; S499-D501 PolarHBondContact OG-OD2 3.41Å
500	G	74.2	Confident	76.1	Confident	48 Å²	48	52.1 Å²	52.1	50%	0.495	28%	0.282	S	S	.	.			trans	75.4	8.3	-169.6	0	0	0	0	0	113.3	N496	N496-G500 WeakPolarHBondContact O-CA 3.38Å; N496-G500 PolarHBondContact O-N 2.83Å
501	D	79.7	Confident	75.7	Confident	95 Å²	95	52.2 Å²	52.2	51%	0.508	28%	0.283	S	S	.	.			trans	-70	142.4	179.3	-65.7	-39.4	0	0	0	111.2	W474 L495 N496 S499	W474-D501 HydrophobicContact CH2-CB 4.02Å; W474-D501 WeakPolarHBondContact CZ3-O 3.4Å; L495-D501 CarbonylContact C-O 3.58Å; L495-D501 WeakPolarHBondContact CA-O 2.92Å; N496-D501 HydrophobicContact CB-CB 4.25Å; N496-D501 PolarHBondContact N-O 2.7Å; S499-D501 WeakPolarHBondContact CB-OD2 3.27Å; S499-D501 WeakPolarHBondContact OG-CB 2.98Å; S499-D501 PolarHBondContact OG-N 2.79Å; S499-D501 PolarHBondContact OG-OD2 3.41Å
502	I	76.8	Confident	74.8	Confident	111 Å²	111	52.7 Å²	52.7	57%	0.569	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110	130.6	177.9	-59.5	171.4	0	0	0	109	F477 A493 F494 L495	F477-I502 HydrophobicContact CE1-CG1 4.49Å; F477-I502 HydrophobicContact CE1-CG2 4.17Å; F477-I502 HydrophobicContact CZ-CD1 4.06Å; F477-I502 HydrophobicContact CZ-CG1 4.03Å; F477-I502 HydrophobicContact CZ-CG2 4.13Å; A493-I502 HydrophobicContact CB-CG2 3.98Å; F494-I502 CarbonylContact O-C 3.45Å; F494-I502 VanDerWaalsContact O-CA 3.3Å; F494-I502 WeakPolarHBondContact O-CA 3.28Å; L495-I502 HydrophobicContact CD1-CG1 4.04Å
503	A	75.7	Confident	73.7	Confident	19 Å²	19	58.2 Å²	58.2	16%	0.157	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	153	175.5	0	0	0	0	0	111.4	W474 F494	W474-A503 HydrophobicContact CE3-CB 4.2Å; W474-A503 HydrophobicContact CH2-CB 3.85Å; W474-A503 HydrophobicContact CZ3-CB 3.52Å; F494-A503 HydrophobicContact CB-CB 4.16Å; F494-A503 PolarHBondContact N-O 3.29Å; F494-A503 PolarHBondContact O-N 3.24Å
504	E	77	Confident	72.7	Confident	51 Å²	51	63.1 Å²	63.1	24%	0.238	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	156.7	178.9	-60.8	-165.7	149.7	0	0	112.6	R487 H550	R487-E504 IonicContact CZ-OE1 3.63Å; R487-E504 IonicContact NH1-OE1 3.66Å; R487-E504 PolarHBondContact NH1-OE1 2.72Å; R487-E504 IonicContact NH2-OE1 2.82Å; R487-E504 PolarHBondContact NH2-OE1 2.95Å; E504-H550 IonicContact OE2-CD2 3.67Å; E504-H550 PolarHBondContact OE2-CD2 3.42Å; E504-H550 IonicContact OE2-CE1 2.85Å; E504-H550 PolarHBondContact OE2-CE1 3.4Å; E504-H550 VanDerWaalsContact OE2-CE1 3.28Å; E504-H550 IonicContact OE2-CG 3.58Å; E504-H550 IonicContact OE2-ND1 3.46Å; E504-H550 PolarHBondContact OE2-ND1 3.29Å; E504-H550 IonicContact OE2-NE2 2.72Å
505	T	75.2	Confident	71.8	Confident	9 Å²	9	64.6 Å²	64.6	6%	0.055	36%	0.355	C	S	.	.			trans	-89.5	133.5	178.4	52.1	0	0	0	0	111.6	V463 L476 L492 F494	V463-T505 HydrophobicContact CG1-CG2 3.98Å; L476-T505 HydrophobicContact CD2-CG2 4.04Å; L492-T505 HydrophobicContact CD2-CG2 4.1Å; L492-T505 HydrophobicContact CG-CG2 4.12Å; L492-T505 PolarHBondContact O-OG1 3.45Å; F494-T505 HydrophobicContact CD2-CG2 3.74Å; F494-T505 HydrophobicContact CE2-CG2 3.75Å
506	F	74.1	Confident	71.1	Confident	109 Å²	109	66.8 Å²	66.8	48%	0.478	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	148.1	173.8	-66.1	-89.7	0	0	0	109.9	V463 K464 H550	V463-F506 CarbonylContact C-O 3.47Å; V463-F506 WeakPolarHBondContact CA-O 3.32Å; K464-F506 HydrophobicContact CB-CB 4.42Å; K464-F506 PolarHBondContact N-O 3.09Å; F506-H550 AromaticContact CE1-CE1 3.42Å; F506-H550 VanDerWaalsContact CE1-CE1 3.42Å; F506-H550 WeakPolarHBondContact CE1-CE1 3.43Å; F506-H550 AromaticContact CE1-ND1 3.91Å; F506-H550 AromaticContact CZ-CE1 3.57Å
507	W	73.4	Confident	70.3	Confident	15 Å²	15	66.9 Å²	66.9	6%	0.057	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	146.1	-172.2	-60	82	0	0	0	112.3	H461 V462 V463 L492 P509 T510 L511 V553 M593 I595	H461-W507 HydrophobicContact CB-CE3 3.97Å; V462-W507 CarbonylContact O-C 3.39Å; V462-W507 WeakPolarHBondContact O-CA 3.46Å; V463-W507 HydrophobicContact CG2-CD2 4.15Å; V463-W507 HydrophobicContact CG2-CE3 3.79Å; V463-W507 HydrophobicContact CG2-CH2 3.36Å; V463-W507 HydrophobicContact CG2-CZ2 3.72Å; V463-W507 HydrophobicContact CG2-CZ3 3.39Å; L492-W507 HydrophobicContact CD2-CH2 4.05Å; L492-W507 HydrophobicContact CD2-CZ2 3.89Å; W507-P509 CarbonylContact C-O 3.56Å; W507-P509 CarbonylContact O-C 3.58Å; W507-T510 WeakPolarHBondContact O-CA 3.46Å; W507-T510 PolarHBondContact O-N 3.21Å; W507-L511 HydrophobicContact CB-CD1 4.38Å; W507-L511 HydrophobicContact CB-CD2 4.42Å; W507-L511 HydrophobicContact CB-CG 3.79Å; W507-L511 HydrophobicContact CD2-CD1 3.77Å; W507-L511 HydrophobicContact CD2-CD2 4.19Å; W507-L511 HydrophobicContact CD2-CG 3.94Å; W507-L511 HydrophobicContact CE3-CD2 4.36Å; W507-L511 HydrophobicContact CG-CD1 3.6Å; W507-L511 HydrophobicContact CG-CD2 4.21Å; W507-L511 HydrophobicContact CG-CG 3.54Å; W507-V553 HydrophobicContact CH2-CG2 4.05Å; W507-V553 HydrophobicContact CZ2-CB 4.39Å; W507-V553 HydrophobicContact CZ2-CG2 3.35Å; W507-M593 HydrophobicContact CH2-CE 4.01Å; W507-M593 HydrophobicContact CH2-CG 4.34Å; W507-M593 HydrophobicContact CH2-SD 4.06Å; W507-I595 HydrophobicContact CD2-CD1 4.28Å; W507-I595 HydrophobicContact CE3-CD1 3.75Å; W507-I595 HydrophobicContact CE3-CG1 4.49Å; W507-I595 HydrophobicContact CH2-CD1 3.51Å; W507-I595 HydrophobicContact CH2-CG1 4.1Å; W507-I595 HydrophobicContact CZ2-CD1 4.08Å; W507-I595 HydrophobicContact CZ3-CD1 3.32Å; W507-I595 HydrophobicContact CZ3-CG1 3.77Å
508	S	65.8	Low	70	Confident	50 Å²	50	63.3 Å²	63.3	35%	0.35	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	120.8	175.2	-154.4	0	0	0	0	111.6	V462 K464	V462-S508 PolarHBondContact N-O 3.48Å; V462-S508 PolarHBondContact O-N 2.85Å; K464-S508 WeakPolarHBondContact CE-OG 3.26Å
509	P	69.1	Low	69.8	Low	67 Å²	67	53.7 Å²	53.7	44%	0.435	32%	0.318	S	S	.	.	S	Bend	cis	-57.1	161.5	-14.9	26.3	-32.5	0	0	0	111	T459 E460 H461 W507 L511	T459-P509 HydrophobicContact CG2-CG 3.75Å; E460-P509 WeakPolarHBondContact O-CD 3.3Å; H461-P509 PolarHBondContact ND1-O 3.16Å; W507-P509 CarbonylContact C-O 3.56Å; W507-P509 CarbonylContact O-C 3.58Å; P509-L511 PolarHBondContact O-N 2.96Å
510	T	67.9	Low	69.8	Low	109 Å²	109	52.2 Å²	52.2	67%	0.669	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-53	142.4	178.9	-45	0	0	0	0	110.4	H461 W507	H461-T510 PolarHBondContact CE1-O 3.24Å; H461-T510 PolarHBondContact ND1-O 3.5Å; W507-T510 WeakPolarHBondContact O-CA 3.46Å; W507-T510 PolarHBondContact O-N 3.21Å
511	L	67.6	Low	69.9	Low	4 Å²	4	50.2 Å²	50.2	2%	0.021	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-61	145.4	174.5	-71.2	173.5	0	0	0	110.3	H461 W507 P509 Y517 V542 F551 I595	H461-L511 HydrophobicContact CB-CD2 3.86Å; W507-L511 HydrophobicContact CB-CD1 4.38Å; W507-L511 HydrophobicContact CB-CD2 4.42Å; W507-L511 HydrophobicContact CB-CG 3.79Å; W507-L511 HydrophobicContact CD2-CD1 3.77Å; W507-L511 HydrophobicContact CD2-CD2 4.19Å; W507-L511 HydrophobicContact CD2-CG 3.94Å; W507-L511 HydrophobicContact CE3-CD2 4.36Å; W507-L511 HydrophobicContact CG-CD1 3.6Å; W507-L511 HydrophobicContact CG-CD2 4.21Å; W507-L511 HydrophobicContact CG-CG 3.54Å; P509-L511 PolarHBondContact O-N 2.96Å; L511-Y517 WeakPolarHBondContact CD2-OH 3.19Å; L511-V542 HydrophobicContact CD1-CG1 3.88Å; L511-V542 HydrophobicContact CD1-CG2 4.43Å; L511-F551 HydrophobicContact CB-CD2 4.08Å; L511-F551 HydrophobicContact CD1-CB 4.16Å; L511-I595 HydrophobicContact CD1-CD1 4.32Å; L511-I595 HydrophobicContact CD2-CD1 3.54Å
512	P	63	Low	69.6	Low	22 Å²	22	50.9 Å²	50.9	14%	0.143	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-53.4	138.4	172.3	-18.1	19.9	0	0	0	112	I514 Y517 R597	P512-I514 PolarHBondContact O-N 2.99Å; P512-Y517 HydrophobicContact CB-CE1 4.39Å; P512-Y517 WeakPolarHBondContact CD-OH 3.34Å; P512-Y517 HydrophobicContact CG-CE1 4.43Å; P512-R597 VanDerWaalsContact CG-NE 3.27Å
513	T	60.1	Low	69.5	Low	118 Å²	118	49.4 Å²	49.4	72%	0.724	27%	0.27	S	S	*	.	S	Bend	trans	-75	-2.5	179.7	55.1	0	0	0	0	114.1	F551	T513-F551 HydrophobicContact CG2-CZ 4.43Å
514	I	59.5	Low	69.5	Low	105 Å²	105	49.3 Å²	49.3	54%	0.538	27%	0.27	S	S	.	.	S	Bend	trans	-95.8	100.5	177.5	-54.2	172	0	0	0	106.7	P512 Y517	P512-I514 PolarHBondContact O-N 2.99Å; I514-Y517 WeakPolarHBondContact O-CD1 3.07Å; I514-Y517 VanDerWaalsContact O-CE1 3.23Å; I514-Y517 WeakPolarHBondContact O-CE1 3.26Å
515	V	61.5	Low	69.4	Low	31 Å²	31	47.1 Å²	47.1	19%	0.188	26%	0.26	C	S	.	.			trans	-124	154.8	178.1	-77.7	0	0	0	0	109.5	Y517 V542 E544 F551	V515-Y517 HydrophobicContact CG1-CD1 3.95Å; V515-Y517 HydrophobicContact CG1-CE1 3.53Å; V515-V542 HydrophobicContact CG1-CB 4.28Å; V515-V542 HydrophobicContact CG1-CG1 3.68Å; V515-E544 HydrophobicContact CG2-CB 3.69Å; V515-E544 HydrophobicContact CG2-CG 4.44Å; V515-F551 HydrophobicContact CB-CD1 4.4Å; V515-F551 HydrophobicContact CB-CE1 4.4Å; V515-F551 HydrophobicContact CG1-CD1 3.67Å; V515-F551 HydrophobicContact CG1-CE1 3.86Å; V515-F551 HydrophobicContact CG2-CD1 3.9Å; V515-F551 HydrophobicContact CG2-CE1 3.58Å
516	P	64.6	Low	69.5	Low	72 Å²	72	50.7 Å²	50.7	47%	0.468	28%	0.276	S	S	.	.			cis	-87.6	157.3	4.3	36	-35.9	0	0	0	114.6	V541 V542 V543 L566	P516-V541 HydrophobicContact CB-CG1 4.05Å; P516-V542 WeakPolarHBondContact CA-O 3.22Å; P516-V542 VanDerWaalsContact CB-O 3.3Å; P516-V542 WeakPolarHBondContact CB-O 3.28Å; P516-V543 HydrophobicContact CB-CG1 4.13Å; P516-L566 HydrophobicContact CB-CD1 3.67Å; P516-L566 HydrophobicContact CG-CD1 3.75Å
517	Y	64.7	Low	69.6	Low	9 Å²	9	45.5 Å²	45.5	4%	0.035	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	154.4	171.9	57.2	-90.8	0	0	0	113	L511 P512 I514 V515 V519 V541 V542	L511-Y517 WeakPolarHBondContact CD2-OH 3.19Å; P512-Y517 HydrophobicContact CB-CE1 4.39Å; P512-Y517 WeakPolarHBondContact CD-OH 3.34Å; P512-Y517 HydrophobicContact CG-CE1 4.43Å; I514-Y517 WeakPolarHBondContact O-CD1 3.07Å; I514-Y517 VanDerWaalsContact O-CE1 3.23Å; I514-Y517 WeakPolarHBondContact O-CE1 3.26Å; V515-Y517 HydrophobicContact CG1-CD1 3.95Å; V515-Y517 HydrophobicContact CG1-CE1 3.53Å; Y517-V519 HydrophobicContact CD2-CG1 3.55Å; Y517-V519 HydrophobicContact CE2-CG1 3.41Å; Y517-V519 VanDerWaalsContact CE2-CG1 3.41Å; Y517-V541 WeakPolarHBondContact O-CA 3.17Å; Y517-V542 HydrophobicContact CD1-CB 4.48Å; Y517-V542 HydrophobicContact CD2-CB 4.36Å; Y517-V542 HydrophobicContact CD2-CG2 4.19Å; Y517-V542 HydrophobicContact CE1-CB 4.09Å; Y517-V542 HydrophobicContact CE1-CG1 4.23Å; Y517-V542 HydrophobicContact CE2-CB 3.94Å; Y517-V542 HydrophobicContact CE2-CG2 3.57Å; Y517-V542 PolarHBondContact N-O 3.43Å; Y517-V542 PolarHBondContact O-N 2.83Å
518	I	68.4	Low	69.4	Low	19 Å²	19	46.3 Å²	46.3	10%	0.097	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	140.6	179.8	-57.8	168.8	0	0	0	110.2	W539 A540 V541 A562 Y563 L566	I518-W539 HydrophobicContact CG2-CE3 3.96Å; I518-W539 HydrophobicContact CG2-CZ3 4.37Å; I518-A540 WeakPolarHBondContact CA-O 2.88Å; I518-V541 HydrophobicContact CG1-CG2 4.2Å; I518-A562 HydrophobicContact CD1-CB 4.31Å; I518-A562 HydrophobicContact CG1-CB 4.13Å; I518-A562 HydrophobicContact CG2-CB 3.88Å; I518-Y563 HydrophobicContact CD1-CD2 3.92Å; I518-Y563 HydrophobicContact CD1-CG 4.43Å; I518-L566 HydrophobicContact CD1-CD2 4.33Å; I518-L566 HydrophobicContact CG1-CB 4.46Å; I518-L566 HydrophobicContact CG1-CD2 4.27Å
519	V	71.4	Confident	69.6	Low	0 Å²	0	46 Å²	46	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	138.6	178.1	-63.2	0	0	0	0	111.1	Y517 L521 A540 V542 V553 I595	Y517-V519 HydrophobicContact CD2-CG1 3.55Å; Y517-V519 HydrophobicContact CE2-CG1 3.41Å; Y517-V519 VanDerWaalsContact CE2-CG1 3.41Å; V519-L521 HydrophobicContact CB-CD2 4.34Å; V519-L521 HydrophobicContact CG2-CD2 3.61Å; V519-L521 HydrophobicContact CG2-CG 4.37Å; V519-A540 HydrophobicContact CG2-CB 3.88Å; V519-A540 WeakPolarHBondContact CG2-O 3.42Å; V519-A540 PolarHBondContact N-O 3.49Å; V519-A540 PolarHBondContact O-N 3.14Å; V519-V542 HydrophobicContact CG1-CG2 3.61Å; V519-V542 HydrophobicContact CG2-CG2 4.01Å; V519-V553 HydrophobicContact CG2-CG1 4.48Å; V519-I595 HydrophobicContact CB-CB 4.32Å; V519-I595 HydrophobicContact CB-CG1 4.01Å; V519-I595 HydrophobicContact CB-CG2 3.7Å; V519-I595 HydrophobicContact CG1-CB 4.29Å; V519-I595 HydrophobicContact CG1-CD1 4.29Å; V519-I595 HydrophobicContact CG1-CG1 4.17Å; V519-I595 HydrophobicContact CG1-CG2 3.28Å; V519-I595 HydrophobicContact CG2-CD1 4.43Å; V519-I595 HydrophobicContact CG2-CG1 4.17Å
520	E	76.5	Confident	69.4	Low	33 Å²	33	47 Å²	47	15%	0.154	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	128.9	163.5	-170.2	-168.9	149.4	0	0	107.7	R522 V538 W539 I595 K596	E520-R522 IonicContact OE1-NE 3.28Å; E520-R522 IonicContact OE1-NH2 3.58Å; E520-V538 CarbonylContact C-O 3.59Å; E520-V538 WeakPolarHBondContact CA-O 3.4Å; E520-V538 HydrophobicContact CG-CG1 4.32Å; E520-W539 HydrophobicContact CB-CE3 4.07Å; E520-W539 HydrophobicContact CB-CH2 3.95Å; E520-W539 HydrophobicContact CB-CZ3 3.68Å; E520-W539 HydrophobicContact CG-CH2 4.1Å; E520-W539 HydrophobicContact CG-CZ2 4.28Å; E520-W539 HydrophobicContact CG-CZ3 4.26Å; E520-I595 WeakPolarHBondContact O-CA 3.21Å; E520-K596 HydrophobicContact CB-CB 3.81Å; E520-K596 PolarHBondContact N-O 3.2Å; E520-K596 PolarHBondContact O-N 3.45Å; E520-K596 WeakPolarHBondContact OE2-CD 3.4Å
521	L	77	Confident	69.5	Low	6 Å²	6	46.1 Å²	46.1	3%	0.031	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	135.5	-179.9	-56.8	-178.5	0	0	0	110	W478 V519 A524 V537 V538 A540 V553 M593 I595	W478-L521 HydrophobicContact CH2-CD1 3.93Å; W478-L521 HydrophobicContact CZ2-CD1 4.24Å; V519-L521 HydrophobicContact CB-CD2 4.34Å; V519-L521 HydrophobicContact CG2-CD2 3.61Å; V519-L521 HydrophobicContact CG2-CG 4.37Å; L521-A524 HydrophobicContact CB-CB 4.12Å; L521-A524 HydrophobicContact CD1-CB 4.25Å; L521-V537 HydrophobicContact CD1-CG1 3.99Å; L521-V538 PolarHBondContact N-O 2.83Å; L521-A540 HydrophobicContact CD1-CB 3.38Å; L521-A540 HydrophobicContact CD2-CB 4.29Å; L521-A540 HydrophobicContact CG-CB 3.89Å; L521-V553 HydrophobicContact CD1-CG1 4.24Å; L521-V553 HydrophobicContact CD2-CG1 4.29Å; L521-M593 HydrophobicContact CB-CE 4.03Å; L521-M593 HydrophobicContact CD1-CE 3.28Å; L521-M593 HydrophobicContact CD2-CE 3.17Å; L521-M593 HydrophobicContact CG-CE 3.61Å; L521-I595 HydrophobicContact CD2-CG1 3.92Å
522	R	73.2	Confident	69.5	Low	109 Å²	109	51 Å²	51	41%	0.411	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	141.6	168.7	-60	-177.3	171.2	-171.8	-7.3	109.7	E520 A524 M593 L594	E520-R522 IonicContact OE1-NE 3.28Å; E520-R522 IonicContact OE1-NH2 3.58Å; R522-A524 PolarHBondContact O-N 2.92Å; R522-M593 VanDerWaalsContact O-CA 3.28Å; R522-M593 WeakPolarHBondContact O-CA 3.27Å; R522-L594 HydrophobicContact CB-CB 4.12Å; R522-L594 HydrophobicContact CB-CD1 4.29Å; R522-L594 HydrophobicContact CG-CB 4.38Å; R522-L594 PolarHBondContact N-O 2.76Å; R522-L594 PolarHBondContact O-N 3.43Å
523	N	73.4	Confident	69.9	Low	80 Å²	80	58.2 Å²	58.2	43%	0.428	30%	0.299	S	S	.	.	S	Bend	trans	59	25.5	179.6	-49.6	-46.9	0	0	0	114.4	A588 T591	N523-A588 HydrophobicContact CB-CB 3.95Å; N523-T591 VanDerWaalsContact ND2-CG2 3.33Å; N523-T591 WeakPolarHBondContact ND2-CG2 3.29Å
524	A	76.2	Confident	70.6	Confident	17 Å²	17	55.3 Å²	55.3	14%	0.14	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-65.5	149.5	173.2	0	0	0	0	0	110.5	W478 L521 R522 M593	W478-A524 HydrophobicContact CZ2-CB 4.2Å; L521-A524 HydrophobicContact CB-CB 4.12Å; L521-A524 HydrophobicContact CD1-CB 4.25Å; R522-A524 PolarHBondContact O-N 2.92Å; A524-M593 HydrophobicContact CB-CE 4.28Å; A524-M593 HydrophobicContact CB-SD 4.32Å
525	P	75.5	Confident	71.3	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.032	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-59	147.7	171.6	22.6	-28.6	0	0	0	110.2	W478 L492	W478-P525 PolarHBondContact NE1-O 3.22Å; L492-P525 HydrophobicContact CD1-CG 3.93Å
526	Q	76.2	Confident	72.1	Confident	85 Å²	85	56 Å²	56	40%	0.397	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-67.9	141.5	172.8	-73.8	-176.7	-20.5	0	0	109.9	A534 V535 D536	Q526-A534 HydrophobicContact CB-CB 4.29Å; Q526-V535 WeakPolarHBondContact CA-O 3.06Å; Q526-D536 VanDerWaalsContact CG-OD1 3.25Å; Q526-D536 WeakPolarHBondContact CG-OD1 3.45Å; Q526-D536 PolarHBondContact NE2-OD1 3.19Å
527	L	76.5	Confident	72.8	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	125.1	173.9	-173.2	81.1	0	0	0	109.2	W478 V535 V537 P555 L575	W478-L527 HydrophobicContact CB-CD1 3.37Å; W478-L527 HydrophobicContact CD2-CD1 4.28Å; W478-L527 HydrophobicContact CG-CB 4.47Å; W478-L527 HydrophobicContact CG-CD1 3.46Å; W478-L527 VanDerWaalsContact CG-CD1 3.46Å; L527-V535 PolarHBondContact N-O 3.38Å; L527-V535 PolarHBondContact O-N 3.34Å; L527-V537 HydrophobicContact CB-CG2 3.66Å; L527-P555 HydrophobicContact CD2-CG 4.48Å; L527-L575 HydrophobicContact CD2-CB 3.29Å; L527-L575 HydrophobicContact CD2-CD1 3.89Å; L527-L575 HydrophobicContact CD2-CG 4.18Å
528	K	70.3	Confident	73.5	Confident	32 Å²	32	55.5 Å²	55.5	14%	0.139	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	123.7	173.3	-148.3	-177.9	-164.9	-163.5	0	110	D532 R533 S577 Q582	K528-D532 WeakPolarHBondContact CE-O 3.4Å; K528-D532 WeakPolarHBondContact CE-OD1 3.21Å; K528-D532 VanDerWaalsContact NZ-CG 3.27Å; K528-D532 IonicContact NZ-OD1 2.65Å; K528-D532 PolarHBondContact NZ-OD1 3.16Å; K528-D532 IonicContact NZ-OD2 3.7Å; K528-R533 WeakPolarHBondContact CA-O 3.43Å; K528-S577 PolarHBondContact O-OG 3.43Å; K528-Q582 HydrophobicContact CD-CB 4.2Å
529	L	69.4	Low	74.1	Confident	42 Å²	42	56.9 Å²	56.9	22%	0.22	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-81.6	164.2	173.9	-71.3	-179.4	0	0	0	111.3	D531 D532 R533 V535 L575	L529-D531 WeakPolarHBondContact CB-OD1 3.46Å; L529-D531 PolarHBondContact O-N 3.49Å; L529-D531 VanDerWaalsContact O-N 3.08Å; L529-D532 PolarHBondContact O-N 2.8Å; L529-R533 PolarHBondContact N-O 3.42Å; L529-V535 HydrophobicContact CD1-CG2 3.49Å; L529-V535 VanDerWaalsContact CD1-CG2 3.49Å; L529-V535 HydrophobicContact CG-CG2 3.84Å; L529-L575 HydrophobicContact CD2-CD2 4.38Å
530	P	65.5	Low	74.5	Confident	88 Å²	88	56.9 Å²	56.9	57%	0.571	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-21	180	-25.1	34.4	0	0	0	115.4	D532 V579	P530-D532 VanDerWaalsContact C-N 3.26Å; P530-D532 PolarHBondContact O-N 3.17Å; P530-V579 HydrophobicContact CB-CG2 4.16Å; P530-V579 HydrophobicContact CG-CG2 4.44Å
531	D	69.6	Low	74.7	Confident	92 Å²	92	55.3 Å²	55.3	49%	0.492	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	18.6	176.8	67.4	-21.8	0	0	0	113.2	L529 R533	L529-D531 WeakPolarHBondContact CB-OD1 3.46Å; L529-D531 PolarHBondContact O-N 3.49Å; L529-D531 VanDerWaalsContact O-N 3.08Å; D531-R533 PolarHBondContact O-N 3.33Å; D531-R533 VanDerWaalsContact O-N 3.16Å; D531-R533 WeakPolarHBondContact OD1-CB 3.48Å; D531-R533 PolarHBondContact OD1-N 2.89Å; D531-R533 WeakPolarHBondContact OD2-CD 3.36Å; D531-R533 WeakPolarHBondContact OD2-CG 3.43Å; D531-R533 IonicContact OD2-CZ 2.99Å; D531-R533 IonicContact OD2-NE 3.9Å; D531-R533 PolarHBondContact OD2-NE 3.15Å
532	D	67.1	Low	74.7	Confident	107 Å²	107	55 Å²	55	57%	0.572	29%	0.285	S	S	*	.	S	Bend	trans	64.7	7.8	-178.7	-100	-6.7	0	0	0	115.1	K528 L529 P530	K528-D532 WeakPolarHBondContact CE-O 3.4Å; K528-D532 WeakPolarHBondContact CE-OD1 3.21Å; K528-D532 VanDerWaalsContact NZ-CG 3.27Å; K528-D532 IonicContact NZ-OD1 2.65Å; K528-D532 PolarHBondContact NZ-OD1 3.16Å; K528-D532 IonicContact NZ-OD2 3.7Å; L529-D532 PolarHBondContact O-N 2.8Å; P530-D532 VanDerWaalsContact C-N 3.26Å; P530-D532 PolarHBondContact O-N 3.17Å
533	R	71.6	Confident	74.9	Confident	172 Å²	172	50.7 Å²	50.7	65%	0.649	27%	0.27	S	S	*	.			trans	-77.6	128.9	174.6	-66.4	-173.8	-178.2	-176.9	-0.1	111	K528 L529 D531	K528-R533 WeakPolarHBondContact CA-O 3.43Å; L529-R533 PolarHBondContact N-O 3.42Å; D531-R533 PolarHBondContact O-N 3.33Å; D531-R533 VanDerWaalsContact O-N 3.16Å; D531-R533 WeakPolarHBondContact OD1-CB 3.48Å; D531-R533 PolarHBondContact OD1-N 2.89Å; D531-R533 WeakPolarHBondContact OD2-CD 3.36Å; D531-R533 WeakPolarHBondContact OD2-CG 3.43Å; D531-R533 IonicContact OD2-CZ 2.99Å; D531-R533 IonicContact OD2-NE 3.9Å; D531-R533 PolarHBondContact OD2-NE 3.15Å
534	A	74.1	Confident	74.8	Confident	58 Å²	58	51.8 Å²	51.8	48%	0.479	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	128.2	168.2	0	0	0	0	0	109.7	Q526	Q526-A534 HydrophobicContact CB-CB 4.29Å
535	V	75	Confident	74.2	Confident	44 Å²	44	51.1 Å²	51.1	27%	0.267	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	130.9	178.9	-179	0	0	0	0	109.5	Q526 L527 L529 V537	Q526-V535 WeakPolarHBondContact CA-O 3.06Å; L527-V535 PolarHBondContact N-O 3.38Å; L527-V535 PolarHBondContact O-N 3.34Å; L529-V535 HydrophobicContact CD1-CG2 3.49Å; L529-V535 VanDerWaalsContact CD1-CG2 3.49Å; L529-V535 HydrophobicContact CG-CG2 3.84Å; V535-V537 PolarHBondContact O-N 2.95Å
536	D	78.9	Confident	73.3	Confident	107 Å²	107	58.2 Å²	58.2	57%	0.572	31%	0.305	S	S	*	.			trans	-70.5	117.9	170.2	-67.3	-40.2	0	0	0	109.4	Q526 V538	Q526-D536 VanDerWaalsContact CG-OD1 3.25Å; Q526-D536 WeakPolarHBondContact CG-OD1 3.45Å; Q526-D536 PolarHBondContact NE2-OD1 3.19Å; D536-V538 PolarHBondContact O-N 3.25Å
537	V	78.2	Confident	72	Confident	6 Å²	6	61.2 Å²	61.2	4%	0.036	31%	0.313	C	S	.	.			trans	-85.9	100.9	177	-174.3	0	0	0	0	109.2	W478 L521 L527 V535 W539 P555 L575	W478-V537 HydrophobicContact CH2-CG1 4.07Å; W478-V537 HydrophobicContact CZ2-CB 3.72Å; W478-V537 HydrophobicContact CZ2-CG1 3.67Å; W478-V537 HydrophobicContact CZ2-CG2 3.88Å; L521-V537 HydrophobicContact CD1-CG1 3.99Å; L527-V537 HydrophobicContact CB-CG2 3.66Å; V535-V537 PolarHBondContact O-N 2.95Å; V537-W539 WeakPolarHBondContact CG1-O 3.45Å; V537-P555 HydrophobicContact CB-CB 4.45Å; V537-P555 HydrophobicContact CG1-CB 3.53Å; V537-P555 HydrophobicContact CG2-CB 4.06Å; V537-L575 HydrophobicContact CG2-CD1 4.16Å
538	V	80.2	Confident	70.7	Confident	64 Å²	64	67 Å²	67	39%	0.388	34%	0.344	S	S	.	.			trans	-94.3	-26	179.2	-174.7	0	0	0	0	112.1	E520 L521 D536	E520-V538 CarbonylContact C-O 3.59Å; E520-V538 WeakPolarHBondContact CA-O 3.4Å; E520-V538 HydrophobicContact CG-CG1 4.32Å; L521-V538 PolarHBondContact N-O 2.83Å; D536-V538 PolarHBondContact O-N 3.25Å
539	W	80.6	Confident	69.8	Low	47 Å²	47	75.1 Å²	75.1	18%	0.178	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	142	-176.6	-64.1	97.7	0	0	0	111.1	I518 E520 V537 C556 R559 L598	I518-W539 HydrophobicContact CG2-CE3 3.96Å; I518-W539 HydrophobicContact CG2-CZ3 4.37Å; E520-W539 HydrophobicContact CB-CE3 4.07Å; E520-W539 HydrophobicContact CB-CH2 3.95Å; E520-W539 HydrophobicContact CB-CZ3 3.68Å; E520-W539 HydrophobicContact CG-CH2 4.1Å; E520-W539 HydrophobicContact CG-CZ2 4.28Å; E520-W539 HydrophobicContact CG-CZ3 4.26Å; V537-W539 WeakPolarHBondContact CG1-O 3.45Å; W539-C556 PolarHBondContact O-N 2.93Å; W539-C556 VanDerWaalsContact O-O 3.11Å; W539-R559 HydrophobicContact CD2-CB 3.89Å; W539-R559 HydrophobicContact CD2-CG 4.4Å; W539-R559 HydrophobicContact CE3-CB 4.34Å; W539-R559 HydrophobicContact CE3-CG 4.36Å; W539-R559 HydrophobicContact CG-CB 4.18Å; W539-R559 HydrophobicContact CH2-CG 4.49Å; W539-R559 HydrophobicContact CZ2-CB 4.26Å; W539-R559 HydrophobicContact CZ3-CG 4.4Å; W539-L598 HydrophobicContact CH2-CD1 4.46Å
540	A	80.5	Confident	69.6	Low	0 Å²	0	75.2 Å²	75.2	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	169.4	177.1	0	0	0	0	0	111.6	I518 V519 L521 V553 V554	I518-A540 WeakPolarHBondContact CA-O 2.88Å; V519-A540 HydrophobicContact CG2-CB 3.88Å; V519-A540 WeakPolarHBondContact CG2-O 3.42Å; V519-A540 PolarHBondContact N-O 3.49Å; V519-A540 PolarHBondContact O-N 3.14Å; L521-A540 HydrophobicContact CD1-CB 3.38Å; L521-A540 HydrophobicContact CD2-CB 4.29Å; L521-A540 HydrophobicContact CG-CB 3.89Å; A540-V553 HydrophobicContact CB-CG1 3.54Å; A540-V554 CarbonylContact C-O 3.34Å; A540-V554 WeakPolarHBondContact CA-O 3.16Å; A540-V554 WeakPolarHBondContact CB-O 3.38Å
541	V	79.7	Confident	70	Confident	1 Å²	1	72.6 Å²	72.6	1%	0.006	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	130.3	172.4	-179.6	0	0	0	0	109.2	P516 Y517 I518 V543 V554 A562 F565 L566	P516-V541 HydrophobicContact CB-CG1 4.05Å; Y517-V541 WeakPolarHBondContact O-CA 3.17Å; I518-V541 HydrophobicContact CG1-CG2 4.2Å; V541-V543 HydrophobicContact CG1-CG1 3.86Å; V541-V554 PolarHBondContact N-O 3.36Å; V541-V554 PolarHBondContact O-N 3.41Å; V541-A562 HydrophobicContact CG2-CB 3.84Å; V541-A562 WeakPolarHBondContact CG2-O 3.26Å; V541-F565 HydrophobicContact CB-CD1 3.74Å; V541-F565 HydrophobicContact CB-CE1 3.97Å; V541-F565 HydrophobicContact CG1-CD1 4.12Å; V541-F565 HydrophobicContact CG1-CE1 4.16Å; V541-F565 HydrophobicContact CG2-CD1 3.74Å; V541-F565 HydrophobicContact CG2-CE1 4.46Å; V541-L566 HydrophobicContact CG1-CD1 3.74Å
542	V	77.4	Confident	70.4	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	125.4	170.7	-174.9	0	0	0	0	107.9	L511 V515 P516 Y517 V519 F551 D552 V553 I595	L511-V542 HydrophobicContact CD1-CG1 3.88Å; L511-V542 HydrophobicContact CD1-CG2 4.43Å; V515-V542 HydrophobicContact CG1-CB 4.28Å; V515-V542 HydrophobicContact CG1-CG1 3.68Å; P516-V542 WeakPolarHBondContact CA-O 3.22Å; P516-V542 VanDerWaalsContact CB-O 3.3Å; P516-V542 WeakPolarHBondContact CB-O 3.28Å; Y517-V542 HydrophobicContact CD1-CB 4.48Å; Y517-V542 HydrophobicContact CD2-CB 4.36Å; Y517-V542 HydrophobicContact CD2-CG2 4.19Å; Y517-V542 HydrophobicContact CE1-CB 4.09Å; Y517-V542 HydrophobicContact CE1-CG1 4.23Å; Y517-V542 HydrophobicContact CE2-CB 3.94Å; Y517-V542 HydrophobicContact CE2-CG2 3.57Å; Y517-V542 PolarHBondContact N-O 3.43Å; Y517-V542 PolarHBondContact O-N 2.83Å; V519-V542 HydrophobicContact CG1-CG2 3.61Å; V519-V542 HydrophobicContact CG2-CG2 4.01Å; V542-F551 HydrophobicContact CG1-CB 3.86Å; V542-F551 HydrophobicContact CG1-CG 4.39Å; V542-D552 CarbonylContact C-O 3.54Å; V542-D552 WeakPolarHBondContact CA-O 3.17Å; V542-V553 HydrophobicContact CG2-CG2 4.23Å; V542-I595 HydrophobicContact CG2-CD1 4.3Å
543	V	77.6	Confident	71.1	Confident	18 Å²	18	63.4 Å²	63.4	11%	0.109	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	150.3	179.4	-58.8	0	0	0	0	110.2	Y489 P516 V541 S545 F551 D552 V554 F565	Y489-V543 HydrophobicContact CE2-CG2 4.13Å; Y489-V543 WeakPolarHBondContact OH-CG2 3.27Å; P516-V543 HydrophobicContact CB-CG1 4.13Å; V541-V543 HydrophobicContact CG1-CG1 3.86Å; V543-S545 PolarHBondContact O-N 3.25Å; V543-F551 CarbonylContact O-C 3.58Å; V543-F551 VanDerWaalsContact O-CA 3.29Å; V543-F551 WeakPolarHBondContact O-CA 3.23Å; V543-D552 HydrophobicContact CG2-CB 3.82Å; V543-D552 PolarHBondContact N-O 3.04Å; V543-D552 PolarHBondContact O-N 2.83Å; V543-V554 HydrophobicContact CG1-CG2 4.27Å; V543-V554 HydrophobicContact CG2-CG2 3.67Å; V543-F565 HydrophobicContact CG1-CE1 3.99Å; V543-F565 HydrophobicContact CG1-CZ 4.37Å
544	E	71.6	Confident	71.6	Confident	102 Å²	102	55.2 Å²	55.2	48%	0.477	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	121.6	169.2	-157.3	170.7	-179.8	0	0	108.7	V515 F551	V515-E544 HydrophobicContact CG2-CB 3.69Å; V515-E544 HydrophobicContact CG2-CG 4.44Å; E544-F551 HydrophobicContact CB-CD1 4.5Å; E544-F551 HydrophobicContact CG-CD1 4.46Å; E544-F551 HydrophobicContact CG-CE1 4.23Å
545	S	63.4	Low	72.2	Confident	3 Å²	3	52.5 Å²	52.5	2%	0.021	25%	0.25	C	S	.	.			trans	-76.8	134	165.9	87.7	0	0	0	0	107.9	R487 V543 Y547 H550 D552	R487-S545 PolarHBondContact NH2-OG 3.18Å; V543-S545 PolarHBondContact O-N 3.25Å; S545-Y547 PolarHBondContact O-N 3.48Å; S545-Y547 PolarHBondContact OG-O 2.86Å; S545-H550 WeakPolarHBondContact CA-O 3.44Å; S545-H550 VanDerWaalsContact CB-O 3.3Å; S545-H550 WeakPolarHBondContact CB-O 3.3Å; S545-H550 PolarHBondContact N-O 3.15Å; S545-H550 PolarHBondContact OG-O 3.01Å; S545-D552 WeakPolarHBondContact CB-OD2 3.31Å
546	N	55.9	Low	72.5	Confident	154 Å²	154	50.4 Å²	50.4	82%	0.824	24%	0.238	S	C	*	.	S	Bend	trans	-61.5	-7	177.9	-82.8	-41	0	0	0	113.5
547	Y	49	Very low	72.4	Confident	148 Å²	148	47.8 Å²	47.8	58%	0.58	24%	0.236	S	C	*	.	S	Bend	trans	-96.2	118.4	-178.7	-160.1	-100.4	0	0	0	109.8	S545 R549 H550	S545-Y547 PolarHBondContact O-N 3.48Å; S545-Y547 PolarHBondContact OG-O 2.86Å; Y547-R549 PolarHBondContact O-N 2.93Å; Y547-H550 PolarHBondContact O-N 2.82Å
548	D	49.8	Very low	72.4	Confident	121 Å²	121	49.2 Å²	49.2	65%	0.647	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	23.2	171.8	-74.3	-17.8	0	0	0	117.1	H550	D548-H550 VanDerWaalsContact CB-CD2 3.46Å; D548-H550 WeakPolarHBondContact CB-CD2 3.49Å; D548-H550 PolarHBondContact O-CD2 2.74Å; D548-H550 PolarHBondContact O-N 3.33Å
549	R	51.4	Low	72	Confident	203 Å²	203	50.6 Å²	50.6	77%	0.766	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.4	32.3	-174.7	-60.5	-175.6	174.1	-177.9	-2.4	113.4	Y547	Y547-R549 PolarHBondContact O-N 2.93Å
550	H	65.6	Low	71.5	Confident	44 Å²	44	53.9 Å²	53.9	20%	0.204	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-79.6	150.7	171.4	-74.5	-95.4	0	0	0	111.2	E504 F506 S545 Y547 D548	E504-H550 IonicContact OE2-CD2 3.67Å; E504-H550 PolarHBondContact OE2-CD2 3.42Å; E504-H550 IonicContact OE2-CE1 2.85Å; E504-H550 PolarHBondContact OE2-CE1 3.4Å; E504-H550 VanDerWaalsContact OE2-CE1 3.28Å; E504-H550 IonicContact OE2-CG 3.58Å; E504-H550 IonicContact OE2-ND1 3.46Å; E504-H550 PolarHBondContact OE2-ND1 3.29Å; E504-H550 IonicContact OE2-NE2 2.72Å; F506-H550 AromaticContact CE1-CE1 3.42Å; F506-H550 VanDerWaalsContact CE1-CE1 3.42Å; F506-H550 WeakPolarHBondContact CE1-CE1 3.43Å; F506-H550 AromaticContact CE1-ND1 3.91Å; F506-H550 AromaticContact CZ-CE1 3.57Å; S545-H550 WeakPolarHBondContact CA-O 3.44Å; S545-H550 VanDerWaalsContact CB-O 3.3Å; S545-H550 WeakPolarHBondContact CB-O 3.3Å; S545-H550 PolarHBondContact N-O 3.15Å; S545-H550 PolarHBondContact OG-O 3.01Å; Y547-H550 PolarHBondContact O-N 2.82Å; D548-H550 VanDerWaalsContact CB-CD2 3.46Å; D548-H550 WeakPolarHBondContact CB-CD2 3.49Å; D548-H550 PolarHBondContact O-CD2 2.74Å; D548-H550 PolarHBondContact O-N 3.33Å
551	F	72.2	Confident	71.1	Confident	34 Å²	34	55 Å²	55	15%	0.149	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	123.6	178	-57.9	-65.6	0	0	0	110.5	L511 T513 V515 V542 V543 E544	L511-F551 HydrophobicContact CB-CD2 4.08Å; L511-F551 HydrophobicContact CD1-CB 4.16Å; T513-F551 HydrophobicContact CG2-CZ 4.43Å; V515-F551 HydrophobicContact CB-CD1 4.4Å; V515-F551 HydrophobicContact CB-CE1 4.4Å; V515-F551 HydrophobicContact CG1-CD1 3.67Å; V515-F551 HydrophobicContact CG1-CE1 3.86Å; V515-F551 HydrophobicContact CG2-CD1 3.9Å; V515-F551 HydrophobicContact CG2-CE1 3.58Å; V542-F551 HydrophobicContact CG1-CB 3.86Å; V542-F551 HydrophobicContact CG1-CG 4.39Å; V543-F551 CarbonylContact O-C 3.58Å; V543-F551 VanDerWaalsContact O-CA 3.29Å; V543-F551 WeakPolarHBondContact O-CA 3.23Å; E544-F551 HydrophobicContact CB-CD1 4.5Å; E544-F551 HydrophobicContact CG-CD1 4.46Å; E544-F551 HydrophobicContact CG-CE1 4.23Å
552	D	78.2	Confident	70.6	Confident	6 Å²	6	55 Å²	55	3%	0.032	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	142	172.9	-72.8	-35.5	0	0	0	109.8	R487 Y489 H491 V542 V543 S545	R487-D552 WeakPolarHBondContact CD-OD2 2.96Å; R487-D552 IonicContact CZ-OD1 3.04Å; R487-D552 IonicContact CZ-OD2 3.39Å; R487-D552 IonicContact NE-OD1 3.52Å; R487-D552 PolarHBondContact NE-OD1 2.77Å; R487-D552 IonicContact NE-OD2 3.98Å; R487-D552 PolarHBondContact NE-OD2 3.48Å; R487-D552 IonicContact NH1-OD1 3.84Å; R487-D552 IonicContact NH2-OD1 3.99Å; R487-D552 IonicContact NH2-OD2 3.57Å; Y489-D552 HydrophobicContact CE2-CB 4.25Å; H491-D552 HydrophobicContact CB-CB 4.14Å; H491-D552 IonicContact CD2-OD1 3.37Å; V542-D552 CarbonylContact C-O 3.54Å; V542-D552 WeakPolarHBondContact CA-O 3.17Å; V543-D552 HydrophobicContact CG2-CB 3.82Å; V543-D552 PolarHBondContact N-O 3.04Å; V543-D552 PolarHBondContact O-N 2.83Å; S545-D552 WeakPolarHBondContact CB-OD2 3.31Å
553	V	81.5	Confident	69.8	Low	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	116.2	170.1	-179.9	0	0	0	0	108.1	W478 H491 L492 W507 V519 L521 A540 V542 M593	W478-V553 WeakPolarHBondContact CZ3-O 3.46Å; H491-V553 WeakPolarHBondContact CA-O 3.47Å; L492-V553 HydrophobicContact CB-CB 4.16Å; L492-V553 PolarHBondContact N-O 3.38Å; W507-V553 HydrophobicContact CH2-CG2 4.05Å; W507-V553 HydrophobicContact CZ2-CB 4.39Å; W507-V553 HydrophobicContact CZ2-CG2 3.35Å; V519-V553 HydrophobicContact CG2-CG1 4.48Å; L521-V553 HydrophobicContact CD1-CG1 4.24Å; L521-V553 HydrophobicContact CD2-CG1 4.29Å; A540-V553 HydrophobicContact CB-CG1 3.54Å; V542-V553 HydrophobicContact CG2-CG2 4.23Å; V553-M593 HydrophobicContact CG1-CE 4.17Å
554	V	83.5	Confident	69.1	Low	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	121.1	-172.6	-174.4	0	0	0	0	110.1	Y489 A540 V541 V543 F565 T574	Y489-V554 HydrophobicContact CD2-CB 4.38Å; Y489-V554 HydrophobicContact CD2-CG1 4.05Å; Y489-V554 HydrophobicContact CD2-CG2 3.46Å; Y489-V554 VanDerWaalsContact CD2-CG2 3.46Å; Y489-V554 HydrophobicContact CE2-CG2 3.54Å; Y489-V554 HydrophobicContact CG-CG1 3.94Å; Y489-V554 HydrophobicContact CG-CG2 4.03Å; A540-V554 CarbonylContact C-O 3.34Å; A540-V554 WeakPolarHBondContact CA-O 3.16Å; A540-V554 WeakPolarHBondContact CB-O 3.38Å; V541-V554 PolarHBondContact N-O 3.36Å; V541-V554 PolarHBondContact O-N 3.41Å; V543-V554 HydrophobicContact CG1-CG2 4.27Å; V543-V554 HydrophobicContact CG2-CG2 3.67Å; V554-F565 HydrophobicContact CB-CE1 3.98Å; V554-F565 HydrophobicContact CG1-CE1 3.89Å; V554-F565 HydrophobicContact CG1-CZ 4.22Å; V554-F565 HydrophobicContact CG2-CE1 4.18Å; V554-T574 HydrophobicContact CG1-CG2 3.48Å; V554-T574 VanDerWaalsContact CG1-CG2 3.48Å
555	P	85.4	Confident	68.9	Low	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	137.6	-175.4	31.3	-32.7	0	0	0	111.7	W478 S490 L527 V537 T574 L575	W478-P555 HydrophobicContact CD2-CB 4.35Å; W478-P555 HydrophobicContact CD2-CG 4.24Å; W478-P555 HydrophobicContact CE3-CB 4.05Å; W478-P555 HydrophobicContact CE3-CG 3.74Å; W478-P555 HydrophobicContact CH2-CB 3.75Å; W478-P555 HydrophobicContact CH2-CG 4.32Å; W478-P555 HydrophobicContact CZ2-CB 4.05Å; W478-P555 HydrophobicContact CZ3-CB 3.74Å; W478-P555 HydrophobicContact CZ3-CG 3.79Å; S490-P555 WeakPolarHBondContact O-CD 3.23Å; L527-P555 HydrophobicContact CD2-CG 4.48Å; V537-P555 HydrophobicContact CB-CB 4.45Å; V537-P555 HydrophobicContact CG1-CB 3.53Å; V537-P555 HydrophobicContact CG2-CB 4.06Å; P555-T574 WeakPolarHBondContact O-CA 3.21Å; P555-L575 HydrophobicContact CB-CB 4.39Å; P555-L575 HydrophobicContact CB-CD1 4.32Å; P555-L575 HydrophobicContact CG-CB 4.3Å; P555-L575 PolarHBondContact O-N 2.97Å
556	C	81.7	Confident	68.8	Low	1 Å²	1	58.6 Å²	58.6	1%	0.007	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	145.3	177.1	-67.5	0	0	0	0	110.7	W539 S558 A561 A562	W539-C556 PolarHBondContact O-N 2.93Å; W539-C556 VanDerWaalsContact O-O 3.11Å; C556-S558 VanDerWaalsContact C-N 3.27Å; C556-S558 PolarHBondContact O-N 2.84Å; C556-A561 HydrophobicContact CB-CB 4.37Å; C556-A562 HydrophobicContact CB-CB 3.75Å; C556-A562 VanDerWaalsContact SG-CA 3.56Å
557	G	77.8	Confident	68.7	Low	51 Å²	51	53.3 Å²	53.3	53%	0.526	26%	0.263	S	S	.	.	S	Bend	trans	-69.2	-24.5	-175.8	0	0	0	0	0	114.2
558	S	78.2	Confident	69.3	Low	37 Å²	37	48.6 Å²	48.6	26%	0.259	25%	0.252	S	S	.	.	S	Bend	trans	-155.6	174.3	177	80.7	0	0	0	0	110.7	C556 E560 A561 A562	C556-S558 VanDerWaalsContact C-N 3.27Å; C556-S558 PolarHBondContact O-N 2.84Å; S558-E560 VanDerWaalsContact C-N 3.29Å; S558-E560 WeakPolarHBondContact CB-OE2 3.46Å; S558-E560 PolarHBondContact O-N 3.14Å; S558-E560 PolarHBondContact OG-N 3.24Å; S558-E560 PolarHBondContact OG-OE2 3.46Å; S558-A561 PolarHBondContact O-N 3.24Å; S558-A561 PolarHBondContact OG-N 3.49Å; S558-A561 VanDerWaalsContact OG-N 3.15Å; S558-A562 PolarHBondContact O-N 3.34Å
559	R	71.7	Confident	69.9	Low	93 Å²	93	47.1 Å²	47.1	35%	0.351	25%	0.251	S	S	.	.	H	α-helix	trans	-63.2	-38.3	173.7	-179.4	179.4	163.7	170.8	-4.5	111.6	W539 A561 A562 Y563 H599	W539-R559 HydrophobicContact CD2-CB 3.89Å; W539-R559 HydrophobicContact CD2-CG 4.4Å; W539-R559 HydrophobicContact CE3-CB 4.34Å; W539-R559 HydrophobicContact CE3-CG 4.36Å; W539-R559 HydrophobicContact CG-CB 4.18Å; W539-R559 HydrophobicContact CH2-CG 4.49Å; W539-R559 HydrophobicContact CZ2-CB 4.26Å; W539-R559 HydrophobicContact CZ3-CG 4.4Å; R559-A561 VanDerWaalsContact C-N 3.35Å; R559-A562 PolarHBondContact O-N 3.31Å; R559-Y563 WeakPolarHBondContact O-CB 3.28Å; R559-Y563 PolarHBondContact O-N 3.37Å; R559-H599 VanDerWaalsContact CZ-NE2 3.34Å; R559-H599 PolarHBondContact NH1-NE2 3.49Å; R559-H599 VanDerWaalsContact NH1-NE2 3.16Å; R559-H599 PolarHBondContact NH2-CD2 3.5Å; R559-H599 PolarHBondContact NH2-NE2 2.79Å
560	E	70	Confident	70.8	Confident	115 Å²	115	41.1 Å²	41.1	54%	0.537	23%	0.234	S	C	.	.	H	α-helix	trans	-66.2	-39.8	177.5	-56.8	69.8	-146.9	0	0	110.5	S558 Y563 A564	S558-E560 VanDerWaalsContact C-N 3.29Å; S558-E560 WeakPolarHBondContact CB-OE2 3.46Å; S558-E560 PolarHBondContact O-N 3.14Å; S558-E560 PolarHBondContact OG-N 3.24Å; S558-E560 PolarHBondContact OG-OE2 3.46Å; E560-Y563 PolarHBondContact O-N 2.94Å; E560-A564 WeakPolarHBondContact O-CB 3.31Å; E560-A564 PolarHBondContact O-N 2.98Å
561	A	72.2	Confident	70.9	Confident	25 Å²	25	42.6 Å²	42.6	21%	0.207	24%	0.241	C	C	.	.	H	α-helix	trans	-66.7	-38.9	174.9	0	0	0	0	0	112	C556 S558 R559 Y563 A564 F565 G573	C556-A561 HydrophobicContact CB-CB 4.37Å; S558-A561 PolarHBondContact O-N 3.24Å; S558-A561 PolarHBondContact OG-N 3.49Å; S558-A561 VanDerWaalsContact OG-N 3.15Å; R559-A561 VanDerWaalsContact C-N 3.35Å; A561-Y563 VanDerWaalsContact C-N 3.35Å; A561-A564 PolarHBondContact O-N 2.92Å; A561-F565 WeakPolarHBondContact O-CB 3.34Å; A561-F565 PolarHBondContact O-N 2.89Å; A561-G573 WeakPolarHBondContact CB-O 3.35Å
562	A	67.8	Low	70.9	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.7	-40.7	172.8	0	0	0	0	0	111.9	I518 V541 C556 S558 R559 L566	I518-A562 HydrophobicContact CD1-CB 4.31Å; I518-A562 HydrophobicContact CG1-CB 4.13Å; I518-A562 HydrophobicContact CG2-CB 3.88Å; V541-A562 HydrophobicContact CG2-CB 3.84Å; V541-A562 WeakPolarHBondContact CG2-O 3.26Å; C556-A562 HydrophobicContact CB-CB 3.75Å; C556-A562 VanDerWaalsContact SG-CA 3.56Å; S558-A562 PolarHBondContact O-N 3.34Å; R559-A562 PolarHBondContact O-N 3.31Å; A562-L566 VanDerWaalsContact O-CB 3.3Å; A562-L566 WeakPolarHBondContact O-CB 3.39Å; A562-L566 PolarHBondContact O-N 3.42Å
563	Y	62.1	Low	70.2	Confident	92 Å²	92	46.6 Å²	46.6	36%	0.361	27%	0.271	S	S	.	.	H	α-helix	trans	-65.4	-46	174.4	-166.8	-93.4	0	0	0	111.4	I518 R559 E560 A561 F565 L566 M567	I518-Y563 HydrophobicContact CD1-CD2 3.92Å; I518-Y563 HydrophobicContact CD1-CG 4.43Å; R559-Y563 WeakPolarHBondContact O-CB 3.28Å; R559-Y563 PolarHBondContact O-N 3.37Å; E560-Y563 PolarHBondContact O-N 2.94Å; A561-Y563 VanDerWaalsContact C-N 3.35Å; Y563-F565 PolarHBondContact O-N 3.13Å; Y563-L566 WeakPolarHBondContact O-CB 3.39Å; Y563-L566 PolarHBondContact O-N 3.12Å; Y563-M567 HydrophobicContact CD1-CG 3.89Å; Y563-M567 HydrophobicContact CE1-CG 3.64Å; Y563-M567 HydrophobicContact CE1-SD 4.33Å; Y563-M567 HydrophobicContact CG-CG 4.5Å; Y563-M567 WeakPolarHBondContact O-CB 3.36Å; Y563-M567 WeakPolarHBondContact O-CG 3.37Å; Y563-M567 PolarHBondContact O-N 3.27Å
564	A	62.5	Low	69.8	Low	47 Å²	47	47.1 Å²	47.1	39%	0.388	27%	0.274	S	S	.	.	H	α-helix	trans	-57.4	-49	175.5	0	0	0	0	0	111.2	E560 A561 L566 M567 S568	E560-A564 WeakPolarHBondContact O-CB 3.31Å; E560-A564 PolarHBondContact O-N 2.98Å; A561-A564 PolarHBondContact O-N 2.92Å; A564-L566 PolarHBondContact O-N 3.36Å; A564-M567 PolarHBondContact O-N 2.88Å; A564-S568 PolarHBondContact O-N 3Å; A564-S568 PolarHBondContact O-OG 2.78Å
565	F	66.6	Low	69.3	Low	11 Å²	11	48.4 Å²	48.4	5%	0.048	28%	0.281	C	S	.	.	H	α-helix	trans	-61.1	-44.4	177.1	176.2	-122.6	0	0	0	112.5	Y489 V541 V543 V554 A561 Y563 M567 S569 D570 T574	Y489-F565 HydrophobicContact CD1-CZ 4.34Å; V541-F565 HydrophobicContact CB-CD1 3.74Å; V541-F565 HydrophobicContact CB-CE1 3.97Å; V541-F565 HydrophobicContact CG1-CD1 4.12Å; V541-F565 HydrophobicContact CG1-CE1 4.16Å; V541-F565 HydrophobicContact CG2-CD1 3.74Å; V541-F565 HydrophobicContact CG2-CE1 4.46Å; V543-F565 HydrophobicContact CG1-CE1 3.99Å; V543-F565 HydrophobicContact CG1-CZ 4.37Å; V554-F565 HydrophobicContact CB-CE1 3.98Å; V554-F565 HydrophobicContact CG1-CE1 3.89Å; V554-F565 HydrophobicContact CG1-CZ 4.22Å; V554-F565 HydrophobicContact CG2-CE1 4.18Å; A561-F565 WeakPolarHBondContact O-CB 3.34Å; A561-F565 PolarHBondContact O-N 2.89Å; Y563-F565 PolarHBondContact O-N 3.13Å; F565-M567 PolarHBondContact O-N 3.3Å; F565-S569 WeakPolarHBondContact O-CA 3.15Å; F565-S569 PolarHBondContact O-N 3.12Å; F565-D570 WeakPolarHBondContact CD2-O 3.38Å; F565-T574 HydrophobicContact CB-CG2 4.25Å; F565-T574 HydrophobicContact CD1-CG2 3.74Å; F565-T574 HydrophobicContact CD2-CG2 3.44Å; F565-T574 VanDerWaalsContact CD2-CG2 3.44Å; F565-T574 HydrophobicContact CE1-CG2 3.88Å; F565-T574 HydrophobicContact CE2-CG2 3.57Å; F565-T574 HydrophobicContact CG-CG2 3.53Å; F565-T574 HydrophobicContact CZ-CG2 3.8Å
566	L	62.5	Low	68.4	Low	48 Å²	48	51.3 Å²	51.3	25%	0.251	30%	0.296	S	S	.	.	H	α-helix	trans	-56.9	-40.6	175.6	-169.5	85.9	0	0	0	111.6	P516 I518 V541 A562 Y563 A564	P516-L566 HydrophobicContact CB-CD1 3.67Å; P516-L566 HydrophobicContact CG-CD1 3.75Å; I518-L566 HydrophobicContact CD1-CD2 4.33Å; I518-L566 HydrophobicContact CG1-CB 4.46Å; I518-L566 HydrophobicContact CG1-CD2 4.27Å; V541-L566 HydrophobicContact CG1-CD1 3.74Å; A562-L566 VanDerWaalsContact O-CB 3.3Å; A562-L566 WeakPolarHBondContact O-CB 3.39Å; A562-L566 PolarHBondContact O-N 3.42Å; Y563-L566 WeakPolarHBondContact O-CB 3.39Å; Y563-L566 PolarHBondContact O-N 3.12Å; A564-L566 PolarHBondContact O-N 3.36Å
567	M	54.2	Low	67.3	Low	44 Å²	44	51.3 Å²	51.3	22%	0.217	30%	0.296	C	S	.	.	H	α-helix	trans	-81.7	-38.7	-175.1	-67.2	-49.9	-48.4	0	0	113.6	Y563 A564 F565 W675 I677	Y563-M567 HydrophobicContact CD1-CG 3.89Å; Y563-M567 HydrophobicContact CE1-CG 3.64Å; Y563-M567 HydrophobicContact CE1-SD 4.33Å; Y563-M567 HydrophobicContact CG-CG 4.5Å; Y563-M567 WeakPolarHBondContact O-CB 3.36Å; Y563-M567 WeakPolarHBondContact O-CG 3.37Å; Y563-M567 PolarHBondContact O-N 3.27Å; A564-M567 PolarHBondContact O-N 2.88Å; F565-M567 PolarHBondContact O-N 3.3Å; M567-W675 HydrophobicContact CE-CD2 3.49Å; M567-W675 VanDerWaalsContact CE-CD2 3.49Å; M567-W675 HydrophobicContact CE-CE3 3.09Å; M567-W675 HydrophobicContact CE-CG 4.3Å; M567-W675 HydrophobicContact CE-CH2 3.55Å; M567-W675 HydrophobicContact CE-CZ2 3.92Å; M567-W675 HydrophobicContact CE-CZ3 3.14Å; M567-W675 HydrophobicContact SD-CH2 4.29Å; M567-W675 HydrophobicContact SD-CZ3 4.29Å; M567-I677 WeakPolarHBondContact O-CD1 3.32Å; M567-I677 WeakPolarHBondContact O-CG1 3.43Å
568	S	59.7	Low	66.1	Low	48 Å²	48	57 Å²	57	34%	0.336	31%	0.309	S	S	.	.	H	α-helix	trans	-99.2	-18.7	-174.8	63.3	0	0	0	0	113.7	A564 D570	A564-S568 PolarHBondContact O-N 3Å; A564-S568 PolarHBondContact O-OG 2.78Å; S568-D570 PolarHBondContact O-N 3.48Å; S568-D570 VanDerWaalsContact O-N 3.15Å; S568-D570 WeakPolarHBondContact OG-CB 3.47Å; S568-D570 PolarHBondContact OG-N 3.07Å
569	S	63.4	Low	64.8	Low	91 Å²	91	58 Å²	58	64%	0.636	31%	0.313	S	S	*	.			trans	54	17	-160.8	-55.2	0	0	0	0	113.4	F565 E571	F565-S569 WeakPolarHBondContact O-CA 3.15Å; F565-S569 PolarHBondContact O-N 3.12Å; S569-E571 PolarHBondContact O-N 3.19Å
570	D	69.3	Low	63.9	Low	77 Å²	77	60.2 Å²	60.2	41%	0.412	33%	0.328	S	S	.	.			trans	-80.6	115.6	-179.7	-171.9	-20.5	0	0	0	109.9	F565 S568 T572 G573	F565-D570 WeakPolarHBondContact CD2-O 3.38Å; S568-D570 PolarHBondContact O-N 3.48Å; S568-D570 VanDerWaalsContact O-N 3.15Å; S568-D570 WeakPolarHBondContact OG-CB 3.47Å; S568-D570 PolarHBondContact OG-N 3.07Å; D570-T572 PolarHBondContact O-N 3.18Å; D570-T572 WeakPolarHBondContact OD1-CB 3.11Å; D570-T572 VanDerWaalsContact OD1-CG2 3.27Å; D570-T572 WeakPolarHBondContact OD1-CG2 3.49Å; D570-T572 PolarHBondContact OD1-N 3.32Å; D570-T572 PolarHBondContact OD1-OG1 2.69Å; D570-T572 PolarHBondContact OD2-OG1 3.22Å; D570-T572 VanDerWaalsContact OD2-OG1 3.12Å; D570-G573 PolarHBondContact O-N 2.75Å
571	E	69.2	Low	62.8	Low	74 Å²	74	56 Å²	56	35%	0.346	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-59	-19	-179	-63.9	166	-162.2	0	0	113	P488 S569 G573 T574 I576	P488-E571 WeakPolarHBondContact CB-OE1 3.17Å; P488-E571 HydrophobicContact CG-CG 4.44Å; P488-E571 WeakPolarHBondContact CG-OE1 3.42Å; S569-E571 PolarHBondContact O-N 3.19Å; E571-G573 PolarHBondContact O-N 3.09Å; E571-T574 WeakPolarHBondContact O-CA 3.3Å; E571-T574 WeakPolarHBondContact O-CB 3.32Å; E571-T574 PolarHBondContact O-N 2.79Å; E571-T574 PolarHBondContact O-OG1 3.4Å; E571-I576 HydrophobicContact CB-CD1 3.98Å
572	T	70.8	Confident	61.7	Low	113 Å²	113	61.4 Å²	61.4	69%	0.693	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-61.2	-22.4	174.3	58.9	0	0	0	0	113.5	D570 T574	D570-T572 PolarHBondContact O-N 3.18Å; D570-T572 WeakPolarHBondContact OD1-CB 3.11Å; D570-T572 VanDerWaalsContact OD1-CG2 3.27Å; D570-T572 WeakPolarHBondContact OD1-CG2 3.49Å; D570-T572 PolarHBondContact OD1-N 3.32Å; D570-T572 PolarHBondContact OD1-OG1 2.69Å; D570-T572 PolarHBondContact OD2-OG1 3.22Å; D570-T572 VanDerWaalsContact OD2-OG1 3.12Å; T572-T574 VanDerWaalsContact C-N 3.28Å
573	G	64.8	Low	60.8	Low	12 Å²	12	67.3 Å²	67.3	12%	0.124	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-79.1	-8.8	171.8	0	0	0	0	0	114.1	A561 D570 E571	A561-G573 WeakPolarHBondContact CB-O 3.35Å; D570-G573 PolarHBondContact O-N 2.75Å; E571-G573 PolarHBondContact O-N 3.09Å
574	T	73.4	Confident	60	Low	10 Å²	10	65.1 Å²	65.1	6%	0.061	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-96.8	155.8	178.3	75.1	0	0	0	0	110.6	V554 P555 F565 E571 T572 I576	V554-T574 HydrophobicContact CG1-CG2 3.48Å; V554-T574 VanDerWaalsContact CG1-CG2 3.48Å; P555-T574 WeakPolarHBondContact O-CA 3.21Å; F565-T574 HydrophobicContact CB-CG2 4.25Å; F565-T574 HydrophobicContact CD1-CG2 3.74Å; F565-T574 HydrophobicContact CD2-CG2 3.44Å; F565-T574 VanDerWaalsContact CD2-CG2 3.44Å; F565-T574 HydrophobicContact CE1-CG2 3.88Å; F565-T574 HydrophobicContact CE2-CG2 3.57Å; F565-T574 HydrophobicContact CG-CG2 3.53Å; F565-T574 HydrophobicContact CZ-CG2 3.8Å; E571-T574 WeakPolarHBondContact O-CA 3.3Å; E571-T574 WeakPolarHBondContact O-CB 3.32Å; E571-T574 PolarHBondContact O-N 2.79Å; E571-T574 PolarHBondContact O-OG1 3.4Å; T572-T574 VanDerWaalsContact C-N 3.28Å; T574-I576 VanDerWaalsContact C-N 3.32Å; T574-I576 PolarHBondContact O-N 3.27Å; T574-I576 WeakPolarHBondContact OG1-CG1 3.21Å
575	L	72.4	Confident	59.2	Low	27 Å²	27	66.5 Å²	66.5	14%	0.141	37%	0.365	C	S	.	.			trans	-80.7	84.5	171.4	-63.9	170.5	0	0	0	109	L527 L529 V537 P555 S577	L527-L575 HydrophobicContact CD2-CB 3.29Å; L527-L575 HydrophobicContact CD2-CD1 3.89Å; L527-L575 HydrophobicContact CD2-CG 4.18Å; L529-L575 HydrophobicContact CD2-CD2 4.38Å; V537-L575 HydrophobicContact CG2-CD1 4.16Å; P555-L575 HydrophobicContact CB-CB 4.39Å; P555-L575 HydrophobicContact CB-CD1 4.32Å; P555-L575 HydrophobicContact CG-CB 4.3Å; P555-L575 PolarHBondContact O-N 2.97Å; L575-S577 PolarHBondContact O-N 2.86Å
576	I	66.5	Low	58	Low	62 Å²	62	67.1 Å²	67.1	32%	0.318	37%	0.37	S	S	.	.			trans	-71.9	109.6	176.1	-52.3	175.7	0	0	0	108.8	P481 E571 T574 Q578	P481-I576 HydrophobicContact CG-CG2 4.01Å; E571-I576 HydrophobicContact CB-CD1 3.98Å; T574-I576 VanDerWaalsContact C-N 3.32Å; T574-I576 PolarHBondContact O-N 3.27Å; T574-I576 WeakPolarHBondContact OG1-CG1 3.21Å; I576-Q578 HydrophobicContact CG2-CG 4.41Å
577	S	58.1	Low	57.1	Low	1 Å²	1	70.7 Å²	70.7	1%	0.007	40%	0.4	C	S	.	.			trans	-104.3	107.3	167.8	-170.3	0	0	0	0	110.1	P481 S490 K528 L575 V579	P481-S577 WeakPolarHBondContact CD-O 3.38Å; S490-S577 PolarHBondContact OG-N 3.19Å; K528-S577 PolarHBondContact O-OG 3.43Å; L575-S577 PolarHBondContact O-N 2.86Å; S577-V579 PolarHBondContact OG-O 3.28Å
578	Q	53.2	Low	56.4	Low	170 Å²	170	69.4 Å²	69.4	79%	0.794	40%	0.396	S	S	*	.			trans	-79.6	-9.2	168.7	-69.9	-163.7	-3.7	0	0	112.7	I576	I576-Q578 HydrophobicContact CG2-CG 4.41Å
579	V	51.1	Low	55.6	Low	57 Å²	57	68.8 Å²	68.8	35%	0.345	39%	0.391	S	S	.	.	S	Bend	trans	-87.7	140.8	179.2	-174	0	0	0	0	108.2	P530 S577 P581	P530-V579 HydrophobicContact CB-CG2 4.16Å; P530-V579 HydrophobicContact CG-CG2 4.44Å; S577-V579 PolarHBondContact OG-O 3.28Å; V579-P581 WeakPolarHBondContact O-CD 3Å
580	E	52	Low	54.6	Low	141 Å²	141	74.3 Å²	74.3	66%	0.659	40%	0.404	S	S	*	.			trans	-54.2	114.2	168.3	-86.1	176.5	172.1	0	0	108	K480 Q582	K480-E580 IonicContact NZ-OE1 3.15Å; E580-Q582 PolarHBondContact O-N 2.96Å
581	P	48	Very low	53.4	Low	26 Å²	26	73.7 Å²	73.7	17%	0.169	40%	0.403	C	S	.	.			trans	-61.6	113.3	177	8.4	-4.6	0	0	0	106.3	F477 W478 V579 E583	F477-P581 HydrophobicContact CD2-CG 4.41Å; W478-P581 WeakPolarHBondContact O-CG 3.23Å; V579-P581 WeakPolarHBondContact O-CD 3Å; P581-E583 PolarHBondContact O-N 3.44Å; P581-E583 VanDerWaalsContact O-N 3.13Å
582	Q	49	Very low	52.3	Low	138 Å²	138	72.2 Å²	72.2	65%	0.645	40%	0.401	S	S	*	.			trans	-60	123.2	170	-84.2	-174.3	-19.2	0	0	107.2	K528 E580 A584	K528-Q582 HydrophobicContact CD-CB 4.2Å; E580-Q582 PolarHBondContact O-N 2.96Å; Q582-A584 PolarHBondContact O-N 2.86Å
583	E	48.3	Very low	51.3	Low	124 Å²	124	67 Å²	67	58%	0.579	37%	0.368	S	S	*	.			trans	-40.7	99.2	173.8	-64.1	167.2	167.9	0	0	109.6	L495 P581 P585	L495-E583 HydrophobicContact CD2-CG 4.49Å; P581-E583 PolarHBondContact O-N 3.44Å; P581-E583 VanDerWaalsContact O-N 3.13Å; E583-P585 WeakPolarHBondContact O-CD 3.44Å
584	A	44.1	Very low	50.6	Low	46 Å²	46	67.6 Å²	67.6	38%	0.38	37%	0.369	S	S	.	.			trans	-92.4	91	150.7	0	0	0	0	0	103.4	Q582 S586	Q582-A584 PolarHBondContact O-N 2.86Å; A584-S586 PolarHBondContact O-N 3.2Å
585	P	46.7	Very low	49.5	Very low	76 Å²	76	67.2 Å²	67.2	49%	0.494	37%	0.366	S	S	.	.			trans	-55.4	103.3	167.6	22.5	-30.5	0	0	0	105.1	E583 S587	E583-P585 WeakPolarHBondContact O-CD 3.44Å; P585-S587 PolarHBondContact O-N 2.74Å
586	S	41.6	Very low	48.3	Very low	24 Å²	24	68.5 Å²	68.5	17%	0.168	37%	0.371	C	S	.	.			trans	-64.5	117.2	172.2	101.4	0	0	0	0	102.9	A584 A588 C589	A584-S586 PolarHBondContact O-N 3.2Å; S586-A588 PolarHBondContact O-N 3.34Å; S586-A588 WeakPolarHBondContact OG-CA 3.46Å; S586-A588 WeakPolarHBondContact OG-CB 3.46Å; S586-A588 PolarHBondContact OG-N 3.38Å; S586-C589 PolarHBondContact O-N 3.01Å; S586-C589 PolarHBondContact OG-N 3.25Å
587	S	42.7	Very low	47.2	Very low	124 Å²	124	70.4 Å²	70.4	87%	0.867	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-53.3	-10.8	166.1	51.7	0	0	0	0	111.4	P585 C589	P585-S587 PolarHBondContact O-N 2.74Å; S587-C589 VanDerWaalsContact C-N 3.34Å
588	A	40.7	Very low	46.5	Very low	17 Å²	17	72.7 Å²	72.7	14%	0.14	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-80.3	11.9	170.5	0	0	0	0	0	116.3	N523 S586 K590 T591	N523-A588 HydrophobicContact CB-CB 3.95Å; S586-A588 PolarHBondContact O-N 3.34Å; S586-A588 WeakPolarHBondContact OG-CA 3.46Å; S586-A588 WeakPolarHBondContact OG-CB 3.46Å; S586-A588 PolarHBondContact OG-N 3.38Å; A588-K590 PolarHBondContact O-N 2.94Å; A588-T591 WeakPolarHBondContact CA-OG1 3.29Å; A588-T591 WeakPolarHBondContact CB-OG1 3.13Å; A588-T591 CarbonylContact O-C 3.52Å; A588-T591 WeakPolarHBondContact O-CA 3.33Å; A588-T591 PolarHBondContact O-N 2.85Å; A588-T591 PolarHBondContact O-OG1 2.8Å
589	C	41.6	Very low	45.8	Very low	35 Å²	35	67.8 Å²	67.8	24%	0.236	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-57.1	-15.7	162.8	-76.3	0	0	0	0	113	M465 S586 S587	M465-C589 HydrophobicContact CE-CB 3.61Å; M465-C589 VanDerWaalsContact CE-O 3.25Å; M465-C589 WeakPolarHBondContact CE-O 3.16Å; S586-C589 PolarHBondContact O-N 3.01Å; S586-C589 PolarHBondContact OG-N 3.25Å; S587-C589 VanDerWaalsContact C-N 3.34Å
590	K	43.2	Very low	45.1	Very low	206 Å²	206	70.8 Å²	70.8	90%	0.896	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-85	-21.1	167	-75.6	-175.7	177.7	177.1	0	114.4	A588	A588-K590 PolarHBondContact O-N 2.94Å
591	T	44.2	Very low	44.3	Very low	64 Å²	64	65.5 Å²	65.5	39%	0.393	35%	0.351	S	S	.	.	S	Bend	trans	-98.7	101.5	-173.3	-13.7	0	0	0	0	107.5	N523 A588 M593	N523-T591 VanDerWaalsContact ND2-CG2 3.33Å; N523-T591 WeakPolarHBondContact ND2-CG2 3.29Å; A588-T591 WeakPolarHBondContact CA-OG1 3.29Å; A588-T591 WeakPolarHBondContact CB-OG1 3.13Å; A588-T591 CarbonylContact O-C 3.52Å; A588-T591 WeakPolarHBondContact O-CA 3.33Å; A588-T591 PolarHBondContact O-N 2.85Å; A588-T591 PolarHBondContact O-OG1 2.8Å; T591-M593 PolarHBondContact O-N 3.23Å; T591-M593 VanDerWaalsContact O-N 3.07Å
592	S	46.9	Very low	43.6	Very low	43 Å²	43	68.3 Å²	68.3	30%	0.301	37%	0.365	S	S	.	.			trans	-26.6	115	165.6	51.5	0	0	0	0	112.4	V462 L594	V462-S592 VanDerWaalsContact CG2-CB 3.48Å; S592-L594 PolarHBondContact O-N 2.92Å; S592-L594 VanDerWaalsContact O-N 3.16Å
593	M	48.6	Very low	42.8	Very low	4 Å²	4	64.5 Å²	64.5	2%	0.02	35%	0.348	C	S	.	.			trans	-66.2	114.9	165.5	178.7	173.8	165.7	0	0	106.5	V463 L492 W507 L521 R522 A524 V553 T591	V463-M593 HydrophobicContact CG2-CB 3.96Å; V463-M593 HydrophobicContact CG2-SD 4.31Å; L492-M593 HydrophobicContact CD1-CE 4.41Å; L492-M593 HydrophobicContact CD1-SD 4.08Å; L492-M593 HydrophobicContact CD2-CE 3.71Å; L492-M593 HydrophobicContact CD2-SD 3.32Å; L492-M593 WeakPolarHBondContact CD2-SD 3.19Å; L492-M593 HydrophobicContact CG-SD 4.33Å; W507-M593 HydrophobicContact CH2-CE 4.01Å; W507-M593 HydrophobicContact CH2-CG 4.34Å; W507-M593 HydrophobicContact CH2-SD 4.06Å; L521-M593 HydrophobicContact CB-CE 4.03Å; L521-M593 HydrophobicContact CD1-CE 3.28Å; L521-M593 HydrophobicContact CD2-CE 3.17Å; L521-M593 HydrophobicContact CG-CE 3.61Å; R522-M593 VanDerWaalsContact O-CA 3.28Å; R522-M593 WeakPolarHBondContact O-CA 3.27Å; A524-M593 HydrophobicContact CB-CE 4.28Å; A524-M593 HydrophobicContact CB-SD 4.32Å; V553-M593 HydrophobicContact CG1-CE 4.17Å; T591-M593 PolarHBondContact O-N 3.23Å; T591-M593 VanDerWaalsContact O-N 3.07Å
594	L	51	Low	41.9	Very low	25 Å²	25	61.8 Å²	61.8	13%	0.131	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	120.8	-174.6	-66.9	158.1	0	0	0	108.7	E460 R522 S592	E460-L594 HydrophobicContact CB-CD2 3.61Å; E460-L594 HydrophobicContact CG-CD2 3.75Å; E460-L594 WeakPolarHBondContact OE2-CD2 3.48Å; R522-L594 HydrophobicContact CB-CB 4.12Å; R522-L594 HydrophobicContact CB-CD1 4.29Å; R522-L594 HydrophobicContact CG-CB 4.38Å; R522-L594 PolarHBondContact N-O 2.76Å; R522-L594 PolarHBondContact O-N 3.43Å; S592-L594 PolarHBondContact O-N 2.92Å; S592-L594 VanDerWaalsContact O-N 3.16Å
595	I	50.5	Low	41.2	Very low	1 Å²	1	64 Å²	64	1%	0.005	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	116	164.9	-77	170.3	0	0	0	108.9	H461 W507 L511 V519 E520 L521 V542	H461-I595 HydrophobicContact CB-CB 4.2Å; H461-I595 PolarHBondContact O-N 3.3Å; W507-I595 HydrophobicContact CD2-CD1 4.28Å; W507-I595 HydrophobicContact CE3-CD1 3.75Å; W507-I595 HydrophobicContact CE3-CG1 4.49Å; W507-I595 HydrophobicContact CH2-CD1 3.51Å; W507-I595 HydrophobicContact CH2-CG1 4.1Å; W507-I595 HydrophobicContact CZ2-CD1 4.08Å; W507-I595 HydrophobicContact CZ3-CD1 3.32Å; W507-I595 HydrophobicContact CZ3-CG1 3.77Å; L511-I595 HydrophobicContact CD1-CD1 4.32Å; L511-I595 HydrophobicContact CD2-CD1 3.54Å; V519-I595 HydrophobicContact CB-CB 4.32Å; V519-I595 HydrophobicContact CB-CG1 4.01Å; V519-I595 HydrophobicContact CB-CG2 3.7Å; V519-I595 HydrophobicContact CG1-CB 4.29Å; V519-I595 HydrophobicContact CG1-CD1 4.29Å; V519-I595 HydrophobicContact CG1-CG1 4.17Å; V519-I595 HydrophobicContact CG1-CG2 3.28Å; V519-I595 HydrophobicContact CG2-CD1 4.43Å; V519-I595 HydrophobicContact CG2-CG1 4.17Å; E520-I595 WeakPolarHBondContact O-CA 3.21Å; L521-I595 HydrophobicContact CD2-CG1 3.92Å; V542-I595 HydrophobicContact CG2-CD1 4.3Å
596	K	46.9	Very low	40.7	Very low	54 Å²	54	61.5 Å²	61.5	24%	0.235	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	108.7	167	-134.8	-174.9	172.8	-170	0	107.8	L458 E520 L598	L458-K596 HydrophobicContact CD1-CD 4.18Å; L458-K596 HydrophobicContact CD1-CG 3.97Å; L458-K596 HydrophobicContact CD2-CD 4.4Å; L458-K596 HydrophobicContact CD2-CG 3.6Å; L458-K596 HydrophobicContact CG-CG 4.2Å; E520-K596 HydrophobicContact CB-CB 3.81Å; E520-K596 PolarHBondContact N-O 3.2Å; E520-K596 PolarHBondContact O-N 3.45Å; E520-K596 WeakPolarHBondContact OE2-CD 3.4Å; K596-L598 HydrophobicContact CD-CD1 4.21Å; K596-L598 PolarHBondContact O-N 2.89Å; K596-L598 VanDerWaalsContact O-N 3.12Å
597	R	43.9	Very low	40.6	Very low	102 Å²	102	67.5 Å²	67.5	39%	0.385	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	108.7	171.1	-92.5	175.7	147.2	-165.5	-14.4	109.1	L458 P512	L458-R597 VanDerWaalsContact CD2-O 3.31Å; L458-R597 WeakPolarHBondContact CD2-O 3.05Å; P512-R597 VanDerWaalsContact CG-NE 3.27Å
598	L	42.1	Very low	40.7	Very low	50 Å²	50	64.5 Å²	64.5	26%	0.262	36%	0.359	S	S	.	.			trans	-128	125.1	174.3	-99.4	155.8	0	0	0	109.8	W539 K596	W539-L598 HydrophobicContact CH2-CD1 4.46Å; K596-L598 HydrophobicContact CD-CD1 4.21Å; K596-L598 PolarHBondContact O-N 2.89Å; K596-L598 VanDerWaalsContact O-N 3.12Å
599	H	39.6	Very low	41	Very low	66 Å²	66	67.1 Å²	67.1	31%	0.306	38%	0.381	S	S	.	.			trans	76.2	32.1	161.2	-51.8	-68.2	0	0	0	120	R559 F601	R559-H599 VanDerWaalsContact CZ-NE2 3.34Å; R559-H599 PolarHBondContact NH1-NE2 3.49Å; R559-H599 VanDerWaalsContact NH1-NE2 3.16Å; R559-H599 PolarHBondContact NH2-CD2 3.5Å; R559-H599 PolarHBondContact NH2-NE2 2.79Å; H599-F601 HydrophobicContact CB-CD2 4.26Å; H599-F601 HydrophobicContact CB-CE2 3.85Å; H599-F601 HydrophobicContact CB-CZ 4.4Å; H599-F601 AromaticContact CE1-CZ 3.71Å; H599-F601 AromaticContact CG-CE2 3.93Å; H599-F601 AromaticContact ND1-CE1 3.58Å; H599-F601 AromaticContact ND1-CE2 3.4Å; H599-F601 WeakPolarHBondContact ND1-CE2 3.47Å; H599-F601 AromaticContact ND1-CZ 3.03Å; H599-F601 WeakPolarHBondContact ND1-CZ 3.05Å; H599-F601 PolarHBondContact O-N 2.82Å
600	L	34.8	Very low	41.3	Very low	121 Å²	121	67.3 Å²	67.3	63%	0.634	38%	0.382	S	S	*	.			trans	-74.2	95.1	131.1	-94.9	151.6	0	0	0	104.2	D602	L600-D602 PolarHBondContact O-N 3.34Å
601	F	36.6	Very low	41.8	Very low	29 Å²	29	59 Å²	59	13%	0.127	35%	0.348	C	S	.	.			trans	-62.7	98.8	162.8	-64.8	-81.3	0	0	0	105	H599 I603 L646 A652	H599-F601 HydrophobicContact CB-CD2 4.26Å; H599-F601 HydrophobicContact CB-CE2 3.85Å; H599-F601 HydrophobicContact CB-CZ 4.4Å; H599-F601 AromaticContact CE1-CZ 3.71Å; H599-F601 AromaticContact CG-CE2 3.93Å; H599-F601 AromaticContact ND1-CE1 3.58Å; H599-F601 AromaticContact ND1-CE2 3.4Å; H599-F601 WeakPolarHBondContact ND1-CE2 3.47Å; H599-F601 AromaticContact ND1-CZ 3.03Å; H599-F601 WeakPolarHBondContact ND1-CZ 3.05Å; H599-F601 PolarHBondContact O-N 2.82Å; F601-I603 WeakPolarHBondContact O-CG1 3.23Å; F601-I603 PolarHBondContact O-N 3.2Å; F601-L646 HydrophobicContact CD2-CD2 3.71Å; F601-L646 HydrophobicContact CE1-CD2 4.4Å; F601-L646 HydrophobicContact CE1-CG 4.27Å; F601-L646 HydrophobicContact CE2-CD2 3.07Å; F601-L646 HydrophobicContact CE2-CG 3.79Å; F601-L646 HydrophobicContact CZ-CB 4.49Å; F601-L646 HydrophobicContact CZ-CD2 3.44Å; F601-L646 VanDerWaalsContact CZ-CD2 3.44Å; F601-L646 HydrophobicContact CZ-CG 3.58Å; F601-A652 HydrophobicContact CB-CB 3.45Å; F601-A652 VanDerWaalsContact CB-CB 3.45Å; F601-A652 HydrophobicContact CD1-CB 3.12Å; F601-A652 HydrophobicContact CD2-CB 4.07Å; F601-A652 HydrophobicContact CE1-CB 3.74Å; F601-A652 HydrophobicContact CG-CB 3.26Å; F601-A652 HydrophobicContact CZ-CB 4.44Å
602	D	32.7	Very low	42	Very low	86 Å²	86	63.1 Å²	63.1	46%	0.46	37%	0.367	S	S	.	.			trans	-76.1	83.3	175.9	-172.4	-1.5	0	0	0	106.7	L600 G604 T605	L600-D602 PolarHBondContact O-N 3.34Å; D602-G604 PolarHBondContact O-N 2.81Å; D602-G604 WeakPolarHBondContact OD1-CA 3.28Å; D602-G604 PolarHBondContact OD1-N 3.36Å; D602-G604 VanDerWaalsContact OD1-N 3.1Å; D602-T605 WeakPolarHBondContact CB-OG1 3.27Å; D602-T605 PolarHBondContact O-N 3.44Å; D602-T605 PolarHBondContact OD1-N 3.2Å; D602-T605 WeakPolarHBondContact OD2-CB 3.23Å; D602-T605 WeakPolarHBondContact OD2-CG2 3.26Å; D602-T605 PolarHBondContact OD2-OG1 2.58Å
603	I	31.5	Very low	42.6	Very low	57 Å²	57	66.2 Å²	66.2	29%	0.292	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-16.5	177.1	-47.6	144.1	0	0	0	109.6	F601 F656 Q657	F601-I603 WeakPolarHBondContact O-CG1 3.23Å; F601-I603 PolarHBondContact O-N 3.2Å; I603-F656 HydrophobicContact CD1-CB 3.25Å; I603-F656 HydrophobicContact CD1-CD2 3.89Å; I603-F656 HydrophobicContact CD1-CG 3.69Å; I603-F656 HydrophobicContact CG1-CB 3.71Å; I603-F656 HydrophobicContact CG1-CD2 4.09Å; I603-F656 HydrophobicContact CG1-CG 4.24Å; I603-F656 HydrophobicContact CG2-CB 4.19Å; I603-Q657 HydrophobicContact CG2-CB 3.68Å; I603-Q657 HydrophobicContact CG2-CG 3.88Å
604	G	30.2	Very low	43	Very low	68 Å²	68	68 Å²	68	70%	0.701	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-28.7	178.6	0	0	0	0	0	115.1	D602	D602-G604 PolarHBondContact O-N 2.81Å; D602-G604 WeakPolarHBondContact OD1-CA 3.28Å; D602-G604 PolarHBondContact OD1-N 3.36Å; D602-G604 VanDerWaalsContact OD1-N 3.1Å
605	T	30.1	Very low	42.8	Very low	92 Å²	92	68 Å²	68	56%	0.564	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.4	-2.9	-169.5	55.8	0	0	0	0	115.5	D602 T607	D602-T605 WeakPolarHBondContact CB-OG1 3.27Å; D602-T605 PolarHBondContact O-N 3.44Å; D602-T605 PolarHBondContact OD1-N 3.2Å; D602-T605 WeakPolarHBondContact OD2-CB 3.23Å; D602-T605 WeakPolarHBondContact OD2-CG2 3.26Å; D602-T605 PolarHBondContact OD2-OG1 2.58Å; T605-T607 PolarHBondContact O-N 2.96Å
606	S	36.2	Very low	42.5	Very low	23 Å²	23	71.4 Å²	71.4	16%	0.161	43%	0.425	C	S	.	.			trans	-80	107.3	-172.7	-178.1	0	0	0	0	112.6	T608	S606-T608 PolarHBondContact O-N 3.14Å; S606-T608 VanDerWaalsContact O-N 3.14Å; S606-T608 WeakPolarHBondContact OG-CB 3.32Å; S606-T608 PolarHBondContact OG-N 3.23Å; S606-T608 VanDerWaalsContact OG-N 3.16Å; S606-T608 PolarHBondContact OG-OG1 3.3Å
607	T	38.9	Very low	42.7	Very low	150 Å²	150	71.5 Å²	71.5	92%	0.92	43%	0.425	S	S	*	.			trans	-67.3	3.6	160	50	0	0	0	0	112.7	T605 A609	T605-T607 PolarHBondContact O-N 2.96Å; T607-A609 PolarHBondContact O-N 3.38Å
608	T	45.4	Very low	42.6	Very low	62 Å²	62	74.5 Å²	74.5	38%	0.38	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-76.9	121.8	-178.2	-34.1	0	0	0	0	108.9	S606	S606-T608 PolarHBondContact O-N 3.14Å; S606-T608 VanDerWaalsContact O-N 3.14Å; S606-T608 WeakPolarHBondContact OG-CB 3.32Å; S606-T608 PolarHBondContact OG-N 3.23Å; S606-T608 VanDerWaalsContact OG-N 3.16Å; S606-T608 PolarHBondContact OG-OG1 3.3Å
609	A	47.1	Very low	43.1	Very low	72 Å²	72	73.7 Å²	73.7	60%	0.595	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-59.6	145.2	174	0	0	0	0	0	110.2	T607 S650	T607-A609 PolarHBondContact O-N 3.38Å; A609-S650 VanDerWaalsContact O-CB 3.28Å; A609-S650 WeakPolarHBondContact O-CB 3.33Å; A609-S650 PolarHBondContact O-OG 3.11Å
610	P	48	Very low	43.3	Very low	38 Å²	38	71.4 Å²	71.4	25%	0.247	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-65.9	148.7	178.3	23.8	-31.5	0	0	0	111.9	L612 S650 V653 A654 L659	P610-L612 PolarHBondContact O-N 3.36Å; P610-S650 WeakPolarHBondContact CA-O 3.49Å; P610-V653 HydrophobicContact CB-CB 4.46Å; P610-V653 HydrophobicContact CB-CG1 3.64Å; P610-V653 HydrophobicContact CG-CG1 4.2Å; P610-A654 HydrophobicContact CB-CB 4.02Å; P610-L659 HydrophobicContact CG-CD1 4.35Å; P610-L659 HydrophobicContact CG-CG 4.39Å
611	T	51.9	Low	43.8	Very low	32 Å²	32	72.2 Å²	72.2	20%	0.196	42%	0.422	C	S	.	.			trans	-68.9	99.5	173.1	-50.9	0	0	0	0	108.5	N613 K614 C615 S650 D651	T611-N613 WeakPolarHBondContact CG2-OD1 3.43Å; T611-N613 PolarHBondContact O-N 3.08Å; T611-K614 HydrophobicContact CG2-CD 4.48Å; T611-K614 HydrophobicContact CG2-CG 4.18Å; T611-K614 PolarHBondContact O-N 2.53Å; T611-C615 PolarHBondContact O-N 2.74Å; T611-C615 PolarHBondContact O-SG 3.49Å; T611-S650 WeakPolarHBondContact CA-OG 3.18Å; T611-S650 PolarHBondContact N-O 3.4Å; T611-S650 PolarHBondContact N-OG 2.83Å; T611-S650 VanDerWaalsContact OG1-C 3.31Å; T611-S650 WeakPolarHBondContact OG1-CB 3.23Å; T611-S650 PolarHBondContact OG1-OG 3.39Å; T611-D651 VanDerWaalsContact CB-OD1 3.22Å; T611-D651 WeakPolarHBondContact CB-OD1 3.21Å; T611-D651 PolarHBondContact OG1-N 3.3Å; T611-D651 PolarHBondContact OG1-OD1 3.35Å
612	L	50.2	Low	44.4	Very low	150 Å²	150	73.2 Å²	73.2	79%	0.785	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-48.9	-39.3	-171.4	-83.8	157.1	0	0	0	114.4	P610 K614 C615	P610-L612 PolarHBondContact O-N 3.36Å; L612-K614 VanDerWaalsContact C-N 3.29Å; L612-K614 PolarHBondContact O-N 2.77Å; L612-C615 WeakPolarHBondContact O-CB 3.31Å; L612-C615 PolarHBondContact O-N 2.9Å
613	N	59	Low	46.2	Very low	109 Å²	109	72.2 Å²	72.2	58%	0.583	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-79.1	-6	-178.9	72	-9.8	0	0	0	114.4	T611 K617	T611-N613 WeakPolarHBondContact CG2-OD1 3.43Å; T611-N613 PolarHBondContact O-N 3.08Å; N613-K617 WeakPolarHBondContact O-CE 3.28Å; N613-K617 PolarHBondContact O-NZ 2.84Å
614	K	55.8	Low	48.1	Very low	40 Å²	40	72.6 Å²	72.6	17%	0.174	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-105.1	-9.5	173.1	-60.7	-166.7	-173.5	171.3	0	113.1	T611 L612 K617 W619 L640 D645 D651 A654	T611-K614 HydrophobicContact CG2-CD 4.48Å; T611-K614 HydrophobicContact CG2-CG 4.18Å; T611-K614 PolarHBondContact O-N 2.53Å; L612-K614 VanDerWaalsContact C-N 3.29Å; L612-K614 PolarHBondContact O-N 2.77Å; K614-K617 WeakPolarHBondContact O-CB 3.15Å; K614-K617 PolarHBondContact O-N 3.43Å; K614-W619 HydrophobicContact CB-CZ2 4.14Å; K614-W619 HydrophobicContact CD-CH2 4.12Å; K614-W619 HydrophobicContact CD-CZ2 4.36Å; K614-L640 HydrophobicContact CB-CD1 3.68Å; K614-L640 HydrophobicContact CD-CD1 3.94Å; K614-L640 HydrophobicContact CG-CD1 3.76Å; K614-D645 PolarHBondContact NZ-O 3.18Å; K614-D651 HydrophobicContact CD-CB 4.21Å; K614-D651 VanDerWaalsContact CD-OD1 3.31Å; K614-D651 WeakPolarHBondContact CD-OD1 3.43Å; K614-D651 WeakPolarHBondContact CE-OD1 3.32Å; K614-D651 IonicContact NZ-OD1 3.59Å; K614-D651 PolarHBondContact NZ-OD1 2.92Å; K614-D651 VanDerWaalsContact NZ-OD1 3.15Å; K614-D651 IonicContact NZ-OD2 2.81Å; K614-D651 PolarHBondContact NZ-OD2 2.72Å; K614-A654 HydrophobicContact CB-CB 4.07Å
615	C	48.3	Very low	49.1	Very low	26 Å²	26	71.1 Å²	71.1	18%	0.176	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	136.1	178.6	-65.4	0	0	0	0	111.9	T611 L612 K617 A654 L659	T611-C615 PolarHBondContact O-N 2.74Å; T611-C615 PolarHBondContact O-SG 3.49Å; L612-C615 WeakPolarHBondContact O-CB 3.31Å; L612-C615 PolarHBondContact O-N 2.9Å; C615-K617 PolarHBondContact O-N 3.41Å; C615-A654 VanDerWaalsContact SG-CB 3.56Å; C615-L659 HydrophobicContact CB-CD1 3.24Å; C615-L659 WeakPolarHBondContact SG-CD1 3.33Å
616	G	43.2	Very low	50.4	Low	72 Å²	72	66.8 Å²	66.8	74%	0.742	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	6.9	179	0	0	0	0	0	114.5
617	K	50.4	Low	52.1	Low	56 Å²	56	69 Å²	69	24%	0.243	40%	0.398	C	S	.	.			trans	-81.1	154.8	169	-65.1	-167.3	172.2	-174.7	0	110.4	N613 K614 C615 W619 E637 L638 L640	N613-K617 WeakPolarHBondContact O-CE 3.28Å; N613-K617 PolarHBondContact O-NZ 2.84Å; K614-K617 WeakPolarHBondContact O-CB 3.15Å; K614-K617 PolarHBondContact O-N 3.43Å; C615-K617 PolarHBondContact O-N 3.41Å; K617-W619 VanDerWaalsContact O-CD1 3.23Å; K617-E637 WeakPolarHBondContact CD-O 3.38Å; K617-E637 WeakPolarHBondContact CE-O 2.79Å; K617-E637 PolarHBondContact NZ-O 3.23Å; K617-L638 WeakPolarHBondContact CA-O 3.42Å; K617-L638 WeakPolarHBondContact CB-O 3.49Å; K617-L640 HydrophobicContact CB-CD1 3.86Å; K617-L640 HydrophobicContact CB-CG 3.98Å; K617-L640 HydrophobicContact CD-CD1 3.73Å; K617-L640 HydrophobicContact CD-CD2 4.03Å; K617-L640 HydrophobicContact CD-CG 3.75Å; K617-L640 HydrophobicContact CG-CD1 4.35Å
618	W	43.8	Very low	53	Low	166 Å²	166	64.7 Å²	64.7	63%	0.629	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	136	177.4	-67.6	86.8	0	0	0	109.8	L638 Y639 L640	W618-L638 PolarHBondContact N-O 3.17Å; W618-Y639 HydrophobicContact CB-CD1 3.49Å; W618-Y639 VanDerWaalsContact CB-CD1 3.49Å; W618-Y639 HydrophobicContact CB-CE1 3.56Å; W618-Y639 HydrophobicContact CB-CG 4.31Å; W618-Y639 HydrophobicContact CG-CD1 4.36Å; W618-Y639 AromaticContact CG-CE1 3.98Å; W618-Y639 HydrophobicContact CG-CE1 3.98Å; W618-Y639 CarbonylContact O-C 3.52Å; W618-Y639 VanDerWaalsContact O-CA 3.28Å; W618-Y639 WeakPolarHBondContact O-CA 3.33Å; W618-L640 PolarHBondContact O-N 3.46Å
619	W	50.7	Low	52.8	Low	33 Å²	33	64.8 Å²	64.8	13%	0.125	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	130.6	-176.6	-66.6	79.9	0	0	0	110.9	K614 K617 L640 Y642 D645 L646 D651 A655	K614-W619 HydrophobicContact CB-CZ2 4.14Å; K614-W619 HydrophobicContact CD-CH2 4.12Å; K614-W619 HydrophobicContact CD-CZ2 4.36Å; K617-W619 VanDerWaalsContact O-CD1 3.23Å; W619-L640 CarbonylContact C-O 3.59Å; W619-L640 VanDerWaalsContact CA-O 3.27Å; W619-L640 WeakPolarHBondContact CA-O 3.29Å; W619-L640 HydrophobicContact CD2-CB 3.91Å; W619-L640 HydrophobicContact CD2-CD1 4.37Å; W619-L640 HydrophobicContact CE3-CB 3.82Å; W619-L640 HydrophobicContact CH2-CB 4.33Å; W619-L640 HydrophobicContact CH2-CD1 3.77Å; W619-L640 HydrophobicContact CZ2-CB 4.4Å; W619-L640 HydrophobicContact CZ2-CD1 3.46Å; W619-L640 VanDerWaalsContact CZ2-CD1 3.46Å; W619-L640 HydrophobicContact CZ3-CB 4.03Å; W619-L640 HydrophobicContact CZ3-CD1 4.31Å; W619-Y642 HydrophobicContact CB-CD1 4.08Å; W619-Y642 HydrophobicContact CB-CD2 4.39Å; W619-Y642 HydrophobicContact CB-CE1 3.43Å; W619-Y642 VanDerWaalsContact CB-CE1 3.43Å; W619-Y642 HydrophobicContact CB-CE2 3.79Å; W619-Y642 WeakPolarHBondContact CB-OH 3.4Å; W619-Y642 HydrophobicContact CD2-CD1 4.15Å; W619-Y642 AromaticContact CD2-CE1 3.94Å; W619-Y642 HydrophobicContact CD2-CE1 3.94Å; W619-Y642 AromaticContact CE3-CD1 3.61Å; W619-Y642 HydrophobicContact CE3-CD1 3.61Å; W619-Y642 AromaticContact CE3-CE1 3.9Å; W619-Y642 HydrophobicContact CE3-CE1 3.9Å; W619-Y642 HydrophobicContact CE3-CG 4.35Å; W619-Y642 HydrophobicContact CG-CD1 4.38Å; W619-Y642 AromaticContact CG-CE1 3.78Å; W619-Y642 HydrophobicContact CG-CE1 3.78Å; W619-Y642 HydrophobicContact CZ3-CD1 4.37Å; W619-D645 HydrophobicContact CH2-CB 4.33Å; W619-D645 HydrophobicContact CZ3-CB 3.91Å; W619-L646 HydrophobicContact CE3-CD1 4.28Å; W619-L646 HydrophobicContact CH2-CB 4.45Å; W619-L646 HydrophobicContact CH2-CD1 3.72Å; W619-L646 HydrophobicContact CZ2-CD1 4.46Å; W619-L646 HydrophobicContact CZ3-CB 3.88Å; W619-L646 HydrophobicContact CZ3-CD1 3.64Å; W619-L646 HydrophobicContact CZ3-CG 4.39Å; W619-D651 HydrophobicContact CH2-CB 4.49Å; W619-A655 HydrophobicContact CD2-CB 3.79Å; W619-A655 HydrophobicContact CE3-CB 4.37Å; W619-A655 HydrophobicContact CG-CB 4.21Å; W619-A655 HydrophobicContact CH2-CB 4.14Å; W619-A655 HydrophobicContact CZ2-CB 3.52Å
620	T	44.1	Very low	53.1	Low	18 Å²	18	61.6 Å²	61.6	11%	0.11	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	165.4	172.9	64.6	0	0	0	0	110.3	T622 S626 I629 Y639 L640 A641 Y642	T620-T622 PolarHBondContact OG1-O 2.8Å; T620-S626 WeakPolarHBondContact OG1-CA 3.32Å; T620-S626 VanDerWaalsContact OG1-CB 3.23Å; T620-S626 WeakPolarHBondContact OG1-CB 3.37Å; T620-S626 PolarHBondContact OG1-N 3.38Å; T620-S626 VanDerWaalsContact OG1-N 3.13Å; T620-I629 HydrophobicContact CG2-CD1 3.88Å; T620-Y639 HydrophobicContact CG2-CD1 4.46Å; T620-L640 PolarHBondContact N-O 2.79Å; T620-L640 PolarHBondContact OG1-O 2.89Å; T620-A641 CarbonylContact O-C 3.29Å; T620-A641 VanDerWaalsContact O-CA 3.26Å; T620-A641 WeakPolarHBondContact O-CA 3.5Å; T620-Y642 WeakPolarHBondContact O-CD2 3.41Å; T620-Y642 PolarHBondContact O-N 3.01Å
621	E	46	Very low	53.4	Low	138 Å²	138	68 Å²	68	65%	0.645	36%	0.362	S	S	*	.	S	Bend	trans	-62	-59.4	176.5	-172.2	-179.8	-171.3	0	0	111.8	E643	E621-E643 WeakPolarHBondContact O-CB 3.34Å; E621-E643 PolarHBondContact O-N 3.23Å; E621-E643 VanDerWaalsContact O-N 3.11Å
622	T	49.9	Very low	53.1	Low	50 Å²	50	76.8 Å²	76.8	31%	0.307	39%	0.391	S	S	.	.	S	Bend	trans	-111.4	157.5	-174.6	63	0	0	0	0	113.1	T620 A624 A625 S626 A641 E643	T620-T622 PolarHBondContact OG1-O 2.8Å; T622-A624 VanDerWaalsContact C-N 3.28Å; T622-A624 PolarHBondContact O-N 2.85Å; T622-A625 PolarHBondContact O-N 2.9Å; T622-A625 PolarHBondContact OG1-N 3.27Å; T622-S626 PolarHBondContact O-N 2.9Å; T622-A641 WeakPolarHBondContact O-CB 3.29Å; T622-E643 WeakPolarHBondContact CA-OE2 3.38Å; T622-E643 VanDerWaalsContact CB-OE2 3.28Å; T622-E643 WeakPolarHBondContact CB-OE2 3.39Å
623	K	70.3	Confident	52.7	Low	64 Å²	64	72.2 Å²	72.2	28%	0.278	37%	0.371	S	S	.	.	H	α-helix	trans	-63.2	-37.1	177.1	-168.7	53.5	162.8	-166.5	0	112.3	A625 S626 D627 A641 E643 T644 D645	K623-A625 VanDerWaalsContact C-N 3.32Å; K623-A625 PolarHBondContact O-N 2.99Å; K623-S626 WeakPolarHBondContact O-CB 3.27Å; K623-S626 PolarHBondContact O-N 2.77Å; K623-D627 WeakPolarHBondContact O-CB 3.34Å; K623-D627 VanDerWaalsContact O-CG 3.27Å; K623-D627 PolarHBondContact O-N 2.87Å; K623-A641 HydrophobicContact CB-CB 4.21Å; K623-A641 HydrophobicContact CD-CB 4.19Å; K623-E643 PolarHBondContact N-OE2 3.3Å; K623-T644 HydrophobicContact CB-CG2 4.03Å; K623-D645 IonicContact NZ-OD1 3.07Å; K623-D645 PolarHBondContact NZ-OD1 2.9Å; K623-D645 IonicContact NZ-OD2 2.75Å; K623-D645 PolarHBondContact NZ-OD2 3.35Å
624	A	70.8	Confident	51.9	Low	66 Å²	66	70.1 Å²	70.1	55%	0.545	38%	0.376	S	S	.	.	H	α-helix	trans	-59	-42.3	175.7	0	0	0	0	0	112.1	T622 D627 V628	T622-A624 VanDerWaalsContact C-N 3.28Å; T622-A624 PolarHBondContact O-N 2.85Å; A624-D627 PolarHBondContact O-N 3.02Å; A624-V628 VanDerWaalsContact O-CG2 3.27Å; A624-V628 WeakPolarHBondContact O-CG2 3.43Å; A624-V628 PolarHBondContact O-N 3Å
625	A	51	Low	51.3	Low	36 Å²	36	71 Å²	71	30%	0.298	39%	0.386	S	S	.	.	H	α-helix	trans	-65.4	-47.3	177	0	0	0	0	0	111.9	T622 K623 D627 V628 I629	T622-A625 PolarHBondContact O-N 2.9Å; T622-A625 PolarHBondContact OG1-N 3.27Å; K623-A625 VanDerWaalsContact C-N 3.32Å; K623-A625 PolarHBondContact O-N 2.99Å; A625-D627 VanDerWaalsContact C-N 3.31Å; A625-D627 PolarHBondContact O-N 2.95Å; A625-V628 PolarHBondContact O-N 2.81Å; A625-I629 WeakPolarHBondContact O-CG1 3.21Å; A625-I629 PolarHBondContact O-N 3.08Å
626	S	57.8	Low	51.4	Low	1 Å²	1	79.9 Å²	79.9	1%	0.007	42%	0.416	C	S	.	.	H	α-helix	trans	-52.6	-49.7	173.3	168.8	0	0	0	0	110.9	T620 T622 K623 V628 I629 A630 Y639	T620-S626 WeakPolarHBondContact OG1-CA 3.32Å; T620-S626 VanDerWaalsContact OG1-CB 3.23Å; T620-S626 WeakPolarHBondContact OG1-CB 3.37Å; T620-S626 PolarHBondContact OG1-N 3.38Å; T620-S626 VanDerWaalsContact OG1-N 3.13Å; T622-S626 PolarHBondContact O-N 2.9Å; K623-S626 WeakPolarHBondContact O-CB 3.27Å; K623-S626 PolarHBondContact O-N 2.77Å; S626-V628 VanDerWaalsContact C-N 3.35Å; S626-V628 PolarHBondContact O-N 3.11Å; S626-I629 PolarHBondContact O-N 2.82Å; S626-A630 WeakPolarHBondContact O-CB 3.38Å; S626-A630 PolarHBondContact O-N 2.91Å; S626-Y639 WeakPolarHBondContact OG-CB 3.42Å; S626-Y639 PolarHBondContact OG-O 3.4Å
627	D	71.7	Confident	52.1	Low	69 Å²	69	83.9 Å²	83.9	37%	0.369	42%	0.415	S	S	.	.	H	α-helix	trans	-68.3	-31.2	-176.6	-70.5	-12.4	0	0	0	113.4	K623 A624 A625 R631	K623-D627 WeakPolarHBondContact O-CB 3.34Å; K623-D627 VanDerWaalsContact O-CG 3.27Å; K623-D627 PolarHBondContact O-N 2.87Å; A624-D627 PolarHBondContact O-N 3.02Å; A625-D627 VanDerWaalsContact C-N 3.31Å; A625-D627 PolarHBondContact O-N 2.95Å; D627-R631 VanDerWaalsContact O-CB 3.28Å; D627-R631 WeakPolarHBondContact O-CB 3.24Å; D627-R631 WeakPolarHBondContact O-CG 3.28Å; D627-R631 PolarHBondContact O-N 2.66Å; D627-R631 VanDerWaalsContact O-N 3.1Å; D627-R631 PolarHBondContact O-NE 2.89Å; D627-R631 VanDerWaalsContact O-NE 3.12Å
628	V	57	Low	52.2	Low	60 Å²	60	85 Å²	85	36%	0.364	42%	0.423	S	S	.	.	H	α-helix	trans	-68.7	-47.5	173.7	168.2	0	0	0	0	110.2	A624 A625 S626 R631 R632	A624-V628 VanDerWaalsContact O-CG2 3.27Å; A624-V628 WeakPolarHBondContact O-CG2 3.43Å; A624-V628 PolarHBondContact O-N 3Å; A625-V628 PolarHBondContact O-N 2.81Å; S626-V628 VanDerWaalsContact C-N 3.35Å; S626-V628 PolarHBondContact O-N 3.11Å; V628-R631 PolarHBondContact O-N 3.26Å; V628-R632 WeakPolarHBondContact O-CG 3.1Å; V628-R632 PolarHBondContact O-N 3.16Å
629	I	42.8	Very low	52.5	Low	65 Å²	65	78.5 Å²	78.5	33%	0.333	40%	0.399	S	S	.	.	H	α-helix	trans	-66.5	-47.4	-180	-62.5	173.2	0	0	0	110.2	T620 A625 S626 R631 R632 C633 Y639	T620-I629 HydrophobicContact CG2-CD1 3.88Å; A625-I629 WeakPolarHBondContact O-CG1 3.21Å; A625-I629 PolarHBondContact O-N 3.08Å; S626-I629 PolarHBondContact O-N 2.82Å; I629-R631 VanDerWaalsContact C-N 3.26Å; I629-R631 PolarHBondContact O-N 3.46Å; I629-R632 PolarHBondContact O-N 2.99Å; I629-C633 PolarHBondContact O-N 3.02Å; I629-C633 PolarHBondContact O-SG 3.33Å; I629-Y639 HydrophobicContact CB-CD1 4.37Å; I629-Y639 HydrophobicContact CB-CE1 4.36Å; I629-Y639 HydrophobicContact CG2-CD1 3.88Å; I629-Y639 HydrophobicContact CG2-CD2 4.25Å; I629-Y639 HydrophobicContact CG2-CE1 3.41Å; I629-Y639 VanDerWaalsContact CG2-CE1 3.41Å; I629-Y639 HydrophobicContact CG2-CE2 3.84Å; I629-Y639 HydrophobicContact CG2-CG 4.28Å
630	A	52.6	Low	53.1	Low	4 Å²	4	77.6 Å²	77.6	3%	0.033	40%	0.396	C	S	.	.	H	α-helix	trans	-58.6	-37.2	178.6	0	0	0	0	0	112.4	S626 G634 C635 Y639	S626-A630 WeakPolarHBondContact O-CB 3.38Å; S626-A630 PolarHBondContact O-N 2.91Å; A630-G634 PolarHBondContact O-N 3.04Å; A630-G634 VanDerWaalsContact O-N 3.1Å; A630-C635 PolarHBondContact O-N 2.96Å; A630-C635 VanDerWaalsContact O-N 3.13Å; A630-Y639 HydrophobicContact CB-CD2 4.07Å
631	R	53.7	Low	53.7	Low	174 Å²	174	76.7 Å²	76.7	66%	0.657	39%	0.391	S	S	*	.	H	α-helix	trans	-66.5	-45.2	171.7	-87	-176.5	-78.6	-165.8	-4.4	112.4	D627 V628 I629 G634	D627-R631 VanDerWaalsContact O-CB 3.28Å; D627-R631 WeakPolarHBondContact O-CB 3.24Å; D627-R631 WeakPolarHBondContact O-CG 3.28Å; D627-R631 PolarHBondContact O-N 2.66Å; D627-R631 VanDerWaalsContact O-N 3.1Å; D627-R631 PolarHBondContact O-NE 2.89Å; D627-R631 VanDerWaalsContact O-NE 3.12Å; V628-R631 PolarHBondContact O-N 3.26Å; I629-R631 VanDerWaalsContact C-N 3.26Å; I629-R631 PolarHBondContact O-N 3.46Å; R631-G634 PolarHBondContact O-N 3.02Å
632	R	47.1	Very low	54	Low	215 Å²	215	73.8 Å²	73.8	81%	0.811	38%	0.375	S	S	*	.	H	α-helix	trans	-66.8	-37.4	-178.5	-74.8	-179.6	179.1	-167.2	0.6	112.7	V628 I629	V628-R632 WeakPolarHBondContact O-CG 3.1Å; V628-R632 PolarHBondContact O-N 3.16Å; I629-R632 PolarHBondContact O-N 2.99Å
633	C	40.8	Very low	54.2	Low	54 Å²	54	76.6 Å²	76.6	37%	0.365	38%	0.384	S	S	.	.	H	α-helix	trans	-89.1	-9.3	-179.7	74.6	0	0	0	0	113.8	I629 C635 Y639	I629-C633 PolarHBondContact O-N 3.02Å; I629-C633 PolarHBondContact O-SG 3.33Å; C633-C635 VanDerWaalsContact C-N 3.31Å; C633-C635 PolarHBondContact O-N 2.86Å; C633-C635 PolarHBondContact O-SG 3.45Å; C633-C635 PolarHBondContact SG-N 3.19Å; C633-C635 VanDerWaalsContact SG-N 3.35Å; C633-Y639 WeakPolarHBondContact SG-CE2 3.35Å
634	G	41.2	Very low	54.2	Low	66 Å²	66	77.3 Å²	77.3	68%	0.68	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	17.2	-176.3	0	0	0	0	0	115	A630 R631	A630-G634 PolarHBondContact O-N 3.04Å; A630-G634 VanDerWaalsContact O-N 3.1Å; R631-G634 PolarHBondContact O-N 3.02Å
635	C	44.2	Very low	54.2	Low	57 Å²	57	75.6 Å²	75.6	39%	0.385	38%	0.376	S	S	.	.			trans	-119.9	80.1	-176.3	-53.5	0	0	0	0	111.3	A630 C633 E637 L638	A630-C635 PolarHBondContact O-N 2.96Å; A630-C635 VanDerWaalsContact O-N 3.13Å; C633-C635 VanDerWaalsContact C-N 3.31Å; C633-C635 PolarHBondContact O-N 2.86Å; C633-C635 PolarHBondContact O-SG 3.45Å; C633-C635 PolarHBondContact SG-N 3.19Å; C633-C635 VanDerWaalsContact SG-N 3.35Å; C635-E637 PolarHBondContact O-N 3.28Å; C635-E637 VanDerWaalsContact O-N 3.13Å; C635-L638 HydrophobicContact CB-CB 3.94Å; C635-L638 PolarHBondContact O-N 3.34Å
636	R	50.4	Low	54.6	Low	213 Å²	213	74.8 Å²	74.8	80%	0.804	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-27.3	-173.5	-79.1	-173.3	177.5	178.6	-0.2	115.8
637	E	58.7	Low	54.8	Low	157 Å²	157	77.5 Å²	77.5	73%	0.734	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-3.9	-174.2	-62.2	-170	179.2	0	0	114.2	K617 C635	K617-E637 WeakPolarHBondContact CD-O 3.38Å; K617-E637 WeakPolarHBondContact CE-O 2.79Å; K617-E637 PolarHBondContact NZ-O 3.23Å; C635-E637 PolarHBondContact O-N 3.28Å; C635-E637 VanDerWaalsContact O-N 3.13Å
638	L	51.8	Low	54.2	Low	79 Å²	79	77.9 Å²	77.9	41%	0.414	40%	0.396	S	S	.	.	S	Bend	trans	-83	-19.3	-173.5	-144.3	89.4	0	0	0	113	K617 W618 C635	K617-L638 WeakPolarHBondContact CA-O 3.42Å; K617-L638 WeakPolarHBondContact CB-O 3.49Å; W618-L638 PolarHBondContact N-O 3.17Å; C635-L638 HydrophobicContact CB-CB 3.94Å; C635-L638 PolarHBondContact O-N 3.34Å
639	Y	50.9	Low	54.1	Low	30 Å²	30	78.6 Å²	78.6	12%	0.118	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	135.4	-175.3	-62.8	-91.4	0	0	0	111	W618 T620 S626 I629 A630 C633	W618-Y639 HydrophobicContact CB-CD1 3.49Å; W618-Y639 VanDerWaalsContact CB-CD1 3.49Å; W618-Y639 HydrophobicContact CB-CE1 3.56Å; W618-Y639 HydrophobicContact CB-CG 4.31Å; W618-Y639 HydrophobicContact CG-CD1 4.36Å; W618-Y639 AromaticContact CG-CE1 3.98Å; W618-Y639 HydrophobicContact CG-CE1 3.98Å; W618-Y639 CarbonylContact O-C 3.52Å; W618-Y639 VanDerWaalsContact O-CA 3.28Å; W618-Y639 WeakPolarHBondContact O-CA 3.33Å; T620-Y639 HydrophobicContact CG2-CD1 4.46Å; S626-Y639 WeakPolarHBondContact OG-CB 3.42Å; S626-Y639 PolarHBondContact OG-O 3.4Å; I629-Y639 HydrophobicContact CB-CD1 4.37Å; I629-Y639 HydrophobicContact CB-CE1 4.36Å; I629-Y639 HydrophobicContact CG2-CD1 3.88Å; I629-Y639 HydrophobicContact CG2-CD2 4.25Å; I629-Y639 HydrophobicContact CG2-CE1 3.41Å; I629-Y639 VanDerWaalsContact CG2-CE1 3.41Å; I629-Y639 HydrophobicContact CG2-CE2 3.84Å; I629-Y639 HydrophobicContact CG2-CG 4.28Å; A630-Y639 HydrophobicContact CB-CD2 4.07Å; C633-Y639 WeakPolarHBondContact SG-CE2 3.35Å
640	L	61.3	Low	54.8	Low	13 Å²	13	76.5 Å²	76.5	7%	0.068	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	159	176.4	-63.7	-178	0	0	0	108.7	K614 K617 W618 W619 T620 D645	K614-L640 HydrophobicContact CB-CD1 3.68Å; K614-L640 HydrophobicContact CD-CD1 3.94Å; K614-L640 HydrophobicContact CG-CD1 3.76Å; K617-L640 HydrophobicContact CB-CD1 3.86Å; K617-L640 HydrophobicContact CB-CG 3.98Å; K617-L640 HydrophobicContact CD-CD1 3.73Å; K617-L640 HydrophobicContact CD-CD2 4.03Å; K617-L640 HydrophobicContact CD-CG 3.75Å; K617-L640 HydrophobicContact CG-CD1 4.35Å; W618-L640 PolarHBondContact O-N 3.46Å; W619-L640 CarbonylContact C-O 3.59Å; W619-L640 VanDerWaalsContact CA-O 3.27Å; W619-L640 WeakPolarHBondContact CA-O 3.29Å; W619-L640 HydrophobicContact CD2-CB 3.91Å; W619-L640 HydrophobicContact CD2-CD1 4.37Å; W619-L640 HydrophobicContact CE3-CB 3.82Å; W619-L640 HydrophobicContact CH2-CB 4.33Å; W619-L640 HydrophobicContact CH2-CD1 3.77Å; W619-L640 HydrophobicContact CZ2-CB 4.4Å; W619-L640 HydrophobicContact CZ2-CD1 3.46Å; W619-L640 VanDerWaalsContact CZ2-CD1 3.46Å; W619-L640 HydrophobicContact CZ3-CB 4.03Å; W619-L640 HydrophobicContact CZ3-CD1 4.31Å; T620-L640 PolarHBondContact N-O 2.79Å; T620-L640 PolarHBondContact OG1-O 2.89Å; L640-D645 WeakPolarHBondContact CA-OD2 3.41Å; L640-D645 HydrophobicContact CB-CB 3.82Å; L640-D645 HydrophobicContact CD1-CB 4.48Å; L640-D645 HydrophobicContact CD2-CB 4.03Å; L640-D645 HydrophobicContact CG-CB 4.32Å
641	A	57.8	Low	55.1	Low	0 Å²	0	76.6 Å²	76.6	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	134	176	0	0	0	0	0	111.8	T620 T622 K623 E643 T644 D645	T620-A641 CarbonylContact O-C 3.29Å; T620-A641 VanDerWaalsContact O-CA 3.26Å; T620-A641 WeakPolarHBondContact O-CA 3.5Å; T622-A641 WeakPolarHBondContact O-CB 3.29Å; K623-A641 HydrophobicContact CB-CB 4.21Å; K623-A641 HydrophobicContact CD-CB 4.19Å; A641-E643 PolarHBondContact O-N 3.23Å; A641-T644 PolarHBondContact O-N 2.98Å; A641-D645 PolarHBondContact N-OD2 2.97Å; A641-D645 WeakPolarHBondContact O-CA 3.11Å; A641-D645 VanDerWaalsContact O-CB 3.3Å; A641-D645 WeakPolarHBondContact O-CB 3.13Å; A641-D645 PolarHBondContact O-N 3.2Å
642	Y	51.5	Low	55	Low	77 Å²	77	68.4 Å²	68.4	30%	0.302	36%	0.359	S	S	.	.	H	α-helix	trans	-57.5	-35.3	174.6	-63.9	-60.2	0	0	0	111.7	W619 T620 T644 L646 A655 F656	W619-Y642 HydrophobicContact CB-CD1 4.08Å; W619-Y642 HydrophobicContact CB-CD2 4.39Å; W619-Y642 HydrophobicContact CB-CE1 3.43Å; W619-Y642 VanDerWaalsContact CB-CE1 3.43Å; W619-Y642 HydrophobicContact CB-CE2 3.79Å; W619-Y642 WeakPolarHBondContact CB-OH 3.4Å; W619-Y642 HydrophobicContact CD2-CD1 4.15Å; W619-Y642 AromaticContact CD2-CE1 3.94Å; W619-Y642 HydrophobicContact CD2-CE1 3.94Å; W619-Y642 AromaticContact CE3-CD1 3.61Å; W619-Y642 HydrophobicContact CE3-CD1 3.61Å; W619-Y642 AromaticContact CE3-CE1 3.9Å; W619-Y642 HydrophobicContact CE3-CE1 3.9Å; W619-Y642 HydrophobicContact CE3-CG 4.35Å; W619-Y642 HydrophobicContact CG-CD1 4.38Å; W619-Y642 AromaticContact CG-CE1 3.78Å; W619-Y642 HydrophobicContact CG-CE1 3.78Å; W619-Y642 HydrophobicContact CZ3-CD1 4.37Å; T620-Y642 WeakPolarHBondContact O-CD2 3.41Å; T620-Y642 PolarHBondContact O-N 3.01Å; Y642-T644 PolarHBondContact O-N 2.63Å; Y642-L646 HydrophobicContact CD1-CD1 4.33Å; Y642-L646 HydrophobicContact CD1-CD2 4.21Å; Y642-L646 WeakPolarHBondContact O-CB 3.05Å; Y642-A655 HydrophobicContact CE1-CB 4.36Å; Y642-F656 HydrophobicContact CD1-CE1 4.41Å; Y642-F656 AromaticContact CD1-CZ 3.84Å; Y642-F656 HydrophobicContact CD1-CZ 3.84Å; Y642-F656 AromaticContact CE1-CE1 3.53Å; Y642-F656 HydrophobicContact CE1-CE1 3.53Å; Y642-F656 HydrophobicContact CE1-CE2 4.31Å; Y642-F656 AromaticContact CE1-CZ 3.38Å; Y642-F656 HydrophobicContact CE1-CZ 3.38Å; Y642-F656 AromaticContact CZ-CE1 3.86Å
643	E	55.2	Low	55	Low	109 Å²	109	58.3 Å²	58.3	51%	0.509	32%	0.321	S	S	.	.	H	α-helix	trans	-58.6	-41.8	177.1	-177.3	-170.7	-165	0	0	114.1	E621 T622 K623 A641	E621-E643 WeakPolarHBondContact O-CB 3.34Å; E621-E643 PolarHBondContact O-N 3.23Å; E621-E643 VanDerWaalsContact O-N 3.11Å; T622-E643 WeakPolarHBondContact CA-OE2 3.38Å; T622-E643 VanDerWaalsContact CB-OE2 3.28Å; T622-E643 WeakPolarHBondContact CB-OE2 3.39Å; K623-E643 PolarHBondContact N-OE2 3.3Å; A641-E643 PolarHBondContact O-N 3.23Å
644	T	70.5	Confident	55.6	Low	78 Å²	78	56.1 Å²	56.1	48%	0.479	31%	0.307	S	S	.	.	H	α-helix	trans	-122	-29.4	-168	53.1	0	0	0	0	114.3	K623 A641 Y642	K623-T644 HydrophobicContact CB-CG2 4.03Å; A641-T644 PolarHBondContact O-N 2.98Å; Y642-T644 PolarHBondContact O-N 2.63Å
645	D	70.2	Confident	55.9	Low	30 Å²	30	54 Å²	54	16%	0.16	28%	0.283	C	S	.	.	H	α-helix	trans	-97.2	-7.5	-174.5	-63	-64.4	0	0	0	112.5	K614 W619 K623 L640 A641 G647	K614-D645 PolarHBondContact NZ-O 3.18Å; W619-D645 HydrophobicContact CH2-CB 4.33Å; W619-D645 HydrophobicContact CZ3-CB 3.91Å; K623-D645 IonicContact NZ-OD1 3.07Å; K623-D645 PolarHBondContact NZ-OD1 2.9Å; K623-D645 IonicContact NZ-OD2 2.75Å; K623-D645 PolarHBondContact NZ-OD2 3.35Å; L640-D645 WeakPolarHBondContact CA-OD2 3.41Å; L640-D645 HydrophobicContact CB-CB 3.82Å; L640-D645 HydrophobicContact CD1-CB 4.48Å; L640-D645 HydrophobicContact CD2-CB 4.03Å; L640-D645 HydrophobicContact CG-CB 4.32Å; A641-D645 PolarHBondContact N-OD2 2.97Å; A641-D645 WeakPolarHBondContact O-CA 3.11Å; A641-D645 VanDerWaalsContact O-CB 3.3Å; A641-D645 WeakPolarHBondContact O-CB 3.13Å; A641-D645 PolarHBondContact O-N 3.2Å; D645-G647 PolarHBondContact O-N 2.75Å
646	L	58.5	Low	55.8	Low	20 Å²	20	55.3 Å²	55.3	11%	0.105	28%	0.282	C	S	.	.			trans	-96.2	78	178.7	-159.5	80.3	0	0	0	111	F601 W619 Y642 D651 A652 A655 F656	F601-L646 HydrophobicContact CD2-CD2 3.71Å; F601-L646 HydrophobicContact CE1-CD2 4.4Å; F601-L646 HydrophobicContact CE1-CG 4.27Å; F601-L646 HydrophobicContact CE2-CD2 3.07Å; F601-L646 HydrophobicContact CE2-CG 3.79Å; F601-L646 HydrophobicContact CZ-CB 4.49Å; F601-L646 HydrophobicContact CZ-CD2 3.44Å; F601-L646 VanDerWaalsContact CZ-CD2 3.44Å; F601-L646 HydrophobicContact CZ-CG 3.58Å; W619-L646 HydrophobicContact CE3-CD1 4.28Å; W619-L646 HydrophobicContact CH2-CB 4.45Å; W619-L646 HydrophobicContact CH2-CD1 3.72Å; W619-L646 HydrophobicContact CZ2-CD1 4.46Å; W619-L646 HydrophobicContact CZ3-CB 3.88Å; W619-L646 HydrophobicContact CZ3-CD1 3.64Å; W619-L646 HydrophobicContact CZ3-CG 4.39Å; Y642-L646 HydrophobicContact CD1-CD1 4.33Å; Y642-L646 HydrophobicContact CD1-CD2 4.21Å; Y642-L646 WeakPolarHBondContact O-CB 3.05Å; L646-D651 HydrophobicContact CD1-CB 4.44Å; L646-A652 HydrophobicContact CD1-CB 4.08Å; L646-A655 HydrophobicContact CD1-CB 3.85Å; L646-F656 HydrophobicContact CD1-CE2 4.12Å; L646-F656 HydrophobicContact CD2-CE2 4.09Å; L646-F656 HydrophobicContact CD2-CZ 4.47Å
647	G	62.2	Low	55.2	Low	57 Å²	57	49 Å²	49	59%	0.588	26%	0.262	S	S	*	.			trans	-92.1	-24.6	-169.5	0	0	0	0	0	115.7	D645 D651	D645-G647 PolarHBondContact O-N 2.75Å; G647-D651 PolarHBondContact N-OD2 3.41Å
648	N	60.8	Low	53.8	Low	77 Å²	77	44.1 Å²	44.1	41%	0.412	24%	0.244	S	C	.	.	S	Bend	trans	-154.9	174.9	-173.1	60.8	47.9	0	0	0	112.3	S650 D651 A652	N648-S650 VanDerWaalsContact C-N 3.28Å; N648-S650 PolarHBondContact O-N 3.31Å; N648-S650 WeakPolarHBondContact OD1-CA 3.44Å; N648-S650 VanDerWaalsContact OD1-CB 3.25Å; N648-S650 WeakPolarHBondContact OD1-CB 3.17Å; N648-S650 PolarHBondContact OD1-N 3.03Å; N648-D651 WeakPolarHBondContact O-CB 3.22Å; N648-D651 PolarHBondContact O-N 2.79Å; N648-D651 VanDerWaalsContact O-N 3.13Å; N648-D651 VanDerWaalsContact OD1-CG 3.24Å; N648-D651 PolarHBondContact OD1-N 3.49Å; N648-A652 PolarHBondContact O-N 3.04Å; N648-A652 VanDerWaalsContact O-N 3.1Å
649	D	54.1	Low	52.6	Low	75 Å²	75	43.9 Å²	43.9	40%	0.401	24%	0.243	S	C	.	.	H	α-helix	trans	-62	-33.4	-179.5	-64.3	-14.2	0	0	0	113.1	D651 A652 V653	D649-D651 VanDerWaalsContact C-N 3.33Å; D649-D651 PolarHBondContact O-N 2.76Å; D649-A652 PolarHBondContact O-N 3.43Å; D649-V653 VanDerWaalsContact O-CB 3.3Å; D649-V653 WeakPolarHBondContact O-CB 3.23Å; D649-V653 WeakPolarHBondContact O-CG2 3.24Å; D649-V653 PolarHBondContact O-N 3.34Å
650	S	56.4	Low	51.2	Low	22 Å²	22	52.4 Å²	52.4	15%	0.154	28%	0.281	C	S	.	.	H	α-helix	trans	-64.6	-36.2	175.5	171.1	0	0	0	0	111.8	A609 P610 T611 N648 A654	A609-S650 VanDerWaalsContact O-CB 3.28Å; A609-S650 WeakPolarHBondContact O-CB 3.33Å; A609-S650 PolarHBondContact O-OG 3.11Å; P610-S650 WeakPolarHBondContact CA-O 3.49Å; T611-S650 WeakPolarHBondContact CA-OG 3.18Å; T611-S650 PolarHBondContact N-O 3.4Å; T611-S650 PolarHBondContact N-OG 2.83Å; T611-S650 VanDerWaalsContact OG1-C 3.31Å; T611-S650 WeakPolarHBondContact OG1-CB 3.23Å; T611-S650 PolarHBondContact OG1-OG 3.39Å; N648-S650 VanDerWaalsContact C-N 3.28Å; N648-S650 PolarHBondContact O-N 3.31Å; N648-S650 WeakPolarHBondContact OD1-CA 3.44Å; N648-S650 VanDerWaalsContact OD1-CB 3.25Å; N648-S650 WeakPolarHBondContact OD1-CB 3.17Å; N648-S650 PolarHBondContact OD1-N 3.03Å; S650-A654 WeakPolarHBondContact O-CB 3.4Å; S650-A654 PolarHBondContact O-N 2.77Å
651	D	59.9	Low	49.3	Very low	5 Å²	5	57.5 Å²	57.5	3%	0.027	31%	0.312	C	S	.	.	H	α-helix	trans	-71.4	-40.7	175	-64.1	-25.6	0	0	0	111.4	T611 K614 W619 L646 G647 N648 D649 A654 A655	T611-D651 VanDerWaalsContact CB-OD1 3.22Å; T611-D651 WeakPolarHBondContact CB-OD1 3.21Å; T611-D651 PolarHBondContact OG1-N 3.3Å; T611-D651 PolarHBondContact OG1-OD1 3.35Å; K614-D651 HydrophobicContact CD-CB 4.21Å; K614-D651 VanDerWaalsContact CD-OD1 3.31Å; K614-D651 WeakPolarHBondContact CD-OD1 3.43Å; K614-D651 WeakPolarHBondContact CE-OD1 3.32Å; K614-D651 IonicContact NZ-OD1 3.59Å; K614-D651 PolarHBondContact NZ-OD1 2.92Å; K614-D651 VanDerWaalsContact NZ-OD1 3.15Å; K614-D651 IonicContact NZ-OD2 2.81Å; K614-D651 PolarHBondContact NZ-OD2 2.72Å; W619-D651 HydrophobicContact CH2-CB 4.49Å; L646-D651 HydrophobicContact CD1-CB 4.44Å; G647-D651 PolarHBondContact N-OD2 3.41Å; N648-D651 WeakPolarHBondContact O-CB 3.22Å; N648-D651 PolarHBondContact O-N 2.79Å; N648-D651 VanDerWaalsContact O-N 3.13Å; N648-D651 VanDerWaalsContact OD1-CG 3.24Å; N648-D651 PolarHBondContact OD1-N 3.49Å; D649-D651 VanDerWaalsContact C-N 3.33Å; D649-D651 PolarHBondContact O-N 2.76Å; D651-A654 CarbonylContact O-C 3.51Å; D651-A654 WeakPolarHBondContact O-CB 3.31Å; D651-A654 PolarHBondContact O-N 3.24Å; D651-A655 WeakPolarHBondContact O-CB 3.49Å; D651-A655 PolarHBondContact O-N 3.07Å
652	A	51.2	Low	47.6	Very low	2 Å²	2	62.5 Å²	62.5	2%	0.017	35%	0.346	C	S	.	.	H	α-helix	trans	-68.8	-34.8	175.3	0	0	0	0	0	112.8	F601 L646 N648 D649 A654 A655 F656	F601-A652 HydrophobicContact CB-CB 3.45Å; F601-A652 VanDerWaalsContact CB-CB 3.45Å; F601-A652 HydrophobicContact CD1-CB 3.12Å; F601-A652 HydrophobicContact CD2-CB 4.07Å; F601-A652 HydrophobicContact CE1-CB 3.74Å; F601-A652 HydrophobicContact CG-CB 3.26Å; F601-A652 HydrophobicContact CZ-CB 4.44Å; L646-A652 HydrophobicContact CD1-CB 4.08Å; N648-A652 PolarHBondContact O-N 3.04Å; N648-A652 VanDerWaalsContact O-N 3.1Å; D649-A652 PolarHBondContact O-N 3.43Å; A652-A654 VanDerWaalsContact C-N 3.33Å; A652-A655 PolarHBondContact O-N 2.85Å; A652-F656 HydrophobicContact CB-CD2 3.97Å; A652-F656 HydrophobicContact CB-CE2 4.21Å; A652-F656 WeakPolarHBondContact O-CB 3.44Å; A652-F656 VanDerWaalsContact O-CD2 3.23Å; A652-F656 WeakPolarHBondContact O-CD2 3.26Å; A652-F656 PolarHBondContact O-N 2.99Å
653	V	48.1	Very low	46.1	Very low	3 Å²	3	64.8 Å²	64.8	2%	0.018	35%	0.354	C	S	.	.	H	α-helix	trans	-64.1	-39.9	169.4	164.5	0	0	0	0	110.2	P610 D649 A655 Q657	P610-V653 HydrophobicContact CB-CB 4.46Å; P610-V653 HydrophobicContact CB-CG1 3.64Å; P610-V653 HydrophobicContact CG-CG1 4.2Å; D649-V653 VanDerWaalsContact O-CB 3.3Å; D649-V653 WeakPolarHBondContact O-CB 3.23Å; D649-V653 WeakPolarHBondContact O-CG2 3.24Å; D649-V653 PolarHBondContact O-N 3.34Å; V653-A655 PolarHBondContact O-N 2.86Å; V653-Q657 HydrophobicContact CB-CB 4.31Å; V653-Q657 HydrophobicContact CG1-CB 3.89Å; V653-Q657 VanDerWaalsContact O-CA 3.28Å; V653-Q657 WeakPolarHBondContact O-CA 3.25Å; V653-Q657 WeakPolarHBondContact O-CB 3.2Å; V653-Q657 PolarHBondContact O-N 3.09Å
654	A	52.2	Low	44.4	Very low	8 Å²	8	64.5 Å²	64.5	7%	0.066	36%	0.364	C	S	.	.	H	α-helix	trans	-66.8	-32.8	172.6	0	0	0	0	0	113.8	P610 K614 C615 S650 D651 A652	P610-A654 HydrophobicContact CB-CB 4.02Å; K614-A654 HydrophobicContact CB-CB 4.07Å; C615-A654 VanDerWaalsContact SG-CB 3.56Å; S650-A654 WeakPolarHBondContact O-CB 3.4Å; S650-A654 PolarHBondContact O-N 2.77Å; D651-A654 CarbonylContact O-C 3.51Å; D651-A654 WeakPolarHBondContact O-CB 3.31Å; D651-A654 PolarHBondContact O-N 3.24Å; A652-A654 VanDerWaalsContact C-N 3.33Å
655	A	48.2	Very low	42	Very low	23 Å²	23	63.1 Å²	63.1	19%	0.19	36%	0.358	C	S	.	.	H	α-helix	trans	-79.2	-44.9	-178.6	0	0	0	0	0	113	W619 Y642 L646 D651 A652 V653	W619-A655 HydrophobicContact CD2-CB 3.79Å; W619-A655 HydrophobicContact CE3-CB 4.37Å; W619-A655 HydrophobicContact CG-CB 4.21Å; W619-A655 HydrophobicContact CH2-CB 4.14Å; W619-A655 HydrophobicContact CZ2-CB 3.52Å; Y642-A655 HydrophobicContact CE1-CB 4.36Å; L646-A655 HydrophobicContact CD1-CB 3.85Å; D651-A655 WeakPolarHBondContact O-CB 3.49Å; D651-A655 PolarHBondContact O-N 3.07Å; A652-A655 PolarHBondContact O-N 2.85Å; V653-A655 PolarHBondContact O-N 2.86Å
656	F	41.4	Very low	39.6	Very low	84 Å²	84	66.1 Å²	66.1	37%	0.368	38%	0.379	S	S	.	.	H	α-helix	trans	-116.1	-26	-167.5	-54.7	-68.5	0	0	0	113.5	I603 Y642 L646 A652 P658	I603-F656 HydrophobicContact CD1-CB 3.25Å; I603-F656 HydrophobicContact CD1-CD2 3.89Å; I603-F656 HydrophobicContact CD1-CG 3.69Å; I603-F656 HydrophobicContact CG1-CB 3.71Å; I603-F656 HydrophobicContact CG1-CD2 4.09Å; I603-F656 HydrophobicContact CG1-CG 4.24Å; I603-F656 HydrophobicContact CG2-CB 4.19Å; Y642-F656 HydrophobicContact CD1-CE1 4.41Å; Y642-F656 AromaticContact CD1-CZ 3.84Å; Y642-F656 HydrophobicContact CD1-CZ 3.84Å; Y642-F656 AromaticContact CE1-CE1 3.53Å; Y642-F656 HydrophobicContact CE1-CE1 3.53Å; Y642-F656 HydrophobicContact CE1-CE2 4.31Å; Y642-F656 AromaticContact CE1-CZ 3.38Å; Y642-F656 HydrophobicContact CE1-CZ 3.38Å; Y642-F656 AromaticContact CZ-CE1 3.86Å; L646-F656 HydrophobicContact CD1-CE2 4.12Å; L646-F656 HydrophobicContact CD2-CE2 4.09Å; L646-F656 HydrophobicContact CD2-CZ 4.47Å; A652-F656 HydrophobicContact CB-CD2 3.97Å; A652-F656 HydrophobicContact CB-CE2 4.21Å; A652-F656 WeakPolarHBondContact O-CB 3.44Å; A652-F656 VanDerWaalsContact O-CD2 3.23Å; A652-F656 WeakPolarHBondContact O-CD2 3.26Å; A652-F656 PolarHBondContact O-N 2.99Å; F656-P658 WeakPolarHBondContact O-CD 3.41Å
657	Q	38.3	Very low	37.9	Very low	80 Å²	80	71.8 Å²	71.8	37%	0.374	40%	0.404	S	S	.	.	S	Bend	trans	-78.6	123.4	177	-146.8	173.7	18.8	0	0	108.6	I603 V653 L659	I603-Q657 HydrophobicContact CG2-CB 3.68Å; I603-Q657 HydrophobicContact CG2-CG 3.88Å; V653-Q657 HydrophobicContact CB-CB 4.31Å; V653-Q657 HydrophobicContact CG1-CB 3.89Å; V653-Q657 VanDerWaalsContact O-CA 3.28Å; V653-Q657 WeakPolarHBondContact O-CA 3.25Å; V653-Q657 WeakPolarHBondContact O-CB 3.2Å; V653-Q657 PolarHBondContact O-N 3.09Å; Q657-L659 PolarHBondContact O-N 2.85Å
658	P	30	Very low	36	Very low	55 Å²	55	73.5 Å²	73.5	36%	0.357	40%	0.398	S	S	.	.			trans	-67.5	99.9	178.8	26.1	-32.1	0	0	0	108.2	F656 F660 R663	F656-P658 WeakPolarHBondContact O-CD 3.41Å; P658-F660 PolarHBondContact O-N 3.47Å; P658-R663 HydrophobicContact CB-CG 4.45Å
659	L	25.9	Very low	34.1	Very low	74 Å²	74	76.4 Å²	76.4	39%	0.387	40%	0.404	S	S	.	.			trans	-50.6	119.9	169.9	-112.7	154.1	0	0	0	107.7	P610 C615 Q657 V661 C662	P610-L659 HydrophobicContact CG-CD1 4.35Å; P610-L659 HydrophobicContact CG-CG 4.39Å; C615-L659 HydrophobicContact CB-CD1 3.24Å; C615-L659 WeakPolarHBondContact SG-CD1 3.33Å; Q657-L659 PolarHBondContact O-N 2.85Å; L659-V661 PolarHBondContact O-N 3.35Å; L659-C662 PolarHBondContact O-N 3.28Å
660	F	22.4	Very low	32.5	Very low	208 Å²	208	79.9 Å²	79.9	91%	0.912	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-2.4	-169.8	-107	-98.3	0	0	0	116	P658	P658-F660 PolarHBondContact O-N 3.47Å
661	V	21.3	Very low	30.7	Very low	121 Å²	121	87.1 Å²	87.1	73%	0.733	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-19.5	-170.3	-169.6	0	0	0	0	113.2	L659	L659-V661 PolarHBondContact O-N 3.35Å
662	C	20.3	Very low	28.8	Very low	105 Å²	105	92.5 Å²	92.5	71%	0.709	48%	0.476	S	S	*	.	S	Bend	trans	-112.6	5.2	-174.6	-66.7	0	0	0	0	116.4	L659	L659-C662 PolarHBondContact O-N 3.28Å
663	R	20.6	Very low	27.3	Very low	124 Å²	124	96 Å²	96	47%	0.468	51%	0.505	S	S	.	.			trans	-97	27.9	-177.4	-77.9	-165.5	169.8	-175.5	-1.3	115.8	P658 S665	P658-R663 HydrophobicContact CB-CG 4.45Å; R663-S665 PolarHBondContact O-N 3.12Å; R663-S665 VanDerWaalsContact O-N 3.14Å
664	S	19.5	Very low	25.9	Very low	103 Å²	103	104.4 Å²	104.4	72%	0.72	55%	0.545	S	S	*	.			trans	-72.7	8.8	169.1	58	0	0	0	0	114.4
665	S	20.2	Very low	24.3	Very low	50 Å²	50	112 Å²	112	35%	0.35	57%	0.572	S	S	.	*	S	Bend	trans	-106.3	118.5	169.2	179.8	0	0	0	0	110.7	R663 H667 M668	R663-S665 PolarHBondContact O-N 3.12Å; R663-S665 VanDerWaalsContact O-N 3.14Å; S665-H667 PolarHBondContact O-N 2.74Å; S665-H667 PolarHBondContact OG-CD2 3.04Å; S665-M668 PolarHBondContact O-N 3.27Å
666	P	21.1	Very low	23	Very low	92 Å²	92	114.2 Å²	114.2	60%	0.597	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-57.8	-10.4	176.9	-23.1	33	0	0	0	114.8
667	H	22.7	Very low	22.1	Very low	139 Å²	139	114.9 Å²	114.9	64%	0.644	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-86.7	-8.5	-173.6	-56.5	-63	0	0	0	114.5	S665	S665-H667 PolarHBondContact O-N 2.74Å; S665-H667 PolarHBondContact OG-CD2 3.04Å
668	M	20.3	Very low	21.3	Very low	94 Å²	94	116 Å²	116	46%	0.463	61%	0.608	S	S	.	*	G	3₁₀ helix	trans	-94.7	6.6	177.1	-72.7	-166.3	159.9	0	0	114.2	S665	S665-M668 PolarHBondContact O-N 3.27Å
669	R	21.5	Very low	20.8	Very low	138 Å²	138	118.2 Å²	118.2	52%	0.521	61%	0.613	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.1	-12.3	-175.4	-70.7	-173	179.6	178.4	0.7	114.8
670	M	20.3	Very low	20.5	Very low	148 Å²	148	121.7 Å²	121.7	73%	0.729	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	16.7	-174.2	-65.2	-78.5	-76.4	0	0	113	T672	M670-T672 PolarHBondContact O-N 3.07Å
671	W	19.6	Very low	20.3	Very low	173 Å²	173	122.4 Å²	122.4	66%	0.655	63%	0.628	S	S	*	*			trans	-73	86.1	163.7	-82.8	33.1	0	0	0	109
672	T	19.8	Very low	20.1	Very low	118 Å²	118	123.2 Å²	123.2	72%	0.724	63%	0.633	S	S	*	*			trans	-75.3	113.8	132.7	41.7	0	0	0	0	105.2	M670 E674	M670-T672 PolarHBondContact O-N 3.07Å; T672-E674 PolarHBondContact O-N 3.09Å
673	A	18.6	Very low	20	Very low	76 Å²	76	122.6 Å²	122.6	63%	0.628	63%	0.626	S	S	*	*			trans	-62.1	96.6	166	0	0	0	0	0	106.6	W675	A673-W675 VanDerWaalsContact O-CD1 3.27Å; A673-W675 PolarHBondContact O-N 3.47Å
674	E	18.8	Very low	19.9	Very low	180 Å²	180	125.2 Å²	125.2	84%	0.841	65%	0.646	S	S	*	*			trans	-82.2	107.1	174.2	-152.7	175	-160.2	0	0	106.2	T672 S676	T672-E674 PolarHBondContact O-N 3.09Å; E674-S676 PolarHBondContact O-N 3.25Å; E674-S676 VanDerWaalsContact O-N 3.09Å
675	W	19.5	Very low	19.9	Very low	168 Å²	168	125.7 Å²	125.7	64%	0.636	65%	0.645	S	S	*	*			trans	-72.4	98.2	177.7	-64.5	78.1	0	0	0	108.4	M567 A673 I677	M567-W675 HydrophobicContact CE-CD2 3.49Å; M567-W675 VanDerWaalsContact CE-CD2 3.49Å; M567-W675 HydrophobicContact CE-CE3 3.09Å; M567-W675 HydrophobicContact CE-CG 4.3Å; M567-W675 HydrophobicContact CE-CH2 3.55Å; M567-W675 HydrophobicContact CE-CZ2 3.92Å; M567-W675 HydrophobicContact CE-CZ3 3.14Å; M567-W675 HydrophobicContact SD-CH2 4.29Å; M567-W675 HydrophobicContact SD-CZ3 4.29Å; A673-W675 VanDerWaalsContact O-CD1 3.27Å; A673-W675 PolarHBondContact O-N 3.47Å; W675-I677 HydrophobicContact CB-CG1 4.38Å; W675-I677 PolarHBondContact O-N 3.47Å
676	S	20.3	Very low	19.9	Very low	69 Å²	69	132.5 Å²	132.5	48%	0.483	67%	0.671	S	S	.	*			trans	-83.8	92.5	169.1	179.9	0	0	0	0	109.1	E674 S678	E674-S676 PolarHBondContact O-N 3.25Å; E674-S676 VanDerWaalsContact O-N 3.09Å; S676-S678 PolarHBondContact O-N 2.8Å
677	I	23.3	Very low	19.8	Very low	97 Å²	97	133.7 Å²	133.7	50%	0.497	68%	0.677	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.8	-9.4	-174.3	-68.4	152.6	0	0	0	112.8	M567 W675 K679	M567-I677 WeakPolarHBondContact O-CD1 3.32Å; M567-I677 WeakPolarHBondContact O-CG1 3.43Å; W675-I677 HydrophobicContact CB-CG1 4.38Å; W675-I677 PolarHBondContact O-N 3.47Å; I677-K679 PolarHBondContact O-N 3.08Å
678	S	21	Very low	19.8	Very low	103 Å²	103	133.8 Å²	133.8	72%	0.72	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	13.3	-172.4	73.8	0	0	0	0	115.8	S676	S676-S678 PolarHBondContact O-N 2.8Å
679	K	20.1	Very low	19.8	Very low	103 Å²	103	137.3 Å²	137.3	45%	0.448	70%	0.702	S	S	.	*			trans	-106.2	41.1	175.1	-72	-174.9	-171.8	161.6	0	113.1	I677 E886	I677-K679 PolarHBondContact O-N 3.08Å; K679-E886 VanDerWaalsContact NZ-CD 3.27Å; K679-E886 IonicContact NZ-OE1 3.36Å; K679-E886 PolarHBondContact NZ-OE1 3.23Å; K679-E886 IonicContact NZ-OE2 3.37Å; K679-E886 PolarHBondContact NZ-OE2 3.32Å
680	N	19	Very low	19.7	Very low	147 Å²	147	136.4 Å²	136.4	79%	0.786	71%	0.712	S	S	*	*	S	Bend	trans	-98.2	112.2	156.1	-83.3	-19.1	0	0	0	107.7
681	R	18.4	Very low	19.7	Very low	222 Å²	222	137.9 Å²	137.9	84%	0.838	72%	0.717	S	S	*	*			trans	92.2	89.3	179.1	-62.2	-179.4	160.5	-174.3	-5.6	116.7	T683	R681-T683 VanDerWaalsContact C-N 3.26Å; R681-T683 WeakPolarHBondContact CB-OG1 3.02Å; R681-T683 PolarHBondContact O-N 3.27Å
682	V	18.1	Very low	19.7	Very low	139 Å²	139	140.7 Å²	140.7	84%	0.842	73%	0.728	S	S	*	*			trans	-82.9	87.6	136.8	-175.8	0	0	0	0	106
683	T	17.4	Very low	19.6	Very low	91 Å²	91	140 Å²	140	56%	0.558	73%	0.727	S	S	*	*			trans	-99.5	120.7	158.2	-8.6	0	0	0	0	103.9	R681 T685	R681-T683 VanDerWaalsContact C-N 3.26Å; R681-T683 WeakPolarHBondContact CB-OG1 3.02Å; R681-T683 PolarHBondContact O-N 3.27Å; T683-T685 PolarHBondContact O-N 3.15Å
684	M	17.9	Very low	19.7	Very low	179 Å²	179	141.8 Å²	141.8	88%	0.882	73%	0.733	S	S	*	*			trans	-64.1	88.8	170	-71.5	-177.5	67.5	0	0	107.5	E686	M684-E686 PolarHBondContact O-N 3.02Å
685	T	19.5	Very low	19.7	Very low	114 Å²	114	140.9 Å²	140.9	70%	0.699	73%	0.731	S	S	*	*			trans	-74.3	107.3	160.8	45.1	0	0	0	0	106.4	T683 V687	T683-T685 PolarHBondContact O-N 3.15Å; T685-V687 PolarHBondContact O-N 2.77Å
686	E	19.9	Very low	19.6	Very low	192 Å²	192	139.8 Å²	139.8	90%	0.897	74%	0.736	S	S	*	*			trans	-30.1	96.7	151.7	-65.3	170.4	148.2	0	0	110.4	M684	M684-E686 PolarHBondContact O-N 3.02Å
687	V	20.5	Very low	19.6	Very low	118 Å²	118	143.2 Å²	143.2	72%	0.715	75%	0.748	S	S	*	*			trans	-137.6	95	158.2	-174.6	0	0	0	0	104.8	T685	T685-V687 PolarHBondContact O-N 2.77Å
688	D	22.5	Very low	19.4	Very low	141 Å²	141	145.5 Å²	145.5	75%	0.754	76%	0.762	S	S	*	*			trans	7.8	127.7	162.1	-59	-44	0	0	0	116.8	V690	D688-V690 VanDerWaalsContact C-N 3.3Å; D688-V690 PolarHBondContact O-N 2.79Å
689	D	20.2	Very low	19.3	Very low	167 Å²	167	143.6 Å²	143.6	89%	0.893	76%	0.758	S	S	*	*			trans	-40.4	91.7	159.8	-72	-49.2	0	0	0	111.1	E691	D689-E691 VanDerWaalsContact C-N 3.26Å; D689-E691 PolarHBondContact O-N 2.87Å
690	V	19.9	Very low	19.2	Very low	120 Å²	120	147 Å²	147	73%	0.727	78%	0.781	S	S	*	*			trans	-74.6	94.5	164.8	-175.6	0	0	0	0	105.4	D688 R692	D688-V690 VanDerWaalsContact C-N 3.3Å; D688-V690 PolarHBondContact O-N 2.79Å; V690-R692 VanDerWaalsContact C-N 3.3Å; V690-R692 PolarHBondContact O-N 3.42Å
691	E	19.8	Very low	19.2	Very low	178 Å²	178	145.1 Å²	145.1	83%	0.832	78%	0.78	S	S	*	*			trans	-40.1	96.4	159.9	-88.4	-173	140.6	0	0	108.6	D689 S693	D689-E691 VanDerWaalsContact C-N 3.26Å; D689-E691 PolarHBondContact O-N 2.87Å; E691-S693 VanDerWaalsContact C-N 3.34Å; E691-S693 PolarHBondContact O-N 2.88Å
692	R	18.8	Very low	19.3	Very low	233 Å²	233	143 Å²	143	88%	0.879	78%	0.779	S	S	*	*			trans	-73.9	100.3	167	-75.8	-171.7	178.5	-177.5	1.2	106.1	V690	V690-R692 VanDerWaalsContact C-N 3.3Å; V690-R692 PolarHBondContact O-N 3.42Å
693	S	18.9	Very low	19.4	Very low	102 Å²	102	147.1 Å²	147.1	71%	0.713	78%	0.78	S	S	*	*			trans	-44.5	130	175.2	-57.9	0	0	0	0	110.1	E691 M695	E691-S693 VanDerWaalsContact C-N 3.34Å; E691-S693 PolarHBondContact O-N 2.88Å; S693-M695 PolarHBondContact O-N 2.69Å
694	P	19.9	Very low	19.4	Very low	115 Å²	115	148.2 Å²	148.2	75%	0.747	79%	0.791	S	S	*	*			trans	-57.6	115.4	-179.5	21	-30.6	0	0	0	108.7	L696	P694-L696 VanDerWaalsContact C-N 3.32Å; P694-L696 PolarHBondContact O-N 3.26Å
695	M	18.1	Very low	19.4	Very low	161 Å²	161	144.9 Å²	144.9	79%	0.793	78%	0.784	S	S	*	*			trans	-63.5	97.3	175.4	-123.4	-179.9	83.6	0	0	108	S693 L697	S693-M695 PolarHBondContact O-N 2.69Å; M695-L697 VanDerWaalsContact C-N 3.29Å; M695-L697 HydrophobicContact CE-CD1 3.62Å; M695-L697 HydrophobicContact CE-CG 4.02Å; M695-L697 PolarHBondContact O-N 3.35Å
696	L	18.9	Very low	19.4	Very low	144 Å²	144	147.9 Å²	147.9	75%	0.754	80%	0.796	S	S	*	*			trans	-60.4	87.4	166.5	-93.3	135.6	0	0	0	108.9	P694 N698	P694-L696 VanDerWaalsContact C-N 3.32Å; P694-L696 PolarHBondContact O-N 3.26Å; L696-N698 VanDerWaalsContact C-N 3.28Å; L696-N698 PolarHBondContact O-N 2.75Å
697	L	20.2	Very low	19.3	Very low	141 Å²	141	141.7 Å²	141.7	74%	0.738	78%	0.784	S	S	*	*			trans	-87.9	76	163.9	-89.8	157.8	0	0	0	108.7	M695 G699	M695-L697 VanDerWaalsContact C-N 3.29Å; M695-L697 HydrophobicContact CE-CD1 3.62Å; M695-L697 HydrophobicContact CE-CG 4.02Å; M695-L697 PolarHBondContact O-N 3.35Å; L697-G699 PolarHBondContact O-N 2.93Å
698	N	18.8	Very low	19.2	Very low	146 Å²	146	146.2 Å²	146.2	78%	0.781	79%	0.789	S	S	*	*			trans	-68.4	116.1	155.1	-78.6	-27.2	0	0	0	107.5	L696	L696-N698 VanDerWaalsContact C-N 3.28Å; L696-N698 PolarHBondContact O-N 2.75Å
699	G	18.5	Very low	19	Very low	63 Å²	63	144.8 Å²	144.8	65%	0.649	79%	0.791	S	S	*	*			trans	-170.7	60.9	-176.2	0	0	0	0	0	112.5	L697 S701	L697-G699 PolarHBondContact O-N 2.93Å; G699-S701 PolarHBondContact O-N 3.07Å
700	D	18.6	Very low	19	Very low	173 Å²	173	143.6 Å²	143.6	93%	0.925	79%	0.789	S	S	*	*			trans	-52.8	101.8	165.5	-73.4	-41.8	0	0	0	110.8
701	S	19.5	Very low	18.9	Very low	109 Å²	109	140 Å²	140	76%	0.762	78%	0.776	S	S	*	*			trans	-147.9	82.9	152.9	58.6	0	0	0	0	110	G699 R703	G699-S701 PolarHBondContact O-N 3.07Å; S701-R703 PolarHBondContact O-N 3.07Å; S701-R703 VanDerWaalsContact O-N 3.14Å
702	E	20.1	Very low	18.9	Very low	176 Å²	176	137 Å²	137	82%	0.822	77%	0.77	S	S	*	*			trans	-64.1	104.2	161.5	-70.6	-176.1	149.7	0	0	109.2
703	R	18.7	Very low	18.9	Very low	227 Å²	227	128.1 Å²	128.1	86%	0.857	75%	0.751	S	S	*	*	S	Bend	trans	145.5	131	148.2	-78.5	159.8	-167.7	-157.8	4.3	109.4	S701	S701-R703 PolarHBondContact O-N 3.07Å; S701-R703 VanDerWaalsContact O-N 3.14Å
704	S	18.9	Very low	19	Very low	113 Å²	113	131 Å²	131	79%	0.79	75%	0.751	S	S	*	*			trans	77.1	73.3	167.3	71.9	0	0	0	0	117.9
705	C	17.4	Very low	19.1	Very low	109 Å²	109	132.3 Å²	132.3	74%	0.736	75%	0.747	S	S	*	*			trans	-138.5	67.2	145	-86.9	0	0	0	0	109.4	G707	C705-G707 VanDerWaalsContact C-N 3.32Å; C705-G707 PolarHBondContact O-N 3.42Å; C705-G707 VanDerWaalsContact O-N 3.14Å
706	N	19.6	Very low	19.4	Very low	178 Å²	178	130.4 Å²	130.4	95%	0.952	74%	0.739	S	S	*	*			trans	-72	90.5	158.6	-80.8	-22.9	0	0	0	107.4
707	G	18.6	Very low	19.5	Very low	62 Å²	62	128.5 Å²	128.5	64%	0.639	73%	0.726	S	S	*	*			trans	145.7	67.8	-179.4	0	0	0	0	0	111.4	C705 S709	C705-G707 VanDerWaalsContact C-N 3.32Å; C705-G707 PolarHBondContact O-N 3.42Å; C705-G707 VanDerWaalsContact O-N 3.14Å; G707-S709 PolarHBondContact O-N 3.32Å; G707-S709 VanDerWaalsContact O-N 3.09Å
708	Y	18.1	Very low	19.8	Very low	212 Å²	212	131 Å²	131	83%	0.831	73%	0.726	S	S	*	*			trans	-67.4	109.1	170.6	-87.5	-88	0	0	0	109.5	V710	Y708-V710 PolarHBondContact O-N 2.99Å
709	S	18	Very low	20.1	Very low	112 Å²	112	127.3 Å²	127.3	78%	0.783	71%	0.709	S	S	*	*			trans	-71.7	100.3	163.7	59.2	0	0	0	0	108.7	G707 G711	G707-S709 PolarHBondContact O-N 3.32Å; G707-S709 VanDerWaalsContact O-N 3.09Å; S709-G711 PolarHBondContact O-N 3.22Å; S709-G711 VanDerWaalsContact O-N 3.11Å
710	V	19.1	Very low	20.3	Very low	141 Å²	141	124.9 Å²	124.9	86%	0.855	68%	0.683	S	S	*	*			trans	-78.9	94.9	171.3	-178.5	0	0	0	0	108.3	Y708	Y708-V710 PolarHBondContact O-N 2.99Å
711	G	19.4	Very low	20.6	Very low	44 Å²	44	121.8 Å²	121.8	45%	0.454	67%	0.667	S	S	.	*			trans	70	44.3	133.2	0	0	0	0	0	119.3	S709 G713	S709-G711 PolarHBondContact O-N 3.22Å; S709-G711 VanDerWaalsContact O-N 3.11Å; G711-G713 PolarHBondContact O-N 2.97Å
712	T	19.6	Very low	21	Very low	117 Å²	117	120.9 Å²	120.9	72%	0.718	67%	0.666	S	S	*	*	H	α-helix	trans	-66.1	-10.2	160.5	39.8	0	0	0	0	113.3
713	G	18.2	Very low	21.2	Very low	46 Å²	46	117.8 Å²	117.8	47%	0.474	65%	0.654	S	S	.	*	H	α-helix	trans	-70.7	-28.3	-178.1	0	0	0	0	0	115.7	G711 H717	G711-G713 PolarHBondContact O-N 2.97Å; G713-H717 PolarHBondContact O-N 2.85Å
714	F	20.6	Very low	21.4	Very low	162 Å²	162	109.4 Å²	109.4	71%	0.711	64%	0.639	S	S	*	*	H	α-helix	trans	-85.9	-28.2	-178.7	-77.6	-77.6	0	0	0	113.3	L716 H717 R718	F714-L716 VanDerWaalsContact C-N 3.34Å; F714-H717 PolarHBondContact O-N 2.94Å; F714-R718 PolarHBondContact O-N 3.37Å
715	H	22.5	Very low	21.7	Very low	143 Å²	143	111.6 Å²	111.6	66%	0.662	63%	0.634	S	S	*	*	H	α-helix	trans	-65.4	-38.1	173.2	-96.2	-65.7	0	0	0	111.9	R718 V719	H715-R718 PolarHBondContact O-N 3.28Å; H715-V719 VanDerWaalsContact O-CB 3.28Å; H715-V719 WeakPolarHBondContact O-CB 3.33Å; H715-V719 VanDerWaalsContact O-CG2 3.22Å; H715-V719 WeakPolarHBondContact O-CG2 3.38Å; H715-V719 PolarHBondContact O-N 2.82Å
716	L	23.2	Very low	22	Very low	121 Å²	121	112.6 Å²	112.6	63%	0.634	62%	0.624	S	S	*	*	H	α-helix	trans	-70	-32.2	175.8	-96.2	145.8	0	0	0	112.8	F714 G720	F714-L716 VanDerWaalsContact C-N 3.34Å; L716-G720 VanDerWaalsContact O-CA 3.3Å; L716-G720 WeakPolarHBondContact O-CA 3.32Å; L716-G720 PolarHBondContact O-N 3.05Å
717	H	22.9	Very low	22.3	Very low	104 Å²	104	112.5 Å²	112.5	48%	0.481	62%	0.618	S	S	.	*	H	α-helix	trans	-68.2	-37.8	172	-106.2	-70.8	0	0	0	112.5	G713 F714 G720 N721 Y726	G713-H717 PolarHBondContact O-N 2.85Å; F714-H717 PolarHBondContact O-N 2.94Å; H717-G720 PolarHBondContact O-N 3.08Å; H717-N721 WeakPolarHBondContact O-CB 3.36Å; H717-N721 PolarHBondContact O-N 3.48Å; H717-Y726 PolarHBondContact CE1-OH 3.33Å; H717-Y726 PolarHBondContact ND1-OH 3.07Å
718	R	25	Very low	22.7	Very low	193 Å²	193	116.1 Å²	116.1	73%	0.728	63%	0.63	S	S	*	*	H	α-helix	trans	-79.9	-39.2	-179.9	-74.1	-172.3	178.5	177.4	1.3	113.3	F714 H715 G720 N721 A722	F714-R718 PolarHBondContact O-N 3.37Å; H715-R718 PolarHBondContact O-N 3.28Å; R718-G720 PolarHBondContact O-N 3.23Å; R718-N721 PolarHBondContact O-N 3.47Å; R718-A722 VanDerWaalsContact O-CB 3.31Å; R718-A722 WeakPolarHBondContact O-CB 3.3Å; R718-A722 PolarHBondContact O-N 2.94Å
719	V	25.6	Very low	23.2	Very low	69 Å²	69	110.1 Å²	110.1	42%	0.418	62%	0.624	S	S	.	*	H	α-helix	trans	-63.9	-36.3	167.7	173.7	0	0	0	0	109	H715 N721 A722 L723	H715-V719 VanDerWaalsContact O-CB 3.28Å; H715-V719 WeakPolarHBondContact O-CB 3.33Å; H715-V719 VanDerWaalsContact O-CG2 3.22Å; H715-V719 WeakPolarHBondContact O-CG2 3.38Å; H715-V719 PolarHBondContact O-N 2.82Å; V719-N721 PolarHBondContact O-N 3.41Å; V719-A722 PolarHBondContact O-N 3.11Å; V719-L723 HydrophobicContact CG1-CD1 3.41Å; V719-L723 VanDerWaalsContact CG1-CD1 3.41Å; V719-L723 HydrophobicContact CG1-CG 3.96Å; V719-L723 WeakPolarHBondContact O-CB 3.47Å; V719-L723 WeakPolarHBondContact O-CG 3.22Å; V719-L723 PolarHBondContact O-N 3.21Å
720	G	22.3	Very low	23.5	Very low	11 Å²	11	109 Å²	109	11%	0.113	63%	0.63	C	S	.	*	H	α-helix	trans	-60.3	-44.4	173	0	0	0	0	0	113.6	L716 H717 R718 G724 F725	L716-G720 VanDerWaalsContact O-CA 3.3Å; L716-G720 WeakPolarHBondContact O-CA 3.32Å; L716-G720 PolarHBondContact O-N 3.05Å; H717-G720 PolarHBondContact O-N 3.08Å; R718-G720 PolarHBondContact O-N 3.23Å; G720-G724 PolarHBondContact O-N 2.88Å; G720-F725 PolarHBondContact O-N 2.98Å; G720-F725 VanDerWaalsContact O-N 3.11Å
721	N	25.1	Very low	23.6	Very low	108 Å²	108	105.2 Å²	105.2	58%	0.578	62%	0.62	S	S	*	*	H	α-helix	trans	-66.5	-45.1	173.5	-108.7	7.3	0	0	0	112.4	H717 R718 V719 L723 G724 Y726	H717-N721 WeakPolarHBondContact O-CB 3.36Å; H717-N721 PolarHBondContact O-N 3.48Å; R718-N721 PolarHBondContact O-N 3.47Å; V719-N721 PolarHBondContact O-N 3.41Å; N721-L723 VanDerWaalsContact C-N 3.29Å; N721-L723 PolarHBondContact O-N 2.9Å; N721-G724 PolarHBondContact O-N 2.98Å; N721-Y726 WeakPolarHBondContact OD1-CD2 3.34Å; N721-Y726 VanDerWaalsContact OD1-CE2 3.26Å; N721-Y726 WeakPolarHBondContact OD1-CE2 3.03Å
722	A	27.9	Very low	23.8	Very low	90 Å²	90	109.2 Å²	109.2	74%	0.744	64%	0.636	S	S	*	*	H	α-helix	trans	-68.3	-28.8	-179.3	0	0	0	0	0	112.6	R718 V719	R718-A722 VanDerWaalsContact O-CB 3.31Å; R718-A722 WeakPolarHBondContact O-CB 3.3Å; R718-A722 PolarHBondContact O-N 2.94Å; V719-A722 PolarHBondContact O-N 3.11Å
723	L	25.2	Very low	23.9	Very low	111 Å²	111	107.5 Å²	107.5	58%	0.581	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	4.8	177	-65.9	176.8	0	0	0	113.5	V719 N721 F725	V719-L723 HydrophobicContact CG1-CD1 3.41Å; V719-L723 VanDerWaalsContact CG1-CD1 3.41Å; V719-L723 HydrophobicContact CG1-CG 3.96Å; V719-L723 WeakPolarHBondContact O-CB 3.47Å; V719-L723 WeakPolarHBondContact O-CG 3.22Å; V719-L723 PolarHBondContact O-N 3.21Å; N721-L723 VanDerWaalsContact C-N 3.29Å; N721-L723 PolarHBondContact O-N 2.9Å; L723-F725 VanDerWaalsContact C-N 3.31Å; L723-F725 HydrophobicContact CB-CD2 3.87Å; L723-F725 HydrophobicContact CB-CE2 3.7Å; L723-F725 HydrophobicContact CB-CZ 4.45Å; L723-F725 HydrophobicContact CD1-CE2 3.75Å; L723-F725 HydrophobicContact CG-CE2 4.41Å; L723-F725 PolarHBondContact O-N 3.36Å
724	G	22.8	Very low	24.1	Very low	52 Å²	52	113.1 Å²	113.1	54%	0.536	65%	0.646	S	S	.	*	T	Hydrogen-bonded Turn	trans	68.8	23.8	173.7	0	0	0	0	0	114.8	G720 N721 Y726	G720-G724 PolarHBondContact O-N 2.88Å; N721-G724 PolarHBondContact O-N 2.98Å; G724-Y726 PolarHBondContact O-N 3.14Å
725	F	24.5	Very low	24.3	Very low	158 Å²	158	113.2 Å²	113.2	69%	0.693	65%	0.646	S	S	*	*			trans	-70.2	5.9	174.7	-69	-58.5	0	0	0	113.9	G720 L723	G720-F725 PolarHBondContact O-N 2.98Å; G720-F725 VanDerWaalsContact O-N 3.11Å; L723-F725 VanDerWaalsContact C-N 3.31Å; L723-F725 HydrophobicContact CB-CD2 3.87Å; L723-F725 HydrophobicContact CB-CE2 3.7Å; L723-F725 HydrophobicContact CB-CZ 4.45Å; L723-F725 HydrophobicContact CD1-CE2 3.75Å; L723-F725 HydrophobicContact CG-CE2 4.41Å; L723-F725 PolarHBondContact O-N 3.36Å
726	Y	24.2	Very low	24.3	Very low	130 Å²	130	113.6 Å²	113.6	51%	0.51	65%	0.646	S	S	.	*			trans	-101	96.7	167.5	-78.2	-88.3	0	0	0	109.1	H717 N721 G724	H717-Y726 PolarHBondContact CE1-OH 3.33Å; H717-Y726 PolarHBondContact ND1-OH 3.07Å; N721-Y726 WeakPolarHBondContact OD1-CD2 3.34Å; N721-Y726 VanDerWaalsContact OD1-CE2 3.26Å; N721-Y726 WeakPolarHBondContact OD1-CE2 3.03Å; G724-Y726 PolarHBondContact O-N 3.14Å
727	E	25.5	Very low	24.5	Very low	177 Å²	177	111 Å²	111	83%	0.827	64%	0.638	S	S	*	*			trans	-73.3	125.6	155.7	-85.1	-168.8	160.3	0	0	108.1	A729	E727-A729 PolarHBondContact O-N 3.11Å
728	P	27.5	Very low	24.7	Very low	137 Å²	137	109.8 Å²	109.8	89%	0.89	65%	0.646	S	S	*	*	S	Bend	trans	-71.1	14.2	-169.1	-17.6	31.8	0	0	0	116
729	A	28.4	Very low	24.7	Very low	86 Å²	86	108.1 Å²	108.1	71%	0.711	64%	0.644	S	S	*	*	S	Bend	trans	-121.6	75	-168.3	0	0	0	0	0	113.1	E727 G731	E727-A729 PolarHBondContact O-N 3.11Å; A729-G731 PolarHBondContact O-N 3.21Å
730	G	24.8	Very low	24.8	Very low	88 Å²	88	109.5 Å²	109.5	91%	0.907	65%	0.646	S	S	*	*	S	Bend	trans	64.9	-4.1	148.5	0	0	0	0	0	120
731	G	21.2	Very low	25	Very low	63 Å²	63	114.4 Å²	114.4	65%	0.649	67%	0.667	S	S	*	*			trans	-86.3	107.8	173.3	0	0	0	0	0	111.1	A729 P733	A729-G731 PolarHBondContact O-N 3.21Å; G731-P733 VanDerWaalsContact O-CD 3.3Å; G731-P733 WeakPolarHBondContact O-CD 3.49Å
732	T	23.7	Very low	25	Very low	128 Å²	128	112.5 Å²	112.5	79%	0.785	66%	0.663	S	S	*	*			trans	-54.8	117.9	163.6	27.6	0	0	0	0	108.7	D734	T732-D734 PolarHBondContact O-N 2.89Å
733	P	21.6	Very low	25	Very low	81 Å²	81	112.9 Å²	112.9	53%	0.526	65%	0.65	S	S	.	*			trans	-56.2	136.1	177.1	-21.7	31.9	0	0	0	109.5	G731 F735	G731-P733 VanDerWaalsContact O-CD 3.3Å; G731-P733 WeakPolarHBondContact O-CD 3.49Å; P733-F735 WeakPolarHBondContact O-CD2 3.45Å; P733-F735 PolarHBondContact O-N 2.82Å
734	D	21.8	Very low	25.1	Very low	164 Å²	164	114.2 Å²	114.2	88%	0.877	65%	0.652	S	S	*	*			trans	-59.1	90.9	167.4	-96.8	-33.3	0	0	0	107.9	T732 F736	T732-D734 PolarHBondContact O-N 2.89Å; D734-F736 PolarHBondContact O-N 2.94Å; D734-F736 VanDerWaalsContact O-N 3.1Å
735	F	24	Very low	25.4	Very low	164 Å²	164	116.3 Å²	116.3	72%	0.719	65%	0.654	S	S	*	*			trans	-62.3	117.3	178.5	-77.1	-86.1	0	0	0	107.9	P733 S737	P733-F735 WeakPolarHBondContact O-CD2 3.45Å; P733-F735 PolarHBondContact O-N 2.82Å; F735-S737 PolarHBondContact O-N 3.28Å
736	F	24.1	Very low	25.4	Very low	151 Å²	151	117.9 Å²	117.9	66%	0.662	66%	0.655	S	S	*	*			trans	-46.8	113.2	158	-71.8	-86.6	0	0	0	107.3	D734 A738 M741	D734-F736 PolarHBondContact O-N 2.94Å; D734-F736 VanDerWaalsContact O-N 3.1Å; F736-A738 PolarHBondContact O-N 3.42Å; F736-M741 HydrophobicContact CB-CG 4.43Å
737	S	26.8	Very low	25.6	Very low	65 Å²	65	118 Å²	118	46%	0.455	66%	0.66	S	S	.	*			trans	-50.4	141.9	-177.5	66.5	0	0	0	0	109.4	F735 K739 Q740 M741	F735-S737 PolarHBondContact O-N 3.28Å; S737-K739 CarbonylContact O-C 3.53Å; S737-K739 PolarHBondContact O-N 3.11Å; S737-Q740 PolarHBondContact O-N 3.2Å; S737-M741 PolarHBondContact O-N 3.03Å
738	A	26.7	Very low	25.6	Very low	80 Å²	80	113.2 Å²	113.2	66%	0.661	64%	0.643	S	S	*	*	H	α-helix	trans	-49.7	-23.7	178.8	0	0	0	0	0	112.9	F736 S742	F736-A738 PolarHBondContact O-N 3.42Å; A738-S742 WeakPolarHBondContact O-CB 3.37Å; A738-S742 PolarHBondContact O-N 3.09Å; A738-S742 PolarHBondContact O-OG 3.24Å
739	K	25.6	Very low	25.5	Very low	158 Å²	158	109.6 Å²	109.6	69%	0.687	62%	0.624	S	S	*	*	H	α-helix	trans	-61	-45.9	170.5	-162.7	175	-175.9	179.4	0	113.1	S737 S742 M743	S737-K739 CarbonylContact O-C 3.53Å; S737-K739 PolarHBondContact O-N 3.11Å; K739-S742 PolarHBondContact O-OG 2.94Å; K739-M743 WeakPolarHBondContact O-CG 3.49Å; K739-M743 PolarHBondContact O-N 3.43Å
740	Q	27	Very low	25.3	Very low	98 Å²	98	109.7 Å²	109.7	46%	0.458	62%	0.619	S	S	.	*	H	α-helix	trans	-69.3	-41.4	175.4	-77.4	173.9	-31.5	0	0	112.1	S737 S742 M743 F744	S737-Q740 PolarHBondContact O-N 3.2Å; Q740-S742 PolarHBondContact O-N 3.16Å; Q740-M743 HydrophobicContact CG-CE 4.17Å; Q740-M743 PolarHBondContact O-N 2.95Å; Q740-F744 PolarHBondContact O-N 2.95Å
741	M	26.1	Very low	25.4	Very low	113 Å²	113	111.2 Å²	111.2	56%	0.557	61%	0.606	S	S	*	*	H	α-helix	trans	-62.4	-42.6	175.3	-72.2	177.2	103.7	0	0	111.9	F736 S737 F744 V745	F736-M741 HydrophobicContact CB-CG 4.43Å; S737-M741 PolarHBondContact O-N 3.03Å; M741-F744 PolarHBondContact O-N 3.05Å; M741-V745 WeakPolarHBondContact O-CG2 3.42Å; M741-V745 PolarHBondContact O-N 2.83Å
742	S	26.3	Very low	25.7	Very low	69 Å²	69	111 Å²	111	48%	0.483	60%	0.598	S	S	.	*	H	α-helix	trans	-66.5	-37.1	175.3	69.3	0	0	0	0	112.6	A738 K739 Q740 F744 R746	A738-S742 WeakPolarHBondContact O-CB 3.37Å; A738-S742 PolarHBondContact O-N 3.09Å; A738-S742 PolarHBondContact O-OG 3.24Å; K739-S742 PolarHBondContact O-OG 2.94Å; Q740-S742 PolarHBondContact O-N 3.16Å; S742-F744 VanDerWaalsContact C-N 3.32Å; S742-F744 PolarHBondContact O-N 3.24Å; S742-R746 WeakPolarHBondContact O-CB 3.4Å; S742-R746 PolarHBondContact O-N 3.46Å
743	M	26.8	Very low	25.6	Very low	98 Å²	98	106.7 Å²	106.7	48%	0.483	58%	0.579	S	S	.	*	H	α-helix	trans	-62.3	-40.3	172.3	-78.3	-164.7	-55.5	0	0	111.5	K739 Q740 R746 Q747	K739-M743 WeakPolarHBondContact O-CG 3.49Å; K739-M743 PolarHBondContact O-N 3.43Å; Q740-M743 HydrophobicContact CG-CE 4.17Å; Q740-M743 PolarHBondContact O-N 2.95Å; M743-R746 PolarHBondContact O-N 2.99Å; M743-Q747 WeakPolarHBondContact O-CB 3.4Å; M743-Q747 WeakPolarHBondContact O-CG 3.14Å; M743-Q747 PolarHBondContact O-N 3.37Å
744	F	28.8	Very low	25.7	Very low	139 Å²	139	104.2 Å²	104.2	61%	0.61	57%	0.568	S	S	*	*	H	α-helix	trans	-65	-50.1	177.4	-176.7	-100.1	0	0	0	112	Q740 M741 S742 R746 Q747 V748	Q740-F744 PolarHBondContact O-N 2.95Å; M741-F744 PolarHBondContact O-N 3.05Å; S742-F744 VanDerWaalsContact C-N 3.32Å; S742-F744 PolarHBondContact O-N 3.24Å; F744-R746 VanDerWaalsContact C-N 3.28Å; F744-R746 PolarHBondContact O-N 3.43Å; F744-Q747 PolarHBondContact O-N 2.68Å; F744-Q747 VanDerWaalsContact O-N 3.15Å; F744-V748 HydrophobicContact CD1-CG2 4.29Å; F744-V748 HydrophobicContact CE1-CG2 3.94Å; F744-V748 HydrophobicContact CE2-CG2 4.35Å; F744-V748 HydrophobicContact CZ-CG2 3.97Å; F744-V748 WeakPolarHBondContact O-CG2 3.06Å; F744-V748 PolarHBondContact O-N 3.34Å
745	V	28	Very low	26	Very low	95 Å²	95	101.1 Å²	101.1	58%	0.576	55%	0.551	S	S	*	*	H	α-helix	trans	-60	-40.7	176.3	174.3	0	0	0	0	110.9	M741 V748 A749	M741-V745 WeakPolarHBondContact O-CG2 3.42Å; M741-V745 PolarHBondContact O-N 2.83Å; V745-V748 PolarHBondContact O-N 3.21Å; V745-A749 VanDerWaalsContact O-CB 3.31Å; V745-A749 WeakPolarHBondContact O-CB 3.27Å; V745-A749 PolarHBondContact O-N 3.44Å
746	R	25.5	Very low	26.1	Very low	191 Å²	191	99.5 Å²	99.5	72%	0.721	54%	0.544	S	S	*	.	H	α-helix	trans	-66.5	-39.1	177.1	-160.2	175.3	-171.7	179.1	2.6	111.8	S742 M743 F744 C750	S742-R746 WeakPolarHBondContact O-CB 3.4Å; S742-R746 PolarHBondContact O-N 3.46Å; M743-R746 PolarHBondContact O-N 2.99Å; F744-R746 VanDerWaalsContact C-N 3.28Å; F744-R746 PolarHBondContact O-N 3.43Å; R746-C750 VanDerWaalsContact O-CB 3.23Å; R746-C750 WeakPolarHBondContact O-CB 3.17Å; R746-C750 PolarHBondContact O-N 3.42Å; R746-C750 PolarHBondContact O-SG 2.88Å
747	Q	26.8	Very low	26.2	Very low	132 Å²	132	98.2 Å²	98.2	62%	0.617	54%	0.54	S	S	*	.	H	α-helix	trans	-65.2	-44.8	174.2	-80.3	178.8	-4.7	0	0	111.7	M743 F744 C750 L751	M743-Q747 WeakPolarHBondContact O-CB 3.4Å; M743-Q747 WeakPolarHBondContact O-CG 3.14Å; M743-Q747 PolarHBondContact O-N 3.37Å; F744-Q747 PolarHBondContact O-N 2.68Å; F744-Q747 VanDerWaalsContact O-N 3.15Å; Q747-C750 PolarHBondContact O-N 3.22Å; Q747-L751 WeakPolarHBondContact O-CB 3.32Å; Q747-L751 PolarHBondContact O-N 3.33Å
748	V	26.9	Very low	26.2	Very low	77 Å²	77	99 Å²	99	47%	0.467	54%	0.542	S	S	.	.	H	α-helix	trans	-65.4	-42.4	178.1	175.9	0	0	0	0	111.4	F744 V745 L751 A752	F744-V748 HydrophobicContact CD1-CG2 4.29Å; F744-V748 HydrophobicContact CE1-CG2 3.94Å; F744-V748 HydrophobicContact CE2-CG2 4.35Å; F744-V748 HydrophobicContact CZ-CG2 3.97Å; F744-V748 WeakPolarHBondContact O-CG2 3.06Å; F744-V748 PolarHBondContact O-N 3.34Å; V745-V748 PolarHBondContact O-N 3.21Å; V748-L751 PolarHBondContact O-N 3.12Å; V748-A752 WeakPolarHBondContact O-CB 3.11Å; V748-A752 PolarHBondContact O-N 3.22Å
749	A	24.7	Very low	26.3	Very low	61 Å²	61	99.7 Å²	99.7	50%	0.504	53%	0.534	S	S	.	.	H	α-helix	trans	-67.1	-40	176.1	0	0	0	0	0	112.3	V745 L751 A752 G753	V745-A749 VanDerWaalsContact O-CB 3.31Å; V745-A749 WeakPolarHBondContact O-CB 3.27Å; V745-A749 PolarHBondContact O-N 3.44Å; A749-L751 VanDerWaalsContact C-N 3.31Å; A749-A752 PolarHBondContact O-N 3.22Å; A749-G753 PolarHBondContact O-N 3.04Å
750	C	24.9	Very low	26.3	Very low	89 Å²	89	92.9 Å²	92.9	60%	0.601	51%	0.505	S	S	*	.	H	α-helix	trans	-64.8	-34.6	171.4	-77.9	0	0	0	0	111.9	R746 Q747 G754	R746-C750 VanDerWaalsContact O-CB 3.23Å; R746-C750 WeakPolarHBondContact O-CB 3.17Å; R746-C750 PolarHBondContact O-N 3.42Å; R746-C750 PolarHBondContact O-SG 2.88Å; Q747-C750 PolarHBondContact O-N 3.22Å; C750-G754 WeakPolarHBondContact O-CA 3.32Å; C750-G754 PolarHBondContact O-N 3.4Å
751	L	25.6	Very low	26.3	Very low	119 Å²	119	91.2 Å²	91.2	62%	0.623	51%	0.509	S	S	*	.	H	α-helix	trans	-70.4	-44.4	176.8	-148.4	95.7	0	0	0	111	Q747 V748 A749 G754 L755	Q747-L751 WeakPolarHBondContact O-CB 3.32Å; Q747-L751 PolarHBondContact O-N 3.33Å; V748-L751 PolarHBondContact O-N 3.12Å; A749-L751 VanDerWaalsContact C-N 3.31Å; L751-G754 PolarHBondContact O-N 3.05Å; L751-L755 HydrophobicContact CD2-CD1 4.17Å; L751-L755 HydrophobicContact CG-CD1 4.41Å; L751-L755 VanDerWaalsContact O-CB 3.27Å; L751-L755 WeakPolarHBondContact O-CB 3.37Å; L751-L755 PolarHBondContact O-N 3.36Å
752	A	27.3	Very low	26.3	Very low	59 Å²	59	93.9 Å²	93.9	49%	0.488	52%	0.517	S	S	.	.	H	α-helix	trans	-67.4	-42.9	177.5	0	0	0	0	0	111.8	V748 A749 L755 F756	V748-A752 WeakPolarHBondContact O-CB 3.11Å; V748-A752 PolarHBondContact O-N 3.22Å; A749-A752 PolarHBondContact O-N 3.22Å; A752-L755 PolarHBondContact O-N 2.7Å; A752-F756 WeakPolarHBondContact O-CB 3.38Å; A752-F756 PolarHBondContact O-N 2.84Å
753	G	23.2	Very low	26.4	Very low	38 Å²	38	95.4 Å²	95.4	39%	0.392	52%	0.52	S	S	.	.	H	α-helix	trans	-63.9	-41.8	172.8	0	0	0	0	0	112.1	A749 F756 E757	A749-G753 PolarHBondContact O-N 3.04Å; G753-F756 PolarHBondContact O-N 2.75Å; G753-E757 PolarHBondContact O-N 2.79Å
754	G	22.6	Very low	26.3	Very low	28 Å²	28	94.1 Å²	94.1	29%	0.289	53%	0.532	S	S	.	.	H	α-helix	trans	-65.6	-41.1	174.5	0	0	0	0	0	112.8	C750 L751 F756 E757 V758	C750-G754 WeakPolarHBondContact O-CA 3.32Å; C750-G754 PolarHBondContact O-N 3.4Å; L751-G754 PolarHBondContact O-N 3.05Å; G754-F756 VanDerWaalsContact C-N 3.33Å; G754-E757 PolarHBondContact O-N 3.18Å; G754-V758 VanDerWaalsContact O-CB 3.28Å; G754-V758 WeakPolarHBondContact O-CB 3.3Å; G754-V758 WeakPolarHBondContact O-CG2 3.34Å; G754-V758 PolarHBondContact O-N 2.78Å
755	L	28.3	Very low	26.1	Very low	100 Å²	100	93.8 Å²	93.8	52%	0.524	53%	0.531	S	S	.	.	H	α-helix	trans	-64.7	-38.3	173.8	-101	146	0	0	0	111.1	L751 A752 V758 L759	L751-L755 HydrophobicContact CD2-CD1 4.17Å; L751-L755 HydrophobicContact CG-CD1 4.41Å; L751-L755 VanDerWaalsContact O-CB 3.27Å; L751-L755 WeakPolarHBondContact O-CB 3.37Å; L751-L755 PolarHBondContact O-N 3.36Å; A752-L755 PolarHBondContact O-N 2.7Å; L755-V758 PolarHBondContact O-N 3.38Å; L755-L759 VanDerWaalsContact O-CB 3.26Å; L755-L759 WeakPolarHBondContact O-CB 3.18Å; L755-L759 PolarHBondContact O-N 3.41Å
756	F	26.8	Very low	26	Very low	130 Å²	130	93.6 Å²	93.6	57%	0.57	53%	0.526	S	S	*	.	H	α-helix	trans	-70	-39.7	176.2	-160.6	-95.8	0	0	0	112	A752 G753 G754 T760	A752-F756 WeakPolarHBondContact O-CB 3.38Å; A752-F756 PolarHBondContact O-N 2.84Å; G753-F756 PolarHBondContact O-N 2.75Å; G754-F756 VanDerWaalsContact C-N 3.33Å; F756-T760 HydrophobicContact CD1-CG2 4.31Å; F756-T760 HydrophobicContact CE1-CG2 4.12Å; F756-T760 WeakPolarHBondContact O-CB 3.21Å; F756-T760 WeakPolarHBondContact O-CG2 3.42Å; F756-T760 PolarHBondContact O-N 2.83Å; F756-T760 PolarHBondContact O-OG1 2.88Å
757	E	26.1	Very low	26.1	Very low	124 Å²	124	86 Å²	86	58%	0.579	50%	0.504	S	S	*	.	H	α-helix	trans	-64.1	-41.3	169.8	-82.7	-170	164	0	0	111.8	G753 G754 T760 A761	G753-E757 PolarHBondContact O-N 2.79Å; G754-E757 PolarHBondContact O-N 3.18Å; E757-T760 WeakPolarHBondContact CA-OG1 3.37Å; E757-T760 PolarHBondContact O-OG1 2.78Å; E757-T760 VanDerWaalsContact O-OG1 3.11Å; E757-A761 WeakPolarHBondContact O-CB 3.2Å; E757-A761 PolarHBondContact O-N 3.39Å
758	V	27.3	Very low	26.1	Very low	80 Å²	80	84.7 Å²	84.7	49%	0.485	51%	0.506	S	S	.	.	H	α-helix	trans	-67.2	-42.4	177.2	169.7	0	0	0	0	110.6	G754 L755 A761 F762	G754-V758 VanDerWaalsContact O-CB 3.28Å; G754-V758 WeakPolarHBondContact O-CB 3.3Å; G754-V758 WeakPolarHBondContact O-CG2 3.34Å; G754-V758 PolarHBondContact O-N 2.78Å; L755-V758 PolarHBondContact O-N 3.38Å; V758-A761 PolarHBondContact O-N 2.82Å; V758-F762 HydrophobicContact CG1-CD2 3.87Å; V758-F762 HydrophobicContact CG1-CE2 4.34Å; V758-F762 VanDerWaalsContact O-CB 3.29Å; V758-F762 WeakPolarHBondContact O-CB 3.3Å; V758-F762 PolarHBondContact O-N 2.77Å
759	L	28.3	Very low	26	Very low	96 Å²	96	87.7 Å²	87.7	50%	0.503	52%	0.516	S	S	.	.	H	α-helix	trans	-65.5	-43.7	176.7	-107.9	137.3	0	0	0	111.7	L755 N763	L755-L759 VanDerWaalsContact O-CB 3.26Å; L755-L759 WeakPolarHBondContact O-CB 3.18Å; L755-L759 PolarHBondContact O-N 3.41Å; L759-N763 WeakPolarHBondContact O-CB 3.48Å; L759-N763 PolarHBondContact O-N 3.08Å; L759-N763 PolarHBondContact O-ND2 3.14Å
760	T	25.6	Very low	26	Very low	14 Å²	14	87 Å²	87	9%	0.086	51%	0.505	C	S	.	.	H	α-helix	trans	-67	-41.8	176.2	47.8	0	0	0	0	110.9	F756 E757 N763 G764 F765 V770	F756-T760 HydrophobicContact CD1-CG2 4.31Å; F756-T760 HydrophobicContact CE1-CG2 4.12Å; F756-T760 WeakPolarHBondContact O-CB 3.21Å; F756-T760 WeakPolarHBondContact O-CG2 3.42Å; F756-T760 PolarHBondContact O-N 2.83Å; F756-T760 PolarHBondContact O-OG1 2.88Å; E757-T760 WeakPolarHBondContact CA-OG1 3.37Å; E757-T760 PolarHBondContact O-OG1 2.78Å; E757-T760 VanDerWaalsContact O-OG1 3.11Å; T760-N763 CarbonylContact O-C 3.36Å; T760-N763 PolarHBondContact O-N 3.24Å; T760-G764 PolarHBondContact O-N 2.93Å; T760-F765 CarbonylContact C-O 3.48Å; T760-F765 VanDerWaalsContact C-O 3.29Å; T760-F765 HydrophobicContact CG2-CB 4.48Å; T760-F765 WeakPolarHBondContact O-CA 3.23Å; T760-F765 PolarHBondContact O-N 3.03Å; T760-V770 HydrophobicContact CG2-CG2 4.41Å
761	A	25.9	Very low	26	Very low	64 Å²	64	89.4 Å²	89.4	53%	0.529	51%	0.51	S	S	.	.	H	α-helix	trans	-64.6	-42.4	174.8	0	0	0	0	0	113.1	E757 V758 N763 G764	E757-A761 WeakPolarHBondContact O-CB 3.2Å; E757-A761 PolarHBondContact O-N 3.39Å; V758-A761 PolarHBondContact O-N 2.82Å; A761-N763 VanDerWaalsContact C-N 3.26Å; A761-N763 PolarHBondContact O-N 2.73Å; A761-G764 PolarHBondContact O-N 2.9Å
762	F	27.5	Very low	25.8	Very low	168 Å²	168	85.2 Å²	85.2	74%	0.737	50%	0.495	S	S	*	.	H	α-helix	trans	-63.5	-34.9	177.3	-110.9	-87.3	0	0	0	111.8	V758 G764	V758-F762 HydrophobicContact CG1-CD2 3.87Å; V758-F762 HydrophobicContact CG1-CE2 4.34Å; V758-F762 VanDerWaalsContact O-CB 3.29Å; V758-F762 WeakPolarHBondContact O-CB 3.3Å; V758-F762 PolarHBondContact O-N 2.77Å; F762-G764 VanDerWaalsContact C-N 3.3Å; F762-G764 PolarHBondContact O-N 2.98Å
763	N	27.1	Very low	25.7	Very low	101 Å²	101	87.8 Å²	87.8	54%	0.54	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	12.6	-179.4	-64.8	-27.5	0	0	0	113.1	L759 T760 A761 F765	L759-N763 WeakPolarHBondContact O-CB 3.48Å; L759-N763 PolarHBondContact O-N 3.08Å; L759-N763 PolarHBondContact O-ND2 3.14Å; T760-N763 CarbonylContact O-C 3.36Å; T760-N763 PolarHBondContact O-N 3.24Å; A761-N763 VanDerWaalsContact C-N 3.26Å; A761-N763 PolarHBondContact O-N 2.73Å; N763-F765 HydrophobicContact CB-CD2 3.78Å; N763-F765 HydrophobicContact CB-CE2 4.04Å; N763-F765 WeakPolarHBondContact O-CD2 3.25Å; N763-F765 PolarHBondContact O-N 2.85Å
764	G	25	Very low	25.8	Very low	71 Å²	71	90.1 Å²	90.1	73%	0.732	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	8.4	174.6	0	0	0	0	0	114.9	T760 A761 F762	T760-G764 PolarHBondContact O-N 2.93Å; A761-G764 PolarHBondContact O-N 2.9Å; F762-G764 VanDerWaalsContact C-N 3.3Å; F762-G764 PolarHBondContact O-N 2.98Å
765	F	24.8	Very low	25.9	Very low	133 Å²	133	96.5 Å²	96.5	58%	0.583	53%	0.529	S	S	*	.			trans	-84.6	122.9	175.2	-66.1	-74	0	0	0	110	T760 N763 A767 V770	T760-F765 CarbonylContact C-O 3.48Å; T760-F765 VanDerWaalsContact C-O 3.29Å; T760-F765 HydrophobicContact CG2-CB 4.48Å; T760-F765 WeakPolarHBondContact O-CA 3.23Å; T760-F765 PolarHBondContact O-N 3.03Å; N763-F765 HydrophobicContact CB-CD2 3.78Å; N763-F765 HydrophobicContact CB-CE2 4.04Å; N763-F765 WeakPolarHBondContact O-CD2 3.25Å; N763-F765 PolarHBondContact O-N 2.85Å; F765-A767 PolarHBondContact O-N 3.27Å; F765-V770 HydrophobicContact CB-CG2 4.3Å
766	N	26.6	Very low	25.6	Very low	91 Å²	91	98 Å²	98	49%	0.487	53%	0.534	S	S	.	.			trans	-68.6	116.1	168.8	-177.7	-12.5	0	0	0	108.3	T768 M769 V770	N766-T768 PolarHBondContact O-N 3.2Å; N766-T768 VanDerWaalsContact O-N 3.07Å; N766-T768 WeakPolarHBondContact OD1-CB 3.23Å; N766-T768 PolarHBondContact OD1-N 3.31Å; N766-T768 VanDerWaalsContact OD1-N 3.11Å; N766-T768 PolarHBondContact OD1-OG1 3.24Å; N766-M769 HydrophobicContact CB-CB 4.27Å; N766-M769 WeakPolarHBondContact O-CA 3.19Å; N766-M769 WeakPolarHBondContact O-CB 3.35Å; N766-M769 PolarHBondContact O-N 2.84Å; N766-V770 PolarHBondContact O-N 2.85Å
767	A	26	Very low	25.5	Very low	31 Å²	31	97.3 Å²	97.3	26%	0.256	54%	0.539	S	S	.	.	H	α-helix	trans	-52.8	-31.6	-179.9	0	0	0	0	0	112.6	F765 M769 V770 M771	F765-A767 PolarHBondContact O-N 3.27Å; A767-M769 VanDerWaalsContact C-N 3.3Å; A767-M769 PolarHBondContact O-N 2.75Å; A767-V770 PolarHBondContact O-N 2.93Å; A767-M771 WeakPolarHBondContact O-CB 3.11Å; A767-M771 PolarHBondContact O-N 2.84Å
768	T	27.2	Very low	25.4	Very low	105 Å²	105	93.3 Å²	93.3	64%	0.644	53%	0.528	S	S	*	.	H	α-helix	trans	-66.4	-31.1	175	-33.7	0	0	0	0	112.4	N766 G772	N766-T768 PolarHBondContact O-N 3.2Å; N766-T768 VanDerWaalsContact O-N 3.07Å; N766-T768 WeakPolarHBondContact OD1-CB 3.23Å; N766-T768 PolarHBondContact OD1-N 3.31Å; N766-T768 VanDerWaalsContact OD1-N 3.11Å; N766-T768 PolarHBondContact OD1-OG1 3.24Å; T768-G772 WeakPolarHBondContact O-CA 3.08Å; T768-G772 PolarHBondContact O-N 3.35Å
769	M	25.1	Very low	25.3	Very low	140 Å²	140	98.1 Å²	98.1	69%	0.69	54%	0.539	S	S	*	.	H	α-helix	trans	-71.7	-36.8	174.3	-118.8	175.9	161.5	0	0	111.5	N766 A767 G772 L773	N766-M769 HydrophobicContact CB-CB 4.27Å; N766-M769 WeakPolarHBondContact O-CA 3.19Å; N766-M769 WeakPolarHBondContact O-CB 3.35Å; N766-M769 PolarHBondContact O-N 2.84Å; A767-M769 VanDerWaalsContact C-N 3.3Å; A767-M769 PolarHBondContact O-N 2.75Å; M769-G772 CarbonylContact O-C 3.53Å; M769-G772 PolarHBondContact O-N 2.85Å; M769-L773 WeakPolarHBondContact O-CB 3.44Å; M769-L773 PolarHBondContact O-N 2.77Å
770	V	25.6	Very low	25.1	Very low	45 Å²	45	102 Å²	102	27%	0.273	55%	0.548	S	S	.	.	H	α-helix	trans	-71	-44.2	176	-179	0	0	0	0	110.8	T760 F765 N766 A767 G772 L773 C774	T760-V770 HydrophobicContact CG2-CG2 4.41Å; F765-V770 HydrophobicContact CB-CG2 4.3Å; N766-V770 PolarHBondContact O-N 2.85Å; A767-V770 PolarHBondContact O-N 2.93Å; V770-G772 VanDerWaalsContact C-N 3.27Å; V770-G772 PolarHBondContact O-N 3.49Å; V770-L773 CarbonylContact O-C 3.57Å; V770-L773 WeakPolarHBondContact O-CA 3.15Å; V770-L773 WeakPolarHBondContact O-CB 3.29Å; V770-L773 PolarHBondContact O-N 3.32Å; V770-L773 VanDerWaalsContact O-N 3.1Å; V770-C774 PolarHBondContact O-N 3.48Å
771	M	24.5	Very low	25.1	Very low	141 Å²	141	106.9 Å²	106.9	70%	0.695	57%	0.574	S	S	*	*	H	α-helix	trans	-61.4	-37.4	170.4	-81.7	-87.5	-75.6	0	0	111.8	A767 C774 K775	A767-M771 WeakPolarHBondContact O-CB 3.11Å; A767-M771 PolarHBondContact O-N 2.84Å; M771-C774 PolarHBondContact O-N 3.04Å; M771-K775 PolarHBondContact O-N 3.34Å
772	G	21.6	Very low	25	Very low	31 Å²	31	105.8 Å²	105.8	32%	0.32	57%	0.568	S	S	.	*	H	α-helix	trans	-62.4	-40.6	171	0	0	0	0	0	112.1	T768 M769 V770 K775 E776	T768-G772 WeakPolarHBondContact O-CA 3.08Å; T768-G772 PolarHBondContact O-N 3.35Å; M769-G772 CarbonylContact O-C 3.53Å; M769-G772 PolarHBondContact O-N 2.85Å; V770-G772 VanDerWaalsContact C-N 3.27Å; V770-G772 PolarHBondContact O-N 3.49Å; G772-K775 CarbonylContact O-C 3.6Å; G772-K775 WeakPolarHBondContact O-CA 3.42Å; G772-K775 WeakPolarHBondContact O-CB 3.44Å; G772-K775 PolarHBondContact O-N 3.37Å; G772-K775 VanDerWaalsContact O-N 3.16Å; G772-E776 WeakPolarHBondContact O-CB 3.45Å; G772-E776 PolarHBondContact O-N 3.09Å
773	L	25.2	Very low	24.9	Very low	112 Å²	112	101.6 Å²	101.6	59%	0.586	56%	0.56	S	S	*	*	H	α-helix	trans	-66.4	-40.9	175.6	-131.3	95.2	0	0	0	111.3	M769 V770 K775 E776 V777	M769-L773 WeakPolarHBondContact O-CB 3.44Å; M769-L773 PolarHBondContact O-N 2.77Å; V770-L773 CarbonylContact O-C 3.57Å; V770-L773 WeakPolarHBondContact O-CA 3.15Å; V770-L773 WeakPolarHBondContact O-CB 3.29Å; V770-L773 PolarHBondContact O-N 3.32Å; V770-L773 VanDerWaalsContact O-N 3.1Å; L773-K775 VanDerWaalsContact C-N 3.26Å; L773-K775 PolarHBondContact O-N 2.86Å; L773-E776 PolarHBondContact O-N 2.88Å; L773-V777 VanDerWaalsContact O-CB 3.31Å; L773-V777 WeakPolarHBondContact O-CB 3.38Å; L773-V777 WeakPolarHBondContact O-CG2 3.19Å; L773-V777 PolarHBondContact O-N 3.03Å
774	C	24.9	Very low	24.8	Very low	87 Å²	87	102.6 Å²	102.6	59%	0.588	57%	0.565	S	S	*	*	H	α-helix	trans	-63.2	-35.4	172.3	-71.2	0	0	0	0	111.5	V770 M771 A778	V770-C774 PolarHBondContact O-N 3.48Å; M771-C774 PolarHBondContact O-N 3.04Å; C774-A778 WeakPolarHBondContact O-CB 3.25Å; C774-A778 PolarHBondContact O-N 3.19Å
775	K	23.4	Very low	24.8	Very low	162 Å²	162	104.8 Å²	104.8	70%	0.704	56%	0.56	S	S	*	*	H	α-helix	trans	-70.2	-35.5	172.8	-99.1	-176	172	-177.9	0	113.4	M771 G772 L773 A778 Y779	M771-K775 PolarHBondContact O-N 3.34Å; G772-K775 CarbonylContact O-C 3.6Å; G772-K775 WeakPolarHBondContact O-CA 3.42Å; G772-K775 WeakPolarHBondContact O-CB 3.44Å; G772-K775 PolarHBondContact O-N 3.37Å; G772-K775 VanDerWaalsContact O-N 3.16Å; L773-K775 VanDerWaalsContact C-N 3.26Å; L773-K775 PolarHBondContact O-N 2.86Å; K775-A778 VanDerWaalsContact O-CB 3.25Å; K775-A778 WeakPolarHBondContact O-CB 3.33Å; K775-Y779 PolarHBondContact O-N 2.79Å
776	E	23.5	Very low	24.8	Very low	133 Å²	133	102.4 Å²	102.4	62%	0.621	55%	0.553	S	S	*	*	H	α-helix	trans	-77.5	-38.6	178.9	-90.1	-93	151	0	0	112.5	G772 L773 A778 Y779	G772-E776 WeakPolarHBondContact O-CB 3.45Å; G772-E776 PolarHBondContact O-N 3.09Å; L773-E776 PolarHBondContact O-N 2.88Å; E776-A778 PolarHBondContact O-N 3.49Å; E776-Y779 PolarHBondContact O-N 3.39Å
777	V	24.9	Very low	24.7	Very low	114 Å²	114	106.8 Å²	106.8	69%	0.691	56%	0.564	S	S	*	*	H	α-helix	trans	-64.2	-30.8	172	171.3	0	0	0	0	110.8	L773 Y779	L773-V777 VanDerWaalsContact O-CB 3.31Å; L773-V777 WeakPolarHBondContact O-CB 3.38Å; L773-V777 WeakPolarHBondContact O-CG2 3.19Å; L773-V777 PolarHBondContact O-N 3.03Å; V777-Y779 VanDerWaalsContact C-N 3.35Å
778	A	24.1	Very low	24.7	Very low	41 Å²	41	107.6 Å²	107.6	34%	0.339	57%	0.57	S	S	.	*	H	α-helix	trans	-60.1	-45.4	165.9	0	0	0	0	0	110.6	C774 K775 E776 Y780 W933	C774-A778 WeakPolarHBondContact O-CB 3.25Å; C774-A778 PolarHBondContact O-N 3.19Å; K775-A778 VanDerWaalsContact O-CB 3.25Å; K775-A778 WeakPolarHBondContact O-CB 3.33Å; E776-A778 PolarHBondContact O-N 3.49Å; A778-Y780 PolarHBondContact O-N 2.74Å; A778-W933 VanDerWaalsContact C-CZ2 3.41Å; A778-W933 HydrophobicContact CB-CH2 3.5Å; A778-W933 HydrophobicContact CB-CZ2 4.2Å; A778-W933 HydrophobicContact CB-CZ3 4.46Å; A778-W933 WeakPolarHBondContact O-CH2 3.33Å; A778-W933 WeakPolarHBondContact O-CZ2 3.49Å
779	Y	23.8	Very low	24.6	Very low	181 Å²	181	107.7 Å²	107.7	71%	0.71	57%	0.567	S	S	*	*	S	Bend	trans	-76.6	-4.6	-163.7	-121.9	-88.1	0	0	0	118.2	K775 E776 V777	K775-Y779 PolarHBondContact O-N 2.79Å; E776-Y779 PolarHBondContact O-N 3.39Å; V777-Y779 VanDerWaalsContact C-N 3.35Å
780	Y	25.1	Very low	24.5	Very low	177 Å²	177	106.3 Å²	106.3	69%	0.694	55%	0.554	S	S	*	*	S	Bend	trans	-125.1	124.4	-171.5	-110.8	-83.7	0	0	0	117.1	A778 G782	A778-Y780 PolarHBondContact O-N 2.74Å; Y780-G782 PolarHBondContact O-N 2.78Å
781	N	25.7	Very low	24.4	Very low	117 Å²	117	109.9 Å²	109.9	63%	0.626	57%	0.566	S	S	*	*			trans	18	62	156.5	-76.5	-2.7	0	0	0	118.1	S783	N781-S783 PolarHBondContact O-N 3.3Å
782	G	24.3	Very low	24.3	Very low	41 Å²	41	105 Å²	105	42%	0.423	55%	0.545	S	S	.	.	H	α-helix	trans	-67.3	-9.3	177.3	0	0	0	0	0	115.8	Y780 L786	Y780-G782 PolarHBondContact O-N 2.78Å; G782-L786 WeakPolarHBondContact O-CB 3.33Å; G782-L786 PolarHBondContact O-N 2.87Å
783	S	24.1	Very low	24.3	Very low	79 Å²	79	107.8 Å²	107.8	55%	0.552	56%	0.555	S	S	*	*	H	α-helix	trans	-67.3	-44.4	-175.9	50.2	0	0	0	0	113.2	N781 Y787	N781-S783 PolarHBondContact O-N 3.3Å; S783-Y787 PolarHBondContact O-N 2.89Å
784	D	24.8	Very low	24.2	Very low	122 Å²	122	107.8 Å²	107.8	65%	0.652	55%	0.551	S	S	*	*	H	α-helix	trans	-76.7	-33.4	-177.2	-68.4	-16.9	0	0	0	111.7	L786 Y787 A788	D784-L786 PolarHBondContact O-N 2.71Å; D784-Y787 PolarHBondContact O-N 3.49Å; D784-A788 WeakPolarHBondContact O-CB 3.29Å; D784-A788 PolarHBondContact O-N 3.44Å
785	N	26.1	Very low	24	Very low	118 Å²	118	105.6 Å²	105.6	63%	0.631	54%	0.543	S	S	*	.	H	α-helix	trans	-69.1	-32.4	176.6	-76	-28.9	0	0	0	112.6	L789	N785-L789 WeakPolarHBondContact O-CG 3.31Å; N785-L789 PolarHBondContact O-N 3.31Å; N785-L789 VanDerWaalsContact O-N 3.08Å
786	L	24.7	Very low	23.9	Very low	83 Å²	83	103.8 Å²	103.8	44%	0.435	54%	0.537	S	S	.	.	H	α-helix	trans	-76.2	-35.9	175.3	-95.4	154.5	0	0	0	112.4	G782 D784 A788 L789 W790	G782-L786 WeakPolarHBondContact O-CB 3.33Å; G782-L786 PolarHBondContact O-N 2.87Å; D784-L786 PolarHBondContact O-N 2.71Å; L786-A788 VanDerWaalsContact C-N 3.26Å; L786-A788 PolarHBondContact O-N 2.97Å; L786-L789 HydrophobicContact CD2-CD1 4.23Å; L786-L789 HydrophobicContact CG-CD1 4.4Å; L786-L789 WeakPolarHBondContact O-CB 3.38Å; L786-L789 PolarHBondContact O-N 3.23Å; L786-L789 VanDerWaalsContact O-N 3.13Å; L786-W790 VanDerWaalsContact O-CD1 3.26Å; L786-W790 PolarHBondContact O-N 2.87Å
787	Y	25	Very low	23.8	Very low	183 Å²	183	101.8 Å²	101.8	72%	0.718	53%	0.529	S	S	*	.	H	α-helix	trans	-62.4	-37.2	171.3	-131.7	-82.7	0	0	0	111.4	S783 D784 W790	S783-Y787 PolarHBondContact O-N 2.89Å; D784-Y787 PolarHBondContact O-N 3.49Å; Y787-W790 PolarHBondContact O-N 3.49Å
788	A	25.4	Very low	23.7	Very low	47 Å²	47	105.2 Å²	105.2	39%	0.388	53%	0.53	S	S	.	.	H	α-helix	trans	-66.6	-32.4	172.8	0	0	0	0	0	113.2	D784 L786 P792	D784-A788 WeakPolarHBondContact O-CB 3.29Å; D784-A788 PolarHBondContact O-N 3.44Å; L786-A788 VanDerWaalsContact C-N 3.26Å; L786-A788 PolarHBondContact O-N 2.97Å; A788-P792 WeakPolarHBondContact O-CD 3.44Å
789	L	24.3	Very low	23.5	Very low	108 Å²	108	106.7 Å²	106.7	57%	0.565	55%	0.549	S	S	*	.	H	α-helix	trans	-70.6	-28.9	172.7	-81.6	158.3	0	0	0	113	N785 L786 T793	N785-L789 WeakPolarHBondContact O-CG 3.31Å; N785-L789 PolarHBondContact O-N 3.31Å; N785-L789 VanDerWaalsContact O-N 3.08Å; L786-L789 HydrophobicContact CD2-CD1 4.23Å; L786-L789 HydrophobicContact CG-CD1 4.4Å; L786-L789 WeakPolarHBondContact O-CB 3.38Å; L786-L789 PolarHBondContact O-N 3.23Å; L786-L789 VanDerWaalsContact O-N 3.13Å; L789-T793 PolarHBondContact O-OG1 2.86Å
790	W	22.6	Very low	23.3	Very low	111 Å²	111	107.7 Å²	107.7	42%	0.42	55%	0.552	S	S	.	*	H	α-helix	trans	-71.5	-34.8	-177.7	-93.8	56.9	0	0	0	113.7	L786 Y787 F794 F923	L786-W790 VanDerWaalsContact O-CD1 3.26Å; L786-W790 PolarHBondContact O-N 2.87Å; Y787-W790 PolarHBondContact O-N 3.49Å; W790-F794 HydrophobicContact CE3-CE2 4.37Å; W790-F923 HydrophobicContact CH2-CD2 4.48Å
791	K	24.9	Very low	23.1	Very low	120 Å²	120	107.1 Å²	107.1	52%	0.522	55%	0.55	S	S	.	.	H	α-helix	trans	-72.1	-42.3	-171	-135.2	-179.6	-173.8	-172.4	0	114.6	C90 T793 F794 G795	C90-K791 PolarHBondContact O-NZ 3.41Å; K791-T793 VanDerWaalsContact C-N 3.28Å; K791-T793 PolarHBondContact O-N 2.92Å; K791-F794 PolarHBondContact O-N 3.37Å; K791-G795 PolarHBondContact O-N 2.93Å
792	P	21.4	Very low	22.9	Very low	39 Å²	39	104.3 Å²	104.3	25%	0.253	54%	0.542	S	S	.	.	H	α-helix	trans	-65.9	-30.8	177.7	-19.5	30.7	0	0	0	112.8	A788 F794 G795 H796	A788-P792 WeakPolarHBondContact O-CD 3.44Å; P792-F794 VanDerWaalsContact C-N 3.25Å; P792-F794 PolarHBondContact O-N 3.36Å; P792-G795 CarbonylContact O-C 3.54Å; P792-G795 VanDerWaalsContact O-CA 3.25Å; P792-G795 WeakPolarHBondContact O-CA 3.1Å; P792-G795 PolarHBondContact O-N 2.53Å; P792-H796 PolarHBondContact O-CD2 2.77Å; P792-H796 PolarHBondContact O-N 3.45Å; P792-H796 VanDerWaalsContact O-N 3.07Å
793	T	23.2	Very low	22.8	Very low	88 Å²	88	106 Å²	106	54%	0.54	54%	0.542	S	S	.	.	H	α-helix	trans	-63.3	-32.1	-178.2	-39.9	0	0	0	0	112.1	L789 K791	L789-T793 PolarHBondContact O-OG1 2.86Å; K791-T793 VanDerWaalsContact C-N 3.28Å; K791-T793 PolarHBondContact O-N 2.92Å
794	F	21.4	Very low	22.6	Very low	112 Å²	112	112.2 Å²	112.2	49%	0.491	55%	0.553	S	S	.	*	H	α-helix	trans	-75.1	-29.3	167.5	-76.4	-75.3	0	0	0	113.2	W790 K791 P792 H796 I797	W790-F794 HydrophobicContact CE3-CE2 4.37Å; K791-F794 PolarHBondContact O-N 3.37Å; P792-F794 VanDerWaalsContact C-N 3.25Å; P792-F794 PolarHBondContact O-N 3.36Å; F794-H796 VanDerWaalsContact C-N 3.27Å; F794-H796 PolarHBondContact O-N 3.36Å; F794-I797 PolarHBondContact O-N 2.74Å
795	G	20.6	Very low	22.5	Very low	41 Å²	41	110.5 Å²	110.5	42%	0.423	55%	0.55	S	S	.	.	H	α-helix	trans	-62.9	-29.1	174.1	0	0	0	0	0	113.8	K791 P792 I797 R798	K791-G795 PolarHBondContact O-N 2.93Å; P792-G795 CarbonylContact O-C 3.54Å; P792-G795 VanDerWaalsContact O-CA 3.25Å; P792-G795 WeakPolarHBondContact O-CA 3.1Å; P792-G795 PolarHBondContact O-N 2.53Å; G795-I797 VanDerWaalsContact C-N 3.29Å; G795-I797 PolarHBondContact O-N 3.42Å; G795-R798 WeakPolarHBondContact O-CB 3.45Å; G795-R798 PolarHBondContact O-N 3.38Å
796	H	21.4	Very low	22.5	Very low	124 Å²	124	107.9 Å²	107.9	57%	0.574	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-14.3	177.1	-63.4	-64	0	0	0	113.8	Y99 P792 F794 R798	Y99-H796 PolarHBondContact OH-CE1 2.9Å; Y99-H796 PolarHBondContact OH-NE2 2.76Å; P792-H796 PolarHBondContact O-CD2 2.77Å; P792-H796 PolarHBondContact O-N 3.45Å; P792-H796 VanDerWaalsContact O-N 3.07Å; F794-H796 VanDerWaalsContact C-N 3.27Å; F794-H796 PolarHBondContact O-N 3.36Å; H796-R798 PolarHBondContact O-N 2.88Å
797	I	22.8	Very low	22.3	Very low	91 Å²	91	111.4 Å²	111.4	47%	0.467	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	27.2	176.2	-52.4	174.1	0	0	0	109.7	F794 G795 G799 W800 Y801	F794-I797 PolarHBondContact O-N 2.74Å; G795-I797 VanDerWaalsContact C-N 3.29Å; G795-I797 PolarHBondContact O-N 3.42Å; I797-G799 PolarHBondContact O-N 3.16Å; I797-G799 VanDerWaalsContact O-N 3.11Å; I797-W800 HydrophobicContact CG2-CB 3.64Å; I797-W800 HydrophobicContact CG2-CG 4.43Å; I797-W800 CarbonylContact O-C 3.47Å; I797-W800 PolarHBondContact O-N 3.08Å; I797-Y801 PolarHBondContact O-N 3.48Å
798	R	21.5	Very low	22.2	Very low	187 Å²	187	108.6 Å²	108.6	71%	0.706	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	0.9	-179.2	-125.2	-177	176.8	-174.3	0	115.8	G795 H796 Y801	G795-R798 WeakPolarHBondContact O-CB 3.45Å; G795-R798 PolarHBondContact O-N 3.38Å; H796-R798 PolarHBondContact O-N 2.88Å; R798-Y801 HydrophobicContact CG-CD2 4.11Å
799	G	21	Very low	22.1	Very low	72 Å²	72	110.8 Å²	110.8	74%	0.742	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	-8.8	164.3	0	0	0	0	0	113.9	I797	I797-G799 PolarHBondContact O-N 3.16Å; I797-G799 VanDerWaalsContact O-N 3.11Å
800	W	20.1	Very low	22.1	Very low	202 Å²	202	109.3 Å²	109.3	77%	0.765	56%	0.555	S	S	*	*	S	Bend	trans	-120.4	18.4	177.6	-80.1	53.6	0	0	0	111.8	I797 A802	I797-W800 HydrophobicContact CG2-CB 3.64Å; I797-W800 HydrophobicContact CG2-CG 4.43Å; I797-W800 CarbonylContact O-C 3.47Å; I797-W800 PolarHBondContact O-N 3.08Å; W800-A802 PolarHBondContact O-N 3.49Å; W800-A802 VanDerWaalsContact O-N 3.14Å
801	Y	19.9	Very low	22.1	Very low	165 Å²	165	108 Å²	108	65%	0.647	58%	0.576	S	S	*	*	S	Bend	trans	-65.7	108.9	144.4	-94.7	-92.2	0	0	0	105.6	I797 R798 D803	I797-Y801 PolarHBondContact O-N 3.48Å; R798-Y801 HydrophobicContact CG-CD2 4.11Å; Y801-D803 VanDerWaalsContact C-N 3.29Å; Y801-D803 PolarHBondContact O-N 3.36Å
802	A	21.9	Very low	21.9	Very low	57 Å²	57	105.7 Å²	105.7	47%	0.471	59%	0.586	S	S	.	*			trans	-46.5	106.3	157.7	0	0	0	0	0	106	W800 R804	W800-A802 PolarHBondContact O-N 3.49Å; W800-A802 VanDerWaalsContact O-N 3.14Å; A802-R804 PolarHBondContact O-N 2.85Å
803	D	22.1	Very low	22	Very low	77 Å²	77	108.1 Å²	108.1	41%	0.412	60%	0.597	S	S	.	*			trans	-58.6	110.5	-178.1	169.1	24.3	0	0	0	107	Y801 C805 S806 W807	Y801-D803 VanDerWaalsContact C-N 3.29Å; Y801-D803 PolarHBondContact O-N 3.36Å; D803-C805 PolarHBondContact O-N 2.76Å; D803-C805 VanDerWaalsContact O-N 3.09Å; D803-C805 WeakPolarHBondContact OD1-CB 3.36Å; D803-C805 PolarHBondContact OD1-N 2.61Å; D803-S806 PolarHBondContact O-N 3.46Å; D803-S806 VanDerWaalsContact O-N 3.11Å; D803-S806 WeakPolarHBondContact OD2-CB 3.18Å; D803-S806 PolarHBondContact OD2-N 3.01Å; D803-S806 PolarHBondContact OD2-OG 3.26Å; D803-W807 PolarHBondContact O-N 3.42Å
804	R	20.8	Very low	22.1	Very low	210 Å²	210	113.9 Å²	113.9	79%	0.792	61%	0.614	S	S	*	*	H	α-helix	trans	-54.6	-29.7	179.9	-157.9	-178	-172	-165.1	3.8	110.2	A802 L808	A802-R804 PolarHBondContact O-N 2.85Å; R804-L808 HydrophobicContact CG-CD1 4.44Å; R804-L808 WeakPolarHBondContact O-CB 3.39Å; R804-L808 WeakPolarHBondContact O-CD1 3.48Å; R804-L808 WeakPolarHBondContact O-CG 3.46Å; R804-L808 PolarHBondContact O-N 3.15Å; R804-L808 VanDerWaalsContact O-N 3.16Å
805	C	22.7	Very low	22.2	Very low	86 Å²	86	111 Å²	111	58%	0.581	61%	0.608	S	S	*	*	H	α-helix	trans	-77.1	-44.5	178.1	-69.3	0	0	0	0	112.5	D803 W807 L808 S809	D803-C805 PolarHBondContact O-N 2.76Å; D803-C805 VanDerWaalsContact O-N 3.09Å; D803-C805 WeakPolarHBondContact OD1-CB 3.36Å; D803-C805 PolarHBondContact OD1-N 2.61Å; C805-W807 VanDerWaalsContact C-N 3.26Å; C805-W807 PolarHBondContact O-N 2.87Å; C805-L808 PolarHBondContact O-N 3.06Å; C805-S809 PolarHBondContact O-N 3.02Å; C805-S809 PolarHBondContact O-OG 3.13Å
806	S	24.4	Very low	22.3	Very low	62 Å²	62	110.5 Å²	110.5	43%	0.434	60%	0.598	S	S	.	*	H	α-helix	trans	-59.1	-35.2	177.1	-69.5	0	0	0	0	113	D803 S809	D803-S806 PolarHBondContact O-N 3.46Å; D803-S806 VanDerWaalsContact O-N 3.11Å; D803-S806 WeakPolarHBondContact OD2-CB 3.18Å; D803-S806 PolarHBondContact OD2-N 3.01Å; D803-S806 PolarHBondContact OD2-OG 3.26Å; S806-S809 VanDerWaalsContact C-OG 3.27Å; S806-S809 WeakPolarHBondContact CA-OG 3.06Å; S806-S809 PolarHBondContact O-OG 3.28Å
807	W	21.4	Very low	22.4	Very low	157 Å²	157	109 Å²	109	60%	0.595	59%	0.594	S	S	*	*	H	α-helix	trans	-84.6	-27.8	177	-76.2	72.1	0	0	0	113.7	D803 C805 S809 C810 L813	D803-W807 PolarHBondContact O-N 3.42Å; C805-W807 VanDerWaalsContact C-N 3.26Å; C805-W807 PolarHBondContact O-N 2.87Å; W807-S809 VanDerWaalsContact C-N 3.31Å; W807-C810 PolarHBondContact O-N 3.42Å; W807-L813 HydrophobicContact CE3-CD1 3.63Å; W807-L813 HydrophobicContact CZ3-CD1 3.59Å
808	L	22.5	Very low	22.4	Very low	124 Å²	124	110.7 Å²	110.7	65%	0.649	61%	0.608	S	S	*	*	H	α-helix	trans	-66.3	-32.9	168.2	-85.7	164.3	0	0	0	112.1	R804 C805 C810	R804-L808 HydrophobicContact CG-CD1 4.44Å; R804-L808 WeakPolarHBondContact O-CB 3.39Å; R804-L808 WeakPolarHBondContact O-CD1 3.48Å; R804-L808 WeakPolarHBondContact O-CG 3.46Å; R804-L808 PolarHBondContact O-N 3.15Å; R804-L808 VanDerWaalsContact O-N 3.16Å; C805-L808 PolarHBondContact O-N 3.06Å; L808-C810 PolarHBondContact O-N 2.8Å
809	S	23.8	Very low	22.4	Very low	94 Å²	94	108.5 Å²	108.5	66%	0.657	61%	0.609	S	S	*	*	H	α-helix	trans	-68.9	-22	175.2	40.7	0	0	0	0	113.5	C805 S806 W807 G811	C805-S809 PolarHBondContact O-N 3.02Å; C805-S809 PolarHBondContact O-OG 3.13Å; S806-S809 VanDerWaalsContact C-OG 3.27Å; S806-S809 WeakPolarHBondContact CA-OG 3.06Å; S806-S809 PolarHBondContact O-OG 3.28Å; W807-S809 VanDerWaalsContact C-N 3.31Å; S809-G811 VanDerWaalsContact C-N 3.29Å; S809-G811 PolarHBondContact O-N 3.02Å
810	C	23.5	Very low	22.5	Very low	76 Å²	76	107.5 Å²	107.5	51%	0.514	59%	0.587	S	S	.	*	S	Bend	trans	-80.2	82.1	166.4	-68.7	0	0	0	0	108.4	W807 L808 G812 L813	W807-C810 PolarHBondContact O-N 3.42Å; L808-C810 PolarHBondContact O-N 2.8Å; C810-G812 PolarHBondContact O-N 3.11Å; C810-L813 PolarHBondContact O-N 3.07Å
811	G	22	Very low	22.8	Very low	84 Å²	84	109.8 Å²	109.8	87%	0.866	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.8	25.3	-172.3	0	0	0	0	0	118.4	S809	S809-G811 VanDerWaalsContact C-N 3.29Å; S809-G811 PolarHBondContact O-N 3.02Å
812	G	22.6	Very low	23.1	Very low	71 Å²	71	105.4 Å²	105.4	73%	0.732	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.3	-4	175.7	0	0	0	0	0	115.8	C810	C810-G812 PolarHBondContact O-N 3.11Å
813	L	23.1	Very low	23.3	Very low	91 Å²	91	105.4 Å²	105.4	48%	0.476	59%	0.593	S	S	.	*			trans	-120.1	57.9	-168.2	-66.9	164.5	0	0	0	112.7	W807 C810 S815	W807-L813 HydrophobicContact CE3-CD1 3.63Å; W807-L813 HydrophobicContact CZ3-CD1 3.59Å; C810-L813 PolarHBondContact O-N 3.07Å; L813-S815 PolarHBondContact O-N 2.91Å
814	K	25.1	Very low	23.6	Very low	208 Å²	208	108.3 Å²	108.3	90%	0.904	61%	0.608	S	S	*	*	S	Bend	trans	-71.1	-7.4	177.9	-87.1	-176.5	175.5	177.9	0	114.6
815	S	24	Very low	24	Very low	53 Å²	53	108.4 Å²	108.4	37%	0.371	61%	0.609	S	S	.	*	S	Bend	trans	-160.6	146.5	176.6	46.6	0	0	0	0	110.2	L813 N817	L813-S815 PolarHBondContact O-N 2.91Å; S815-N817 PolarHBondContact O-N 3.3Å; S815-N817 VanDerWaalsContact OG-CG 3.26Å; S815-N817 PolarHBondContact OG-ND2 3.33Å; S815-N817 VanDerWaalsContact OG-ND2 3.13Å; S815-N817 PolarHBondContact OG-OD1 3.25Å
816	P	22.8	Very low	24.2	Very low	30 Å²	30	106.4 Å²	106.4	20%	0.195	59%	0.594	C	S	.	*	G	3₁₀ helix	trans	-73.3	29.7	177.8	31.8	-33.8	0	0	0	113	V818 L819 L820	P816-V818 PolarHBondContact O-N 2.99Å; P816-L819 PolarHBondContact O-N 2.82Å; P816-L820 PolarHBondContact O-N 3.31Å
817	N	21.5	Very low	24.5	Very low	92 Å²	92	109.8 Å²	109.8	49%	0.492	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-56.4	-23.9	-179.6	-75.1	0.2	0	0	0	112.8	S815	S815-N817 PolarHBondContact O-N 3.3Å; S815-N817 VanDerWaalsContact OG-CG 3.26Å; S815-N817 PolarHBondContact OG-ND2 3.33Å; S815-N817 VanDerWaalsContact OG-ND2 3.13Å; S815-N817 PolarHBondContact OG-OD1 3.25Å
818	V	23.1	Very low	24.8	Very low	126 Å²	126	108.7 Å²	108.7	76%	0.764	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-82.7	-30.2	178.4	-172.5	0	0	0	0	112.1	P816	P816-V818 PolarHBondContact O-N 2.99Å
819	L	22.9	Very low	25.1	Very low	141 Å²	141	108.8 Å²	108.8	74%	0.738	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-29.2	179.9	-85.6	161	0	0	0	112.8	P816	P816-L819 PolarHBondContact O-N 2.82Å
820	L	23.3	Very low	25.2	Very low	52 Å²	52	109.1 Å²	109.1	27%	0.272	59%	0.592	S	S	.	*	S	Bend	trans	-124.4	78.6	-178.2	-61.5	173.1	0	0	0	108.4	P816 G822 D823 T826 L831	P816-L820 PolarHBondContact O-N 3.31Å; L820-G822 PolarHBondContact O-N 2.81Å; L820-D823 HydrophobicContact CB-CB 4.36Å; L820-D823 PolarHBondContact O-N 3.4Å; L820-D823 VanDerWaalsContact O-N 3.15Å; L820-T826 HydrophobicContact CD1-CG2 4.02Å; L820-L831 HydrophobicContact CD1-CD1 4.02Å; L820-L831 HydrophobicContact CD1-CD2 4.27Å; L820-L831 HydrophobicContact CD1-CG 4.46Å
821	R	25.6	Very low	25.2	Very low	249 Å²	249	108 Å²	108	94%	0.94	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-43.7	98.1	179.8	-98.4	-172.4	173.1	-175.7	-0.3	111
822	G	25.3	Very low	25.2	Very low	74 Å²	74	112.5 Å²	112.5	76%	0.763	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	82.6	13.6	170.1	0	0	0	0	0	117.2	L820	L820-G822 PolarHBondContact O-N 2.81Å
823	D	26.8	Very low	25.1	Very low	56 Å²	56	114.6 Å²	114.6	30%	0.299	57%	0.566	S	S	.	*			trans	-101.2	97.5	171.5	-173.1	-3.1	0	0	0	111	L820 R825 T826	L820-D823 HydrophobicContact CB-CB 4.36Å; L820-D823 PolarHBondContact O-N 3.4Å; L820-D823 VanDerWaalsContact O-N 3.15Å; D823-R825 VanDerWaalsContact C-N 3.34Å; D823-R825 PolarHBondContact OD1-N 2.87Å; D823-T826 VanDerWaalsContact CG-OG1 3.32Å; D823-T826 PolarHBondContact OD1-N 3.1Å; D823-T826 WeakPolarHBondContact OD2-CB 3.4Å; D823-T826 PolarHBondContact OD2-OG1 3.43Å
824	D	29.1	Very low	25	Very low	139 Å²	139	113.8 Å²	113.8	74%	0.743	58%	0.58	S	S	*	*			trans	-85.5	-3.2	176.8	55.7	-14.9	0	0	0	113.5
825	R	28.9	Very low	24.7	Very low	212 Å²	212	109.9 Å²	109.9	80%	0.8	57%	0.568	S	S	*	*	S	Bend	trans	-99.4	-22.6	-176.7	-63	-173.2	178.3	-172	-0.8	113.4	D823 K827	D823-R825 VanDerWaalsContact C-N 3.34Å; D823-R825 PolarHBondContact OD1-N 2.87Å; R825-K827 PolarHBondContact O-N 2.76Å
826	T	27.3	Very low	24.6	Very low	44 Å²	44	112.5 Å²	112.5	27%	0.27	58%	0.582	S	S	.	*			trans	-74.7	108.6	-179.8	-67.1	0	0	0	0	111.2	L820 D823 N830 L831	L820-T826 HydrophobicContact CD1-CG2 4.02Å; D823-T826 VanDerWaalsContact CG-OG1 3.32Å; D823-T826 PolarHBondContact OD1-N 3.1Å; D823-T826 WeakPolarHBondContact OD2-CB 3.4Å; D823-T826 PolarHBondContact OD2-OG1 3.43Å; T826-N830 HydrophobicContact CG2-CB 4.09Å; T826-L831 HydrophobicContact CG2-CD1 4.4Å; T826-L831 HydrophobicContact CG2-CG 4.3Å
827	K	29.5	Very low	24.6	Very low	133 Å²	133	114.8 Å²	114.8	58%	0.578	60%	0.597	S	S	*	*			trans	-73	153.8	173.9	-63.5	-178	-179.2	178.4	0	110.5	R825 D829 N830	R825-K827 PolarHBondContact O-N 2.76Å; K827-D829 PolarHBondContact O-N 2.98Å; K827-D829 VanDerWaalsContact O-N 3.12Å; K827-N830 WeakPolarHBondContact O-CB 3.48Å; K827-N830 PolarHBondContact O-N 3.41Å
828	W	28.8	Very low	24.9	Very low	134 Å²	134	116.3 Å²	116.3	51%	0.508	60%	0.601	S	S	.	*	G	3₁₀ helix	trans	-51.4	-35.8	173.6	-97.4	119	0	0	0	112.7	N830 L831 F833	W828-N830 PolarHBondContact O-N 3.38Å; W828-N830 VanDerWaalsContact O-N 3.16Å; W828-L831 HydrophobicContact CD2-CD1 4.44Å; W828-L831 HydrophobicContact CE3-CB 4.14Å; W828-L831 HydrophobicContact CE3-CD1 3.78Å; W828-L831 HydrophobicContact CZ3-CB 4.28Å; W828-L831 HydrophobicContact CZ3-CD1 3.85Å; W828-L831 PolarHBondContact O-N 2.79Å; W828-L831 VanDerWaalsContact O-N 3.08Å; W828-F833 HydrophobicContact CE3-CE2 4.02Å; W828-F833 HydrophobicContact CE3-CZ 4.11Å; W828-F833 HydrophobicContact CH2-CE2 4.34Å; W828-F833 AromaticContact CH2-CZ 3.62Å; W828-F833 HydrophobicContact CH2-CZ 3.62Å; W828-F833 HydrophobicContact CZ3-CE1 4.14Å; W828-F833 AromaticContact CZ3-CE2 3.47Å; W828-F833 HydrophobicContact CZ3-CE2 3.47Å; W828-F833 VanDerWaalsContact CZ3-CE2 3.47Å; W828-F833 AromaticContact CZ3-CZ 3.12Å; W828-F833 HydrophobicContact CZ3-CZ 3.12Å
829	D	27.7	Very low	25.2	Very low	125 Å²	125	117.7 Å²	117.7	67%	0.668	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-63.8	-17.3	179.5	-8.3	-31.2	0	0	0	112.8	K827	K827-D829 PolarHBondContact O-N 2.98Å; K827-D829 VanDerWaalsContact O-N 3.12Å
830	N	25.3	Very low	25.6	Very low	102 Å²	102	113.6 Å²	113.6	55%	0.545	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	-97.8	-5.9	178.6	-60.4	-19.5	0	0	0	113	T826 K827 W828 F832	T826-N830 HydrophobicContact CG2-CB 4.09Å; K827-N830 WeakPolarHBondContact O-CB 3.48Å; K827-N830 PolarHBondContact O-N 3.41Å; W828-N830 PolarHBondContact O-N 3.38Å; W828-N830 VanDerWaalsContact O-N 3.16Å; N830-F832 PolarHBondContact O-N 3.14Å
831	L	23.9	Very low	26.2	Very low	52 Å²	52	112.5 Å²	112.5	27%	0.272	57%	0.565	S	S	.	*			trans	-92	97.3	178.5	-86.7	148.7	0	0	0	110.1	L820 T826 W828 F833	L820-L831 HydrophobicContact CD1-CD1 4.02Å; L820-L831 HydrophobicContact CD1-CD2 4.27Å; L820-L831 HydrophobicContact CD1-CG 4.46Å; T826-L831 HydrophobicContact CG2-CD1 4.4Å; T826-L831 HydrophobicContact CG2-CG 4.3Å; W828-L831 HydrophobicContact CD2-CD1 4.44Å; W828-L831 HydrophobicContact CE3-CB 4.14Å; W828-L831 HydrophobicContact CE3-CD1 3.78Å; W828-L831 HydrophobicContact CZ3-CB 4.28Å; W828-L831 HydrophobicContact CZ3-CD1 3.85Å; W828-L831 PolarHBondContact O-N 2.79Å; W828-L831 VanDerWaalsContact O-N 3.08Å; L831-F833 PolarHBondContact O-N 3.02Å
832	F	22.1	Very low	26.7	Very low	178 Å²	178	104.2 Å²	104.2	78%	0.781	54%	0.535	S	S	*	.			trans	-80.4	107.7	170.3	-81.5	-89.5	0	0	0	110.3	N830 G834	N830-F832 PolarHBondContact O-N 3.14Å; F832-G834 PolarHBondContact O-N 2.93Å
833	F	20.7	Very low	27.2	Very low	116 Å²	116	103.5 Å²	103.5	51%	0.509	51%	0.513	S	S	.	.			trans	-72.5	86.5	176.1	-71.3	-80	0	0	0	111.9	W828 L831 L835	W828-F833 HydrophobicContact CE3-CE2 4.02Å; W828-F833 HydrophobicContact CE3-CZ 4.11Å; W828-F833 HydrophobicContact CH2-CE2 4.34Å; W828-F833 AromaticContact CH2-CZ 3.62Å; W828-F833 HydrophobicContact CH2-CZ 3.62Å; W828-F833 HydrophobicContact CZ3-CE1 4.14Å; W828-F833 AromaticContact CZ3-CE2 3.47Å; W828-F833 HydrophobicContact CZ3-CE2 3.47Å; W828-F833 VanDerWaalsContact CZ3-CE2 3.47Å; W828-F833 AromaticContact CZ3-CZ 3.12Å; W828-F833 HydrophobicContact CZ3-CZ 3.12Å; L831-F833 PolarHBondContact O-N 3.02Å; F833-L835 HydrophobicContact CD1-CD1 3.47Å; F833-L835 VanDerWaalsContact CD1-CD1 3.47Å; F833-L835 HydrophobicContact CD1-CG 3.97Å; F833-L835 HydrophobicContact CE1-CD1 3.76Å
834	G	20.4	Very low	27.8	Very low	74 Å²	74	104 Å²	104	76%	0.763	52%	0.515	S	S	*	.			trans	-99.9	48.4	154.6	0	0	0	0	0	110.3	F832 T836	F832-G834 PolarHBondContact O-N 2.93Å; G834-T836 PolarHBondContact O-N 2.99Å
835	L	20.6	Very low	28.3	Very low	125 Å²	125	97.7 Å²	97.7	65%	0.654	48%	0.482	S	S	*	.			trans	-81.1	81.6	-172.3	-77.7	179.2	0	0	0	111.7	F833	F833-L835 HydrophobicContact CD1-CD1 3.47Å; F833-L835 VanDerWaalsContact CD1-CD1 3.47Å; F833-L835 HydrophobicContact CD1-CG 3.97Å; F833-L835 HydrophobicContact CE1-CD1 3.76Å
836	T	20.4	Very low	28.9	Very low	108 Å²	108	89.7 Å²	89.7	66%	0.663	46%	0.456	S	S	*	.			trans	-170.1	114.8	132.8	6	0	0	0	0	107.3	G834 H838	G834-T836 PolarHBondContact O-N 2.99Å; T836-H838 VanDerWaalsContact C-N 3.33Å; T836-H838 PolarHBondContact O-N 2.81Å
837	P	23.3	Very low	29.6	Very low	78 Å²	78	89.6 Å²	89.6	51%	0.506	45%	0.452	S	S	.	.			trans	-60.8	104.6	167.1	23.9	-28.8	0	0	0	106.5	Y839	P837-Y839 PolarHBondContact O-N 2.89Å
838	H	26.9	Very low	30	Very low	124 Å²	124	84 Å²	84	57%	0.574	43%	0.428	S	S	*	.			trans	-50.6	140.1	173.1	-110.9	-100.7	0	0	0	108	T836 E840 I841 K842	T836-H838 VanDerWaalsContact C-N 3.33Å; T836-H838 PolarHBondContact O-N 2.81Å; H838-E840 PolarHBondContact O-N 3.24Å; H838-I841 HydrophobicContact CB-CD1 4.2Å; H838-I841 WeakPolarHBondContact O-CB 3.21Å; H838-I841 PolarHBondContact O-N 3.43Å; H838-K842 PolarHBondContact O-N 3.16Å
839	Y	29.9	Very low	30.5	Very low	156 Å²	156	77.8 Å²	77.8	61%	0.612	41%	0.406	S	S	*	.	H	α-helix	trans	-49.2	-31.4	-173.5	-168	-100.1	0	0	0	112.8	P837 I841 K842 I843	P837-Y839 PolarHBondContact O-N 2.89Å; Y839-I841 PolarHBondContact O-N 2.61Å; Y839-K842 CarbonylContact O-C 3.54Å; Y839-K842 WeakPolarHBondContact O-CB 3.39Å; Y839-K842 PolarHBondContact O-N 2.84Å; Y839-K842 VanDerWaalsContact O-N 3.16Å; Y839-I843 HydrophobicContact CD1-CD1 3.44Å; Y839-I843 VanDerWaalsContact CD1-CD1 3.44Å; Y839-I843 HydrophobicContact CD1-CG1 3.91Å; Y839-I843 HydrophobicContact CE1-CD1 3.55Å; Y839-I843 HydrophobicContact CE1-CG1 3.86Å; Y839-I843 VanDerWaalsContact O-CG1 3.31Å; Y839-I843 WeakPolarHBondContact O-CG1 3.46Å; Y839-I843 PolarHBondContact O-N 2.78Å
840	E	32.6	Very low	31	Very low	55 Å²	55	72.4 Å²	72.4	26%	0.257	38%	0.377	S	S	.	.	H	α-helix	trans	-62	-38.7	175.3	-63.3	162	170.5	0	0	113.5	H838 I843 L844 V884 S887	H838-E840 PolarHBondContact O-N 3.24Å; E840-I843 PolarHBondContact O-N 3.22Å; E840-L844 WeakPolarHBondContact O-CB 3.49Å; E840-L844 PolarHBondContact O-N 3.12Å; E840-V884 HydrophobicContact CB-CG1 3.97Å; E840-V884 HydrophobicContact CG-CG1 3.93Å; E840-S887 PolarHBondContact OE1-OG 3.31Å
841	I	35.6	Very low	31.5	Very low	29 Å²	29	69.4 Å²	69.4	15%	0.149	36%	0.358	C	S	.	.	H	α-helix	trans	-72.9	-36.9	173	-68.2	143.4	0	0	0	110	H838 Y839 I843 L844 L845 A915 V917	H838-I841 HydrophobicContact CB-CD1 4.2Å; H838-I841 WeakPolarHBondContact O-CB 3.21Å; H838-I841 PolarHBondContact O-N 3.43Å; Y839-I841 PolarHBondContact O-N 2.61Å; I841-I843 VanDerWaalsContact C-N 3.32Å; I841-L844 CarbonylContact O-C 3.5Å; I841-L844 PolarHBondContact O-N 3.33Å; I841-L845 HydrophobicContact CG2-CD1 3.64Å; I841-L845 HydrophobicContact CG2-CG 4.04Å; I841-L845 WeakPolarHBondContact O-CB 3.25Å; I841-L845 WeakPolarHBondContact O-CG 3.11Å; I841-L845 PolarHBondContact O-N 2.91Å; I841-A915 HydrophobicContact CB-CB 4.14Å; I841-A915 HydrophobicContact CD1-CB 3.18Å; I841-A915 HydrophobicContact CG1-CB 3.47Å; I841-A915 VanDerWaalsContact CG1-CB 3.47Å; I841-A915 HydrophobicContact CG2-CB 3.61Å; I841-V917 HydrophobicContact CD1-CG2 4.49Å
842	K	35.2	Very low	32.3	Very low	75 Å²	75	67.1 Å²	67.1	33%	0.326	35%	0.347	S	S	.	.	H	α-helix	trans	-60.9	-44.9	173.3	-160.2	-172.4	-178.3	-171	0	110.3	H838 Y839 L844 L845 V846 W851	H838-K842 PolarHBondContact O-N 3.16Å; Y839-K842 CarbonylContact O-C 3.54Å; Y839-K842 WeakPolarHBondContact O-CB 3.39Å; Y839-K842 PolarHBondContact O-N 2.84Å; Y839-K842 VanDerWaalsContact O-N 3.16Å; K842-L844 VanDerWaalsContact C-N 3.35Å; K842-L844 PolarHBondContact O-N 3.4Å; K842-L845 PolarHBondContact O-N 2.86Å; K842-V846 WeakPolarHBondContact O-CB 3.35Å; K842-V846 WeakPolarHBondContact O-CG2 3.34Å; K842-V846 PolarHBondContact O-N 2.77Å; K842-W851 HydrophobicContact CD-CZ2 4.37Å; K842-W851 VanDerWaalsContact CE-CZ2 3.47Å; K842-W851 HydrophobicContact CG-CD2 3.79Å; K842-W851 HydrophobicContact CG-CE3 3.81Å; K842-W851 HydrophobicContact CG-CG 4.39Å; K842-W851 HydrophobicContact CG-CH2 4.47Å; K842-W851 HydrophobicContact CG-CZ2 4.36Å; K842-W851 HydrophobicContact CG-CZ3 4.19Å
843	I	37.4	Very low	33.2	Very low	59 Å²	59	65 Å²	65	30%	0.303	34%	0.344	S	S	.	.	H	α-helix	trans	-58	-47.9	172.3	-68.7	163.6	0	0	0	110	Y839 E840 I841 L845 V846 K847	Y839-I843 HydrophobicContact CD1-CD1 3.44Å; Y839-I843 VanDerWaalsContact CD1-CD1 3.44Å; Y839-I843 HydrophobicContact CD1-CG1 3.91Å; Y839-I843 HydrophobicContact CE1-CD1 3.55Å; Y839-I843 HydrophobicContact CE1-CG1 3.86Å; Y839-I843 VanDerWaalsContact O-CG1 3.31Å; Y839-I843 WeakPolarHBondContact O-CG1 3.46Å; Y839-I843 PolarHBondContact O-N 2.78Å; E840-I843 PolarHBondContact O-N 3.22Å; I841-I843 VanDerWaalsContact C-N 3.32Å; I843-L845 VanDerWaalsContact C-N 3.34Å; I843-L845 PolarHBondContact O-N 2.89Å; I843-V846 PolarHBondContact O-N 3.32Å; I843-K847 HydrophobicContact CG2-CD 3.76Å; I843-K847 HydrophobicContact CG2-CG 4.16Å; I843-K847 VanDerWaalsContact O-CB 3.29Å; I843-K847 WeakPolarHBondContact O-CB 3.39Å; I843-K847 VanDerWaalsContact O-CG 3.29Å; I843-K847 WeakPolarHBondContact O-CG 3.17Å; I843-K847 PolarHBondContact O-N 3.08Å
844	L	38.9	Very low	34.4	Very low	65 Å²	65	65 Å²	65	34%	0.34	35%	0.349	S	S	.	.	H	α-helix	trans	-60.7	-44.9	179.2	-149.7	101.4	0	0	0	111	E840 I841 K842 K847 L848 I898	E840-L844 WeakPolarHBondContact O-CB 3.49Å; E840-L844 PolarHBondContact O-N 3.12Å; I841-L844 CarbonylContact O-C 3.5Å; I841-L844 PolarHBondContact O-N 3.33Å; K842-L844 VanDerWaalsContact C-N 3.35Å; K842-L844 PolarHBondContact O-N 3.4Å; L844-K847 PolarHBondContact O-N 3.03Å; L844-L848 HydrophobicContact CD2-CD1 3.85Å; L844-L848 HydrophobicContact CG-CD1 4.26Å; L844-L848 VanDerWaalsContact O-CB 3.27Å; L844-L848 WeakPolarHBondContact O-CB 3.43Å; L844-L848 WeakPolarHBondContact O-CG 3.44Å; L844-L848 PolarHBondContact O-N 2.94Å; L844-I898 HydrophobicContact CD2-CD1 3.48Å; L844-I898 VanDerWaalsContact CD2-CD1 3.48Å
845	L	39.7	Very low	34.9	Very low	8 Å²	8	63.9 Å²	63.9	4%	0.042	34%	0.337	C	S	.	.	H	α-helix	trans	-68.7	-36.1	179.4	-67.7	168.8	0	0	0	112.6	I841 K842 I843 G849 I850 W851 W857	I841-L845 HydrophobicContact CG2-CD1 3.64Å; I841-L845 HydrophobicContact CG2-CG 4.04Å; I841-L845 WeakPolarHBondContact O-CB 3.25Å; I841-L845 WeakPolarHBondContact O-CG 3.11Å; I841-L845 PolarHBondContact O-N 2.91Å; K842-L845 PolarHBondContact O-N 2.86Å; I843-L845 VanDerWaalsContact C-N 3.34Å; I843-L845 PolarHBondContact O-N 2.89Å; L845-G849 PolarHBondContact O-N 2.86Å; L845-I850 HydrophobicContact CD2-CB 4.34Å; L845-I850 HydrophobicContact CD2-CD1 3.94Å; L845-I850 HydrophobicContact CD2-CG2 4.4Å; L845-I850 PolarHBondContact O-N 3.14Å; L845-W851 HydrophobicContact CB-CB 3.96Å; L845-W851 HydrophobicContact CB-CE3 4.33Å; L845-W851 HydrophobicContact CD1-CE3 4.03Å; L845-W851 HydrophobicContact CD1-CZ3 4.49Å; L845-W851 PolarHBondContact O-N 2.99Å; L845-W857 HydrophobicContact CB-CZ3 4.36Å; L845-W857 HydrophobicContact CD1-CH2 3.81Å; L845-W857 HydrophobicContact CD1-CZ3 4.13Å; L845-W857 HydrophobicContact CD2-CH2 4.39Å; L845-W857 HydrophobicContact CG-CH2 4.49Å
846	V	41.9	Very low	35.5	Very low	43 Å²	43	67.7 Å²	67.7	26%	0.261	34%	0.343	S	S	.	.	H	α-helix	trans	-64.2	-48.4	171	169.7	0	0	0	0	109.8	K842 I843 L848 G849 W851 D853	K842-V846 WeakPolarHBondContact O-CB 3.35Å; K842-V846 WeakPolarHBondContact O-CG2 3.34Å; K842-V846 PolarHBondContact O-N 2.77Å; I843-V846 PolarHBondContact O-N 3.32Å; V846-L848 VanDerWaalsContact C-N 3.33Å; V846-L848 PolarHBondContact O-N 3.08Å; V846-G849 WeakPolarHBondContact O-CA 3.26Å; V846-G849 PolarHBondContact O-N 3.17Å; V846-W851 HydrophobicContact CB-CB 4.23Å; V846-W851 HydrophobicContact CG2-CB 3.55Å; V846-W851 HydrophobicContact CG2-CG 3.65Å; V846-D853 VanDerWaalsContact CG1-OD1 3.23Å; V846-D853 WeakPolarHBondContact CG1-OD1 3.43Å
847	K	40.9	Very low	36.2	Very low	43 Å²	43	67.4 Å²	67.4	19%	0.187	33%	0.329	C	S	.	.	H	α-helix	trans	-67	-31.4	179.8	-73	-177.5	177.5	-179.9	0	112.7	I843 L844 G849 L877 E881	I843-K847 HydrophobicContact CG2-CD 3.76Å; I843-K847 HydrophobicContact CG2-CG 4.16Å; I843-K847 VanDerWaalsContact O-CB 3.29Å; I843-K847 WeakPolarHBondContact O-CB 3.39Å; I843-K847 VanDerWaalsContact O-CG 3.29Å; I843-K847 WeakPolarHBondContact O-CG 3.17Å; I843-K847 PolarHBondContact O-N 3.08Å; L844-K847 PolarHBondContact O-N 3.03Å; K847-G849 PolarHBondContact O-N 3.48Å; K847-L877 HydrophobicContact CD-CB 4.14Å; K847-L877 PolarHBondContact NZ-O 3.35Å; K847-E881 IonicContact NZ-OE2 3.75Å; K847-E881 PolarHBondContact NZ-OE2 3.27Å
848	L	38.2	Very low	36.7	Very low	15 Å²	15	66.1 Å²	66.1	8%	0.079	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	1.7	170.8	-69.2	172	0	0	0	112.8	L844 V846 I850 I872 I898	L844-L848 HydrophobicContact CD2-CD1 3.85Å; L844-L848 HydrophobicContact CG-CD1 4.26Å; L844-L848 VanDerWaalsContact O-CB 3.27Å; L844-L848 WeakPolarHBondContact O-CB 3.43Å; L844-L848 WeakPolarHBondContact O-CG 3.44Å; L844-L848 PolarHBondContact O-N 2.94Å; V846-L848 VanDerWaalsContact C-N 3.33Å; V846-L848 PolarHBondContact O-N 3.08Å; L848-I850 HydrophobicContact CB-CD1 3.93Å; L848-I850 HydrophobicContact CB-CG1 4Å; L848-I850 HydrophobicContact CD1-CD1 4.22Å; L848-I850 PolarHBondContact O-N 3.17Å; L848-I872 HydrophobicContact CD2-CD1 3.45Å; L848-I872 VanDerWaalsContact CD2-CD1 3.45Å; L848-I872 HydrophobicContact CD2-CG1 3.63Å; L848-I872 HydrophobicContact CD2-CG2 4.22Å; L848-I898 HydrophobicContact CD1-CD1 4.5Å
849	G	38.2	Very low	37.1	Very low	4 Å²	4	65.6 Å²	65.6	4%	0.041	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.9	-0.4	179.5	0	0	0	0	0	115.2	L845 V846 K847 L864	L845-G849 PolarHBondContact O-N 2.86Å; V846-G849 WeakPolarHBondContact O-CA 3.26Å; V846-G849 PolarHBondContact O-N 3.17Å; K847-G849 PolarHBondContact O-N 3.48Å; G849-L864 WeakPolarHBondContact O-CD2 3.31Å
850	I	38.6	Very low	37.5	Very low	12 Å²	12	63.7 Å²	63.7	6%	0.062	32%	0.315	C	S	.	.	S	Bend	trans	-76.3	-31.6	-176.7	-53.1	172.7	0	0	0	110.9	L845 L848 W857 I870 F900	L845-I850 HydrophobicContact CD2-CB 4.34Å; L845-I850 HydrophobicContact CD2-CD1 3.94Å; L845-I850 HydrophobicContact CD2-CG2 4.4Å; L845-I850 PolarHBondContact O-N 3.14Å; L848-I850 HydrophobicContact CB-CD1 3.93Å; L848-I850 HydrophobicContact CB-CG1 4Å; L848-I850 HydrophobicContact CD1-CD1 4.22Å; L848-I850 PolarHBondContact O-N 3.17Å; I850-W857 HydrophobicContact CG2-CH2 3.89Å; I850-W857 HydrophobicContact CG2-CZ3 4.26Å; I850-I870 HydrophobicContact CD1-CD1 4.23Å; I850-I870 HydrophobicContact CG1-CG2 4.43Å; I850-F900 HydrophobicContact CD1-CE1 4.35Å; I850-F900 HydrophobicContact CD1-CZ 4.34Å
851	W	36.9	Very low	37.4	Very low	39 Å²	39	64.4 Å²	64.4	15%	0.148	32%	0.315	C	S	.	.	S	Bend	trans	-102.6	136.3	-180	-163.1	-66	0	0	0	110.8	K842 L845 V846 W857	K842-W851 HydrophobicContact CD-CZ2 4.37Å; K842-W851 VanDerWaalsContact CE-CZ2 3.47Å; K842-W851 HydrophobicContact CG-CD2 3.79Å; K842-W851 HydrophobicContact CG-CE3 3.81Å; K842-W851 HydrophobicContact CG-CG 4.39Å; K842-W851 HydrophobicContact CG-CH2 4.47Å; K842-W851 HydrophobicContact CG-CZ2 4.36Å; K842-W851 HydrophobicContact CG-CZ3 4.19Å; L845-W851 HydrophobicContact CB-CB 3.96Å; L845-W851 HydrophobicContact CB-CE3 4.33Å; L845-W851 HydrophobicContact CD1-CE3 4.03Å; L845-W851 HydrophobicContact CD1-CZ3 4.49Å; L845-W851 PolarHBondContact O-N 2.99Å; V846-W851 HydrophobicContact CB-CB 4.23Å; V846-W851 HydrophobicContact CG2-CB 3.55Å; V846-W851 HydrophobicContact CG2-CG 3.65Å; W851-W857 HydrophobicContact CB-CE3 4.04Å; W851-W857 HydrophobicContact CB-CZ3 3.7Å; W851-W857 HydrophobicContact CD2-CD2 4.38Å; W851-W857 AromaticContact CD2-CE3 3.21Å; W851-W857 HydrophobicContact CD2-CE3 3.21Å; W851-W857 AromaticContact CD2-CZ3 3.43Å; W851-W857 HydrophobicContact CD2-CZ3 3.43Å; W851-W857 VanDerWaalsContact CD2-CZ3 3.43Å; W851-W857 AromaticContact CE2-CE3 3.8Å; W851-W857 HydrophobicContact CE3-CD2 4.05Å; W851-W857 AromaticContact CE3-CE3 3.02Å; W851-W857 HydrophobicContact CE3-CE3 3.02Å; W851-W857 AromaticContact CE3-CH2 3.87Å; W851-W857 HydrophobicContact CE3-CH2 3.87Å; W851-W857 AromaticContact CE3-CZ3 2.92Å; W851-W857 HydrophobicContact CE3-CZ3 2.92Å; W851-W857 AromaticContact CG-CE3 3.74Å; W851-W857 HydrophobicContact CG-CE3 3.74Å; W851-W857 AromaticContact CG-CZ3 3.82Å; W851-W857 HydrophobicContact CG-CZ3 3.82Å; W851-W857 HydrophobicContact CH2-CB 4.42Å; W851-W857 HydrophobicContact CH2-CD2 4.2Å; W851-W857 AromaticContact CH2-CE3 3.85Å; W851-W857 HydrophobicContact CH2-CE3 3.85Å; W851-W857 HydrophobicContact CH2-CZ3 4.46Å; W851-W857 HydrophobicContact CZ2-CB 4.27Å; W851-W857 HydrophobicContact CZ2-CE3 4.09Å; W851-W857 AromaticContact CZ3-CD2 3.92Å; W851-W857 HydrophobicContact CZ3-CD2 3.92Å; W851-W857 AromaticContact CZ3-CE3 3.34Å; W851-W857 HydrophobicContact CZ3-CE3 3.34Å; W851-W857 HydrophobicContact CZ3-CH2 4.19Å; W851-W857 AromaticContact CZ3-CZ3 3.52Å; W851-W857 HydrophobicContact CZ3-CZ3 3.52Å
852	S	40.4	Very low	37.4	Very low	4 Å²	4	67.1 Å²	67.1	3%	0.028	34%	0.336	C	S	.	.			trans	-89.3	133.4	174.8	102.1	0	0	0	0	112.1	D854 G855 W856	S852-D854 WeakPolarHBondContact CB-OD1 3.46Å; S852-D854 PolarHBondContact O-N 3.35Å; S852-D854 VanDerWaalsContact OG-CG 3.31Å; S852-D854 PolarHBondContact OG-OD1 3.12Å; S852-G855 PolarHBondContact O-N 3.25Å; S852-G855 VanDerWaalsContact O-N 3.14Å; S852-W856 PolarHBondContact OG-N 3.13Å; S852-W856 PolarHBondContact OG-O 3.24Å; S852-W856 VanDerWaalsContact OG-O 3.08Å
853	D	41.7	Very low	37.3	Very low	134 Å²	134	68.2 Å²	68.2	72%	0.717	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-28.3	180	-80.8	-25.8	0	0	0	113.4	V846 G855	V846-D853 VanDerWaalsContact CG1-OD1 3.23Å; V846-D853 WeakPolarHBondContact CG1-OD1 3.43Å; D853-G855 PolarHBondContact O-N 3.28Å
854	D	44.7	Very low	36.9	Very low	116 Å²	116	66.4 Å²	66.4	62%	0.62	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	5.4	178.2	50.1	-36.5	0	0	0	114	S852 W856	S852-D854 WeakPolarHBondContact CB-OD1 3.46Å; S852-D854 PolarHBondContact O-N 3.35Å; S852-D854 VanDerWaalsContact OG-CG 3.31Å; S852-D854 PolarHBondContact OG-OD1 3.12Å; D854-W856 VanDerWaalsContact C-N 3.25Å; D854-W856 PolarHBondContact O-N 3.3Å
855	G	32.1	Very low	36.4	Very low	49 Å²	49	65.3 Å²	65.3	51%	0.505	33%	0.333	S	S	.	.	S	Bend	trans	81	1.1	170.1	0	0	0	0	0	114.6	S852 D853 W857	S852-G855 PolarHBondContact O-N 3.25Å; S852-G855 VanDerWaalsContact O-N 3.14Å; D853-G855 PolarHBondContact O-N 3.28Å; G855-W857 PolarHBondContact O-N 3Å
856	W	31.6	Very low	35.9	Very low	205 Å²	205	72.5 Å²	72.5	78%	0.777	37%	0.366	S	S	*	.			trans	-88.4	93.8	175.2	-70.8	84.8	0	0	0	109.6	S852 D854 P858	S852-W856 PolarHBondContact OG-N 3.13Å; S852-W856 PolarHBondContact OG-O 3.24Å; S852-W856 VanDerWaalsContact OG-O 3.08Å; D854-W856 VanDerWaalsContact C-N 3.25Å; D854-W856 PolarHBondContact O-N 3.3Å; W856-P858 CarbonylContact O-C 3.57Å
857	W	35.7	Very low	35.2	Very low	102 Å²	102	82.8 Å²	82.8	39%	0.386	40%	0.401	S	S	.	.	S	Bend	trans	-78	133.3	164.9	-174.4	-89.8	0	0	0	109.9	L845 I850 W851 G855	L845-W857 HydrophobicContact CB-CZ3 4.36Å; L845-W857 HydrophobicContact CD1-CH2 3.81Å; L845-W857 HydrophobicContact CD1-CZ3 4.13Å; L845-W857 HydrophobicContact CD2-CH2 4.39Å; L845-W857 HydrophobicContact CG-CH2 4.49Å; I850-W857 HydrophobicContact CG2-CH2 3.89Å; I850-W857 HydrophobicContact CG2-CZ3 4.26Å; W851-W857 HydrophobicContact CB-CE3 4.04Å; W851-W857 HydrophobicContact CB-CZ3 3.7Å; W851-W857 HydrophobicContact CD2-CD2 4.38Å; W851-W857 AromaticContact CD2-CE3 3.21Å; W851-W857 HydrophobicContact CD2-CE3 3.21Å; W851-W857 AromaticContact CD2-CZ3 3.43Å; W851-W857 HydrophobicContact CD2-CZ3 3.43Å; W851-W857 VanDerWaalsContact CD2-CZ3 3.43Å; W851-W857 AromaticContact CE2-CE3 3.8Å; W851-W857 HydrophobicContact CE3-CD2 4.05Å; W851-W857 AromaticContact CE3-CE3 3.02Å; W851-W857 HydrophobicContact CE3-CE3 3.02Å; W851-W857 AromaticContact CE3-CH2 3.87Å; W851-W857 HydrophobicContact CE3-CH2 3.87Å; W851-W857 AromaticContact CE3-CZ3 2.92Å; W851-W857 HydrophobicContact CE3-CZ3 2.92Å; W851-W857 AromaticContact CG-CE3 3.74Å; W851-W857 HydrophobicContact CG-CE3 3.74Å; W851-W857 AromaticContact CG-CZ3 3.82Å; W851-W857 HydrophobicContact CG-CZ3 3.82Å; W851-W857 HydrophobicContact CH2-CB 4.42Å; W851-W857 HydrophobicContact CH2-CD2 4.2Å; W851-W857 AromaticContact CH2-CE3 3.85Å; W851-W857 HydrophobicContact CH2-CE3 3.85Å; W851-W857 HydrophobicContact CH2-CZ3 4.46Å; W851-W857 HydrophobicContact CZ2-CB 4.27Å; W851-W857 HydrophobicContact CZ2-CE3 4.09Å; W851-W857 AromaticContact CZ3-CD2 3.92Å; W851-W857 HydrophobicContact CZ3-CD2 3.92Å; W851-W857 AromaticContact CZ3-CE3 3.34Å; W851-W857 HydrophobicContact CZ3-CE3 3.34Å; W851-W857 HydrophobicContact CZ3-CH2 4.19Å; W851-W857 AromaticContact CZ3-CZ3 3.52Å; W851-W857 HydrophobicContact CZ3-CZ3 3.52Å; G855-W857 PolarHBondContact O-N 3Å
858	P	33.5	Very low	34.6	Very low	51 Å²	51	91.2 Å²	91.2	33%	0.331	43%	0.431	S	S	.	.	S	Bend	cis	-97.2	160.6	-12	1	22.2	0	0	0	111.9	W856 W861	W856-P858 CarbonylContact O-C 3.57Å; P858-W861 HydrophobicContact CB-CH2 4.49Å; P858-W861 HydrophobicContact CB-CZ2 3.63Å; P858-W861 HydrophobicContact CG-CZ2 3.53Å
859	R	35.8	Very low	34.1	Very low	113 Å²	113	91.2 Å²	91.2	43%	0.426	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-58	146.8	163	-83.4	-167.4	172.1	174.4	1.1	109.5	W861 L864	R859-W861 PolarHBondContact O-N 3.13Å; R859-L864 HydrophobicContact CB-CD1 4.16Å
860	D	37.8	Very low	33.7	Very low	117 Å²	117	92.6 Å²	92.6	63%	0.626	44%	0.441	S	S	*	.			trans	-53.9	109	-179.2	-168.9	-24.2	0	0	0	110.8	S862 T863	D860-S862 PolarHBondContact O-N 3.02Å; D860-S862 PolarHBondContact OD1-N 3.43Å; D860-S862 PolarHBondContact OD1-OG 3.34Å; D860-T863 PolarHBondContact O-N 3.35Å; D860-T863 PolarHBondContact O-OG1 3.05Å
861	W	30.9	Very low	33.4	Very low	69 Å²	69	99 Å²	99	26%	0.261	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-21.9	-169.9	-61.4	85.2	0	0	0	114.3	P858 R859 T863 L864 F865 P910	P858-W861 HydrophobicContact CB-CH2 4.49Å; P858-W861 HydrophobicContact CB-CZ2 3.63Å; P858-W861 HydrophobicContact CG-CZ2 3.53Å; R859-W861 PolarHBondContact O-N 3.13Å; W861-T863 PolarHBondContact O-N 3.27Å; W861-L864 PolarHBondContact O-N 3.19Å; W861-F865 HydrophobicContact CE3-CD2 4.45Å; W861-F865 HydrophobicContact CE3-CE2 4.02Å; W861-F865 HydrophobicContact CZ3-CE2 4.26Å; W861-P910 HydrophobicContact CE3-CB 4.39Å; W861-P910 HydrophobicContact CE3-CG 3.86Å; W861-P910 HydrophobicContact CH2-CB 3.91Å; W861-P910 HydrophobicContact CH2-CG 4.27Å; W861-P910 WeakPolarHBondContact CH2-O 3.2Å; W861-P910 HydrophobicContact CZ3-CB 3.48Å; W861-P910 VanDerWaalsContact CZ3-CB 3.48Å; W861-P910 VanDerWaalsContact CZ3-CD 3.43Å; W861-P910 HydrophobicContact CZ3-CG 3.36Å
862	S	34.4	Very low	33.2	Very low	86 Å²	86	98.8 Å²	98.8	60%	0.601	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-24.9	176.9	56.8	0	0	0	0	113.2	D860	D860-S862 PolarHBondContact O-N 3.02Å; D860-S862 PolarHBondContact OD1-N 3.43Å; D860-S862 PolarHBondContact OD1-OG 3.34Å
863	T	33.1	Very low	33	Very low	99 Å²	99	104.3 Å²	104.3	61%	0.607	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-24.6	-178	54.5	0	0	0	0	114.5	D860 W861	D860-T863 PolarHBondContact O-N 3.35Å; D860-T863 PolarHBondContact O-OG1 3.05Å; W861-T863 PolarHBondContact O-N 3.27Å
864	L	30.3	Very low	32.6	Very low	21 Å²	21	100.2 Å²	100.2	11%	0.11	48%	0.483	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-22.9	-176.6	-85.8	157.3	0	0	0	113.9	G849 R859 W861	G849-L864 WeakPolarHBondContact O-CD2 3.31Å; R859-L864 HydrophobicContact CB-CD1 4.16Å; W861-L864 PolarHBondContact O-N 3.19Å
865	F	28.1	Very low	31.9	Very low	42 Å²	42	95.6 Å²	95.6	18%	0.184	46%	0.462	C	S	.	.			trans	-119.3	63.9	-179.1	-67	-87.3	0	0	0	110.2	W861 I870 W908 P910	W861-F865 HydrophobicContact CE3-CD2 4.45Å; W861-F865 HydrophobicContact CE3-CE2 4.02Å; W861-F865 HydrophobicContact CZ3-CE2 4.26Å; F865-I870 HydrophobicContact CE1-CG1 3.83Å; F865-I870 HydrophobicContact CZ-CD1 4.35Å; F865-I870 HydrophobicContact CZ-CG1 3.89Å; F865-W908 HydrophobicContact CB-CB 4.41Å; F865-W908 HydrophobicContact CD1-CB 4.32Å; F865-W908 HydrophobicContact CD1-CE3 4.31Å; F865-W908 HydrophobicContact CE1-CE3 4.37Å; F865-W908 HydrophobicContact CG-CB 4.38Å; F865-P910 HydrophobicContact CD2-CG 4.39Å; F865-P910 HydrophobicContact CE1-CG 4.31Å; F865-P910 HydrophobicContact CE2-CG 3.47Å; F865-P910 VanDerWaalsContact CE2-CG 3.47Å; F865-P910 HydrophobicContact CZ-CG 3.42Å; F865-P910 VanDerWaalsContact CZ-CG 3.42Å
866	E	28.7	Very low	31.7	Very low	158 Å²	158	97.6 Å²	97.6	74%	0.738	46%	0.461	S	S	*	.	S	Bend	trans	-58.7	152.9	146.9	-70.8	-161.5	165.7	0	0	108	R868 G869	E866-R868 PolarHBondContact O-N 3.42Å; E866-G869 PolarHBondContact O-N 3.27Å
867	R	28.6	Very low	31.7	Very low	260 Å²	260	91.7 Å²	91.7	98%	0.981	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	4.7	-168.6	-76.1	179.7	172.3	177.7	-2.1	117
868	R	27.4	Very low	31.4	Very low	219 Å²	219	88.9 Å²	88.9	83%	0.826	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.5	1.6	-169.8	-63	-172.4	176.2	-167.4	-1.2	115.4	E866	E866-R868 PolarHBondContact O-N 3.42Å
869	G	27.3	Very low	31	Very low	16 Å²	16	90.6 Å²	90.6	17%	0.165	45%	0.445	C	S	.	.			trans	112.6	-177.2	174.4	0	0	0	0	0	114.4	E866 Q871	E866-G869 PolarHBondContact O-N 3.27Å; G869-Q871 PolarHBondContact O-N 3.24Å
870	I	30.4	Very low	30.7	Very low	33 Å²	33	91.3 Å²	91.3	17%	0.169	46%	0.457	C	S	.	.			trans	-71.4	120.7	-179.8	-59.9	168.7	0	0	0	108.5	I850 F865 F900	I850-I870 HydrophobicContact CD1-CD1 4.23Å; I850-I870 HydrophobicContact CG1-CG2 4.43Å; F865-I870 HydrophobicContact CE1-CG1 3.83Å; F865-I870 HydrophobicContact CZ-CD1 4.35Å; F865-I870 HydrophobicContact CZ-CG1 3.89Å; I870-F900 HydrophobicContact CD1-CZ 4.42Å
871	Q	32.6	Very low	30.2	Very low	147 Å²	147	89.6 Å²	89.6	69%	0.687	45%	0.445	S	S	*	.			trans	-82	119	173.8	-156.6	173	8	0	0	109.3	G869	G869-Q871 PolarHBondContact O-N 3.24Å
872	I	31.1	Very low	30	Very low	33 Å²	33	93.8 Å²	93.8	17%	0.169	47%	0.469	C	S	.	.			trans	-97.3	108.9	179.8	-56.8	176	0	0	0	108.6	L848 S874 A875 D977	L848-I872 HydrophobicContact CD2-CD1 3.45Å; L848-I872 VanDerWaalsContact CD2-CD1 3.45Å; L848-I872 HydrophobicContact CD2-CG1 3.63Å; L848-I872 HydrophobicContact CD2-CG2 4.22Å; I872-S874 PolarHBondContact O-N 3.04Å; I872-A875 HydrophobicContact CG2-CB 4.47Å; I872-D977 WeakPolarHBondContact CD1-OD2 3.4Å
873	D	36.5	Very low	29.6	Very low	120 Å²	120	94.3 Å²	94.3	64%	0.642	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-20.3	-173.8	-71.8	-26.4	0	0	0	113.9
874	S	33.5	Very low	29.2	Very low	48 Å²	48	91.5 Å²	91.5	34%	0.336	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-156.9	75.5	-177.8	-153.3	0	0	0	0	114	I872 N876 L877	I872-S874 PolarHBondContact O-N 3.04Å; S874-N876 PolarHBondContact O-N 3.06Å; S874-L877 PolarHBondContact O-N 3.46Å
875	A	29.6	Very low	28.9	Very low	20 Å²	20	92.4 Å²	92.4	17%	0.165	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-33	179.8	0	0	0	0	0	113.6	I872 L877 C878 L879 V979	I872-A875 HydrophobicContact CG2-CB 4.47Å; A875-L877 PolarHBondContact O-N 2.84Å; A875-C878 PolarHBondContact O-N 2.78Å; A875-L879 PolarHBondContact O-N 3Å; A875-V979 HydrophobicContact CB-CG2 4.33Å
876	N	29.7	Very low	28.6	Very low	90 Å²	90	96 Å²	96	48%	0.481	48%	0.477	S	S	.	.	H	α-helix	trans	-59	-33.5	179.2	-63	-12	0	0	0	112.2	S874 C878 L879 L880	S874-N876 PolarHBondContact O-N 3.06Å; N876-C878 VanDerWaalsContact C-N 3.3Å; N876-C878 PolarHBondContact O-N 3.06Å; N876-L879 PolarHBondContact O-N 3.32Å; N876-L880 HydrophobicContact CB-CD1 4.44Å; N876-L880 WeakPolarHBondContact O-CB 3.46Å; N876-L880 WeakPolarHBondContact O-CD1 3.46Å; N876-L880 VanDerWaalsContact O-CG 3.28Å; N876-L880 WeakPolarHBondContact O-CG 3.31Å; N876-L880 PolarHBondContact O-N 2.9Å
877	L	30	Very low	28.4	Very low	82 Å²	82	90.9 Å²	90.9	43%	0.429	46%	0.458	S	S	.	.	H	α-helix	trans	-73.9	-17.6	178.4	-74	173.6	0	0	0	113.8	K847 S874 A875	K847-L877 HydrophobicContact CD-CB 4.14Å; K847-L877 PolarHBondContact NZ-O 3.35Å; S874-L877 PolarHBondContact O-N 3.46Å; A875-L877 PolarHBondContact O-N 2.84Å
878	C	29.3	Very low	28.3	Very low	43 Å²	43	81.2 Å²	81.2	29%	0.291	43%	0.426	S	S	.	.	H	α-helix	trans	-83.1	-32.7	173	-75.6	0	0	0	0	111.7	A875 N876	A875-C878 PolarHBondContact O-N 2.78Å; N876-C878 VanDerWaalsContact C-N 3.3Å; N876-C878 PolarHBondContact O-N 3.06Å
879	L	26.2	Very low	28.1	Very low	87 Å²	87	75.4 Å²	75.4	46%	0.455	42%	0.418	S	S	.	.	H	α-helix	trans	-85.6	-36	-179	-72.6	169.5	0	0	0	113.5	A875 N876 E881 I957	A875-L879 PolarHBondContact O-N 3Å; N876-L879 PolarHBondContact O-N 3.32Å; L879-E881 PolarHBondContact O-N 3.01Å; L879-I957 HydrophobicContact CD2-CD1 4.49Å
880	L	30.3	Very low	28	Very low	128 Å²	128	76.3 Å²	76.3	67%	0.67	42%	0.424	S	S	*	.	S	Bend	trans	-65.7	-22.6	-176.9	-78.3	165.9	0	0	0	113.3	N876 M882	N876-L880 HydrophobicContact CB-CD1 4.44Å; N876-L880 WeakPolarHBondContact O-CB 3.46Å; N876-L880 WeakPolarHBondContact O-CD1 3.46Å; N876-L880 VanDerWaalsContact O-CG 3.28Å; N876-L880 WeakPolarHBondContact O-CG 3.31Å; N876-L880 PolarHBondContact O-N 2.9Å; L880-M882 PolarHBondContact O-N 2.92Å
881	E	27.1	Very low	27.7	Very low	80 Å²	80	77.5 Å²	77.5	37%	0.374	45%	0.445	S	S	.	.			trans	-104.8	73.6	-179.3	-75.1	178.4	152.2	0	0	112	K847 L879 Q883 V884	K847-E881 IonicContact NZ-OE2 3.75Å; K847-E881 PolarHBondContact NZ-OE2 3.27Å; L879-E881 PolarHBondContact O-N 3.01Å; E881-Q883 HydrophobicContact CB-CB 4.34Å; E881-Q883 PolarHBondContact O-N 2.89Å; E881-V884 HydrophobicContact CB-CG2 4.48Å; E881-V884 PolarHBondContact O-N 3.31Å; E881-V884 VanDerWaalsContact O-N 3.16Å
882	M	25.7	Very low	27.5	Very low	157 Å²	157	78.9 Å²	78.9	77%	0.773	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-54	-3.1	147.1	-75.1	-158.5	-59.5	0	0	112.8	L880 V884 G885 E886	L880-M882 PolarHBondContact O-N 2.92Å; M882-V884 VanDerWaalsContact C-N 3.29Å; M882-V884 PolarHBondContact O-N 3.39Å; M882-G885 WeakPolarHBondContact O-CA 3.33Å; M882-G885 PolarHBondContact O-N 2.96Å; M882-E886 PolarHBondContact O-N 2.91Å
883	Q	25.4	Very low	27.3	Very low	97 Å²	97	85.9 Å²	85.9	45%	0.453	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-70.1	-17	170	-74.5	-172.5	-43.4	0	0	114.4	E881 G885 E886	E881-Q883 HydrophobicContact CB-CB 4.34Å; E881-Q883 PolarHBondContact O-N 2.89Å; Q883-G885 PolarHBondContact O-N 3.28Å; Q883-E886 PolarHBondContact O-N 2.8Å
884	V	26.5	Very low	27.1	Very low	41 Å²	41	81.2 Å²	81.2	25%	0.248	46%	0.458	C	S	.	.	G	3₁₀ helix	trans	-72	-3.8	162.1	-155.3	0	0	0	0	111	E840 E881 M882 R896	E840-V884 HydrophobicContact CB-CG1 3.97Å; E840-V884 HydrophobicContact CG-CG1 3.93Å; E881-V884 HydrophobicContact CB-CG2 4.48Å; E881-V884 PolarHBondContact O-N 3.31Å; E881-V884 VanDerWaalsContact O-N 3.16Å; M882-V884 VanDerWaalsContact C-N 3.29Å; M882-V884 PolarHBondContact O-N 3.39Å; V884-R896 PolarHBondContact O-NH1 2.59Å; V884-R896 PolarHBondContact O-NH2 3.18Å
885	G	22.8	Very low	27.1	Very low	39 Å²	39	80.1 Å²	80.1	40%	0.402	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-21.8	174.1	0	0	0	0	0	114.6	M882 Q883	M882-G885 WeakPolarHBondContact O-CA 3.33Å; M882-G885 PolarHBondContact O-N 2.96Å; Q883-G885 PolarHBondContact O-N 3.28Å
886	E	23.1	Very low	27.5	Very low	118 Å²	118	83.5 Å²	83.5	55%	0.551	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-23.7	-177.6	-77.3	174.5	179.2	0	0	112.6	K679 M882 Q883 L888	K679-E886 VanDerWaalsContact NZ-CD 3.27Å; K679-E886 IonicContact NZ-OE1 3.36Å; K679-E886 PolarHBondContact NZ-OE1 3.23Å; K679-E886 IonicContact NZ-OE2 3.37Å; K679-E886 PolarHBondContact NZ-OE2 3.32Å; M882-E886 PolarHBondContact O-N 2.91Å; Q883-E886 PolarHBondContact O-N 2.8Å; E886-L888 VanDerWaalsContact C-N 3.33Å; E886-L888 PolarHBondContact O-N 3.38Å
887	S	24.2	Very low	27.9	Very low	50 Å²	50	79.9 Å²	79.9	35%	0.35	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-11.2	-178.6	131.7	0	0	0	0	114.6	E840	E840-S887 PolarHBondContact OE1-OG 3.31Å
888	L	25.5	Very low	28.3	Very low	58 Å²	58	76.7 Å²	76.7	30%	0.304	42%	0.423	S	S	.	.			trans	-118.9	112.3	-176.4	-64.7	173.4	0	0	0	110.6	E886 A890 V917	E886-L888 VanDerWaalsContact C-N 3.33Å; E886-L888 PolarHBondContact O-N 3.38Å; L888-A890 PolarHBondContact O-N 2.9Å; L888-V917 HydrophobicContact CD1-CG1 4.29Å
889	S	24.2	Very low	28.7	Very low	96 Å²	96	75 Å²	75	67%	0.671	41%	0.411	S	S	*	.	S	Bend	trans	-54.4	36.4	166	59	0	0	0	0	114.9
890	A	24.5	Very low	29.3	Very low	35 Å²	35	71.3 Å²	71.3	29%	0.289	39%	0.391	S	S	.	.			trans	-131.1	68.5	-178.7	0	0	0	0	0	107.8	L888 D892 V894	L888-A890 PolarHBondContact O-N 2.9Å; A890-D892 PolarHBondContact O-N 3.45Å; A890-V894 HydrophobicContact CB-CG2 3.36Å
891	G	24.4	Very low	29.5	Very low	59 Å²	59	68.4 Å²	68.4	61%	0.608	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.9	133.5	170.9	0	0	0	0	0	110.9	R893	G891-R893 VanDerWaalsContact O-CB 3.32Å; G891-R893 WeakPolarHBondContact O-CB 3.27Å; G891-R893 VanDerWaalsContact O-CG 3.3Å; G891-R893 WeakPolarHBondContact O-CG 3.11Å; G891-R893 PolarHBondContact O-N 3.12Å
892	D	27.2	Very low	29.9	Very low	176 Å²	176	67.3 Å²	67.3	94%	0.941	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.6	12.7	169	-58.8	-19.5	0	0	0	119.2	A890	A890-D892 PolarHBondContact O-N 3.45Å
893	R	28	Very low	30.5	Very low	179 Å²	179	61.6 Å²	61.6	68%	0.675	34%	0.34	S	S	*	.			trans	-126.1	5.4	-165.8	-68.3	-173.9	-172.4	-165.3	5.4	115.2	G891 P895 Q921	G891-R893 VanDerWaalsContact O-CB 3.32Å; G891-R893 WeakPolarHBondContact O-CB 3.27Å; G891-R893 VanDerWaalsContact O-CG 3.3Å; G891-R893 WeakPolarHBondContact O-CG 3.11Å; G891-R893 PolarHBondContact O-N 3.12Å; R893-P895 VanDerWaalsContact O-CD 3.28Å; R893-P895 WeakPolarHBondContact O-CD 3.47Å; R893-Q921 PolarHBondContact O-NE2 2.85Å
894	V	32.6	Very low	30.8	Very low	23 Å²	23	61 Å²	61	14%	0.139	36%	0.359	C	S	.	.			trans	-104.4	104.8	177.3	-165.9	0	0	0	0	110.1	A890 Q921	A890-V894 HydrophobicContact CB-CG2 3.36Å; V894-Q921 HydrophobicContact CG1-CG 4.48Å; V894-Q921 VanDerWaalsContact CG2-NE2 3.34Å
895	P	32.9	Very low	31.4	Very low	24 Å²	24	66.3 Å²	66.3	16%	0.156	38%	0.381	C	S	.	.			trans	-59.8	138.1	164.6	-20.9	31.5	0	0	0	111.8	R893 D924 P960	R893-P895 VanDerWaalsContact O-CD 3.28Å; R893-P895 WeakPolarHBondContact O-CD 3.47Å; P895-D924 HydrophobicContact CG-CB 4.04Å; P895-D924 VanDerWaalsContact CG-OD2 3.24Å; P895-D924 WeakPolarHBondContact CG-OD2 3.39Å; P895-P960 HydrophobicContact CB-CB 3.79Å; P895-P960 HydrophobicContact CB-CG 3.72Å; P895-P960 HydrophobicContact CG-CB 4.32Å
896	R	37.7	Very low	31.9	Very low	92 Å²	92	69.1 Å²	69.1	35%	0.347	40%	0.401	S	S	.	.			trans	-119.8	112.1	178.8	-58.5	-175.9	-173.6	-155.1	-1.7	109.8	V884 H955	V884-R896 PolarHBondContact O-NH1 2.59Å; V884-R896 PolarHBondContact O-NH2 3.18Å; R896-H955 HydrophobicContact CB-CB 4.3Å; R896-H955 PolarHBondContact O-N 3.2Å
897	A	38.2	Very low	32.2	Very low	14 Å²	14	72.8 Å²	72.8	12%	0.116	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	144.1	178	0	0	0	0	0	110.7	F899 V952 V953 P960	A897-F899 HydrophobicContact CB-CE2 4.04Å; A897-F899 HydrophobicContact CB-CZ 4.39Å; A897-V952 HydrophobicContact CB-CG1 3.82Å; A897-V953 CarbonylContact C-O 3.55Å; A897-V953 WeakPolarHBondContact CA-O 3.31Å; A897-P960 HydrophobicContact CB-CG 4.1Å
898	I	39.5	Very low	32.5	Very low	14 Å²	14	76.3 Å²	76.3	7%	0.072	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.3	171.4	-61.8	174.4	0	0	0	108	L844 L848 F900 A913 V952 V953	L844-I898 HydrophobicContact CD2-CD1 3.48Å; L844-I898 VanDerWaalsContact CD2-CD1 3.48Å; L848-I898 HydrophobicContact CD1-CD1 4.5Å; I898-F900 HydrophobicContact CB-CE2 4.1Å; I898-F900 HydrophobicContact CB-CZ 4.33Å; I898-F900 HydrophobicContact CG2-CD2 4.29Å; I898-F900 HydrophobicContact CG2-CE1 4.11Å; I898-F900 HydrophobicContact CG2-CE2 3.59Å; I898-F900 HydrophobicContact CG2-CZ 3.51Å; I898-A913 HydrophobicContact CG2-CB 4.26Å; I898-V952 WeakPolarHBondContact O-CA 3.42Å; I898-V953 PolarHBondContact N-O 3.36Å; I898-V953 PolarHBondContact O-N 3.1Å
899	F	37.6	Very low	32.9	Very low	7 Å²	7	77.1 Å²	77.1	3%	0.031	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	136.4	178.9	-63.5	-98.5	0	0	0	110.6	A897 A913 V914 F916 W920 I947 F950 G951 V952	A897-F899 HydrophobicContact CB-CE2 4.04Å; A897-F899 HydrophobicContact CB-CZ 4.39Å; F899-A913 WeakPolarHBondContact O-CA 3.38Å; F899-V914 PolarHBondContact N-O 3.41Å; F899-V914 PolarHBondContact O-N 3.35Å; F899-V914 VanDerWaalsContact O-N 3.11Å; F899-F916 AromaticContact CD2-CD2 3.63Å; F899-F916 HydrophobicContact CD2-CD2 3.63Å; F899-F916 AromaticContact CD2-CE2 3.66Å; F899-F916 HydrophobicContact CD2-CE2 3.66Å; F899-F916 AromaticContact CE2-CD2 3.87Å; F899-F916 HydrophobicContact CE2-CD2 3.87Å; F899-F916 HydrophobicContact CE2-CE2 4.14Å; F899-F916 HydrophobicContact CG-CE2 4.39Å; F899-W920 HydrophobicContact CE1-CH2 4.5Å; F899-W920 HydrophobicContact CE2-CZ2 4.41Å; F899-W920 AromaticContact CZ-CH2 3.89Å; F899-W920 HydrophobicContact CZ-CH2 3.89Å; F899-W920 HydrophobicContact CZ-CZ2 4.12Å; F899-W920 HydrophobicContact CZ-CZ3 4.27Å; F899-I947 HydrophobicContact CD1-CB 4.45Å; F899-I947 HydrophobicContact CD1-CG2 4.49Å; F899-I947 HydrophobicContact CE1-CB 4.11Å; F899-I947 HydrophobicContact CE1-CD1 4.28Å; F899-I947 HydrophobicContact CE1-CG2 4.04Å; F899-F950 HydrophobicContact CB-CB 4.12Å; F899-F950 HydrophobicContact CB-CD1 4.18Å; F899-F950 HydrophobicContact CB-CG 4.39Å; F899-F950 HydrophobicContact CD1-CB 4.1Å; F899-G951 CarbonylContact C-O 3.44Å; F899-G951 VanDerWaalsContact CA-O 3.31Å; F899-G951 WeakPolarHBondContact CA-O 3.18Å; F899-V952 HydrophobicContact CD1-CB 4.43Å; F899-V952 HydrophobicContact CD1-CG1 4.27Å; F899-V952 HydrophobicContact CD1-CG2 3.53Å; F899-V952 HydrophobicContact CE1-CB 4.42Å; F899-V952 HydrophobicContact CE1-CG1 4.02Å; F899-V952 HydrophobicContact CE1-CG2 3.51Å; F899-V952 HydrophobicContact CG-CG2 4.5Å; F899-V952 HydrophobicContact CZ-CG1 4.25Å; F899-V952 HydrophobicContact CZ-CG2 4.49Å
900	F	37.3	Very low	33.2	Very low	10 Å²	10	73 Å²	73	4%	0.044	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	122.6	179.4	-60.2	-86.9	0	0	0	110.2	I850 I870 I898 P910 L912 A913 F950 G951 V953	I850-F900 HydrophobicContact CD1-CE1 4.35Å; I850-F900 HydrophobicContact CD1-CZ 4.34Å; I870-F900 HydrophobicContact CD1-CZ 4.42Å; I898-F900 HydrophobicContact CB-CE2 4.1Å; I898-F900 HydrophobicContact CB-CZ 4.33Å; I898-F900 HydrophobicContact CG2-CD2 4.29Å; I898-F900 HydrophobicContact CG2-CE1 4.11Å; I898-F900 HydrophobicContact CG2-CE2 3.59Å; I898-F900 HydrophobicContact CG2-CZ 3.51Å; F900-P910 HydrophobicContact CD1-CB 4.29Å; F900-L912 WeakPolarHBondContact CA-O 3.2Å; F900-A913 HydrophobicContact CD1-CB 4.21Å; F900-A913 HydrophobicContact CE1-CB 3.95Å; F900-F950 CarbonylContact O-C 3.55Å; F900-F950 WeakPolarHBondContact O-CA 3.3Å; F900-G951 PolarHBondContact N-O 3.47Å; F900-G951 PolarHBondContact O-N 2.87Å; F900-V953 HydrophobicContact CD2-CG2 4.13Å; F900-V953 HydrophobicContact CE2-CB 3.93Å; F900-V953 HydrophobicContact CE2-CG2 3.43Å; F900-V953 VanDerWaalsContact CE2-CG2 3.43Å; F900-V953 HydrophobicContact CZ-CG2 4.32Å
901	H	34.3	Very low	33.6	Very low	67 Å²	67	79.3 Å²	79.3	31%	0.31	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	136.8	175	-177	-58.1	0	0	0	111.8	R911 L912 F950	H901-R911 PolarHBondContact O-N 2.93Å; H901-L912 PolarHBondContact N-O 2.86Å; H901-F950 HydrophobicContact CB-CD1 3.82Å; H901-F950 HydrophobicContact CB-CE1 3.77Å
902	Y	37.2	Very low	33.9	Very low	58 Å²	58	81.6 Å²	81.6	23%	0.227	40%	0.404	C	S	.	.			trans	-106.7	133.2	174.1	-61.6	-73	0	0	0	113.5	W908	Y902-W908 HydrophobicContact CD1-CE3 4.14Å; Y902-W908 HydrophobicContact CD1-CZ3 4.41Å; Y902-W908 HydrophobicContact CE1-CD2 4.32Å; Y902-W908 AromaticContact CE1-CE3 3.35Å; Y902-W908 HydrophobicContact CE1-CE3 3.35Å; Y902-W908 AromaticContact CE1-CZ3 3.47Å; Y902-W908 HydrophobicContact CE1-CZ3 3.47Å; Y902-W908 VanDerWaalsContact CE1-CZ3 3.47Å; Y902-W908 AromaticContact CZ-CE3 3.96Å; Y902-W908 AromaticContact CZ-CZ3 3.57Å; Y902-W908 WeakPolarHBondContact OH-CZ3 3.02Å
903	D	38.7	Very low	34.1	Very low	37 Å²	37	75 Å²	75	20%	0.198	37%	0.374	C	S	.	.			trans	-78.3	121.4	165.7	174.8	-26.9	0	0	0	108.1	Q905 R911	D903-Q905 PolarHBondContact O-N 3.04Å; D903-Q905 WeakPolarHBondContact OD1-CB 3.25Å; D903-Q905 WeakPolarHBondContact OD1-CG 3.47Å; D903-Q905 PolarHBondContact OD1-N 3.49Å; D903-Q905 VanDerWaalsContact OD1-N 3.09Å; D903-R911 IonicContact OD2-CZ 3.35Å; D903-R911 IonicContact OD2-NH2 3.85Å; D903-R911 PolarHBondContact OD2-NH2 3.32Å
904	G	31.2	Very low	34.3	Very low	84 Å²	84	68.4 Å²	68.4	87%	0.866	35%	0.354	S	S	*	.	S	Bend	trans	-59.2	5.7	-176	0	0	0	0	0	116.5	A906	G904-A906 PolarHBondContact O-N 3.43Å; G904-A906 VanDerWaalsContact O-N 3.15Å
905	Q	38.4	Very low	34.3	Very low	152 Å²	152	69 Å²	69	71%	0.71	36%	0.361	S	S	*	.	S	Bend	trans	-79.8	26.4	178.3	-70	-173.1	9.2	0	0	115.4	D903 R907	D903-Q905 PolarHBondContact O-N 3.04Å; D903-Q905 WeakPolarHBondContact OD1-CB 3.25Å; D903-Q905 WeakPolarHBondContact OD1-CG 3.47Å; D903-Q905 PolarHBondContact OD1-N 3.49Å; D903-Q905 VanDerWaalsContact OD1-N 3.09Å; Q905-R907 PolarHBondContact O-N 3.44Å
906	A	32.5	Very low	34.3	Very low	98 Å²	98	71.2 Å²	71.2	81%	0.81	37%	0.368	S	S	*	.	S	Bend	trans	54.5	13.2	176.3	0	0	0	0	0	115.5	G904	G904-A906 PolarHBondContact O-N 3.43Å; G904-A906 VanDerWaalsContact O-N 3.15Å
907	R	30.5	Very low	34	Very low	196 Å²	196	70.6 Å²	70.6	74%	0.74	38%	0.375	S	S	*	.	S	Bend	trans	-108.9	123.6	169.6	-77.6	-173.7	173.2	-170.5	-2	108.3	Q905 L909	Q905-R907 PolarHBondContact O-N 3.44Å; R907-L909 VanDerWaalsContact C-N 3.3Å; R907-L909 HydrophobicContact CB-CD1 4.43Å; R907-L909 PolarHBondContact O-N 3.41Å
908	W	31.2	Very low	33.5	Very low	124 Å²	124	71.5 Å²	71.5	47%	0.47	39%	0.386	S	S	.	.			trans	-68.2	87.9	176.3	-68.7	79.3	0	0	0	109.2	F865 Y902 W975	F865-W908 HydrophobicContact CB-CB 4.41Å; F865-W908 HydrophobicContact CD1-CB 4.32Å; F865-W908 HydrophobicContact CD1-CE3 4.31Å; F865-W908 HydrophobicContact CE1-CE3 4.37Å; F865-W908 HydrophobicContact CG-CB 4.38Å; Y902-W908 HydrophobicContact CD1-CE3 4.14Å; Y902-W908 HydrophobicContact CD1-CZ3 4.41Å; Y902-W908 HydrophobicContact CE1-CD2 4.32Å; Y902-W908 AromaticContact CE1-CE3 3.35Å; Y902-W908 HydrophobicContact CE1-CE3 3.35Å; Y902-W908 AromaticContact CE1-CZ3 3.47Å; Y902-W908 HydrophobicContact CE1-CZ3 3.47Å; Y902-W908 VanDerWaalsContact CE1-CZ3 3.47Å; Y902-W908 AromaticContact CZ-CE3 3.96Å; Y902-W908 AromaticContact CZ-CZ3 3.57Å; Y902-W908 WeakPolarHBondContact OH-CZ3 3.02Å; W908-W975 HydrophobicContact CH2-CZ2 4.22Å; W908-W975 HydrophobicContact CZ3-CZ2 4.32Å
909	L	32.4	Very low	33	Very low	75 Å²	75	75.7 Å²	75.7	39%	0.393	41%	0.413	S	S	.	.			trans	-117.7	92.3	172.9	-76.5	164.7	0	0	0	107.7	R907 R911	R907-L909 VanDerWaalsContact C-N 3.3Å; R907-L909 HydrophobicContact CB-CD1 4.43Å; R907-L909 PolarHBondContact O-N 3.41Å; L909-R911 PolarHBondContact O-N 3.43Å
910	P	32.2	Very low	32.8	Very low	8 Å²	8	77.3 Å²	77.3	5%	0.052	42%	0.419	C	S	.	.			trans	-62.4	108.4	171.4	-15.4	28.9	0	0	0	108.1	W861 F865 F900	W861-P910 HydrophobicContact CE3-CB 4.39Å; W861-P910 HydrophobicContact CE3-CG 3.86Å; W861-P910 HydrophobicContact CH2-CB 3.91Å; W861-P910 HydrophobicContact CH2-CG 4.27Å; W861-P910 WeakPolarHBondContact CH2-O 3.2Å; W861-P910 HydrophobicContact CZ3-CB 3.48Å; W861-P910 VanDerWaalsContact CZ3-CB 3.48Å; W861-P910 VanDerWaalsContact CZ3-CD 3.43Å; W861-P910 HydrophobicContact CZ3-CG 3.36Å; F865-P910 HydrophobicContact CD2-CG 4.39Å; F865-P910 HydrophobicContact CE1-CG 4.31Å; F865-P910 HydrophobicContact CE2-CG 3.47Å; F865-P910 VanDerWaalsContact CE2-CG 3.47Å; F865-P910 HydrophobicContact CZ-CG 3.42Å; F865-P910 VanDerWaalsContact CZ-CG 3.42Å; F900-P910 HydrophobicContact CD1-CB 4.29Å
911	R	31.8	Very low	32.7	Very low	169 Å²	169	79.9 Å²	79.9	64%	0.638	43%	0.432	S	S	*	.			trans	-83.1	-25.8	-179.6	-76.7	-165.1	-178.1	-165.9	7.7	113.1	H901 D903 L909	H901-R911 PolarHBondContact O-N 2.93Å; D903-R911 IonicContact OD2-CZ 3.35Å; D903-R911 IonicContact OD2-NH2 3.85Å; D903-R911 PolarHBondContact OD2-NH2 3.32Å; L909-R911 PolarHBondContact O-N 3.43Å
912	L	29.9	Very low	32.7	Very low	106 Å²	106	82.1 Å²	82.1	56%	0.555	45%	0.445	S	S	*	.			trans	-154.1	128.2	-174.4	-153.8	79.3	0	0	0	110	F900 H901 V914	F900-L912 WeakPolarHBondContact CA-O 3.2Å; H901-L912 PolarHBondContact N-O 2.86Å; L912-V914 HydrophobicContact CD2-CG2 3.4Å; L912-V914 HydrophobicContact CG-CG2 3.91Å
913	A	32.2	Very low	32.6	Very low	38 Å²	38	80.8 Å²	80.8	31%	0.314	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	116	164.3	0	0	0	0	0	107.7	I898 F899 F900	I898-A913 HydrophobicContact CG2-CB 4.26Å; F899-A913 WeakPolarHBondContact O-CA 3.38Å; F900-A913 HydrophobicContact CD1-CB 4.21Å; F900-A913 HydrophobicContact CE1-CB 3.95Å
914	V	31.4	Very low	32.6	Very low	41 Å²	41	79.1 Å²	79.1	25%	0.248	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	119.3	177.1	-166.2	0	0	0	0	109	F899 L912 F916	F899-V914 PolarHBondContact N-O 3.41Å; F899-V914 PolarHBondContact O-N 3.35Å; F899-V914 VanDerWaalsContact O-N 3.11Å; L912-V914 HydrophobicContact CD2-CG2 3.4Å; L912-V914 HydrophobicContact CG-CG2 3.91Å; V914-F916 HydrophobicContact CB-CD2 4.32Å; V914-F916 HydrophobicContact CB-CE2 3.61Å; V914-F916 HydrophobicContact CB-CZ 3.91Å; V914-F916 HydrophobicContact CG1-CD1 4.31Å; V914-F916 HydrophobicContact CG1-CD2 3.98Å; V914-F916 HydrophobicContact CG1-CE1 3.75Å; V914-F916 HydrophobicContact CG1-CE2 3.36Å; V914-F916 HydrophobicContact CG1-CG 4.44Å; V914-F916 HydrophobicContact CG1-CZ 3.25Å
915	A	33	Very low	32.8	Very low	35 Å²	35	79 Å²	79	29%	0.289	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	131.3	175.4	0	0	0	0	0	110.2	I841	I841-A915 HydrophobicContact CB-CB 4.14Å; I841-A915 HydrophobicContact CD1-CB 3.18Å; I841-A915 HydrophobicContact CG1-CB 3.47Å; I841-A915 VanDerWaalsContact CG1-CB 3.47Å; I841-A915 HydrophobicContact CG2-CB 3.61Å
916	F	34.4	Very low	32.6	Very low	70 Å²	70	73.2 Å²	73.2	31%	0.307	39%	0.385	S	S	.	.			trans	-120.1	119.8	-171.3	-70	-79.9	0	0	0	111.6	F899 V914 W920	F899-F916 AromaticContact CD2-CD2 3.63Å; F899-F916 HydrophobicContact CD2-CD2 3.63Å; F899-F916 AromaticContact CD2-CE2 3.66Å; F899-F916 HydrophobicContact CD2-CE2 3.66Å; F899-F916 AromaticContact CE2-CD2 3.87Å; F899-F916 HydrophobicContact CE2-CD2 3.87Å; F899-F916 HydrophobicContact CE2-CE2 4.14Å; F899-F916 HydrophobicContact CG-CE2 4.39Å; V914-F916 HydrophobicContact CB-CD2 4.32Å; V914-F916 HydrophobicContact CB-CE2 3.61Å; V914-F916 HydrophobicContact CB-CZ 3.91Å; V914-F916 HydrophobicContact CG1-CD1 4.31Å; V914-F916 HydrophobicContact CG1-CD2 3.98Å; V914-F916 HydrophobicContact CG1-CE1 3.75Å; V914-F916 HydrophobicContact CG1-CE2 3.36Å; V914-F916 HydrophobicContact CG1-CG 4.44Å; V914-F916 HydrophobicContact CG1-CZ 3.25Å; F916-W920 HydrophobicContact CB-CB 4.15Å; F916-W920 HydrophobicContact CB-CG 3.99Å; F916-W920 AromaticContact CD1-CD1 3.21Å; F916-W920 HydrophobicContact CD1-CG 4.3Å; F916-W920 AromaticContact CD1-NE1 3.45Å; F916-W920 AromaticContact CD2-NE1 3.95Å; F916-W920 AromaticContact CE1-CD1 3.76Å; F916-W920 AromaticContact CE1-NE1 3.51Å; F916-W920 AromaticContact CG-CD1 3.41Å; F916-W920 VanDerWaalsContact CG-CD1 3.41Å; F916-W920 HydrophobicContact CG-CG 4.16Å; F916-W920 AromaticContact CG-NE1 3.65Å; F916-W920 AromaticContact CZ-NE1 3.78Å
917	V	31.4	Very low	32.9	Very low	80 Å²	80	68.9 Å²	68.9	49%	0.485	35%	0.348	S	S	.	.			trans	-137.1	114.9	176.8	-168.9	0	0	0	0	107.8	I841 L888 P919	I841-V917 HydrophobicContact CD1-CG2 4.49Å; L888-V917 HydrophobicContact CD1-CG1 4.29Å; V917-P919 WeakPolarHBondContact O-CD 3.34Å
918	G	26.8	Very low	33.2	Very low	33 Å²	33	61.4 Å²	61.4	34%	0.34	32%	0.322	S	S	.	.	S	Bend	trans	112.2	-80.1	177.8	0	0	0	0	0	114.8	W920 Q921	G918-W920 PolarHBondContact O-N 3.47Å; G918-W920 VanDerWaalsContact O-N 3.08Å; G918-Q921 PolarHBondContact O-N 2.85Å
919	P	29.3	Very low	33.4	Very low	101 Å²	101	60.8 Å²	60.8	66%	0.656	32%	0.32	S	S	*	.	H	α-helix	trans	-59.1	-27.9	-175.2	-22.8	32.2	0	0	0	113.6	V917 L922 F923	V917-P919 WeakPolarHBondContact O-CD 3.34Å; P919-L922 PolarHBondContact O-N 3.3Å; P919-F923 PolarHBondContact O-N 2.79Å
920	W	32.9	Very low	33.5	Very low	41 Å²	41	58.9 Å²	58.9	16%	0.155	31%	0.313	C	S	.	.	H	α-helix	trans	-77.7	-13.4	179.2	-97.3	83.8	0	0	0	115	F899 F916 G918 L922 F923 D924 I947 F962	F899-W920 HydrophobicContact CE1-CH2 4.5Å; F899-W920 HydrophobicContact CE2-CZ2 4.41Å; F899-W920 AromaticContact CZ-CH2 3.89Å; F899-W920 HydrophobicContact CZ-CH2 3.89Å; F899-W920 HydrophobicContact CZ-CZ2 4.12Å; F899-W920 HydrophobicContact CZ-CZ3 4.27Å; F916-W920 HydrophobicContact CB-CB 4.15Å; F916-W920 HydrophobicContact CB-CG 3.99Å; F916-W920 AromaticContact CD1-CD1 3.21Å; F916-W920 HydrophobicContact CD1-CG 4.3Å; F916-W920 AromaticContact CD1-NE1 3.45Å; F916-W920 AromaticContact CD2-NE1 3.95Å; F916-W920 AromaticContact CE1-CD1 3.76Å; F916-W920 AromaticContact CE1-NE1 3.51Å; F916-W920 AromaticContact CG-CD1 3.41Å; F916-W920 VanDerWaalsContact CG-CD1 3.41Å; F916-W920 HydrophobicContact CG-CG 4.16Å; F916-W920 AromaticContact CG-NE1 3.65Å; F916-W920 AromaticContact CZ-NE1 3.78Å; G918-W920 PolarHBondContact O-N 3.47Å; G918-W920 VanDerWaalsContact O-N 3.08Å; W920-L922 PolarHBondContact O-N 3.09Å; W920-F923 HydrophobicContact CB-CB 4.49Å; W920-F923 HydrophobicContact CD2-CB 3.82Å; W920-F923 AromaticContact CD2-CD1 3.96Å; W920-F923 HydrophobicContact CD2-CD1 3.96Å; W920-F923 AromaticContact CD2-CG 3.97Å; W920-F923 HydrophobicContact CD2-CG 3.97Å; W920-F923 HydrophobicContact CE3-CB 3.8Å; W920-F923 AromaticContact CE3-CD1 3.42Å; W920-F923 HydrophobicContact CE3-CD1 3.42Å; W920-F923 VanDerWaalsContact CE3-CD1 3.42Å; W920-F923 HydrophobicContact CE3-CE1 4.18Å; W920-F923 AromaticContact CE3-CG 3.86Å; W920-F923 HydrophobicContact CE3-CG 3.86Å; W920-F923 HydrophobicContact CG-CB 4.13Å; W920-F923 AromaticContact CH2-CD1 3.32Å; W920-F923 HydrophobicContact CH2-CD1 3.32Å; W920-F923 AromaticContact CH2-CE1 3.15Å; W920-F923 HydrophobicContact CH2-CE1 3.15Å; W920-F923 HydrophobicContact CH2-CG 4.13Å; W920-F923 AromaticContact CH2-CZ 3.86Å; W920-F923 HydrophobicContact CH2-CZ 3.86Å; W920-F923 AromaticContact CZ2-CD1 3.84Å; W920-F923 HydrophobicContact CZ2-CD1 3.84Å; W920-F923 AromaticContact CZ2-CE1 3.75Å; W920-F923 HydrophobicContact CZ2-CE1 3.75Å; W920-F923 HydrophobicContact CZ2-CE2 4.48Å; W920-F923 HydrophobicContact CZ2-CG 4.22Å; W920-F923 HydrophobicContact CZ2-CZ 4.05Å; W920-F923 HydrophobicContact CZ3-CB 4.37Å; W920-F923 AromaticContact CZ3-CD1 3.07Å; W920-F923 HydrophobicContact CZ3-CD1 3.07Å; W920-F923 AromaticContact CZ3-CE1 3.4Å; W920-F923 HydrophobicContact CZ3-CE1 3.4Å; W920-F923 VanDerWaalsContact CZ3-CE1 3.4Å; W920-F923 AromaticContact CZ3-CG 3.94Å; W920-F923 HydrophobicContact CZ3-CG 3.94Å; W920-F923 HydrophobicContact CZ3-CZ 4.45Å; W920-F923 PolarHBondContact O-N 3.31Å; W920-D924 WeakPolarHBondContact O-CB 3.32Å; W920-D924 PolarHBondContact O-N 3.34Å; W920-I947 HydrophobicContact CH2-CG2 4Å; W920-I947 HydrophobicContact CZ2-CG2 4.2Å; W920-F962 HydrophobicContact CE3-CE1 4.22Å; W920-F962 HydrophobicContact CH2-CE1 4.32Å; W920-F962 HydrophobicContact CH2-CZ 4.48Å; W920-F962 HydrophobicContact CZ3-CD1 4Å; W920-F962 AromaticContact CZ3-CE1 3.46Å; W920-F962 HydrophobicContact CZ3-CE1 3.46Å; W920-F962 VanDerWaalsContact CZ3-CE1 3.46Å; W920-F962 HydrophobicContact CZ3-CZ 4.02Å
921	Q	35.8	Very low	33.5	Very low	65 Å²	65	62.7 Å²	62.7	30%	0.304	33%	0.329	S	S	.	.	H	α-helix	trans	-62.1	-37.9	167.2	-77.9	-176.8	-46.6	0	0	110.7	R893 V894 G918 H925	R893-Q921 PolarHBondContact O-NE2 2.85Å; V894-Q921 HydrophobicContact CG1-CG 4.48Å; V894-Q921 VanDerWaalsContact CG2-NE2 3.34Å; G918-Q921 PolarHBondContact O-N 2.85Å; Q921-H925 WeakPolarHBondContact O-CB 3.37Å; Q921-H925 PolarHBondContact O-N 3.39Å
922	L	33.1	Very low	33.5	Very low	113 Å²	113	60.4 Å²	60.4	59%	0.592	33%	0.326	S	S	*	.	H	α-helix	trans	-71.6	-40.5	175.8	-143.7	83.5	0	0	0	110.6	P919 W920 H925 C926	P919-L922 PolarHBondContact O-N 3.3Å; W920-L922 PolarHBondContact O-N 3.09Å; L922-H925 PolarHBondContact O-N 3.03Å; L922-C926 VanDerWaalsContact O-CB 3.29Å; L922-C926 WeakPolarHBondContact O-CB 3.44Å; L922-C926 PolarHBondContact O-N 3.23Å; L922-C926 PolarHBondContact O-SG 3.4Å
923	F	35.6	Very low	33.5	Very low	31 Å²	31	62.1 Å²	62.1	14%	0.136	33%	0.325	C	S	.	.	H	α-helix	trans	-64.9	-45.1	176	-163	-78.7	0	0	0	112.3	W790 P919 W920 H925 C926 A927 H943	W790-F923 HydrophobicContact CH2-CD2 4.48Å; P919-F923 PolarHBondContact O-N 2.79Å; W920-F923 HydrophobicContact CB-CB 4.49Å; W920-F923 HydrophobicContact CD2-CB 3.82Å; W920-F923 AromaticContact CD2-CD1 3.96Å; W920-F923 HydrophobicContact CD2-CD1 3.96Å; W920-F923 AromaticContact CD2-CG 3.97Å; W920-F923 HydrophobicContact CD2-CG 3.97Å; W920-F923 HydrophobicContact CE3-CB 3.8Å; W920-F923 AromaticContact CE3-CD1 3.42Å; W920-F923 HydrophobicContact CE3-CD1 3.42Å; W920-F923 VanDerWaalsContact CE3-CD1 3.42Å; W920-F923 HydrophobicContact CE3-CE1 4.18Å; W920-F923 AromaticContact CE3-CG 3.86Å; W920-F923 HydrophobicContact CE3-CG 3.86Å; W920-F923 HydrophobicContact CG-CB 4.13Å; W920-F923 AromaticContact CH2-CD1 3.32Å; W920-F923 HydrophobicContact CH2-CD1 3.32Å; W920-F923 AromaticContact CH2-CE1 3.15Å; W920-F923 HydrophobicContact CH2-CE1 3.15Å; W920-F923 HydrophobicContact CH2-CG 4.13Å; W920-F923 AromaticContact CH2-CZ 3.86Å; W920-F923 HydrophobicContact CH2-CZ 3.86Å; W920-F923 AromaticContact CZ2-CD1 3.84Å; W920-F923 HydrophobicContact CZ2-CD1 3.84Å; W920-F923 AromaticContact CZ2-CE1 3.75Å; W920-F923 HydrophobicContact CZ2-CE1 3.75Å; W920-F923 HydrophobicContact CZ2-CE2 4.48Å; W920-F923 HydrophobicContact CZ2-CG 4.22Å; W920-F923 HydrophobicContact CZ2-CZ 4.05Å; W920-F923 HydrophobicContact CZ3-CB 4.37Å; W920-F923 AromaticContact CZ3-CD1 3.07Å; W920-F923 HydrophobicContact CZ3-CD1 3.07Å; W920-F923 AromaticContact CZ3-CE1 3.4Å; W920-F923 HydrophobicContact CZ3-CE1 3.4Å; W920-F923 VanDerWaalsContact CZ3-CE1 3.4Å; W920-F923 AromaticContact CZ3-CG 3.94Å; W920-F923 HydrophobicContact CZ3-CG 3.94Å; W920-F923 HydrophobicContact CZ3-CZ 4.45Å; W920-F923 PolarHBondContact O-N 3.31Å; F923-H925 VanDerWaalsContact C-N 3.33Å; F923-H925 PolarHBondContact O-N 3.42Å; F923-C926 PolarHBondContact O-N 3.45Å; F923-A927 HydrophobicContact CD1-CB 4.36Å; F923-A927 HydrophobicContact CE1-CB 4.49Å; F923-A927 WeakPolarHBondContact O-CB 3.32Å; F923-A927 PolarHBondContact O-N 2.85Å; F923-H943 HydrophobicContact CE1-CB 3.84Å; F923-H943 AromaticContact CE1-ND1 3.74Å; F923-H943 AromaticContact CE2-CE1 3.91Å; F923-H943 AromaticContact CE2-ND1 3.25Å; F923-H943 WeakPolarHBondContact CE2-ND1 3.2Å; F923-H943 HydrophobicContact CZ-CB 3.69Å; F923-H943 AromaticContact CZ-CG 3.66Å; F923-H943 AromaticContact CZ-ND1 3.02Å; F923-H943 WeakPolarHBondContact CZ-ND1 3.32Å
924	D	39	Very low	33.3	Very low	1 Å²	1	66.8 Å²	66.8	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-60.3	-43.4	174.3	-177.3	53	0	0	0	111	P895 W920 H928 P960 R961 F962	P895-D924 HydrophobicContact CG-CB 4.04Å; P895-D924 VanDerWaalsContact CG-OD2 3.24Å; P895-D924 WeakPolarHBondContact CG-OD2 3.39Å; W920-D924 WeakPolarHBondContact O-CB 3.32Å; W920-D924 PolarHBondContact O-N 3.34Å; D924-H928 WeakPolarHBondContact O-CB 3.39Å; D924-H928 PolarHBondContact O-N 3.04Å; D924-P960 WeakPolarHBondContact OD1-CB 3.37Å; D924-R961 VanDerWaalsContact CG-N 3.33Å; D924-R961 WeakPolarHBondContact OD1-CA 3.45Å; D924-R961 PolarHBondContact OD1-N 2.87Å; D924-R961 WeakPolarHBondContact OD2-CB 3.2Å; D924-R961 PolarHBondContact OD2-N 3.22Å; D924-R961 IonicContact OD2-NE 3.94Å; D924-R961 PolarHBondContact OD2-NE 2.67Å; D924-F962 WeakPolarHBondContact OD1-CD1 3.34Å; D924-F962 PolarHBondContact OD1-N 3.37Å
925	H	36.4	Very low	33.2	Very low	82 Å²	82	76.6 Å²	76.6	38%	0.38	38%	0.377	S	S	.	.	H	α-helix	trans	-63.2	-51.3	175	-166.1	75.8	0	0	0	111.4	Q921 L922 F923 A927 H928 Y929	Q921-H925 WeakPolarHBondContact O-CB 3.37Å; Q921-H925 PolarHBondContact O-N 3.39Å; L922-H925 PolarHBondContact O-N 3.03Å; F923-H925 VanDerWaalsContact C-N 3.33Å; F923-H925 PolarHBondContact O-N 3.42Å; H925-A927 PolarHBondContact O-N 3.01Å; H925-H928 PolarHBondContact O-N 2.89Å; H925-Y929 AromaticContact CE1-CD2 3.73Å; H925-Y929 AromaticContact CE1-CE2 3.25Å; H925-Y929 WeakPolarHBondContact CE1-CE2 3.25Å; H925-Y929 AromaticContact ND1-CD2 3.86Å; H925-Y929 AromaticContact ND1-CE2 3.53Å; H925-Y929 AromaticContact NE2-CD2 3.88Å; H925-Y929 AromaticContact NE2-CE2 3.81Å; H925-Y929 VanDerWaalsContact O-CD2 3.23Å; H925-Y929 WeakPolarHBondContact O-CD2 3.47Å; H925-Y929 PolarHBondContact O-N 3.01Å
926	C	33.8	Very low	33.1	Very low	31 Å²	31	82.3 Å²	82.3	21%	0.209	40%	0.402	C	S	.	.	H	α-helix	trans	-61.7	-44.7	178.9	-71.1	0	0	0	0	112.3	L922 F923 Y929 S930	L922-C926 VanDerWaalsContact O-CB 3.29Å; L922-C926 WeakPolarHBondContact O-CB 3.44Å; L922-C926 PolarHBondContact O-N 3.23Å; L922-C926 PolarHBondContact O-SG 3.4Å; F923-C926 PolarHBondContact O-N 3.45Å; C926-Y929 PolarHBondContact O-N 3.5Å; C926-S930 WeakPolarHBondContact O-CB 3.41Å; C926-S930 PolarHBondContact O-N 3.25Å
927	A	37.7	Very low	32.9	Very low	6 Å²	6	86.2 Å²	86.2	5%	0.05	43%	0.426	C	S	.	.	H	α-helix	trans	-68.5	-35.2	178.8	0	0	0	0	0	112.3	F923 H925 S930 F962	F923-A927 HydrophobicContact CD1-CB 4.36Å; F923-A927 HydrophobicContact CE1-CB 4.49Å; F923-A927 WeakPolarHBondContact O-CB 3.32Å; F923-A927 PolarHBondContact O-N 2.85Å; H925-A927 PolarHBondContact O-N 3.01Å; A927-S930 PolarHBondContact O-OG 3.44Å; A927-F962 HydrophobicContact CB-CB 3.67Å; A927-F962 HydrophobicContact CB-CG 4.37Å
928	H	37.8	Very low	32.8	Very low	39 Å²	39	84.1 Å²	84.1	18%	0.181	42%	0.42	C	S	.	.	H	α-helix	trans	-65	-41.1	173.6	-176.4	77.6	0	0	0	112	D924 H925 R961	D924-H928 WeakPolarHBondContact O-CB 3.39Å; D924-H928 PolarHBondContact O-N 3.04Å; H925-H928 PolarHBondContact O-N 2.89Å; H928-R961 HydrophobicContact CB-CB 4.05Å; H928-R961 PolarHBondContact ND1-O 2.81Å; H928-R961 VanDerWaalsContact ND1-O 3.09Å
929	Y	35.5	Very low	33.2	Very low	111 Å²	111	84.3 Å²	84.3	44%	0.435	42%	0.417	S	S	.	.	H	α-helix	trans	-86.3	-17	-178.2	-77.1	-75.2	0	0	0	114.5	H925 C926 K931 Q932	H925-Y929 AromaticContact CE1-CD2 3.73Å; H925-Y929 AromaticContact CE1-CE2 3.25Å; H925-Y929 WeakPolarHBondContact CE1-CE2 3.25Å; H925-Y929 AromaticContact ND1-CD2 3.86Å; H925-Y929 AromaticContact ND1-CE2 3.53Å; H925-Y929 AromaticContact NE2-CD2 3.88Å; H925-Y929 AromaticContact NE2-CE2 3.81Å; H925-Y929 VanDerWaalsContact O-CD2 3.23Å; H925-Y929 WeakPolarHBondContact O-CD2 3.47Å; H925-Y929 PolarHBondContact O-N 3.01Å; C926-Y929 PolarHBondContact O-N 3.5Å; Y929-K931 PolarHBondContact O-N 3.4Å; Y929-K931 VanDerWaalsContact O-N 3.17Å; Y929-Q932 PolarHBondContact O-N 2.85Å; Y929-Q932 VanDerWaalsContact O-N 3.14Å
930	S	34.3	Very low	33.4	Very low	36 Å²	36	79.8 Å²	79.8	25%	0.252	39%	0.387	S	S	.	.	H	α-helix	trans	-62.8	-24.9	-179.5	76.6	0	0	0	0	113.5	C926 A927	C926-S930 WeakPolarHBondContact O-CB 3.41Å; C926-S930 PolarHBondContact O-N 3.25Å; A927-S930 PolarHBondContact O-OG 3.44Å
931	K	32.4	Very low	33.6	Very low	88 Å²	88	83 Å²	83	38%	0.383	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-3.3	178.4	-108.2	-171.5	179.9	177.9	0	115	Y929 W933 S940 R965	Y929-K931 PolarHBondContact O-N 3.4Å; Y929-K931 VanDerWaalsContact O-N 3.17Å; K931-W933 PolarHBondContact O-N 2.98Å; K931-S940 WeakPolarHBondContact CE-OG 3.41Å; K931-R965 PolarHBondContact O-NH1 2.79Å
932	Q	30.7	Very low	33.8	Very low	120 Å²	120	83.4 Å²	83.4	56%	0.561	41%	0.411	S	S	*	.	S	Bend	trans	-75.4	-11.6	178.8	-143.8	170.9	10.2	0	0	112	Y929	Y929-Q932 PolarHBondContact O-N 2.85Å; Y929-Q932 VanDerWaalsContact O-N 3.14Å
933	W	29.5	Very low	34.1	Very low	143 Å²	143	80.3 Å²	80.3	54%	0.542	39%	0.393	S	S	.	.	S	Bend	trans	-103.1	102	172.3	-126.4	-82	0	0	0	111.1	A778 K931	A778-W933 VanDerWaalsContact C-CZ2 3.41Å; A778-W933 HydrophobicContact CB-CH2 3.5Å; A778-W933 HydrophobicContact CB-CZ2 4.2Å; A778-W933 HydrophobicContact CB-CZ3 4.46Å; A778-W933 WeakPolarHBondContact O-CH2 3.33Å; A778-W933 WeakPolarHBondContact O-CZ2 3.49Å; K931-W933 PolarHBondContact O-N 2.98Å
934	D	29.3	Very low	34.3	Very low	135 Å²	135	80.6 Å²	80.6	72%	0.722	40%	0.395	S	S	*	.			trans	44.1	136	165	-85.9	-38.8	0	0	0	122.1	L936	D934-L936 PolarHBondContact O-N 3.38Å
935	R	28.6	Very low	34.4	Very low	248 Å²	248	86.3 Å²	86.3	94%	0.936	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	12	-168.9	-87.2	176.7	171.9	173.4	-1.7	118.5
936	L	31.5	Very low	34.5	Very low	154 Å²	154	90.1 Å²	90.1	81%	0.806	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.3	-39.7	-175.8	-81.2	157.6	0	0	0	117.3	D934	D934-L936 PolarHBondContact O-N 3.38Å
937	D	29.7	Very low	34.8	Very low	153 Å²	153	89.2 Å²	89.2	82%	0.818	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.1	-6.7	-168.2	-66.9	-44.6	0	0	0	116.8	S939	D937-S939 PolarHBondContact O-N 3Å
938	G	29.9	Very low	34.9	Very low	35 Å²	35	90.7 Å²	90.7	36%	0.361	44%	0.44	S	S	.	.			trans	-80.1	57.1	171.8	0	0	0	0	0	111.8	S940	G938-S940 PolarHBondContact O-N 3.38Å
939	S	34.4	Very low	34.9	Very low	38 Å²	38	94.1 Å²	94.1	27%	0.266	46%	0.459	S	S	.	.			trans	-73.3	105.4	-163.6	104.2	0	0	0	0	110.1	D937 E941 V942	D937-S939 PolarHBondContact O-N 3Å; S939-E941 VanDerWaalsContact CB-CB 3.44Å; S939-E941 PolarHBondContact O-N 2.82Å; S939-E941 WeakPolarHBondContact OG-CB 3.46Å; S939-V942 PolarHBondContact O-N 3.1Å; S939-V942 VanDerWaalsContact O-N 3.08Å; S939-V942 PolarHBondContact OG-N 3.33Å
940	S	33.3	Very low	35.1	Very low	6 Å²	6	91.3 Å²	91.3	4%	0.042	45%	0.45	C	S	.	.	H	α-helix	trans	-49.4	-18.6	155.6	57.7	0	0	0	0	110.8	K931 G938 V942 H943 M944	K931-S940 WeakPolarHBondContact CE-OG 3.41Å; G938-S940 PolarHBondContact O-N 3.38Å; S940-V942 VanDerWaalsContact C-N 3.28Å; S940-V942 PolarHBondContact O-N 3.18Å; S940-H943 CarbonylContact O-C 3.59Å; S940-H943 PolarHBondContact O-N 2.73Å; S940-H943 VanDerWaalsContact O-N 3.1Å; S940-M944 WeakPolarHBondContact O-CB 3.46Å; S940-M944 WeakPolarHBondContact O-CG 3.48Å; S940-M944 PolarHBondContact O-N 2.94Å; S940-M944 WeakPolarHBondContact OG-CE 2.77Å; S940-M944 PolarHBondContact OG-SD 3.41Å
941	E	38.3	Very low	35.2	Very low	107 Å²	107	89.6 Å²	89.6	50%	0.5	44%	0.438	S	S	.	.	H	α-helix	trans	-47.6	-38.8	168.8	-130.6	179.1	-171.8	0	0	113.7	S939 H943 M944 M945	S939-E941 VanDerWaalsContact CB-CB 3.44Å; S939-E941 PolarHBondContact O-N 2.82Å; S939-E941 WeakPolarHBondContact OG-CB 3.46Å; E941-H943 VanDerWaalsContact C-N 3.35Å; E941-H943 PolarHBondContact O-N 2.7Å; E941-M944 CarbonylContact O-C 3.42Å; E941-M944 PolarHBondContact O-N 2.86Å; E941-M945 HydrophobicContact CG-CE 4.11Å; E941-M945 HydrophobicContact CG-CG 4.46Å; E941-M945 WeakPolarHBondContact O-CA 2.82Å; E941-M945 WeakPolarHBondContact O-CB 3.18Å; E941-M945 VanDerWaalsContact O-CG 3.27Å; E941-M945 WeakPolarHBondContact O-CG 3.21Å; E941-M945 PolarHBondContact O-N 2.77Å
942	V	38.3	Very low	35.6	Very low	75 Å²	75	85.4 Å²	85.4	46%	0.455	42%	0.42	S	S	.	.	H	α-helix	trans	-65	-43.7	176.9	177.4	0	0	0	0	110.8	S939 S940 R946	S939-V942 PolarHBondContact O-N 3.1Å; S939-V942 VanDerWaalsContact O-N 3.08Å; S939-V942 PolarHBondContact OG-N 3.33Å; S940-V942 VanDerWaalsContact C-N 3.28Å; S940-V942 PolarHBondContact O-N 3.18Å; V942-R946 WeakPolarHBondContact O-CB 3.21Å; V942-R946 WeakPolarHBondContact O-CD 3.13Å; V942-R946 WeakPolarHBondContact O-CG 3.33Å; V942-R946 PolarHBondContact O-N 3.45Å
943	H	39.8	Very low	36.1	Very low	48 Å²	48	81 Å²	81	22%	0.222	40%	0.401	C	S	.	.	H	α-helix	trans	-69.1	-38	176	-65.6	-72.5	0	0	0	111.3	F923 S940 E941 I947	F923-H943 HydrophobicContact CE1-CB 3.84Å; F923-H943 AromaticContact CE1-ND1 3.74Å; F923-H943 AromaticContact CE2-CE1 3.91Å; F923-H943 AromaticContact CE2-ND1 3.25Å; F923-H943 WeakPolarHBondContact CE2-ND1 3.2Å; F923-H943 HydrophobicContact CZ-CB 3.69Å; F923-H943 AromaticContact CZ-CG 3.66Å; F923-H943 AromaticContact CZ-ND1 3.02Å; F923-H943 WeakPolarHBondContact CZ-ND1 3.32Å; S940-H943 CarbonylContact O-C 3.59Å; S940-H943 PolarHBondContact O-N 2.73Å; S940-H943 VanDerWaalsContact O-N 3.1Å; E941-H943 VanDerWaalsContact C-N 3.35Å; E941-H943 PolarHBondContact O-N 2.7Å; H943-I947 WeakPolarHBondContact O-CG1 3.18Å; H943-I947 PolarHBondContact O-N 2.74Å
944	M	40.3	Very low	36.6	Very low	36 Å²	36	74.8 Å²	74.8	18%	0.177	38%	0.379	C	S	.	.	H	α-helix	trans	-69.2	-49.1	178.4	-69.4	163.5	174.1	0	0	112.1	S940 E941 R946 I947 A948 C966	S940-M944 WeakPolarHBondContact O-CB 3.46Å; S940-M944 WeakPolarHBondContact O-CG 3.48Å; S940-M944 PolarHBondContact O-N 2.94Å; S940-M944 WeakPolarHBondContact OG-CE 2.77Å; S940-M944 PolarHBondContact OG-SD 3.41Å; E941-M944 CarbonylContact O-C 3.42Å; E941-M944 PolarHBondContact O-N 2.86Å; M944-R946 PolarHBondContact O-N 3.4Å; M944-I947 CarbonylContact O-C 3.55Å; M944-I947 WeakPolarHBondContact O-CG1 3.47Å; M944-I947 PolarHBondContact O-N 3.08Å; M944-A948 WeakPolarHBondContact O-CA 3.47Å; M944-A948 VanDerWaalsContact O-CB 3.31Å; M944-A948 WeakPolarHBondContact O-CB 3.43Å; M944-A948 PolarHBondContact O-N 3.18Å; M944-C966 HydrophobicContact CE-CB 4.23Å; M944-C966 WeakPolarHBondContact CE-SG 2.96Å
945	M	40.8	Very low	37.1	Very low	121 Å²	121	71.6 Å²	71.6	60%	0.596	36%	0.359	S	S	*	.	H	α-helix	trans	-57.7	-37.3	175.5	-77.9	-172.7	179.4	0	0	110.5	E941 I947 A948	E941-M945 HydrophobicContact CG-CE 4.11Å; E941-M945 HydrophobicContact CG-CG 4.46Å; E941-M945 WeakPolarHBondContact O-CA 2.82Å; E941-M945 WeakPolarHBondContact O-CB 3.18Å; E941-M945 VanDerWaalsContact O-CG 3.27Å; E941-M945 WeakPolarHBondContact O-CG 3.21Å; E941-M945 PolarHBondContact O-N 2.77Å; M945-I947 VanDerWaalsContact C-N 3.27Å; M945-I947 PolarHBondContact O-N 2.97Å; M945-A948 PolarHBondContact O-N 3.1Å
946	R	39.7	Very low	37.4	Very low	162 Å²	162	62.9 Å²	62.9	61%	0.611	34%	0.335	S	S	*	.	H	α-helix	trans	-67.3	-24.6	175.1	-75.9	176	-176.7	-158.3	2	113.9	V942 M944 F950	V942-R946 WeakPolarHBondContact O-CB 3.21Å; V942-R946 WeakPolarHBondContact O-CD 3.13Å; V942-R946 WeakPolarHBondContact O-CG 3.33Å; V942-R946 PolarHBondContact O-N 3.45Å; M944-R946 PolarHBondContact O-N 3.4Å; R946-F950 WeakPolarHBondContact O-CE2 3.47Å
947	I	38.2	Very low	37.5	Very low	12 Å²	12	61.6 Å²	61.6	6%	0.062	33%	0.327	C	S	.	.	H	α-helix	trans	-105.3	-8.4	176.1	64.4	173.8	0	0	0	113.4	F899 W920 H943 M944 M945 D949 F950 F962	F899-I947 HydrophobicContact CD1-CB 4.45Å; F899-I947 HydrophobicContact CD1-CG2 4.49Å; F899-I947 HydrophobicContact CE1-CB 4.11Å; F899-I947 HydrophobicContact CE1-CD1 4.28Å; F899-I947 HydrophobicContact CE1-CG2 4.04Å; W920-I947 HydrophobicContact CH2-CG2 4Å; W920-I947 HydrophobicContact CZ2-CG2 4.2Å; H943-I947 WeakPolarHBondContact O-CG1 3.18Å; H943-I947 PolarHBondContact O-N 2.74Å; M944-I947 CarbonylContact O-C 3.55Å; M944-I947 WeakPolarHBondContact O-CG1 3.47Å; M944-I947 PolarHBondContact O-N 3.08Å; M945-I947 VanDerWaalsContact C-N 3.27Å; M945-I947 PolarHBondContact O-N 2.97Å; I947-D949 PolarHBondContact O-N 2.96Å; I947-F950 WeakPolarHBondContact O-CA 3.35Å; I947-F950 WeakPolarHBondContact O-CB 3.27Å; I947-F950 PolarHBondContact O-N 3.31Å; I947-F962 HydrophobicContact CD1-CD2 4.44Å; I947-F962 HydrophobicContact CD1-CE2 3.44Å; I947-F962 VanDerWaalsContact CD1-CE2 3.44Å; I947-F962 HydrophobicContact CD1-CZ 3.75Å
948	A	40.2	Very low	37.9	Very low	38 Å²	38	57.2 Å²	57.2	31%	0.314	31%	0.308	S	S	.	.	H	α-helix	trans	-65.6	-28.4	-173.3	0	0	0	0	0	112.6	M944 M945 F950	M944-A948 WeakPolarHBondContact O-CA 3.47Å; M944-A948 VanDerWaalsContact O-CB 3.31Å; M944-A948 WeakPolarHBondContact O-CB 3.43Å; M944-A948 PolarHBondContact O-N 3.18Å; M945-A948 PolarHBondContact O-N 3.1Å; A948-F950 PolarHBondContact O-N 2.92Å
949	D	39.3	Very low	38.3	Very low	110 Å²	110	57.8 Å²	57.8	59%	0.588	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-6.1	174.1	-61	-27.7	0	0	0	112.6	I947	I947-D949 PolarHBondContact O-N 2.96Å
950	F	37.7	Very low	38.6	Very low	52 Å²	52	56.2 Å²	56.2	23%	0.228	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	132.4	179.5	-56.8	-100.3	0	0	0	111.3	F899 F900 H901 R946 I947 A948	F899-F950 HydrophobicContact CB-CB 4.12Å; F899-F950 HydrophobicContact CB-CD1 4.18Å; F899-F950 HydrophobicContact CB-CG 4.39Å; F899-F950 HydrophobicContact CD1-CB 4.1Å; F900-F950 CarbonylContact O-C 3.55Å; F900-F950 WeakPolarHBondContact O-CA 3.3Å; H901-F950 HydrophobicContact CB-CD1 3.82Å; H901-F950 HydrophobicContact CB-CE1 3.77Å; R946-F950 WeakPolarHBondContact O-CE2 3.47Å; I947-F950 WeakPolarHBondContact O-CA 3.35Å; I947-F950 WeakPolarHBondContact O-CB 3.27Å; I947-F950 PolarHBondContact O-N 3.31Å; A948-F950 PolarHBondContact O-N 2.92Å
951	G	37.9	Very low	38.9	Very low	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	141.8	159.4	0	0	0	0	0	110.5	F899 F900	F899-G951 CarbonylContact C-O 3.44Å; F899-G951 VanDerWaalsContact CA-O 3.31Å; F899-G951 WeakPolarHBondContact CA-O 3.18Å; F900-G951 PolarHBondContact N-O 3.47Å; F900-G951 PolarHBondContact O-N 2.87Å
952	V	41.2	Very low	39.1	Very low	1 Å²	1	55.2 Å²	55.2	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	121.1	-179.2	-166.8	0	0	0	0	109.4	A897 I898 F899 V954 A973	A897-V952 HydrophobicContact CB-CG1 3.82Å; I898-V952 WeakPolarHBondContact O-CA 3.42Å; F899-V952 HydrophobicContact CD1-CB 4.43Å; F899-V952 HydrophobicContact CD1-CG1 4.27Å; F899-V952 HydrophobicContact CD1-CG2 3.53Å; F899-V952 HydrophobicContact CE1-CB 4.42Å; F899-V952 HydrophobicContact CE1-CG1 4.02Å; F899-V952 HydrophobicContact CE1-CG2 3.51Å; F899-V952 HydrophobicContact CG-CG2 4.5Å; F899-V952 HydrophobicContact CZ-CG1 4.25Å; F899-V952 HydrophobicContact CZ-CG2 4.49Å; V952-V954 HydrophobicContact CB-CG2 4.41Å; V952-V954 HydrophobicContact CG1-CG2 3.79Å; V952-A973 PolarHBondContact N-O 2.79Å
953	V	40.5	Very low	39.3	Very low	28 Å²	28	52.2 Å²	52.2	17%	0.17	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	128	166	174.8	0	0	0	0	107.8	A897 I898 F900 W975	A897-V953 CarbonylContact C-O 3.55Å; A897-V953 WeakPolarHBondContact CA-O 3.31Å; I898-V953 PolarHBondContact N-O 3.36Å; I898-V953 PolarHBondContact O-N 3.1Å; F900-V953 HydrophobicContact CD2-CG2 4.13Å; F900-V953 HydrophobicContact CE2-CB 3.93Å; F900-V953 HydrophobicContact CE2-CG2 3.43Å; F900-V953 VanDerWaalsContact CE2-CG2 3.43Å; F900-V953 HydrophobicContact CZ-CG2 4.32Å; V953-W975 HydrophobicContact CG2-CB 4.29Å
954	V	39.6	Very low	39.3	Very low	12 Å²	12	55.7 Å²	55.7	7%	0.073	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	140	-167.6	-165.6	0	0	0	0	109.4	V952 P959 M963	V952-V954 HydrophobicContact CB-CG2 4.41Å; V952-V954 HydrophobicContact CG1-CG2 3.79Å; V954-P959 HydrophobicContact CG1-CB 3.71Å; V954-M963 HydrophobicContact CB-CE 4.36Å; V954-M963 HydrophobicContact CG1-CE 4.31Å; V954-M963 HydrophobicContact CG2-CE 3.24Å
955	H	39.4	Very low	39.1	Very low	68 Å²	68	58.4 Å²	58.4	32%	0.315	29%	0.294	S	S	.	.			trans	-66.5	127	171.6	-168.1	-86.6	0	0	0	110.6	R896 I957 C958	R896-H955 HydrophobicContact CB-CB 4.3Å; R896-H955 PolarHBondContact O-N 3.2Å; H955-I957 VanDerWaalsContact C-N 3.25Å; H955-I957 PolarHBondContact ND1-N 3.31Å; H955-I957 PolarHBondContact O-N 3.32Å; H955-I957 VanDerWaalsContact O-N 3.17Å; H955-C958 CarbonylContact O-C 3.51Å; H955-C958 PolarHBondContact O-N 2.74Å
956	P	35.6	Very low	39	Very low	65 Å²	65	52.7 Å²	52.7	42%	0.422	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-31.5	-170.6	20.7	-31.2	0	0	0	113.4	I976	P956-I976 HydrophobicContact CB-CG2 4.38Å
957	I	34.1	Very low	38.7	Very low	126 Å²	126	46.9 Å²	46.9	65%	0.646	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-20.2	-176.2	-41.2	178.7	0	0	0	112.3	L879 H955	L879-I957 HydrophobicContact CD2-CD1 4.49Å; H955-I957 VanDerWaalsContact C-N 3.25Å; H955-I957 PolarHBondContact ND1-N 3.31Å; H955-I957 PolarHBondContact O-N 3.32Å; H955-I957 VanDerWaalsContact O-N 3.17Å
958	C	36.6	Very low	38.4	Very low	62 Å²	62	55.2 Å²	55.2	42%	0.419	29%	0.286	S	S	.	.	S	Bend	trans	-138.3	60	-172.5	-63.9	0	0	0	0	112.8	H955	H955-C958 CarbonylContact O-C 3.51Å; H955-C958 PolarHBondContact O-N 2.74Å
959	P	38.3	Very low	38	Very low	47 Å²	47	54.8 Å²	54.8	31%	0.305	28%	0.279	S	S	.	.			trans	-66.9	149.2	175.8	29.8	-35.1	0	0	0	111.3	V954 L964	V954-P959 HydrophobicContact CG1-CB 3.71Å; P959-L964 HydrophobicContact CG-CD2 4.31Å
960	P	41.2	Very low	37.6	Very low	4 Å²	4	52.2 Å²	52.2	3%	0.026	27%	0.27	C	S	.	.			trans	-53.2	138	169.1	-21.6	28.8	0	0	0	113.3	P895 A897 D924 F962 M963 L964	P895-P960 HydrophobicContact CB-CB 3.79Å; P895-P960 HydrophobicContact CB-CG 3.72Å; P895-P960 HydrophobicContact CG-CB 4.32Å; A897-P960 HydrophobicContact CB-CG 4.1Å; D924-P960 WeakPolarHBondContact OD1-CB 3.37Å; P960-F962 HydrophobicContact CB-CD1 3.39Å; P960-F962 HydrophobicContact CB-CE1 3.27Å; P960-F962 HydrophobicContact CB-CG 4.43Å; P960-F962 HydrophobicContact CB-CZ 4.24Å; P960-F962 HydrophobicContact CG-CD1 4.4Å; P960-F962 HydrophobicContact CG-CE1 3.79Å; P960-F962 HydrophobicContact CG-CZ 4.49Å; P960-F962 PolarHBondContact O-N 3.32Å; P960-M963 HydrophobicContact CB-CG 3.93Å; P960-M963 HydrophobicContact CG-CG 4.07Å; P960-M963 VanDerWaalsContact O-CB 3.25Å; P960-M963 WeakPolarHBondContact O-CB 3.47Å; P960-M963 PolarHBondContact O-N 3.45Å; P960-L964 PolarHBondContact O-N 2.72Å
961	R	40.8	Very low	37.2	Very low	82 Å²	82	53.5 Å²	53.5	31%	0.309	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-26.3	178.5	-69.3	-177.5	-90.7	-166.1	-16.4	113.5	D924 H928 M963 L964	D924-R961 VanDerWaalsContact CG-N 3.33Å; D924-R961 WeakPolarHBondContact OD1-CA 3.45Å; D924-R961 PolarHBondContact OD1-N 2.87Å; D924-R961 WeakPolarHBondContact OD2-CB 3.2Å; D924-R961 PolarHBondContact OD2-N 3.22Å; D924-R961 IonicContact OD2-NE 3.94Å; D924-R961 PolarHBondContact OD2-NE 2.67Å; H928-R961 HydrophobicContact CB-CB 4.05Å; H928-R961 PolarHBondContact ND1-O 2.81Å; H928-R961 VanDerWaalsContact ND1-O 3.09Å; R961-M963 VanDerWaalsContact C-N 3.3Å; R961-L964 PolarHBondContact O-N 3.3Å
962	F	42.2	Very low	36.8	Very low	10 Å²	10	57 Å²	57	4%	0.044	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-34.2	173.2	82.1	-94.2	0	0	0	111.5	W920 D924 A927 I947 P960 L964 R965 C966	W920-F962 HydrophobicContact CE3-CE1 4.22Å; W920-F962 HydrophobicContact CH2-CE1 4.32Å; W920-F962 HydrophobicContact CH2-CZ 4.48Å; W920-F962 HydrophobicContact CZ3-CD1 4Å; W920-F962 AromaticContact CZ3-CE1 3.46Å; W920-F962 HydrophobicContact CZ3-CE1 3.46Å; W920-F962 VanDerWaalsContact CZ3-CE1 3.46Å; W920-F962 HydrophobicContact CZ3-CZ 4.02Å; D924-F962 WeakPolarHBondContact OD1-CD1 3.34Å; D924-F962 PolarHBondContact OD1-N 3.37Å; A927-F962 HydrophobicContact CB-CB 3.67Å; A927-F962 HydrophobicContact CB-CG 4.37Å; I947-F962 HydrophobicContact CD1-CD2 4.44Å; I947-F962 HydrophobicContact CD1-CE2 3.44Å; I947-F962 VanDerWaalsContact CD1-CE2 3.44Å; I947-F962 HydrophobicContact CD1-CZ 3.75Å; P960-F962 HydrophobicContact CB-CD1 3.39Å; P960-F962 HydrophobicContact CB-CE1 3.27Å; P960-F962 HydrophobicContact CB-CG 4.43Å; P960-F962 HydrophobicContact CB-CZ 4.24Å; P960-F962 HydrophobicContact CG-CD1 4.4Å; P960-F962 HydrophobicContact CG-CE1 3.79Å; P960-F962 HydrophobicContact CG-CZ 4.49Å; P960-F962 PolarHBondContact O-N 3.32Å; F962-L964 VanDerWaalsContact C-N 3.31Å; F962-L964 PolarHBondContact O-N 2.84Å; F962-R965 PolarHBondContact O-N 2.94Å; F962-C966 PolarHBondContact O-N 2.8Å; F962-C966 PolarHBondContact O-SG 3.23Å; F962-C966 VanDerWaalsContact O-SG 3.32Å
963	M	41.7	Very low	36.1	Very low	13 Å²	13	57.1 Å²	57.1	6%	0.064	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-66.6	-34.4	178.7	-62.1	-99.8	-70.8	0	0	111.7	V954 P960 R961 R965 C966 L969 L974	V954-M963 HydrophobicContact CB-CE 4.36Å; V954-M963 HydrophobicContact CG1-CE 4.31Å; V954-M963 HydrophobicContact CG2-CE 3.24Å; P960-M963 HydrophobicContact CB-CG 3.93Å; P960-M963 HydrophobicContact CG-CG 4.07Å; P960-M963 VanDerWaalsContact O-CB 3.25Å; P960-M963 WeakPolarHBondContact O-CB 3.47Å; P960-M963 PolarHBondContact O-N 3.45Å; R961-M963 VanDerWaalsContact C-N 3.3Å; M963-R965 PolarHBondContact O-N 3.23Å; M963-C966 PolarHBondContact O-N 2.85Å; M963-L969 HydrophobicContact CE-CD1 4.36Å; M963-L969 HydrophobicContact SD-CD1 3.33Å; M963-L969 WeakPolarHBondContact SD-CD1 3.32Å; M963-L974 HydrophobicContact CE-CD1 3.38Å; M963-L974 HydrophobicContact CE-CG 4.37Å; M963-L974 HydrophobicContact SD-CD1 4.15Å
964	L	41.1	Very low	35.5	Very low	120 Å²	120	56.7 Å²	56.7	63%	0.628	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-59.9	-16.4	173.3	-62.6	174	0	0	0	113.1	P959 P960 R961 F962	P959-L964 HydrophobicContact CG-CD2 4.31Å; P960-L964 PolarHBondContact O-N 2.72Å; R961-L964 PolarHBondContact O-N 3.3Å; F962-L964 VanDerWaalsContact C-N 3.31Å; F962-L964 PolarHBondContact O-N 2.84Å
965	R	35.9	Very low	35.1	Very low	94 Å²	94	59 Å²	59	36%	0.355	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-110.3	-3.9	174.1	-76.5	-159.1	-179.8	-152.9	5.6	114.4	K931 F962 M963 S967	K931-R965 PolarHBondContact O-NH1 2.79Å; F962-R965 PolarHBondContact O-N 2.94Å; M963-R965 PolarHBondContact O-N 3.23Å; R965-S967 PolarHBondContact O-N 3.09Å
966	C	38	Very low	34.6	Very low	1 Å²	1	57.8 Å²	57.8	1%	0.007	31%	0.31	C	S	.	.			trans	-78.9	95.7	178.4	-73	0	0	0	0	110.2	M944 F962 M963 F968 L969 I997	M944-C966 HydrophobicContact CE-CB 4.23Å; M944-C966 WeakPolarHBondContact CE-SG 2.96Å; F962-C966 PolarHBondContact O-N 2.8Å; F962-C966 PolarHBondContact O-SG 3.23Å; F962-C966 VanDerWaalsContact O-SG 3.32Å; M963-C966 PolarHBondContact O-N 2.85Å; C966-F968 PolarHBondContact O-N 3.15Å; C966-L969 HydrophobicContact CB-CD1 3.7Å; C966-L969 HydrophobicContact CB-CG 4.09Å; C966-I997 VanDerWaalsContact O-CD1 3.3Å; C966-I997 WeakPolarHBondContact O-CD1 3.42Å
967	S	33.4	Very low	34.3	Very low	39 Å²	39	56.7 Å²	56.7	27%	0.273	30%	0.3	S	S	.	.	S	Bend	trans	-77.2	-7.4	169.6	57	0	0	0	0	113.7	R965	R965-S967 PolarHBondContact O-N 3.09Å
968	F	31.4	Very low	33.9	Very low	187 Å²	187	52.8 Å²	52.8	82%	0.82	28%	0.282	S	S	*	.			trans	-137.3	36.4	-168.3	-68.9	-76.8	0	0	0	114.3	C966 S970	C966-F968 PolarHBondContact O-N 3.15Å; F968-S970 PolarHBondContact O-N 2.94Å
969	L	32.5	Very low	33.3	Very low	29 Å²	29	53.1 Å²	53.1	15%	0.152	28%	0.283	C	S	.	.			trans	-70.1	122.3	160.6	-84.8	155.4	0	0	0	107.2	M963 C966 S971 L974	M963-L969 HydrophobicContact CE-CD1 4.36Å; M963-L969 HydrophobicContact SD-CD1 3.33Å; M963-L969 WeakPolarHBondContact SD-CD1 3.32Å; C966-L969 HydrophobicContact CB-CD1 3.7Å; C966-L969 HydrophobicContact CB-CG 4.09Å; L969-S971 PolarHBondContact O-N 3.41Å; L969-L974 HydrophobicContact CB-CD1 4.38Å; L969-L974 HydrophobicContact CD1-CD1 3.84Å
970	S	30.7	Very low	32.7	Very low	57 Å²	57	54.3 Å²	54.3	40%	0.399	29%	0.288	S	S	.	.			trans	-48.4	127.3	172.7	15.2	0	0	0	0	108.2	F968 S972 A973	F968-S970 PolarHBondContact O-N 2.94Å; S970-S972 PolarHBondContact O-N 3.03Å; S970-A973 VanDerWaalsContact O-CB 3.32Å; S970-A973 WeakPolarHBondContact O-CB 3.42Å; S970-A973 PolarHBondContact O-N 3.14Å
971	S	29.3	Very low	32	Very low	78 Å²	78	58.8 Å²	58.8	55%	0.545	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-57.4	-17.3	-170.6	46.3	0	0	0	0	114.7	L969 A973	L969-S971 PolarHBondContact O-N 3.41Å; S971-A973 PolarHBondContact O-N 3.41Å
972	S	28.6	Very low	31.2	Very low	74 Å²	74	57 Å²	57	52%	0.517	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-69.3	-13.9	171.1	44.9	0	0	0	0	114.2	S970	S970-S972 PolarHBondContact O-N 3.03Å
973	A	26.8	Very low	30.8	Very low	3 Å²	3	64.5 Å²	64.5	3%	0.025	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-103.7	-4.8	-170.4	0	0	0	0	0	114.9	V952 S970 S971	V952-A973 PolarHBondContact N-O 2.79Å; S970-A973 VanDerWaalsContact O-CB 3.32Å; S970-A973 WeakPolarHBondContact O-CB 3.42Å; S970-A973 PolarHBondContact O-N 3.14Å; S971-A973 PolarHBondContact O-N 3.41Å
974	L	28.3	Very low	30.2	Very low	20 Å²	20	68.3 Å²	68.3	11%	0.105	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	104.6	-174.6	-143.3	97.9	0	0	0	111.2	M963 L969 I976 V995	M963-L974 HydrophobicContact CE-CD1 3.38Å; M963-L974 HydrophobicContact CE-CG 4.37Å; M963-L974 HydrophobicContact SD-CD1 4.15Å; L969-L974 HydrophobicContact CB-CD1 4.38Å; L969-L974 HydrophobicContact CD1-CD1 3.84Å; L974-I976 HydrophobicContact CD2-CD1 3.85Å; L974-I976 HydrophobicContact CD2-CG1 3.89Å; L974-I976 HydrophobicContact CG-CG1 4.46Å; L974-V995 HydrophobicContact CD2-CB 3.97Å; L974-V995 HydrophobicContact CD2-CG1 4.42Å; L974-V995 HydrophobicContact CD2-CG2 4.39Å
975	W	31.5	Very low	29.5	Very low	61 Å²	61	69.3 Å²	69.3	23%	0.231	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	106.1	170.5	-62.4	71.6	0	0	0	107.3	W908 V953	W908-W975 HydrophobicContact CH2-CZ2 4.22Å; W908-W975 HydrophobicContact CZ3-CZ2 4.32Å; V953-W975 HydrophobicContact CG2-CB 4.29Å
976	I	28.6	Very low	29	Very low	41 Å²	41	74.6 Å²	74.6	21%	0.21	43%	0.428	C	S	.	.			trans	-100.2	109.4	167.9	-52.9	-172.5	0	0	0	105.6	P956 L974 T978 V995 F1004	P956-I976 HydrophobicContact CB-CG2 4.38Å; L974-I976 HydrophobicContact CD2-CD1 3.85Å; L974-I976 HydrophobicContact CD2-CG1 3.89Å; L974-I976 HydrophobicContact CG-CG1 4.46Å; I976-T978 HydrophobicContact CG2-CG2 4.24Å; I976-T978 PolarHBondContact O-N 3.01Å; I976-V995 HydrophobicContact CD1-CG2 3.93Å; I976-V995 HydrophobicContact CG1-CG2 4.37Å; I976-F1004 HydrophobicContact CD1-CE1 4.25Å
977	D	28.8	Very low	28.2	Very low	43 Å²	43	82.4 Å²	82.4	23%	0.23	46%	0.464	C	S	.	.			trans	-70.4	87.7	167.5	-81.4	-41.9	0	0	0	108.6	I872 V979 V990	I872-D977 WeakPolarHBondContact CD1-OD2 3.4Å; D977-V979 PolarHBondContact O-N 2.92Å; D977-V990 VanDerWaalsContact OD1-CG1 3.3Å; D977-V990 WeakPolarHBondContact OD1-CG1 3.19Å
978	T	25.6	Very low	27.8	Very low	43 Å²	43	83.6 Å²	83.6	26%	0.264	47%	0.47	S	S	.	.			trans	-83.9	100.4	158.7	28.9	0	0	0	0	107.8	I976 V980 L1006	I976-T978 HydrophobicContact CG2-CG2 4.24Å; I976-T978 PolarHBondContact O-N 3.01Å; T978-V980 PolarHBondContact O-N 3.01Å; T978-L1006 HydrophobicContact CG2-CD1 4.01Å; T978-L1006 HydrophobicContact CG2-CD2 4.26Å
979	V	25.8	Very low	27.4	Very low	70 Å²	70	81.6 Å²	81.6	42%	0.424	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	110.3	170.8	175.5	0	0	0	0	107.8	A875 D977 T988	A875-V979 HydrophobicContact CB-CG2 4.33Å; D977-V979 PolarHBondContact O-N 2.92Å; V979-T988 HydrophobicContact CB-CG2 4.32Å; V979-T988 HydrophobicContact CG1-CG2 3.75Å; V979-T988 HydrophobicContact CG2-CG2 4.24Å
980	V	24.9	Very low	27.1	Very low	71 Å²	71	82.9 Å²	82.9	43%	0.43	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	123.8	167.8	-166.3	0	0	0	0	106.8	T978 G982	T978-V980 PolarHBondContact O-N 3.01Å; V980-G982 PolarHBondContact O-N 3.1Å
981	S	25.3	Very low	26.8	Very low	99 Å²	99	83.2 Å²	83.2	69%	0.692	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.1	116.4	174	57.9	0	0	0	0	108.8
982	G	25.8	Very low	26.6	Very low	45 Å²	45	83.7 Å²	83.7	46%	0.464	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-69	136.6	164.7	0	0	0	0	0	109.7	V980 S984	V980-G982 PolarHBondContact O-N 3.1Å; G982-S984 PolarHBondContact O-N 3.39Å
983	D	31.9	Very low	26.4	Very low	166 Å²	166	82.5 Å²	82.5	89%	0.888	48%	0.475	S	S	*	.	S	Bend	trans	-69.8	12.8	-173.5	-79.4	-29.6	0	0	0	115.4
984	S	29.2	Very low	26.3	Very low	94 Å²	94	87 Å²	87	66%	0.657	51%	0.505	S	S	*	.	S	Bend	trans	-162.4	122.1	176	54.8	0	0	0	0	109.9	G982	G982-S984 PolarHBondContact O-N 3.39Å
985	D	26.8	Very low	26.1	Very low	140 Å²	140	88.4 Å²	88.4	75%	0.749	51%	0.514	S	S	*	.	S	Bend	trans	63.2	67.7	169.9	-61.2	-24.8	0	0	0	117.1	Q987	D985-Q987 WeakPolarHBondContact O-CG 2.92Å; D985-Q987 PolarHBondContact O-N 3.41Å
986	F	25.4	Very low	25.7	Very low	205 Å²	205	90.6 Å²	90.6	90%	0.899	54%	0.539	S	S	*	.	S	Bend	trans	39.5	13.1	157.6	-63.5	-74.9	0	0	0	119.8	T988	F986-T988 PolarHBondContact O-N 3.49Å
987	Q	22.5	Very low	25.5	Very low	165 Å²	165	91.8 Å²	91.8	77%	0.771	55%	0.545	S	S	*	.			trans	-82.1	105.7	176.7	-75.3	-167.1	-1.4	0	0	106.6	D985 E989	D985-Q987 WeakPolarHBondContact O-CG 2.92Å; D985-Q987 PolarHBondContact O-N 3.41Å; Q987-E989 PolarHBondContact O-N 2.84Å
988	T	23.9	Very low	25.2	Very low	64 Å²	64	92 Å²	92	39%	0.393	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.7	102.4	173.1	-49	0	0	0	0	107.1	V979 F986 V990	V979-T988 HydrophobicContact CB-CG2 4.32Å; V979-T988 HydrophobicContact CG1-CG2 3.75Å; V979-T988 HydrophobicContact CG2-CG2 4.24Å; F986-T988 PolarHBondContact O-N 3.49Å; T988-V990 PolarHBondContact O-N 3.22Å
989	E	23.6	Very low	25.1	Very low	146 Å²	146	97.5 Å²	97.5	68%	0.682	59%	0.585	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.9	109.4	174.3	-147.4	178.9	-164.3	0	0	108.3	Q987 T991	Q987-E989 PolarHBondContact O-N 2.84Å; E989-T991 VanDerWaalsContact C-N 3.35Å; E989-T991 PolarHBondContact O-N 2.93Å
990	V	25.9	Very low	24.9	Very low	55 Å²	55	104.4 Å²	104.4	33%	0.333	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.9	96.5	170.4	178.1	0	0	0	0	106.9	D977 T988 S992	D977-V990 VanDerWaalsContact OD1-CG1 3.3Å; D977-V990 WeakPolarHBondContact OD1-CG1 3.19Å; T988-V990 PolarHBondContact O-N 3.22Å; V990-S992 PolarHBondContact O-N 2.79Å
991	T	25.1	Very low	24.7	Very low	64 Å²	64	106.6 Å²	106.6	39%	0.393	62%	0.619	S	S	.	*			trans	-74.7	109.7	171.6	43.7	0	0	0	0	108.1	E989 G993	E989-T991 VanDerWaalsContact C-N 3.35Å; E989-T991 PolarHBondContact O-N 2.93Å; T991-G993 PolarHBondContact O-N 3.24Å
992	S	25.1	Very low	24.5	Very low	89 Å²	89	110.5 Å²	110.5	62%	0.622	62%	0.62	S	S	*	*			trans	-70.2	67.4	168.3	65.2	0	0	0	0	109.2	V990 C994	V990-S992 PolarHBondContact O-N 2.79Å; S992-C994 PolarHBondContact O-N 2.74Å
993	G	24.2	Very low	24.3	Very low	49 Å²	49	115.6 Å²	115.6	51%	0.505	64%	0.635	S	S	.	*			trans	-70.2	111.1	174.2	0	0	0	0	0	109	T991 V995	T991-G993 PolarHBondContact O-N 3.24Å; G993-V995 WeakPolarHBondContact O-CG2 3.11Å; G993-V995 PolarHBondContact O-N 3.35Å
994	C	23.9	Very low	23.8	Very low	97 Å²	97	115.8 Å²	115.8	66%	0.655	63%	0.628	S	S	*	*			trans	-60.1	99.4	171.3	-114.7	0	0	0	0	109.2	S992 S996	S992-C994 PolarHBondContact O-N 2.74Å; C994-S996 PolarHBondContact O-N 3.46Å
995	V	25.2	Very low	23.4	Very low	50 Å²	50	114.9 Å²	114.9	30%	0.303	63%	0.626	S	S	.	*			trans	-77.4	94.3	177.7	-173	0	0	0	0	108.8	L974 I976 G993 I997	L974-V995 HydrophobicContact CD2-CB 3.97Å; L974-V995 HydrophobicContact CD2-CG1 4.42Å; L974-V995 HydrophobicContact CD2-CG2 4.39Å; I976-V995 HydrophobicContact CD1-CG2 3.93Å; I976-V995 HydrophobicContact CG1-CG2 4.37Å; G993-V995 WeakPolarHBondContact O-CG2 3.11Å; G993-V995 PolarHBondContact O-N 3.35Å; V995-I997 HydrophobicContact CG1-CG1 4Å; V995-I997 PolarHBondContact O-N 3.45Å
996	S	23.2	Very low	23.1	Very low	107 Å²	107	113.9 Å²	113.9	75%	0.748	62%	0.62	S	S	*	*			trans	-73	104.3	163.2	170.9	0	0	0	0	108.3	C994 G998	C994-S996 PolarHBondContact O-N 3.46Å; S996-G998 PolarHBondContact O-N 3.12Å
997	I	23.7	Very low	22.9	Very low	66 Å²	66	110.3 Å²	110.3	34%	0.338	62%	0.616	S	S	.	*			trans	-75.7	74.5	172.3	-56.7	173.7	0	0	0	107.7	C966 V995	C966-I997 VanDerWaalsContact O-CD1 3.3Å; C966-I997 WeakPolarHBondContact O-CD1 3.42Å; V995-I997 HydrophobicContact CG1-CG1 4Å; V995-I997 PolarHBondContact O-N 3.45Å
998	G	21.5	Very low	22.9	Very low	47 Å²	47	111.8 Å²	111.8	49%	0.485	62%	0.622	S	S	.	*			trans	-68	146.4	171.8	0	0	0	0	0	111.1	S996 R1000	S996-G998 PolarHBondContact O-N 3.12Å; G998-R1000 PolarHBondContact O-N 3.38Å
999	N	24.2	Very low	22.7	Very low	158 Å²	158	112.5 Å²	112.5	85%	0.845	64%	0.643	S	S	*	*	S	Bend	trans	-65.5	39	-166.2	-141.1	3.2	0	0	0	116.6
1000	R	21.5	Very low	22.6	Very low	215 Å²	215	111.3 Å²	111.3	81%	0.811	65%	0.65	S	S	*	*			trans	-127.6	127.6	-177.6	-68.5	-167.6	177.8	-170.1	0.9	112	G998 Y1002	G998-R1000 PolarHBondContact O-N 3.38Å; R1000-Y1002 VanDerWaalsContact C-N 3.25Å; R1000-Y1002 PolarHBondContact O-N 2.87Å
1001	P	21.9	Very low	22.5	Very low	118 Å²	118	124.1 Å²	124.1	77%	0.766	69%	0.693	S	S	*	*			trans	-83.3	39.6	-167.6	35.1	-36.9	0	0	0	114.6
1002	Y	20.8	Very low	22.3	Very low	180 Å²	180	127.1 Å²	127.1	71%	0.706	71%	0.708	S	S	*	*			trans	-124.7	124.3	-175.9	-63.1	-81.8	0	0	0	111.4	R1000	R1000-Y1002 VanDerWaalsContact C-N 3.25Å; R1000-Y1002 PolarHBondContact O-N 2.87Å
1003	I	21.2	Very low	22.2	Very low	153 Å²	153	129.1 Å²	129.1	79%	0.785	71%	0.712	S	S	*	*			trans	36.1	120.7	145.5	-56.2	172.8	0	0	0	116.9	A1005	I1003-A1005 VanDerWaalsContact C-N 3.34Å; I1003-A1005 PolarHBondContact O-N 3.19Å
1004	F	21.5	Very low	22.1	Very low	170 Å²	170	133.6 Å²	133.6	75%	0.746	72%	0.724	S	S	*	*			trans	-59.2	91.5	161.4	-79.2	-94.8	0	0	0	110.1	I976	I976-F1004 HydrophobicContact CD1-CE1 4.25Å
1005	A	19.9	Very low	22	Very low	74 Å²	74	135.7 Å²	135.7	61%	0.612	73%	0.728	S	S	*	*			trans	-88.1	105.5	154.8	0	0	0	0	0	106.5	I1003 T1007	I1003-A1005 VanDerWaalsContact C-N 3.34Å; I1003-A1005 PolarHBondContact O-N 3.19Å; A1005-T1007 PolarHBondContact O-N 3.16Å
1006	L	21.9	Very low	21.8	Very low	119 Å²	119	141.1 Å²	141.1	62%	0.623	75%	0.754	S	S	*	*			trans	-61.6	91.3	161.9	-81.3	154.6	0	0	0	106.6	T978 Q1008	T978-L1006 HydrophobicContact CG2-CD1 4.01Å; T978-L1006 HydrophobicContact CG2-CD2 4.26Å; L1006-Q1008 VanDerWaalsContact C-N 3.35Å; L1006-Q1008 PolarHBondContact O-N 3Å
1007	T	20.7	Very low	21.7	Very low	131 Å²	131	143.3 Å²	143.3	80%	0.804	76%	0.755	S	S	*	*			trans	-67.9	98.3	172.2	35.2	0	0	0	0	108.2	A1005 G1009	A1005-T1007 PolarHBondContact O-N 3.16Å; T1007-G1009 PolarHBondContact O-N 2.92Å
1008	Q	21.5	Very low	21.5	Very low	195 Å²	195	148.9 Å²	148.9	91%	0.911	78%	0.784	S	S	*	*			trans	-44.2	125.9	155.3	-101.5	177.5	-15.8	0	0	109	L1006	L1006-Q1008 VanDerWaalsContact C-N 3.35Å; L1006-Q1008 PolarHBondContact O-N 3Å
1009	G	20.6	Very low	21.5	Very low	80 Å²	80	156.7 Å²	156.7	83%	0.825	81%	0.807	S	S	*	*			trans	106	81.6	161.4	0	0	0	0	0	116.2	T1007	T1007-G1009 PolarHBondContact O-N 2.92Å
1010	S	21.5	Very low	21.3	Very low	120 Å²	120	156.6 Å²	156.6	84%	0.839	80%	0.804	S	S	*	*			trans	-127	116.3	132	57.8	0	0	0	0	106.7
1011	R	22.7	Very low	21.3	Very low	324 Å²	324	151.3 Å²	151.3	100%	1.223	80%	0.803	S	S	*	*			trans	-47.3	0	-177.4	-78.1	179.1	171.7	177.6	-3.3	114.8

Retrieved 1,011 of 1,011 residues in 627.2 ms (Link to these results)

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