A0A3Q0KV17_SCHMA Loading...

Ras-associating domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KV17, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,220 aa.

						>A0A3Q0KV17_SCHMA|A0A3Q0KV17
MIEQRNHNNETHRILIYTDLAQGTEVTQIYTISSKDTVKDVIKQILARNHLSLKDPNLFYLTYRRQTNNENITTTTTNKNNKHIKSKQQGLHGDLYESMEVNALTSGIWSLNQNSKEIDVTLYSDAILSRTLDLTKDNRLTLHMQTGGVLKIYDSCFSNPASIRQFHIAKTTCSEELIDLILTVTCSSDPVTDYCLVEEGINEEGRILRPKDYPLLIVQNSQSLGVLVLRKKQDALLMCKRRSAWMNKTKPYFRRSLRDKGTRTPSPVKQTLTQRLNPFPCIFKGLSKSRILENISCETLPSLDKVEFIESESNTNQANGNECIDDKRPRPISTKPLPLKYMNDLDSEDKFEIFSPSHNNNNNGFDKLGYNSQTLPFYNRLNAIRSTSNNDHVASEWSLAPSETHHIMKATSTTPPLPPKSTNSRGRYINGIQHRQYNSYHPSFYEKQSNEQHRQCSSVTEGNKICKPERSASPILAFDANRMCESRQSAVRFQENTNTSGIWTKENECSLEDTTRTAQINGFKPKVFIDRAQSSDSIQTFTPADWDDKTTSHEKVTDSANVGTTYDNGCSNTVTEYDVPADNYVDWKHSIPPPILYDSYSKQKCSDKPNNDYCINRRPSYDINSTQLCEKKPQIQQKKHQRGDRSEENKHGSDIQAHIDFCSKTNGDYDQSLNDFHPTKSDLDRIKLQNSYTQMNSPTKLILNTYNTNNSLELQGMKEIKSFETITTSQSCEDFSLYRHQFMSNSQNNFQNESYSSTSHLSVPTPFHDSDVSVSMVSRENMLTLATELPIQPNEFKQYETHLDFLPNTSVHNNHSNDSGNNNNNLSTLFQQRPSSQVHKLFTYNFEAINNHINSQSSLELTSIENGREATLNNSSHLKHEKKSSYSKKHDRTGILVHGCKKTNASSSDIESVESYPSLFDVLHHCDIYRVILDPNLPSLSDQLGLRLCLTKFPLDDVQRADTLQKLQNNEIFDIKSSDGSVETMNTMNSPKGPKPYIGPRNNGTFKPIEMKRSDMAFDVVTIESIEPDSPASFEGSLAPGHIILEVDGKDLLHPKCLKDGYGNKLNILTIAQNQLRAARQAALNGEIPPIRITAAQYHNNFGLANIVNNLERLSVRPKNGLNRNMHTTTNHNTFDKLYKTNGIINENDQQYTDFDPINENSQSFKTSDPSEINSKYTISEITNSGEDLLELLKSKLIWFSRNQQIQSYQSSFDPRCLEN
					

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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	28.4	Very low	40.6	Very low	215 Å²	215	143.9 Å²	143.9	100%	1.059	71%	0.707	S	S	*	*				0	166.5	0	-64.5	93	76.9	0	0	109.5
2	I	26.8	Very low	42.9	Very low	163 Å²	163	137.6 Å²	137.6	84%	0.836	67%	0.674	S	S	*	*			trans	-115.4	94.2	166	-59.6	173.5	0	0	0	106.1	Q4	I2-Q4 PolarHBondContact O-N 2.96Å
3	E	28.2	Very low	45.1	Very low	156 Å²	156	141.1 Å²	141.1	73%	0.729	68%	0.675	S	S	*	*			trans	-81.6	107.7	169.9	-71.1	-169.9	135.8	0	0	108.8	R5	E3-R5 PolarHBondContact O-N 3.16Å; E3-R5 VanDerWaalsContact O-N 3.1Å
4	Q	30	Very low	47	Very low	173 Å²	173	131.6 Å²	131.6	81%	0.808	63%	0.63	S	S	*	*			trans	-69.2	101	161.9	-70.8	-179.9	-37.9	0	0	107.7	I2 N6	I2-Q4 PolarHBondContact O-N 2.96Å; Q4-N6 PolarHBondContact O-N 3.36Å
5	R	34.3	Very low	48.8	Very low	184 Å²	184	126.4 Å²	126.4	69%	0.694	61%	0.607	S	S	*	*			trans	-62.3	122.9	171.8	-73.2	-172.1	179.4	170	0.5	109.1	E3 H7	E3-R5 PolarHBondContact O-N 3.16Å; E3-R5 VanDerWaalsContact O-N 3.1Å; R5-H7 VanDerWaalsContact C-N 3.34Å; R5-H7 PolarHBondContact O-N 2.92Å
6	N	32.6	Very low	50.5	Low	137 Å²	137	118.5 Å²	118.5	73%	0.733	57%	0.569	S	S	*	*			trans	-76.3	82.9	178.2	-77.4	-48.9	0	0	0	110.3	Q4 N8	Q4-N6 PolarHBondContact O-N 3.36Å; N6-N8 PolarHBondContact O-N 3.26Å
7	H	44.2	Very low	51.7	Low	124 Å²	124	113.7 Å²	113.7	57%	0.574	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	9.8	-179.3	-71.8	-52.6	0	0	0	116.8	R5 N9 E10 S34	R5-H7 VanDerWaalsContact C-N 3.34Å; R5-H7 PolarHBondContact O-N 2.92Å; H7-N9 PolarHBondContact O-N 3.4Å; H7-E10 IonicContact CE1-OE2 3.89Å; H7-E10 IonicContact CG-OE2 3.94Å; H7-E10 IonicContact ND1-OE2 2.96Å; H7-E10 PolarHBondContact ND1-OE2 3.42Å; H7-S34 PolarHBondContact O-OG 3.3Å
8	N	47.4	Very low	52.6	Low	127 Å²	127	107.4 Å²	107.4	68%	0.679	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-10.6	-164.9	-76.5	-14.7	0	0	0	115.6	N6	N6-N8 PolarHBondContact O-N 3.26Å
9	N	52.2	Low	53.1	Low	133 Å²	133	107.7 Å²	107.7	71%	0.711	52%	0.519	S	S	*	.	S	Bend	trans	-156.3	27.5	179.8	-99.1	-20.4	0	0	0	114.8	H7 T11	H7-N9 PolarHBondContact O-N 3.4Å; N9-T11 PolarHBondContact O-N 3.1Å
10	E	57.9	Low	53	Low	69 Å²	69	105.4 Å²	105.4	32%	0.322	51%	0.509	S	S	.	.			trans	-75.2	89.8	-177.5	-63.6	178.1	131	0	0	112.1	H7 H12	H7-E10 IonicContact CE1-OE2 3.89Å; H7-E10 IonicContact CG-OE2 3.94Å; H7-E10 IonicContact ND1-OE2 2.96Å; H7-E10 PolarHBondContact ND1-OE2 3.42Å; E10-H12 PolarHBondContact O-N 3.43Å; E10-H12 PolarHBondContact O-ND1 3.39Å
11	T	64.9	Low	52.4	Low	102 Å²	102	102.1 Å²	102.1	63%	0.626	50%	0.499	S	S	*	.			trans	-75.4	114.1	172.8	56	0	0	0	0	111.1	N9 I32	N9-T11 PolarHBondContact O-N 3.1Å; T11-I32 CarbonylContact C-O 3.6Å; T11-I32 WeakPolarHBondContact CA-O 3.48Å
12	H	67.3	Low	52.9	Low	68 Å²	68	98.3 Å²	98.3	32%	0.315	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	143.1	-179.9	-70.2	66.9	0	0	0	110.8	E10 I14 T31 I32	E10-H12 PolarHBondContact O-N 3.43Å; E10-H12 PolarHBondContact O-ND1 3.39Å; H12-I14 HydrophobicContact CB-CD1 4.07Å; H12-I14 HydrophobicContact CB-CG1 4.03Å; H12-T31 WeakPolarHBondContact O-CA 3.25Å; H12-I32 PolarHBondContact N-O 2.88Å; H12-I32 PolarHBondContact O-N 3.4Å
13	R	71.7	Confident	53.6	Low	183 Å²	183	94 Å²	94	69%	0.691	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.2	114.8	170.7	-69.4	-173.2	71.7	-174.4	1.6	108.7	I29 Y30 T31	R13-I29 HydrophobicContact CB-CG2 4.05Å; R13-Y30 WeakPolarHBondContact CA-O 3.39Å; R13-T31 HydrophobicContact CG-CG2 4.11Å
14	I	71.7	Confident	54.3	Low	8 Å²	8	90.9 Å²	90.9	4%	0.041	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	140.5	-168.5	-37	-169.4	0	0	0	109.9	H12 I29 Y30 I32 L134 L140	H12-I14 HydrophobicContact CB-CD1 4.07Å; H12-I14 HydrophobicContact CB-CG1 4.03Å; I14-I29 WeakPolarHBondContact O-CA 3.41Å; I14-Y30 PolarHBondContact N-O 2.83Å; I14-Y30 PolarHBondContact O-N 3.41Å; I14-I32 HydrophobicContact CB-CD1 4.09Å; I14-I32 HydrophobicContact CD1-CB 4.03Å; I14-I32 HydrophobicContact CD1-CD1 3.63Å; I14-I32 HydrophobicContact CD1-CG1 4.32Å; I14-I32 HydrophobicContact CD1-CG2 4.31Å; I14-I32 HydrophobicContact CG1-CB 4.4Å; I14-I32 HydrophobicContact CG1-CD1 3.9Å; I14-I32 HydrophobicContact CG1-CG1 4.48Å; I14-L134 HydrophobicContact CD1-CB 4.22Å; I14-L134 HydrophobicContact CD1-CD1 3.66Å; I14-L134 HydrophobicContact CD1-CD2 3.86Å; I14-L134 HydrophobicContact CD1-CG 4.09Å; I14-L140 HydrophobicContact CG2-CD1 3.73Å; I14-L140 HydrophobicContact CG2-CG 4.29Å
15	L	73.8	Confident	55.5	Low	54 Å²	54	88.9 Å²	88.9	28%	0.283	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	116.4	-179.6	-158.6	68.1	0	0	0	108.8	Y17 T27 I29	L15-Y17 HydrophobicContact CD2-CE2 4Å; L15-Y17 WeakPolarHBondContact CD2-OH 3.44Å; L15-Y17 HydrophobicContact CG-CE2 4.22Å; L15-T27 HydrophobicContact CD1-CG2 3.56Å; L15-T27 HydrophobicContact CD2-CG2 3.84Å; L15-T27 HydrophobicContact CG-CG2 3.5Å; L15-T27 VanDerWaalsContact CG-CG2 3.5Å; L15-I29 HydrophobicContact CD1-CD1 4.38Å; L15-I29 HydrophobicContact CD1-CG1 3.58Å
16	I	76.5	Confident	56.9	Low	0 Å²	0	83 Å²	83	0%	0	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	121.1	178.5	-52.7	-173.4	0	0	0	108.5	T18 Q28 Y30 I32 V41 I45 L61 L140	I16-T18 HydrophobicContact CG2-CG2 4.13Å; I16-Q28 PolarHBondContact N-O 3.07Å; I16-Q28 PolarHBondContact O-N 2.97Å; I16-Y30 HydrophobicContact CB-CD2 4Å; I16-Y30 HydrophobicContact CB-CE2 4.31Å; I16-Y30 HydrophobicContact CD1-CD2 3.72Å; I16-Y30 HydrophobicContact CD1-CE2 4.48Å; I16-Y30 HydrophobicContact CD1-CG 4.1Å; I16-Y30 HydrophobicContact CG1-CD2 3.92Å; I16-I32 HydrophobicContact CD1-CD1 4.33Å; I16-V41 HydrophobicContact CD1-CG1 3.56Å; I16-I45 HydrophobicContact CD1-CD1 3.88Å; I16-I45 HydrophobicContact CD1-CG1 4.41Å; I16-I45 HydrophobicContact CG2-CD1 4.07Å; I16-L61 HydrophobicContact CG2-CD2 4.12Å; I16-L140 WeakPolarHBondContact CA-O 3.48Å; I16-L140 HydrophobicContact CD1-CD1 4.5Å; I16-L140 HydrophobicContact CG1-CB 4.21Å; I16-L140 HydrophobicContact CG1-CD1 4.34Å
17	Y	71.8	Confident	58.7	Low	37 Å²	37	79.4 Å²	79.4	15%	0.145	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	119	174.6	-63.1	-98	0	0	0	107.8	L15 T27 R139 L140 T141 L142	L15-Y17 HydrophobicContact CD2-CE2 4Å; L15-Y17 WeakPolarHBondContact CD2-OH 3.44Å; L15-Y17 HydrophobicContact CG-CE2 4.22Å; Y17-T27 HydrophobicContact CD1-CG2 4.08Å; Y17-T27 WeakPolarHBondContact CD1-OG1 3.3Å; Y17-T27 HydrophobicContact CE1-CG2 3.92Å; Y17-R139 HydrophobicContact CD2-CB 4.2Å; Y17-R139 HydrophobicContact CD2-CG 4.45Å; Y17-R139 HydrophobicContact CE2-CB 3.95Å; Y17-R139 HydrophobicContact CE2-CG 3.76Å; Y17-L140 PolarHBondContact N-O 3.43Å; Y17-T141 WeakPolarHBondContact O-CA 3.48Å; Y17-L142 PolarHBondContact O-N 3.4Å
18	T	67.6	Low	60.3	Low	1 Å²	1	75.1 Å²	75.1	1%	0.006	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	111.1	-179	63.7	0	0	0	0	110.6	I16 L20 V26 I45 L142	I16-T18 HydrophobicContact CG2-CG2 4.13Å; T18-L20 HydrophobicContact CG2-CD1 4.13Å; T18-L20 PolarHBondContact O-N 3.06Å; T18-V26 PolarHBondContact N-O 2.77Å; T18-V26 PolarHBondContact OG1-O 2.76Å; T18-I45 HydrophobicContact CG2-CG2 4.17Å; T18-L142 HydrophobicContact CG2-CB 4.02Å; T18-L142 HydrophobicContact CG2-CD2 4.05Å
19	D	61.7	Low	61.8	Low	113 Å²	113	72.7 Å²	72.7	60%	0.604	39%	0.391	S	S	*	.			trans	-77.6	58.4	166.7	-173.6	14.7	0	0	0	110	A21	D19-A21 PolarHBondContact O-N 3.47Å; D19-A21 VanDerWaalsContact O-N 3.07Å
20	L	52	Low	63.2	Low	61 Å²	61	66.6 Å²	66.6	32%	0.319	36%	0.358	S	S	.	.			trans	-87.4	54	178.8	-74.5	171.1	0	0	0	110.7	T18 I45 F59 L142	T18-L20 HydrophobicContact CG2-CD1 4.13Å; T18-L20 PolarHBondContact O-N 3.06Å; L20-I45 HydrophobicContact CD1-CG2 4.42Å; L20-F59 HydrophobicContact CD2-CE1 4.11Å; L20-L142 HydrophobicContact CD1-CD2 3.99Å; L20-L142 HydrophobicContact CD2-CD2 4.13Å; L20-L142 HydrophobicContact CG-CD2 4.12Å
21	A	39	Very low	64.3	Low	36 Å²	36	67.4 Å²	67.4	30%	0.298	37%	0.368	S	S	.	.	S	Bend	trans	78.5	155.5	177.2	0	0	0	0	0	117.7	D19	D19-A21 PolarHBondContact O-N 3.47Å; D19-A21 VanDerWaalsContact O-N 3.07Å
22	Q	39.4	Very low	64.9	Low	135 Å²	135	62.6 Å²	62.6	63%	0.631	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	24.4	172	-58.2	-176.7	-81.3	0	0	116.8	T24	Q22-T24 PolarHBondContact O-N 2.73Å
23	G	40.8	Very low	65.4	Low	73 Å²	73	60.8 Å²	60.8	75%	0.753	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	15	163.4	0	0	0	0	0	115.3
24	T	43.5	Very low	65.2	Low	90 Å²	90	53.2 Å²	53.2	55%	0.552	31%	0.308	S	S	*	.			trans	-105.7	116.8	171.6	39.3	0	0	0	0	107.7	Q22 V26	Q22-T24 PolarHBondContact O-N 2.73Å; T24-V26 PolarHBondContact O-N 3.49Å
25	E	56.4	Low	65.5	Low	131 Å²	131	60.2 Å²	60.2	61%	0.612	34%	0.338	S	S	*	.			trans	-69.3	80.9	179.1	-69.5	-171.2	169.9	0	0	110.6	T27	E25-T27 PolarHBondContact O-N 3.48Å; E25-T27 PolarHBondContact O-OG1 2.96Å
26	V	63.6	Low	65.9	Low	60 Å²	60	59.1 Å²	59.1	36%	0.364	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	107.2	176	172.8	0	0	0	0	108	T18 T24 Q28	T18-V26 PolarHBondContact N-O 2.77Å; T18-V26 PolarHBondContact OG1-O 2.76Å; T24-V26 PolarHBondContact O-N 3.49Å; V26-Q28 HydrophobicContact CG1-CG 3.98Å; V26-Q28 VanDerWaalsContact CG1-NE2 3.28Å
27	T	70.5	Confident	66.3	Low	62 Å²	62	60.5 Å²	60.5	38%	0.38	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	113.5	-171.2	-58.1	0	0	0	0	108.8	L15 Y17 E25	L15-T27 HydrophobicContact CD1-CG2 3.56Å; L15-T27 HydrophobicContact CD2-CG2 3.84Å; L15-T27 HydrophobicContact CG-CG2 3.5Å; L15-T27 VanDerWaalsContact CG-CG2 3.5Å; Y17-T27 HydrophobicContact CD1-CG2 4.08Å; Y17-T27 WeakPolarHBondContact CD1-OG1 3.3Å; Y17-T27 HydrophobicContact CE1-CG2 3.92Å; E25-T27 PolarHBondContact O-N 3.48Å; E25-T27 PolarHBondContact O-OG1 2.96Å
28	Q	76.3	Confident	66.9	Low	34 Å²	34	58.8 Å²	58.8	16%	0.159	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	141	-172.6	-67.5	-176.1	20.8	0	0	111.6	I16 V26 Y30 N49	I16-Q28 PolarHBondContact N-O 3.07Å; I16-Q28 PolarHBondContact O-N 2.97Å; V26-Q28 HydrophobicContact CG1-CG 3.98Å; V26-Q28 VanDerWaalsContact CG1-NE2 3.28Å; Q28-Y30 HydrophobicContact CB-CD2 4.35Å; Q28-Y30 HydrophobicContact CB-CE2 3.6Å; Q28-Y30 PolarHBondContact OE1-OH 2.88Å; Q28-N49 PolarHBondContact NE2-OD1 3.45Å; Q28-N49 PolarHBondContact OE1-ND2 2.98Å
29	I	80.2	Confident	67.8	Low	76 Å²	76	60.6 Å²	60.6	39%	0.39	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	124	178.9	-59.4	170.3	0	0	0	110.1	R13 I14 L15 R48	R13-I29 HydrophobicContact CB-CG2 4.05Å; I14-I29 WeakPolarHBondContact O-CA 3.41Å; L15-I29 HydrophobicContact CD1-CD1 4.38Å; L15-I29 HydrophobicContact CD1-CG1 3.58Å; I29-R48 PolarHBondContact O-NH1 2.8Å
30	Y	80.1	Confident	69	Low	6 Å²	6	58.2 Å²	58.2	2%	0.024	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	148.9	176	-70.9	-89.9	0	0	0	111.9	R13 I14 I16 Q28 Q44 I45 R48 N49	R13-Y30 WeakPolarHBondContact CA-O 3.39Å; I14-Y30 PolarHBondContact N-O 2.83Å; I14-Y30 PolarHBondContact O-N 3.41Å; I16-Y30 HydrophobicContact CB-CD2 4Å; I16-Y30 HydrophobicContact CB-CE2 4.31Å; I16-Y30 HydrophobicContact CD1-CD2 3.72Å; I16-Y30 HydrophobicContact CD1-CE2 4.48Å; I16-Y30 HydrophobicContact CD1-CG 4.1Å; I16-Y30 HydrophobicContact CG1-CD2 3.92Å; Q28-Y30 HydrophobicContact CB-CD2 4.35Å; Q28-Y30 HydrophobicContact CB-CE2 3.6Å; Q28-Y30 PolarHBondContact OE1-OH 2.88Å; Y30-Q44 HydrophobicContact CD1-CB 4.15Å; Y30-Q44 HydrophobicContact CE1-CB 4.32Å; Y30-I45 HydrophobicContact CD1-CG1 4.23Å; Y30-I45 HydrophobicContact CD2-CG1 4.2Å; Y30-I45 HydrophobicContact CE1-CB 4.27Å; Y30-I45 HydrophobicContact CE1-CG1 3.76Å; Y30-I45 HydrophobicContact CE2-CG1 3.7Å; Y30-I45 HydrophobicContact CG-CG1 4.44Å; Y30-I45 VanDerWaalsContact CZ-CG1 3.46Å; Y30-I45 WeakPolarHBondContact OH-CA 3.44Å; Y30-R48 HydrophobicContact CE1-CB 4.16Å; Y30-R48 WeakPolarHBondContact OH-CD 3.25Å; Y30-N49 PolarHBondContact OH-ND2 2.91Å
31	T	80.7	Confident	70.7	Confident	86 Å²	86	55.3 Å²	55.3	53%	0.528	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	116	175.7	43.8	0	0	0	0	109.2	H12 R13 Q44	H12-T31 WeakPolarHBondContact O-CA 3.25Å; R13-T31 HydrophobicContact CG-CG2 4.11Å; T31-Q44 PolarHBondContact O-OE1 3.29Å
32	I	77.9	Confident	73	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	121.6	-168.7	-65.7	172.6	0	0	0	108.5	T11 H12 I14 I16 D36 V41 L128	T11-I32 CarbonylContact C-O 3.6Å; T11-I32 WeakPolarHBondContact CA-O 3.48Å; H12-I32 PolarHBondContact N-O 2.88Å; H12-I32 PolarHBondContact O-N 3.4Å; I14-I32 HydrophobicContact CB-CD1 4.09Å; I14-I32 HydrophobicContact CD1-CB 4.03Å; I14-I32 HydrophobicContact CD1-CD1 3.63Å; I14-I32 HydrophobicContact CD1-CG1 4.32Å; I14-I32 HydrophobicContact CD1-CG2 4.31Å; I14-I32 HydrophobicContact CG1-CB 4.4Å; I14-I32 HydrophobicContact CG1-CD1 3.9Å; I14-I32 HydrophobicContact CG1-CG1 4.48Å; I16-I32 HydrophobicContact CD1-CD1 4.33Å; I32-D36 WeakPolarHBondContact CA-OD2 3.37Å; I32-D36 HydrophobicContact CG2-CB 4.18Å; I32-V41 HydrophobicContact CD1-CB 4.44Å; I32-V41 HydrophobicContact CD1-CG1 3.8Å; I32-V41 HydrophobicContact CD1-CG2 3.72Å; I32-V41 HydrophobicContact CG1-CG1 4.39Å; I32-V41 HydrophobicContact CG1-CG2 3.7Å; I32-V41 HydrophobicContact CG2-CG2 4.12Å; I32-L128 HydrophobicContact CD1-CD1 4.01Å; I32-L128 HydrophobicContact CG2-CB 4.44Å; I32-L128 HydrophobicContact CG2-CD1 4.07Å
33	S	77.5	Confident	75.3	Confident	29 Å²	29	51.7 Å²	51.7	20%	0.203	29%	0.29	C	S	.	.			trans	-78.8	160	178.9	-170.1	0	0	0	0	111.7	K35 D36	S33-K35 PolarHBondContact O-N 3.2Å; S33-D36 WeakPolarHBondContact CB-OD1 3.46Å; S33-D36 PolarHBondContact N-OD2 2.89Å; S33-D36 PolarHBondContact O-N 2.84Å
34	S	69.2	Low	77.5	Confident	24 Å²	24	51.1 Å²	51.1	17%	0.168	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-0.9	173.8	66.7	0	0	0	0	114.3	H7 S129	H7-S34 PolarHBondContact O-OG 3.3Å; S34-S129 PolarHBondContact O-OG 3.47Å
35	K	78.2	Confident	79.6	Confident	155 Å²	155	46.9 Å²	46.9	67%	0.674	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113.6	-10.1	178	-62.5	174.7	-175.3	168.9	0	114.3	S33	S33-K35 PolarHBondContact O-N 3.2Å
36	D	81.7	Confident	81.1	Confident	31 Å²	31	40.9 Å²	40.9	17%	0.166	21%	0.214	C	C	.	.			trans	-74.6	134.6	-171.3	-65.4	-9	0	0	0	111.4	I32 S33 D40 V41 L128	I32-D36 WeakPolarHBondContact CA-OD2 3.37Å; I32-D36 HydrophobicContact CG2-CB 4.18Å; S33-D36 WeakPolarHBondContact CB-OD1 3.46Å; S33-D36 PolarHBondContact N-OD2 2.89Å; S33-D36 PolarHBondContact O-N 2.84Å; D36-D40 HydrophobicContact CB-CB 4.39Å; D36-V41 HydrophobicContact CB-CG2 4.31Å; D36-L128 PolarHBondContact O-N 3.26Å
37	T	84.6	Confident	82.1	Confident	30 Å²	30	40.8 Å²	40.8	18%	0.184	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-82.5	161.4	169.2	67.9	0	0	0	0	111.2	K39 D40 V41 S124 A126 I127	T37-K39 PolarHBondContact O-N 3Å; T37-K39 WeakPolarHBondContact OG1-CB 3.47Å; T37-K39 PolarHBondContact OG1-N 2.86Å; T37-D40 WeakPolarHBondContact CB-OD2 3.42Å; T37-D40 PolarHBondContact N-OD2 3.35Å; T37-D40 PolarHBondContact O-N 2.87Å; T37-D40 PolarHBondContact OG1-N 3.35Å; T37-D40 VanDerWaalsContact OG1-N 3.13Å; T37-D40 PolarHBondContact OG1-OD2 3.22Å; T37-V41 PolarHBondContact O-N 3.24Å; T37-S124 WeakPolarHBondContact CB-O 3.42Å; T37-A126 CarbonylContact C-O 3.51Å; T37-A126 WeakPolarHBondContact CA-O 3.23Å; T37-I127 HydrophobicContact CG2-CG1 4.17Å
38	V	84.2	Confident	82.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-50.7	-38.9	167.6	164.8	0	0	0	0	111	V41 I42 L61 L122 Y123 S124 A126 L128	V38-V41 PolarHBondContact O-N 3.21Å; V38-I42 HydrophobicContact CG1-CD1 3.61Å; V38-I42 HydrophobicContact CG1-CG1 4.33Å; V38-I42 WeakPolarHBondContact O-CB 3.14Å; V38-I42 VanDerWaalsContact O-CG1 3.25Å; V38-I42 WeakPolarHBondContact O-CG1 3.49Å; V38-I42 PolarHBondContact O-N 3.21Å; V38-L61 HydrophobicContact CG1-CB 4.43Å; V38-L61 HydrophobicContact CG1-CD1 4.14Å; V38-L61 HydrophobicContact CG1-CG 4.22Å; V38-L61 HydrophobicContact CG2-CD1 4.4Å; V38-L122 HydrophobicContact CG2-CB 3.94Å; V38-Y123 WeakPolarHBondContact CB-O 3.24Å; V38-S124 PolarHBondContact N-O 3.27Å; V38-A126 HydrophobicContact CG2-CB 3.94Å; V38-A126 WeakPolarHBondContact CG2-O 3.42Å; V38-A126 PolarHBondContact N-O 2.93Å; V38-L128 HydrophobicContact CG2-CD2 3.68Å; V38-L128 HydrophobicContact CG2-CG 3.93Å
39	K	86.7	Confident	83	Confident	40 Å²	40	45.4 Å²	45.4	17%	0.174	23%	0.231	C	C	.	.	H	α-helix	trans	-63.9	-39.1	176.3	-161.6	-177	-163.9	167.3	0	113.1	T37 I42 K43 P56 N57 S124 E176	T37-K39 PolarHBondContact O-N 3Å; T37-K39 WeakPolarHBondContact OG1-CB 3.47Å; T37-K39 PolarHBondContact OG1-N 2.86Å; K39-I42 PolarHBondContact O-N 3.48Å; K39-K43 WeakPolarHBondContact O-CB 3.41Å; K39-K43 WeakPolarHBondContact O-CG 3.47Å; K39-K43 PolarHBondContact O-N 2.91Å; K39-P56 HydrophobicContact CG-CB 4.49Å; K39-N57 WeakPolarHBondContact CE-OD1 3.45Å; K39-S124 WeakPolarHBondContact CB-O 3.36Å; K39-S124 PolarHBondContact N-O 3.32Å; K39-E176 WeakPolarHBondContact CE-OE1 3.46Å; K39-E176 IonicContact NZ-OE1 3.68Å; K39-E176 PolarHBondContact NZ-OE1 2.98Å
40	D	87.1	Confident	83.1	Confident	63 Å²	63	50.1 Å²	50.1	34%	0.337	25%	0.251	S	S	.	.	H	α-helix	trans	-68.2	-40.4	176.9	-58.4	-51.5	0	0	0	110.6	D36 T37 K43 Q44	D36-D40 HydrophobicContact CB-CB 4.39Å; T37-D40 WeakPolarHBondContact CB-OD2 3.42Å; T37-D40 PolarHBondContact N-OD2 3.35Å; T37-D40 PolarHBondContact O-N 2.87Å; T37-D40 PolarHBondContact OG1-N 3.35Å; T37-D40 VanDerWaalsContact OG1-N 3.13Å; T37-D40 PolarHBondContact OG1-OD2 3.22Å; D40-K43 WeakPolarHBondContact O-CB 3.36Å; D40-K43 PolarHBondContact O-N 3.27Å; D40-Q44 WeakPolarHBondContact O-CG 3.32Å; D40-Q44 PolarHBondContact O-N 3.38Å
41	V	86.7	Confident	83.3	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-65	-41.6	173.4	178	0	0	0	0	111.5	I16 I32 D36 T37 V38 Q44 I45 L61 L128	I16-V41 HydrophobicContact CD1-CG1 3.56Å; I32-V41 HydrophobicContact CD1-CB 4.44Å; I32-V41 HydrophobicContact CD1-CG1 3.8Å; I32-V41 HydrophobicContact CD1-CG2 3.72Å; I32-V41 HydrophobicContact CG1-CG1 4.39Å; I32-V41 HydrophobicContact CG1-CG2 3.7Å; I32-V41 HydrophobicContact CG2-CG2 4.12Å; D36-V41 HydrophobicContact CB-CG2 4.31Å; T37-V41 PolarHBondContact O-N 3.24Å; V38-V41 PolarHBondContact O-N 3.21Å; V41-Q44 WeakPolarHBondContact O-CB 3.28Å; V41-Q44 PolarHBondContact O-N 3.26Å; V41-I45 HydrophobicContact CG1-CD1 4.05Å; V41-I45 VanDerWaalsContact O-CG1 3.26Å; V41-I45 WeakPolarHBondContact O-CG1 3.29Å; V41-I45 PolarHBondContact O-N 3.38Å; V41-L61 HydrophobicContact CG1-CD1 4.26Å; V41-L128 HydrophobicContact CB-CD1 4.29Å; V41-L128 HydrophobicContact CG2-CD1 3.67Å
42	I	88	Confident	83.4	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-61.9	-42.9	172.3	-71.8	166.4	0	0	0	110.9	V38 K39 Q44 I45 L46 P56 F59 L142	V38-I42 HydrophobicContact CG1-CD1 3.61Å; V38-I42 HydrophobicContact CG1-CG1 4.33Å; V38-I42 WeakPolarHBondContact O-CB 3.14Å; V38-I42 VanDerWaalsContact O-CG1 3.25Å; V38-I42 WeakPolarHBondContact O-CG1 3.49Å; V38-I42 PolarHBondContact O-N 3.21Å; K39-I42 PolarHBondContact O-N 3.48Å; I42-Q44 VanDerWaalsContact C-N 3.32Å; I42-Q44 PolarHBondContact O-N 2.98Å; I42-I45 PolarHBondContact O-N 3.42Å; I42-I45 VanDerWaalsContact O-N 3.15Å; I42-L46 HydrophobicContact CG2-CD1 3.83Å; I42-L46 HydrophobicContact CG2-CG 4.24Å; I42-L46 WeakPolarHBondContact O-CB 3.5Å; I42-L46 WeakPolarHBondContact O-CG 3.47Å; I42-L46 PolarHBondContact O-N 3.06Å; I42-P56 HydrophobicContact CG2-CB 3.92Å; I42-F59 HydrophobicContact CD1-CB 4.08Å; I42-F59 WeakPolarHBondContact CD1-O 3.24Å; I42-F59 HydrophobicContact CG1-CB 4.41Å; I42-F59 HydrophobicContact CG2-CB 3.93Å; I42-F59 HydrophobicContact CG2-CD2 4.34Å; I42-F59 HydrophobicContact CG2-CG 4.44Å; I42-L142 HydrophobicContact CG1-CD1 4.02Å
43	K	88.4	Confident	83.6	Confident	94 Å²	94	56.5 Å²	56.5	41%	0.409	29%	0.286	S	S	.	.	H	α-helix	trans	-59.6	-40.9	173	-78.9	-174.8	171.6	-164.8	0	111.5	K39 D40 A47 P56 D179	K39-K43 WeakPolarHBondContact O-CB 3.41Å; K39-K43 WeakPolarHBondContact O-CG 3.47Å; K39-K43 PolarHBondContact O-N 2.91Å; D40-K43 WeakPolarHBondContact O-CB 3.36Å; D40-K43 PolarHBondContact O-N 3.27Å; K43-A47 VanDerWaalsContact O-CB 3.22Å; K43-A47 WeakPolarHBondContact O-CB 3.44Å; K43-A47 PolarHBondContact O-N 2.97Å; K43-P56 HydrophobicContact CG-CB 4.17Å; K43-P56 HydrophobicContact CG-CG 4.42Å; K43-D179 IonicContact NZ-OD2 3.44Å
44	Q	86.9	Confident	84	Confident	61 Å²	61	59.9 Å²	59.9	29%	0.285	30%	0.298	S	S	.	.	H	α-helix	trans	-63	-42.5	172.5	-69	-179.5	43.2	0	0	112.2	Y30 T31 D40 V41 I42 R48	Y30-Q44 HydrophobicContact CD1-CB 4.15Å; Y30-Q44 HydrophobicContact CE1-CB 4.32Å; T31-Q44 PolarHBondContact O-OE1 3.29Å; D40-Q44 WeakPolarHBondContact O-CG 3.32Å; D40-Q44 PolarHBondContact O-N 3.38Å; V41-Q44 WeakPolarHBondContact O-CB 3.28Å; V41-Q44 PolarHBondContact O-N 3.26Å; I42-Q44 VanDerWaalsContact C-N 3.32Å; I42-Q44 PolarHBondContact O-N 2.98Å; Q44-R48 VanDerWaalsContact O-CB 3.3Å; Q44-R48 WeakPolarHBondContact O-CB 3.5Å; Q44-R48 PolarHBondContact O-N 3.25Å
45	I	86.9	Confident	85	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-63.7	-48.3	178.3	-63.6	158.1	0	0	0	111.1	I16 T18 L20 Y30 V41 I42 R48 N49 L61 L142	I16-I45 HydrophobicContact CD1-CD1 3.88Å; I16-I45 HydrophobicContact CD1-CG1 4.41Å; I16-I45 HydrophobicContact CG2-CD1 4.07Å; T18-I45 HydrophobicContact CG2-CG2 4.17Å; L20-I45 HydrophobicContact CD1-CG2 4.42Å; Y30-I45 HydrophobicContact CD1-CG1 4.23Å; Y30-I45 HydrophobicContact CD2-CG1 4.2Å; Y30-I45 HydrophobicContact CE1-CB 4.27Å; Y30-I45 HydrophobicContact CE1-CG1 3.76Å; Y30-I45 HydrophobicContact CE2-CG1 3.7Å; Y30-I45 HydrophobicContact CG-CG1 4.44Å; Y30-I45 VanDerWaalsContact CZ-CG1 3.46Å; Y30-I45 WeakPolarHBondContact OH-CA 3.44Å; V41-I45 HydrophobicContact CG1-CD1 4.05Å; V41-I45 VanDerWaalsContact O-CG1 3.26Å; V41-I45 WeakPolarHBondContact O-CG1 3.29Å; V41-I45 PolarHBondContact O-N 3.38Å; I42-I45 PolarHBondContact O-N 3.42Å; I42-I45 VanDerWaalsContact O-N 3.15Å; I45-R48 PolarHBondContact O-N 2.69Å; I45-N49 PolarHBondContact O-N 3.19Å; I45-N49 VanDerWaalsContact O-N 3.09Å; I45-N49 PolarHBondContact O-ND2 2.93Å; I45-L61 HydrophobicContact CD1-CD2 4.42Å; I45-L142 HydrophobicContact CD1-CD1 4.11Å; I45-L142 HydrophobicContact CG2-CD2 4Å
46	L	87.1	Confident	85.5	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.026	26%	0.264	C	S	.	.	H	α-helix	trans	-64.3	-42.6	178.9	-68	174.7	0	0	0	111.5	I42 N49 H50 L51 S52 K54 P56 F59	I42-L46 HydrophobicContact CG2-CD1 3.83Å; I42-L46 HydrophobicContact CG2-CG 4.24Å; I42-L46 WeakPolarHBondContact O-CB 3.5Å; I42-L46 WeakPolarHBondContact O-CG 3.47Å; I42-L46 PolarHBondContact O-N 3.06Å; L46-N49 PolarHBondContact O-N 3.11Å; L46-H50 PolarHBondContact O-N 2.81Å; L46-L51 HydrophobicContact CB-CB 4.33Å; L46-L51 HydrophobicContact CD2-CB 3.72Å; L46-L51 HydrophobicContact CD2-CD1 4.32Å; L46-L51 CarbonylContact O-C 3.39Å; L46-L51 WeakPolarHBondContact O-CA 3.37Å; L46-L51 PolarHBondContact O-N 2.98Å; L46-S52 PolarHBondContact O-N 3.37Å; L46-K54 HydrophobicContact CD1-CB 4.48Å; L46-K54 HydrophobicContact CD2-CB 4.47Å; L46-P56 HydrophobicContact CD1-CB 4.17Å; L46-F59 HydrophobicContact CD1-CD2 4Å; L46-F59 HydrophobicContact CD1-CE2 4Å; L46-F59 HydrophobicContact CD2-CD2 4.15Å; L46-F59 HydrophobicContact CD2-CE2 3.66Å; L46-F59 HydrophobicContact CD2-CZ 3.88Å; L46-F59 HydrophobicContact CG-CE2 4.42Å
47	A	86	Confident	85.8	Confident	57 Å²	57	51.2 Å²	51.2	47%	0.471	26%	0.258	S	S	.	.	H	α-helix	trans	-61.7	-44.3	175.1	0	0	0	0	0	112.3	K43 N49 H50	K43-A47 VanDerWaalsContact O-CB 3.22Å; K43-A47 WeakPolarHBondContact O-CB 3.44Å; K43-A47 PolarHBondContact O-N 2.97Å; A47-N49 VanDerWaalsContact C-N 3.31Å; A47-N49 PolarHBondContact O-N 2.73Å; A47-H50 PolarHBondContact O-N 3.32Å
48	R	83.7	Confident	86	Confident	149 Å²	149	49.9 Å²	49.9	56%	0.562	25%	0.249	S	C	*	.	H	α-helix	trans	-64.1	-33.1	179.8	-174.4	172.1	-171.4	140	6.9	113.3	I29 Y30 Q44 I45	I29-R48 PolarHBondContact O-NH1 2.8Å; Y30-R48 HydrophobicContact CE1-CB 4.16Å; Y30-R48 WeakPolarHBondContact OH-CD 3.25Å; Q44-R48 VanDerWaalsContact O-CB 3.3Å; Q44-R48 WeakPolarHBondContact O-CB 3.5Å; Q44-R48 PolarHBondContact O-N 3.25Å; I45-R48 PolarHBondContact O-N 2.69Å
49	N	81.2	Confident	86.1	Confident	45 Å²	45	50.5 Å²	50.5	24%	0.241	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	19.5	-179.4	-63.9	-79.4	0	0	0	112.8	Q28 Y30 I45 L46 A47 L51	Q28-N49 PolarHBondContact NE2-OD1 3.45Å; Q28-N49 PolarHBondContact OE1-ND2 2.98Å; Y30-N49 PolarHBondContact OH-ND2 2.91Å; I45-N49 PolarHBondContact O-N 3.19Å; I45-N49 VanDerWaalsContact O-N 3.09Å; I45-N49 PolarHBondContact O-ND2 2.93Å; L46-N49 PolarHBondContact O-N 3.11Å; A47-N49 VanDerWaalsContact C-N 3.31Å; A47-N49 PolarHBondContact O-N 2.73Å; N49-L51 PolarHBondContact O-N 2.78Å
50	H	83.2	Confident	86.1	Confident	175 Å²	175	51.2 Å²	51.2	81%	0.81	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	23.5	179.6	-52.9	-70.2	0	0	0	115.5	L46 A47	L46-H50 PolarHBondContact O-N 2.81Å; A47-H50 PolarHBondContact O-N 3.32Å
51	L	83.2	Confident	86	Confident	60 Å²	60	48.2 Å²	48.2	31%	0.314	24%	0.238	S	C	.	.			trans	-104.2	20.3	179.1	-66.8	175.1	0	0	0	113.2	L46 N49 L53 K54	L46-L51 HydrophobicContact CB-CB 4.33Å; L46-L51 HydrophobicContact CD2-CB 3.72Å; L46-L51 HydrophobicContact CD2-CD1 4.32Å; L46-L51 CarbonylContact O-C 3.39Å; L46-L51 WeakPolarHBondContact O-CA 3.37Å; L46-L51 PolarHBondContact O-N 2.98Å; N49-L51 PolarHBondContact O-N 2.78Å; L51-L53 PolarHBondContact O-N 2.95Å; L51-K54 HydrophobicContact CB-CG 4.16Å; L51-K54 HydrophobicContact CD2-CG 4.35Å; L51-K54 WeakPolarHBondContact O-CB 3.36Å; L51-K54 WeakPolarHBondContact O-CG 3.35Å; L51-K54 PolarHBondContact O-N 3.22Å
52	S	82.1	Confident	85.7	Confident	64 Å²	64	49 Å²	49	45%	0.448	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-15	179.7	53.5	0	0	0	0	115.1	L46 K54	L46-S52 PolarHBondContact O-N 3.37Å; S52-K54 VanDerWaalsContact C-N 3.3Å
53	L	83.7	Confident	85.2	Confident	102 Å²	102	49.4 Å²	49.4	53%	0.534	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	9.1	174.3	-50.7	-174.2	0	0	0	113.3	L51 T183 V184	L51-L53 PolarHBondContact O-N 2.95Å; L53-T183 HydrophobicContact CD2-CG2 4.13Å; L53-V184 HydrophobicContact CB-CG2 4.07Å; L53-V184 HydrophobicContact CD2-CG2 3.96Å; L53-V184 HydrophobicContact CG-CG2 4.42Å
54	K	86.3	Confident	84.2	Confident	101 Å²	101	49.9 Å²	49.9	44%	0.439	24%	0.244	S	C	.	.	S	Bend	trans	-96.3	146.5	171.6	-63.9	-65.3	-173.9	177.2	0	110.4	L46 L51 S52 P56 F59	L46-K54 HydrophobicContact CD1-CB 4.48Å; L46-K54 HydrophobicContact CD2-CB 4.47Å; L51-K54 HydrophobicContact CB-CG 4.16Å; L51-K54 HydrophobicContact CD2-CG 4.35Å; L51-K54 WeakPolarHBondContact O-CB 3.36Å; L51-K54 WeakPolarHBondContact O-CG 3.35Å; L51-K54 PolarHBondContact O-N 3.22Å; S52-K54 VanDerWaalsContact C-N 3.3Å; K54-P56 WeakPolarHBondContact O-CD 3.28Å; K54-F59 HydrophobicContact CB-CE2 4.24Å
55	D	88.8	Confident	83.1	Confident	3 Å²	3	51.4 Å²	51.4	2%	0.016	25%	0.247	C	C	.	.			trans	-61	119.4	169.5	176.1	4	0	0	0	110.2	N57 L58 I168 A169 T172 L180	D55-N57 VanDerWaalsContact C-N 3.25Å; D55-N57 PolarHBondContact O-N 3.35Å; D55-N57 WeakPolarHBondContact OD1-CB 3.43Å; D55-N57 PolarHBondContact OD1-N 3.23Å; D55-L58 HydrophobicContact CB-CD1 4.05Å; D55-L58 HydrophobicContact CB-CG 4.04Å; D55-L58 WeakPolarHBondContact O-CB 3.33Å; D55-L58 PolarHBondContact O-N 3.23Å; D55-I168 HydrophobicContact CB-CB 4.46Å; D55-I168 HydrophobicContact CB-CG2 4.26Å; D55-I168 WeakPolarHBondContact OD2-CA 3.03Å; D55-I168 VanDerWaalsContact OD2-CB 3.27Å; D55-I168 WeakPolarHBondContact OD2-CB 3.32Å; D55-A169 PolarHBondContact OD2-N 3.16Å; D55-T172 VanDerWaalsContact CG-OG1 3.3Å; D55-T172 PolarHBondContact OD1-OG1 3.29Å; D55-T172 WeakPolarHBondContact OD2-CB 3.49Å; D55-T172 PolarHBondContact OD2-OG1 2.97Å; D55-L180 HydrophobicContact CB-CD2 4.01Å
56	P	88.9	Confident	81.5	Confident	18 Å²	18	57 Å²	57	12%	0.117	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-66.9	-25	179.8	28.3	-35.4	0	0	0	112.9	K39 I42 K43 L46 K54 L58 F59	K39-P56 HydrophobicContact CG-CB 4.49Å; I42-P56 HydrophobicContact CG2-CB 3.92Å; K43-P56 HydrophobicContact CG-CB 4.17Å; K43-P56 HydrophobicContact CG-CG 4.42Å; L46-P56 HydrophobicContact CD1-CB 4.17Å; K54-P56 WeakPolarHBondContact O-CD 3.28Å; P56-L58 PolarHBondContact O-N 2.86Å; P56-F59 PolarHBondContact O-N 2.9Å; P56-F59 VanDerWaalsContact O-N 3.13Å
57	N	88.7	Confident	79.9	Confident	6 Å²	6	59.9 Å²	59.9	3%	0.032	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-73.7	-7.7	178	-62.8	-33.3	0	0	0	112.8	K39 D55 F59 S124 A169 T172 E176	K39-N57 WeakPolarHBondContact CE-OD1 3.45Å; D55-N57 VanDerWaalsContact C-N 3.25Å; D55-N57 PolarHBondContact O-N 3.35Å; D55-N57 WeakPolarHBondContact OD1-CB 3.43Å; D55-N57 PolarHBondContact OD1-N 3.23Å; N57-F59 PolarHBondContact O-N 3.26Å; N57-S124 PolarHBondContact OD1-OG 2.85Å; N57-A169 HydrophobicContact CB-CB 3.86Å; N57-A169 VanDerWaalsContact O-CB 3.26Å; N57-A169 WeakPolarHBondContact O-CB 3.36Å; N57-T172 WeakPolarHBondContact CB-OG1 3.34Å; N57-T172 PolarHBondContact ND2-OG1 3.39Å; N57-T172 VanDerWaalsContact ND2-OG1 3.17Å; N57-E176 VanDerWaalsContact ND2-CD 3.28Å; N57-E176 PolarHBondContact ND2-OE1 2.92Å; N57-E176 PolarHBondContact ND2-OE2 3.18Å
58	L	87.8	Confident	78	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.01	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-69.5	-9.7	167.3	-74.8	173	0	0	0	112.8	D55 P56 M144 Q145 H167 A169	D55-L58 HydrophobicContact CB-CD1 4.05Å; D55-L58 HydrophobicContact CB-CG 4.04Å; D55-L58 WeakPolarHBondContact O-CB 3.33Å; D55-L58 PolarHBondContact O-N 3.23Å; P56-L58 PolarHBondContact O-N 2.86Å; L58-M144 CarbonylContact O-C 3.44Å; L58-M144 VanDerWaalsContact O-CA 3.28Å; L58-M144 WeakPolarHBondContact O-CA 3.39Å; L58-M144 WeakPolarHBondContact O-CG 3.01Å; L58-Q145 PolarHBondContact O-N 3.27Å; L58-H167 VanDerWaalsContact CD1-ND1 3.3Å; L58-H167 WeakPolarHBondContact CD1-ND1 3.46Å; L58-H167 WeakPolarHBondContact CD1-O 3.5Å; L58-A169 HydrophobicContact CD2-CB 4.21Å
59	F	87.8	Confident	75.7	Confident	14 Å²	14	62.3 Å²	62.3	6%	0.061	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	153.3	-175.3	-56.3	-90.6	0	0	0	111.6	L20 I42 L46 K54 P56 N57 L142 H143 M144	L20-F59 HydrophobicContact CD2-CE1 4.11Å; I42-F59 HydrophobicContact CD1-CB 4.08Å; I42-F59 WeakPolarHBondContact CD1-O 3.24Å; I42-F59 HydrophobicContact CG1-CB 4.41Å; I42-F59 HydrophobicContact CG2-CB 3.93Å; I42-F59 HydrophobicContact CG2-CD2 4.34Å; I42-F59 HydrophobicContact CG2-CG 4.44Å; L46-F59 HydrophobicContact CD1-CD2 4Å; L46-F59 HydrophobicContact CD1-CE2 4Å; L46-F59 HydrophobicContact CD2-CD2 4.15Å; L46-F59 HydrophobicContact CD2-CE2 3.66Å; L46-F59 HydrophobicContact CD2-CZ 3.88Å; L46-F59 HydrophobicContact CG-CE2 4.42Å; K54-F59 HydrophobicContact CB-CE2 4.24Å; P56-F59 PolarHBondContact O-N 2.9Å; P56-F59 VanDerWaalsContact O-N 3.13Å; N57-F59 PolarHBondContact O-N 3.26Å; F59-L142 HydrophobicContact CB-CD1 4.02Å; F59-L142 HydrophobicContact CD1-CD2 4.17Å; F59-L142 HydrophobicContact CD1-CG 4.34Å; F59-H143 VanDerWaalsContact CA-O 3.27Å; F59-H143 WeakPolarHBondContact CA-O 3.45Å; F59-M144 HydrophobicContact CD1-CB 4.26Å; F59-M144 HydrophobicContact CD1-CG 4.47Å; F59-M144 HydrophobicContact CE1-CB 4.26Å; F59-M144 HydrophobicContact CE1-CG 4.25Å
60	Y	86	Confident	73.5	Confident	54 Å²	54	67.6 Å²	67.6	21%	0.212	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	157.8	172.5	63.3	-84.5	0	0	0	109.8	T62 T121 H143 Q145	Y60-T62 HydrophobicContact CD2-CG2 4.16Å; Y60-T62 HydrophobicContact CE2-CG2 3.82Å; Y60-T121 HydrophobicContact CD2-CG2 3.72Å; Y60-T121 HydrophobicContact CE2-CG2 4Å; Y60-H143 HydrophobicContact CD1-CB 4.14Å; Y60-H143 HydrophobicContact CD2-CB 4.16Å; Y60-H143 HydrophobicContact CE1-CB 3.63Å; Y60-H143 HydrophobicContact CE2-CB 3.66Å; Y60-H143 AromaticContact CE2-CD2 3.93Å; Y60-H143 HydrophobicContact CG-CB 4.4Å; Y60-H143 PolarHBondContact N-O 3.34Å; Y60-H143 PolarHBondContact O-N 2.92Å; Y60-Q145 HydrophobicContact CD1-CB 4.03Å; Y60-Q145 HydrophobicContact CE1-CB 4.15Å
61	L	84.7	Confident	71.2	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	141.7	172.7	-67.5	173.6	0	0	0	109	I16 V38 V41 I45 L122 L128 T141 L142	I16-L61 HydrophobicContact CG2-CD2 4.12Å; V38-L61 HydrophobicContact CG1-CB 4.43Å; V38-L61 HydrophobicContact CG1-CD1 4.14Å; V38-L61 HydrophobicContact CG1-CG 4.22Å; V38-L61 HydrophobicContact CG2-CD1 4.4Å; V41-L61 HydrophobicContact CG1-CD1 4.26Å; I45-L61 HydrophobicContact CD1-CD2 4.42Å; L61-L122 HydrophobicContact CB-CB 4.31Å; L61-L122 HydrophobicContact CB-CD1 4.37Å; L61-L122 PolarHBondContact N-O 3.28Å; L61-L122 WeakPolarHBondContact O-CA 3.37Å; L61-L122 WeakPolarHBondContact O-CB 3.3Å; L61-L122 PolarHBondContact O-N 3.01Å; L61-L128 HydrophobicContact CD1-CD1 4.49Å; L61-T141 CarbonylContact C-O 3.54Å; L61-T141 WeakPolarHBondContact CA-O 3.46Å; L61-L142 HydrophobicContact CD2-CB 4.15Å; L61-L142 HydrophobicContact CD2-CD1 3.73Å; L61-L142 HydrophobicContact CG-CD1 4.47Å
62	T	79.8	Confident	68.9	Low	16 Å²	16	70.8 Å²	70.8	10%	0.098	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	150	159.7	52.4	0	0	0	0	109	Y60 V120 L140 T141 H143	Y60-T62 HydrophobicContact CD2-CG2 4.16Å; Y60-T62 HydrophobicContact CE2-CG2 3.82Å; T62-V120 CarbonylContact C-O 3.5Å; T62-V120 WeakPolarHBondContact CA-O 3.26Å; T62-L140 WeakPolarHBondContact O-CA 3.5Å; T62-T141 PolarHBondContact N-O 3.1Å; T62-T141 PolarHBondContact O-N 2.92Å; T62-T141 WeakPolarHBondContact OG1-CB 3.48Å; T62-T141 PolarHBondContact OG1-O 3.17Å; T62-T141 PolarHBondContact OG1-OG1 3.14Å; T62-H143 PolarHBondContact OG1-CD2 2.92Å; T62-H143 PolarHBondContact OG1-NE2 2.94Å
63	Y	77.5	Confident	66.3	Low	10 Å²	10	73.4 Å²	73.4	4%	0.039	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	120.1	175.7	164.8	-117.5	0	0	0	109.8	R65 I118 D119 V120 L132 N138 L140	Y63-R65 HydrophobicContact CE1-CB 3.75Å; Y63-R65 HydrophobicContact CE1-CG 4.41Å; Y63-R65 WeakPolarHBondContact OH-CB 3.39Å; Y63-R65 WeakPolarHBondContact OH-CG 3.49Å; Y63-I118 VanDerWaalsContact O-O 3.07Å; Y63-D119 CarbonylContact O-C 3.57Å; Y63-D119 WeakPolarHBondContact O-CA 3.21Å; Y63-V120 HydrophobicContact CD1-CB 4.26Å; Y63-V120 HydrophobicContact CD1-CG2 4.05Å; Y63-V120 PolarHBondContact N-O 3.03Å; Y63-V120 PolarHBondContact O-N 3.02Å; Y63-L132 HydrophobicContact CD1-CD1 4.21Å; Y63-L132 HydrophobicContact CD1-CD2 3.23Å; Y63-L132 HydrophobicContact CD1-CG 4.34Å; Y63-L132 HydrophobicContact CD2-CD1 4.18Å; Y63-L132 HydrophobicContact CE1-CD2 3.63Å; Y63-L132 HydrophobicContact CG-CD1 3.84Å; Y63-L132 HydrophobicContact CG-CD2 3.74Å; Y63-L132 HydrophobicContact CG-CG 4.46Å; Y63-N138 HydrophobicContact CD2-CB 4.25Å; Y63-N138 HydrophobicContact CE2-CB 3.58Å; Y63-N138 VanDerWaalsContact CE2-OD1 3.29Å; Y63-N138 WeakPolarHBondContact CE2-OD1 3.37Å; Y63-N138 PolarHBondContact OH-OD1 3.15Å; Y63-L140 HydrophobicContact CD2-CD2 4.02Å; Y63-L140 HydrophobicContact CG-CD2 4.28Å
64	R	67.9	Low	63.9	Low	104 Å²	104	74 Å²	74	39%	0.392	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	109.8	174	-176.8	159.4	162.3	-174.1	-4.5	110	Q66 E117 D119 R139	R64-Q66 PolarHBondContact O-N 3.2Å; R64-E117 IonicContact CZ-OE1 2.82Å; R64-E117 IonicContact CZ-OE2 3.5Å; R64-E117 IonicContact NE-OE1 3.38Å; R64-E117 PolarHBondContact NE-OE1 2.99Å; R64-E117 IonicContact NE-OE2 3.16Å; R64-E117 PolarHBondContact NE-OE2 2.84Å; R64-E117 IonicContact NH1-OE2 3.42Å; R64-E117 IonicContact NH2-OE1 2.68Å; R64-E117 PolarHBondContact NH2-OE1 2.78Å; R64-E117 IonicContact NH2-OE2 3.46Å; R64-E117 PolarHBondContact NH2-OE2 2.9Å; R64-D119 VanDerWaalsContact CB-OD1 3.23Å; R64-D119 WeakPolarHBondContact CB-OD1 3.36Å; R64-D119 VanDerWaalsContact CD-OD1 3.28Å; R64-D119 WeakPolarHBondContact CD-OD1 3.22Å; R64-D119 WeakPolarHBondContact CG-OD1 3.36Å; R64-R139 PolarHBondContact N-O 3.19Å; R64-R139 VanDerWaalsContact N-O 3.1Å
65	R	63.9	Low	61.2	Low	94 Å²	94	75.6 Å²	75.6	36%	0.355	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	104.6	172.7	-169.3	171.7	-153	166	17.3	109.7	Y63 T67 I118 D133	Y63-R65 HydrophobicContact CE1-CB 3.75Å; Y63-R65 HydrophobicContact CE1-CG 4.41Å; Y63-R65 WeakPolarHBondContact OH-CB 3.39Å; Y63-R65 WeakPolarHBondContact OH-CG 3.49Å; R65-T67 PolarHBondContact O-N 3.39Å; R65-I118 PolarHBondContact N-O 3.29Å; R65-D133 IonicContact CZ-OD2 3.88Å; R65-D133 IonicContact NH2-OD2 3.22Å; R65-D133 PolarHBondContact NH2-OD2 2.87Å
66	Q	53.8	Low	58.5	Low	117 Å²	117	80.9 Å²	80.9	55%	0.547	43%	0.425	S	S	.	.			trans	-72.8	110.4	170.6	-170.8	163.1	-10.2	0	0	109.2	R64 N68	R64-Q66 PolarHBondContact O-N 3.2Å; Q66-N68 PolarHBondContact O-N 2.82Å
67	T	52.3	Low	55.7	Low	66 Å²	66	86.6 Å²	86.6	41%	0.405	46%	0.459	S	S	.	.			trans	-84.4	104.3	176.9	50.9	0	0	0	0	109.5	R65 N69	R65-T67 PolarHBondContact O-N 3.39Å; T67-N69 VanDerWaalsContact C-N 3.33Å; T67-N69 PolarHBondContact O-N 2.82Å
68	N	46	Very low	53.2	Low	110 Å²	110	93.4 Å²	93.4	59%	0.588	50%	0.495	S	S	*	.			trans	-69.5	88.9	178.5	-70.6	-5.2	0	0	0	110.3	Q66 E70	Q66-N68 PolarHBondContact O-N 2.82Å; N68-E70 PolarHBondContact O-N 3.23Å
69	N	36.1	Very low	50.5	Low	148 Å²	148	102.3 Å²	102.3	79%	0.791	53%	0.534	S	S	*	.			trans	-75.2	61.6	174.9	-80.4	-59.1	0	0	0	111.5	T67	T67-N69 VanDerWaalsContact C-N 3.33Å; T67-N69 PolarHBondContact O-N 2.82Å
70	E	35.5	Very low	47.9	Very low	156 Å²	156	109.2 Å²	109.2	73%	0.729	57%	0.572	S	S	*	*			trans	-103.9	129	168.9	-62.6	-166.6	168.8	0	0	109.8	N68	N68-E70 PolarHBondContact O-N 3.23Å
71	N	35.2	Very low	45.3	Very low	139 Å²	139	113.9 Å²	113.9	74%	0.743	60%	0.6	S	S	*	*	S	Bend	trans	76.1	35.3	166	-49.9	-49	0	0	0	119.8
72	I	34.1	Very low	42.8	Very low	162 Å²	162	123.6 Å²	123.6	83%	0.831	64%	0.642	S	S	*	*			trans	-116.1	55.6	153.5	-44.2	-176	0	0	0	111
73	T	28.9	Very low	40.3	Very low	119 Å²	119	131.2 Å²	131.2	73%	0.73	68%	0.677	S	S	*	*			trans	-126.6	46.8	170.6	41.1	0	0	0	0	110.6	T75	T73-T75 PolarHBondContact O-N 3.05Å
74	T	32.6	Very low	38.2	Very low	116 Å²	116	138.4 Å²	138.4	71%	0.712	71%	0.714	S	S	*	*			trans	-65	94.7	173.3	49.4	0	0	0	0	110.6	T76	T74-T76 PolarHBondContact O-N 3.3Å; T74-T76 PolarHBondContact O-OG1 2.84Å
75	T	29.1	Very low	36.3	Very low	134 Å²	134	142.7 Å²	142.7	82%	0.822	74%	0.736	S	S	*	*			trans	-59.6	98.5	172.1	36.2	0	0	0	0	110.5	T73	T73-T75 PolarHBondContact O-N 3.05Å
76	T	33	Very low	34.8	Very low	114 Å²	114	143.5 Å²	143.5	70%	0.699	76%	0.756	S	S	*	*			trans	-135.9	42.5	177.1	-28.3	0	0	0	0	112.8	T74 N78	T74-T76 PolarHBondContact O-N 3.3Å; T74-T76 PolarHBondContact O-OG1 2.84Å; T76-N78 PolarHBondContact O-N 2.94Å
77	T	30.2	Very low	33.6	Very low	137 Å²	137	147.5 Å²	147.5	84%	0.84	77%	0.771	S	S	*	*			trans	-69.1	64.5	161	36.4	0	0	0	0	111.2
78	N	34.7	Very low	32.6	Very low	149 Å²	149	153.7 Å²	153.7	80%	0.797	80%	0.796	S	S	*	*			trans	-147.6	124.6	160.3	-112.9	-38.5	0	0	0	112.8	T76	T76-N78 PolarHBondContact O-N 2.94Å
79	K	32.2	Very low	31.9	Very low	189 Å²	189	157.4 Å²	157.4	82%	0.822	81%	0.809	S	S	*	*			trans	-74.3	124.5	174.9	-60.6	165.6	-177.8	171.8	0	108.2
80	N	33.3	Very low	31.4	Very low	159 Å²	159	153.9 Å²	153.9	85%	0.85	81%	0.808	S	S	*	*			trans	-174.4	145.6	131.5	-95.4	-35.1	0	0	0	113
81	N	29.8	Very low	31	Very low	153 Å²	153	153.9 Å²	153.9	82%	0.818	81%	0.812	S	S	*	*			trans	-68.9	131.3	-177.7	-61.9	-45.6	0	0	0	112.6
82	K	33.3	Very low	30.8	Very low	203 Å²	203	154.3 Å²	154.3	88%	0.883	81%	0.81	S	S	*	*				-170.3	139.6	125.4	-102.7	154.7	-171.7	177.5	0	113.1	I84	K82-I84 PolarHBondContact O-N 2.68Å
83	H	28	Very low	30.6	Very low	176 Å²	176	149.6 Å²	149.6	82%	0.815	80%	0.801	S	S	*	*			trans	-57.9	125.7	175	-80.4	-85.4	0	0	0	113
84	I	32.2	Very low	30.8	Very low	161 Å²	161	150.8 Å²	150.8	83%	0.826	80%	0.803	S	S	*	*			trans	-132.3	122.5	143.3	-61	-176.3	0	0	0	107.3	K82	K82-I84 PolarHBondContact O-N 2.68Å
85	K	28.1	Very low	30.6	Very low	194 Å²	194	150.3 Å²	150.3	84%	0.843	80%	0.795	S	S	*	*			trans	-91.6	107.7	172.7	-73	-178.4	175.8	-178.8	0	109.1
86	S	32.9	Very low	30.7	Very low	111 Å²	111	151.4 Å²	151.4	78%	0.776	79%	0.786	S	S	*	*			trans	-103.5	151.5	161.3	51.7	0	0	0	0	109.8
87	K	28.7	Very low	30.6	Very low	201 Å²	201	154.5 Å²	154.5	87%	0.874	79%	0.792	S	S	*	*			trans	-85.3	114	-175.2	-65.8	173.5	180	173.2	0	110.1	Q89	K87-Q89 PolarHBondContact O-N 3.42Å
88	Q	30.9	Very low	30.5	Very low	196 Å²	196	152.1 Å²	152.1	92%	0.916	78%	0.781	S	S	*	*			trans	-67.9	120.5	154.7	-77.3	175.1	-43.6	0	0	108.2	G90	Q88-G90 PolarHBondContact O-N 2.84Å
89	Q	31	Very low	30.1	Very low	188 Å²	188	152.1 Å²	152.1	88%	0.879	78%	0.778	S	S	*	*			trans	-83.2	102.9	162.5	-75	179.1	-44.8	0	0	107.1	K87	K87-Q89 PolarHBondContact O-N 3.42Å
90	G	25.1	Very low	29.9	Very low	74 Å²	74	148.5 Å²	148.5	76%	0.763	76%	0.764	S	S	*	*			trans	-72.5	127	178	0	0	0	0	0	111.5	Q88	Q88-G90 PolarHBondContact O-N 2.84Å
91	L	27.2	Very low	29.7	Very low	157 Å²	157	147.5 Å²	147.5	82%	0.822	76%	0.763	S	S	*	*			trans	-132.6	95.4	164.8	-81.6	172.3	0	0	0	108.8
92	H	31.5	Very low	29.5	Very low	148 Å²	148	148.1 Å²	148.1	69%	0.685	77%	0.766	S	S	*	*	S	Bend	trans	47	71.5	161.3	-70.5	-74.5	0	0	0	118.6	L95	H92-L95 VanDerWaalsContact ND1-CD1 3.28Å; H92-L95 WeakPolarHBondContact ND1-CD1 3.38Å
93	G	30.8	Very low	29.3	Very low	63 Å²	63	142.4 Å²	142.4	65%	0.649	76%	0.757	S	S	*	*	S	Bend	trans	-79.2	-36.7	147.4	0	0	0	0	0	112.3	L95	G93-L95 PolarHBondContact O-N 3.49Å
94	D	31.4	Very low	29.3	Very low	143 Å²	143	142 Å²	142	77%	0.765	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	17	-149.9	-38.4	-26.9	0	0	0	115.3
95	L	30	Very low	29.3	Very low	106 Å²	106	141.4 Å²	141.4	56%	0.555	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.9	-25.5	-178.6	-88	-177.3	0	0	0	115.1	H92 G93 S98	H92-L95 VanDerWaalsContact ND1-CD1 3.28Å; H92-L95 WeakPolarHBondContact ND1-CD1 3.38Å; G93-L95 PolarHBondContact O-N 3.49Å; L95-S98 PolarHBondContact O-OG 2.97Å
96	Y	29.9	Very low	29.6	Very low	158 Å²	158	136.2 Å²	136.2	62%	0.62	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-81.3	-21.6	-177.1	-91.5	-82.6	0	0	0	114.3	S98 M99	Y96-S98 PolarHBondContact O-N 3.02Å; Y96-M99 PolarHBondContact O-N 3.27Å
97	E	31.6	Very low	29.8	Very low	179 Å²	179	131.7 Å²	131.7	84%	0.836	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-75.5	-2.7	178.6	-154.2	164.6	-142.4	0	0	113
98	S	27	Very low	30.3	Very low	87 Å²	87	126.1 Å²	126.1	61%	0.608	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-107.2	8.1	176.4	66.9	0	0	0	0	114.3	L95 Y96 E100	L95-S98 PolarHBondContact O-OG 2.97Å; Y96-S98 PolarHBondContact O-N 3.02Å; S98-E100 VanDerWaalsContact C-N 3.31Å
99	M	28.1	Very low	30.5	Very low	148 Å²	148	125.8 Å²	125.8	73%	0.729	69%	0.693	S	S	*	*			trans	-93.7	20.6	176.2	-145.2	173.1	76.6	0	0	113.4	Y96	Y96-M99 PolarHBondContact O-N 3.27Å
100	E	27.1	Very low	30.9	Very low	114 Å²	114	121.4 Å²	121.4	53%	0.533	68%	0.683	S	S	.	*	S	Bend	trans	-79.7	144.4	167	-64.6	-161.1	144.5	0	0	112	S98 N102 Q113	S98-E100 VanDerWaalsContact C-N 3.31Å; E100-N102 PolarHBondContact O-N 3.1Å; E100-Q113 PolarHBondContact OE1-NE2 3.04Å
101	V	28.6	Very low	31.4	Very low	137 Å²	137	123.3 Å²	123.3	83%	0.83	68%	0.675	S	S	*	*	S	Bend	trans	51.4	58.5	166.7	-158.3	0	0	0	0	115.8
102	N	25.3	Very low	31.9	Very low	166 Å²	166	120.3 Å²	120.3	89%	0.888	66%	0.66	S	S	*	*			trans	-138.9	135.8	146.6	-91.5	-65.9	0	0	0	111.3	E100	E100-N102 PolarHBondContact O-N 3.1Å
103	A	30.1	Very low	32.4	Very low	84 Å²	84	119.1 Å²	119.1	69%	0.694	65%	0.654	S	S	*	*			trans	-85.7	-178.2	174.7	0	0	0	0	0	111.5
104	L	27.6	Very low	32.8	Very low	166 Å²	166	123.6 Å²	123.6	87%	0.869	66%	0.663	S	S	*	*			trans	76.2	64.2	176.3	-56.9	105.8	0	0	0	116.9
105	T	31.8	Very low	33.3	Very low	150 Å²	150	119 Å²	119	92%	0.92	64%	0.642	S	S	*	*			trans	-159.6	165	130.6	4.9	0	0	0	0	111.3
106	S	35.2	Very low	34	Very low	85 Å²	85	123 Å²	123	59%	0.594	66%	0.655	S	S	*	*	S	Bend	trans	-72.6	145.9	-162.6	-53.2	0	0	0	0	116.1
107	G	36.2	Very low	35	Very low	15 Å²	15	119.9 Å²	119.9	16%	0.155	65%	0.646	C	S	.	*	S	Bend	trans	104	-9.9	144.3	0	0	0	0	0	118.7	Y123	G107-Y123 PolarHBondContact O-N 3.08Å
108	I	39.9	Very low	36.1	Very low	84 Å²	84	114.1 Å²	114.1	43%	0.431	62%	0.621	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.3	127.1	-174.7	-46.7	172.7	0	0	0	110.5	V120 T131	I108-V120 HydrophobicContact CG2-CG1 3.67Å; I108-T131 HydrophobicContact CD1-CG2 3.69Å; I108-T131 HydrophobicContact CG1-CG2 4Å
109	W	36.4	Very low	37.8	Very low	190 Å²	190	114 Å²	114	72%	0.72	61%	0.613	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-138.4	152.9	171.7	-70.6	84	0	0	0	110.9	Y123	W109-Y123 HydrophobicContact CB-CE2 4.4Å
110	S	38.8	Very low	39.7	Very low	96 Å²	96	108 Å²	108	67%	0.671	59%	0.585	S	S	*	*			trans	63.5	79.1	-179.4	-59.1	0	0	0	0	115.7
111	L	36.2	Very low	41.8	Very low	113 Å²	113	103.8 Å²	103.8	59%	0.592	57%	0.567	S	S	*	*			trans	-84.1	101.4	158.2	-178.4	71.1	0	0	0	109	Q113 I118	L111-Q113 HydrophobicContact CD2-CG 3.87Å; L111-Q113 HydrophobicContact CG-CG 3.99Å; L111-Q113 PolarHBondContact O-N 3.48Å; L111-I118 HydrophobicContact CD1-CG2 3.73Å
112	N	37	Very low	44	Very low	95 Å²	95	97.3 Å²	97.3	51%	0.508	53%	0.528	S	S	.	.			trans	-82.3	93.2	172.9	-173.1	8.2	0	0	0	110.4	N114 S115	N112-N114 PolarHBondContact O-N 3.36Å; N112-N114 PolarHBondContact OD1-N 3.47Å; N112-S115 PolarHBondContact O-OG 3.46Å
113	Q	41.4	Very low	46.2	Very low	122 Å²	122	93.1 Å²	93.1	57%	0.57	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-12.6	-177.3	-65	174.5	-42.8	0	0	114.4	E100 L111	E100-Q113 PolarHBondContact OE1-NE2 3.04Å; L111-Q113 HydrophobicContact CD2-CG 3.87Å; L111-Q113 HydrophobicContact CG-CG 3.99Å; L111-Q113 PolarHBondContact O-N 3.48Å
114	N	39.3	Very low	48.2	Very low	157 Å²	157	90 Å²	90	84%	0.84	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-2.1	-173.2	-68.2	-37.6	0	0	0	114.3	N112	N112-N114 PolarHBondContact O-N 3.36Å; N112-N114 PolarHBondContact OD1-N 3.47Å
115	S	42.1	Very low	50.3	Low	47 Å²	47	87.1 Å²	87.1	33%	0.329	46%	0.458	S	S	.	.	S	Bend	trans	-102.9	141.6	173	46.7	0	0	0	0	111.4	N112 E117	N112-S115 PolarHBondContact O-OG 3.46Å; S115-E117 WeakPolarHBondContact CB-O 3.48Å; S115-E117 PolarHBondContact O-N 2.89Å; S115-E117 VanDerWaalsContact O-N 3.11Å; S115-E117 PolarHBondContact OG-O 3.09Å
116	K	45.4	Very low	52.3	Low	190 Å²	190	80 Å²	80	83%	0.826	42%	0.415	S	S	*	.	S	Bend	trans	-65.7	-8.3	172.1	-69.3	-175.4	177.1	-179.1	0	113.5
117	E	51	Low	54	Low	92 Å²	92	78 Å²	78	43%	0.43	40%	0.397	S	S	.	.	S	Bend	trans	-116.8	124.6	178.4	-50	-164.5	129.5	0	0	106.9	R64 S115	R64-E117 IonicContact CZ-OE1 2.82Å; R64-E117 IonicContact CZ-OE2 3.5Å; R64-E117 IonicContact NE-OE1 3.38Å; R64-E117 PolarHBondContact NE-OE1 2.99Å; R64-E117 IonicContact NE-OE2 3.16Å; R64-E117 PolarHBondContact NE-OE2 2.84Å; R64-E117 IonicContact NH1-OE2 3.42Å; R64-E117 IonicContact NH2-OE1 2.68Å; R64-E117 PolarHBondContact NH2-OE1 2.78Å; R64-E117 IonicContact NH2-OE2 3.46Å; R64-E117 PolarHBondContact NH2-OE2 2.9Å; S115-E117 WeakPolarHBondContact CB-O 3.48Å; S115-E117 PolarHBondContact O-N 2.89Å; S115-E117 VanDerWaalsContact O-N 3.11Å; S115-E117 PolarHBondContact OG-O 3.09Å
118	I	53.6	Low	55.5	Low	58 Å²	58	77.2 Å²	77.2	30%	0.297	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	96.2	-178.9	-55.7	175.2	0	0	0	107	Y63 R65 L111 V120	Y63-I118 VanDerWaalsContact O-O 3.07Å; R65-I118 PolarHBondContact N-O 3.29Å; L111-I118 HydrophobicContact CD1-CG2 3.73Å; I118-V120 HydrophobicContact CG2-CG2 3.83Å
119	D	62.2	Low	56.7	Low	84 Å²	84	75.2 Å²	75.2	45%	0.449	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	96.4	173.8	-71.4	-16.9	0	0	0	109.5	Y63 R64	Y63-D119 CarbonylContact O-C 3.57Å; Y63-D119 WeakPolarHBondContact O-CA 3.21Å; R64-D119 VanDerWaalsContact CB-OD1 3.23Å; R64-D119 WeakPolarHBondContact CB-OD1 3.36Å; R64-D119 VanDerWaalsContact CD-OD1 3.28Å; R64-D119 WeakPolarHBondContact CD-OD1 3.22Å; R64-D119 WeakPolarHBondContact CG-OD1 3.36Å
120	V	67.9	Low	57.9	Low	24 Å²	24	75.8 Å²	75.8	15%	0.145	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	123.7	178.1	-172.3	0	0	0	0	109.4	T62 Y63 I108 I118 L122	T62-V120 CarbonylContact C-O 3.5Å; T62-V120 WeakPolarHBondContact CA-O 3.26Å; Y63-V120 HydrophobicContact CD1-CB 4.26Å; Y63-V120 HydrophobicContact CD1-CG2 4.05Å; Y63-V120 PolarHBondContact N-O 3.03Å; Y63-V120 PolarHBondContact O-N 3.02Å; I108-V120 HydrophobicContact CG2-CG1 3.67Å; I118-V120 HydrophobicContact CG2-CG2 3.83Å; V120-L122 HydrophobicContact CG1-CD2 3.79Å
121	T	71.8	Confident	58.8	Low	25 Å²	25	73 Å²	73	15%	0.153	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	128.8	173.2	-57.5	0	0	0	0	110.6	Y60 Y123	Y60-T121 HydrophobicContact CD2-CG2 3.72Å; Y60-T121 HydrophobicContact CE2-CG2 4Å; T121-Y123 HydrophobicContact CG2-CD2 4.29Å; T121-Y123 HydrophobicContact CG2-CE1 4.29Å; T121-Y123 HydrophobicContact CG2-CE2 3.6Å
122	L	75.5	Confident	60.1	Low	0 Å²	0	68.6 Å²	68.6	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	112.7	-173.1	-51.9	169.3	0	0	0	109.8	V38 L61 V120 L128 T131 L132 L140	V38-L122 HydrophobicContact CG2-CB 3.94Å; L61-L122 HydrophobicContact CB-CB 4.31Å; L61-L122 HydrophobicContact CB-CD1 4.37Å; L61-L122 PolarHBondContact N-O 3.28Å; L61-L122 WeakPolarHBondContact O-CA 3.37Å; L61-L122 WeakPolarHBondContact O-CB 3.3Å; L61-L122 PolarHBondContact O-N 3.01Å; V120-L122 HydrophobicContact CG1-CD2 3.79Å; L122-L128 HydrophobicContact CD1-CD2 3.93Å; L122-T131 HydrophobicContact CD2-CG2 3.6Å; L122-L132 HydrophobicContact CD1-CD1 3.86Å; L122-L132 HydrophobicContact CD1-CG 4.5Å; L122-L140 HydrophobicContact CD1-CD2 4.22Å
123	Y	71.9	Confident	61.2	Low	79 Å²	79	68 Å²	68	31%	0.31	34%	0.338	S	S	.	.			trans	-91.8	166.4	178.8	-65.9	-80.2	0	0	0	112.4	V38 G107 W109 T121 D125 A126	V38-Y123 WeakPolarHBondContact CB-O 3.24Å; G107-Y123 PolarHBondContact O-N 3.08Å; W109-Y123 HydrophobicContact CB-CE2 4.4Å; T121-Y123 HydrophobicContact CG2-CD2 4.29Å; T121-Y123 HydrophobicContact CG2-CE1 4.29Å; T121-Y123 HydrophobicContact CG2-CE2 3.6Å; Y123-D125 PolarHBondContact O-N 3.01Å; Y123-A126 WeakPolarHBondContact O-CB 3.2Å; Y123-A126 PolarHBondContact O-N 3.29Å
124	S	70.7	Confident	62.2	Low	17 Å²	17	63.5 Å²	63.5	12%	0.119	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-32.9	-50	-174.6	-51	0	0	0	0	115.5	T37 V38 K39 N57 A126	T37-S124 WeakPolarHBondContact CB-O 3.42Å; V38-S124 PolarHBondContact N-O 3.27Å; K39-S124 WeakPolarHBondContact CB-O 3.36Å; K39-S124 PolarHBondContact N-O 3.32Å; N57-S124 PolarHBondContact OD1-OG 2.85Å; S124-A126 PolarHBondContact O-N 2.92Å
125	D	73.1	Confident	63.1	Low	106 Å²	106	59.2 Å²	59.2	57%	0.567	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-3	-169.1	-54.8	-24.1	0	0	0	114.5	Y123	Y123-D125 PolarHBondContact O-N 3.01Å
126	A	72.2	Confident	63.7	Low	2 Å²	2	66.2 Å²	66.2	2%	0.017	32%	0.322	C	S	.	.			trans	-71.1	131.8	178.5	0	0	0	0	0	110.8	T37 V38 Y123 S124	T37-A126 CarbonylContact C-O 3.51Å; T37-A126 WeakPolarHBondContact CA-O 3.23Å; V38-A126 HydrophobicContact CG2-CB 3.94Å; V38-A126 WeakPolarHBondContact CG2-O 3.42Å; V38-A126 PolarHBondContact N-O 2.93Å; Y123-A126 WeakPolarHBondContact O-CB 3.2Å; Y123-A126 PolarHBondContact O-N 3.29Å; S124-A126 PolarHBondContact O-N 2.92Å
127	I	71.1	Confident	64.2	Low	41 Å²	41	62 Å²	62	21%	0.21	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-92.8	107.1	177.6	-62.6	168.7	0	0	0	107.6	T37 S129 R130 T131	T37-I127 HydrophobicContact CG2-CG1 4.17Å; I127-S129 VanDerWaalsContact C-N 3.26Å; I127-S129 WeakPolarHBondContact CG2-OG 3.37Å; I127-S129 PolarHBondContact O-N 3Å; I127-S129 VanDerWaalsContact O-N 3.14Å; I127-R130 HydrophobicContact CB-CB 4.38Å; I127-R130 HydrophobicContact CB-CG 4.33Å; I127-R130 HydrophobicContact CG2-CB 4.38Å; I127-R130 HydrophobicContact CG2-CG 3.94Å; I127-R130 PolarHBondContact O-N 3.22Å; I127-T131 PolarHBondContact O-N 2.82Å; I127-T131 PolarHBondContact O-OG1 3.48Å
128	L	68.6	Low	64.9	Low	0 Å²	0	58 Å²	58	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-55.5	-39.8	-168	-72.6	171	0	0	0	113.2	I32 D36 V38 V41 L61 L122 R130 T131 L132 L134	I32-L128 HydrophobicContact CD1-CD1 4.01Å; I32-L128 HydrophobicContact CG2-CB 4.44Å; I32-L128 HydrophobicContact CG2-CD1 4.07Å; D36-L128 PolarHBondContact O-N 3.26Å; V38-L128 HydrophobicContact CG2-CD2 3.68Å; V38-L128 HydrophobicContact CG2-CG 3.93Å; V41-L128 HydrophobicContact CB-CD1 4.29Å; V41-L128 HydrophobicContact CG2-CD1 3.67Å; L61-L128 HydrophobicContact CD1-CD1 4.49Å; L122-L128 HydrophobicContact CD1-CD2 3.93Å; L128-R130 PolarHBondContact O-N 3.41Å; L128-T131 PolarHBondContact O-N 3.34Å; L128-L132 HydrophobicContact CD2-CD1 4.09Å; L128-L132 PolarHBondContact O-N 3.14Å; L128-L134 HydrophobicContact CB-CD1 4.17Å
129	S	63.8	Low	65.6	Low	41 Å²	41	60.1 Å²	60.1	29%	0.287	29%	0.294	S	S	.	.	H	α-helix	trans	-66.6	-17.6	178.3	62.2	0	0	0	0	115.4	S34 I127	S34-S129 PolarHBondContact O-OG 3.47Å; I127-S129 VanDerWaalsContact C-N 3.26Å; I127-S129 WeakPolarHBondContact CG2-OG 3.37Å; I127-S129 PolarHBondContact O-N 3Å; I127-S129 VanDerWaalsContact O-N 3.14Å
130	R	62	Low	66.5	Low	202 Å²	202	56.1 Å²	56.1	76%	0.762	27%	0.273	S	S	*	.	H	α-helix	trans	-102.8	-25.6	176.1	-62.3	-177.8	-178.2	176	0.4	112.2	I127 L128	I127-R130 HydrophobicContact CB-CB 4.38Å; I127-R130 HydrophobicContact CB-CG 4.33Å; I127-R130 HydrophobicContact CG2-CB 4.38Å; I127-R130 HydrophobicContact CG2-CG 3.94Å; I127-R130 PolarHBondContact O-N 3.22Å; L128-R130 PolarHBondContact O-N 3.41Å
131	T	57.8	Low	67	Low	39 Å²	39	57 Å²	57	24%	0.239	28%	0.278	C	S	.	.	H	α-helix	trans	-90.3	-26.9	-174.9	-61.8	0	0	0	0	112.7	I108 L122 I127 L128	I108-T131 HydrophobicContact CD1-CG2 3.69Å; I108-T131 HydrophobicContact CG1-CG2 4Å; L122-T131 HydrophobicContact CD2-CG2 3.6Å; I127-T131 PolarHBondContact O-N 2.82Å; I127-T131 PolarHBondContact O-OG1 3.48Å; L128-T131 PolarHBondContact O-N 3.34Å
132	L	63.2	Low	67.5	Low	19 Å²	19	56.1 Å²	56.1	10%	0.099	27%	0.272	C	S	.	.			trans	-133.8	141.7	-172.4	-60.8	-177.1	0	0	0	113.9	Y63 L122 L128 L134 L140	Y63-L132 HydrophobicContact CD1-CD1 4.21Å; Y63-L132 HydrophobicContact CD1-CD2 3.23Å; Y63-L132 HydrophobicContact CD1-CG 4.34Å; Y63-L132 HydrophobicContact CD2-CD1 4.18Å; Y63-L132 HydrophobicContact CE1-CD2 3.63Å; Y63-L132 HydrophobicContact CG-CD1 3.84Å; Y63-L132 HydrophobicContact CG-CD2 3.74Å; Y63-L132 HydrophobicContact CG-CG 4.46Å; L122-L132 HydrophobicContact CD1-CD1 3.86Å; L122-L132 HydrophobicContact CD1-CG 4.5Å; L128-L132 HydrophobicContact CD2-CD1 4.09Å; L128-L132 PolarHBondContact O-N 3.14Å; L132-L134 HydrophobicContact CB-CD2 3.54Å; L132-L134 HydrophobicContact CB-CG 3.91Å; L132-L134 HydrophobicContact CD1-CD2 3.66Å; L132-L134 HydrophobicContact CG-CD2 4.25Å; L132-L134 PolarHBondContact O-N 3.21Å; L132-L134 VanDerWaalsContact O-N 3.11Å; L132-L140 HydrophobicContact CD1-CD2 3.94Å
133	D	61.6	Low	67.8	Low	83 Å²	83	59.2 Å²	59.2	44%	0.444	29%	0.287	S	S	.	.			trans	-72.1	91.3	159.5	-69.5	-40.9	0	0	0	109	R65 T135 N138	R65-D133 IonicContact CZ-OD2 3.88Å; R65-D133 IonicContact NH2-OD2 3.22Å; R65-D133 PolarHBondContact NH2-OD2 2.87Å; D133-T135 PolarHBondContact O-N 3.03Å; D133-N138 PolarHBondContact O-ND2 3.27Å
134	L	61.2	Low	68.3	Low	27 Å²	27	61.3 Å²	61.3	14%	0.141	30%	0.301	C	S	.	.			trans	-77.7	76.8	-170.7	-65.4	169.6	0	0	0	113.6	I14 L128 L132 N138	I14-L134 HydrophobicContact CD1-CB 4.22Å; I14-L134 HydrophobicContact CD1-CD1 3.66Å; I14-L134 HydrophobicContact CD1-CD2 3.86Å; I14-L134 HydrophobicContact CD1-CG 4.09Å; L128-L134 HydrophobicContact CB-CD1 4.17Å; L132-L134 HydrophobicContact CB-CD2 3.54Å; L132-L134 HydrophobicContact CB-CG 3.91Å; L132-L134 HydrophobicContact CD1-CD2 3.66Å; L132-L134 HydrophobicContact CG-CD2 4.25Å; L132-L134 PolarHBondContact O-N 3.21Å; L132-L134 VanDerWaalsContact O-N 3.11Å; L134-N138 WeakPolarHBondContact CA-ND2 3.19Å
135	T	57.5	Low	68.8	Low	68 Å²	68	63.2 Å²	63.2	42%	0.417	31%	0.308	S	S	.	.			trans	-78.1	170	172.4	82.5	0	0	0	0	112.3	D133 D137 N138	D133-T135 PolarHBondContact O-N 3.03Å; T135-D137 VanDerWaalsContact C-N 3.27Å; T135-D137 PolarHBondContact O-N 3.01Å; T135-D137 PolarHBondContact OG1-N 2.91Å; T135-N138 PolarHBondContact N-ND2 2.85Å; T135-N138 PolarHBondContact OG1-OD1 2.85Å
136	K	56.5	Low	69.1	Low	194 Å²	194	62.5 Å²	62.5	84%	0.843	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-22.1	175.3	-66.9	-179.7	-178.2	173.9	0	113.6	N138	K136-N138 VanDerWaalsContact C-N 3.35Å
137	D	55.9	Low	69.8	Low	100 Å²	100	63.3 Å²	63.3	54%	0.535	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-7	-173.4	-40.3	-55.1	0	0	0	111.8	T135 R139	T135-D137 VanDerWaalsContact C-N 3.27Å; T135-D137 PolarHBondContact O-N 3.01Å; T135-D137 PolarHBondContact OG1-N 2.91Å; D137-R139 PolarHBondContact O-N 2.95Å
138	N	65.1	Low	70.5	Confident	9 Å²	9	62 Å²	62	5%	0.048	31%	0.312	C	S	.	.			trans	-66.9	118.9	178.1	-78.3	-5.7	0	0	0	111.8	Y63 D133 L134 T135 K136	Y63-N138 HydrophobicContact CD2-CB 4.25Å; Y63-N138 HydrophobicContact CE2-CB 3.58Å; Y63-N138 VanDerWaalsContact CE2-OD1 3.29Å; Y63-N138 WeakPolarHBondContact CE2-OD1 3.37Å; Y63-N138 PolarHBondContact OH-OD1 3.15Å; D133-N138 PolarHBondContact O-ND2 3.27Å; L134-N138 WeakPolarHBondContact CA-ND2 3.19Å; T135-N138 PolarHBondContact N-ND2 2.85Å; T135-N138 PolarHBondContact OG1-OD1 2.85Å; K136-N138 VanDerWaalsContact C-N 3.35Å
139	R	68.9	Low	71.5	Confident	103 Å²	103	65 Å²	65	39%	0.389	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	115.4	169.1	-59.4	-167.7	-179.7	-146.8	-0.2	110.1	Y17 R64 D137	Y17-R139 HydrophobicContact CD2-CB 4.2Å; Y17-R139 HydrophobicContact CD2-CG 4.45Å; Y17-R139 HydrophobicContact CE2-CB 3.95Å; Y17-R139 HydrophobicContact CE2-CG 3.76Å; R64-R139 PolarHBondContact N-O 3.19Å; R64-R139 VanDerWaalsContact N-O 3.1Å; D137-R139 PolarHBondContact O-N 2.95Å
140	L	79.4	Confident	72.8	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	125.5	164.1	-68.8	-177.9	0	0	0	109.4	I14 I16 Y17 T62 Y63 L122 L132	I14-L140 HydrophobicContact CG2-CD1 3.73Å; I14-L140 HydrophobicContact CG2-CG 4.29Å; I16-L140 WeakPolarHBondContact CA-O 3.48Å; I16-L140 HydrophobicContact CD1-CD1 4.5Å; I16-L140 HydrophobicContact CG1-CB 4.21Å; I16-L140 HydrophobicContact CG1-CD1 4.34Å; Y17-L140 PolarHBondContact N-O 3.43Å; T62-L140 WeakPolarHBondContact O-CA 3.5Å; Y63-L140 HydrophobicContact CD2-CD2 4.02Å; Y63-L140 HydrophobicContact CG-CD2 4.28Å; L122-L140 HydrophobicContact CD1-CD2 4.22Å; L132-L140 HydrophobicContact CD1-CD2 3.94Å
141	T	78.3	Confident	74.1	Confident	42 Å²	42	58.8 Å²	58.8	26%	0.258	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	127.3	-178.3	15	0	0	0	0	110.6	Y17 L61 T62 H143	Y17-T141 WeakPolarHBondContact O-CA 3.48Å; L61-T141 CarbonylContact C-O 3.54Å; L61-T141 WeakPolarHBondContact CA-O 3.46Å; T62-T141 PolarHBondContact N-O 3.1Å; T62-T141 PolarHBondContact O-N 2.92Å; T62-T141 WeakPolarHBondContact OG1-CB 3.48Å; T62-T141 PolarHBondContact OG1-O 3.17Å; T62-T141 PolarHBondContact OG1-OG1 3.14Å; T141-H143 PolarHBondContact O-CD2 3.29Å
142	L	84.2	Confident	75.7	Confident	6 Å²	6	57 Å²	57	3%	0.031	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	126.5	177.2	-173.4	79.5	0	0	0	110.9	Y17 T18 L20 I42 I45 F59 L61	Y17-L142 PolarHBondContact O-N 3.4Å; T18-L142 HydrophobicContact CG2-CB 4.02Å; T18-L142 HydrophobicContact CG2-CD2 4.05Å; L20-L142 HydrophobicContact CD1-CD2 3.99Å; L20-L142 HydrophobicContact CD2-CD2 4.13Å; L20-L142 HydrophobicContact CG-CD2 4.12Å; I42-L142 HydrophobicContact CG1-CD1 4.02Å; I45-L142 HydrophobicContact CD1-CD1 4.11Å; I45-L142 HydrophobicContact CG2-CD2 4Å; F59-L142 HydrophobicContact CB-CD1 4.02Å; F59-L142 HydrophobicContact CD1-CD2 4.17Å; F59-L142 HydrophobicContact CD1-CG 4.34Å; L61-L142 HydrophobicContact CD2-CB 4.15Å; L61-L142 HydrophobicContact CD2-CD1 3.73Å; L61-L142 HydrophobicContact CG-CD1 4.47Å
143	H	81	Confident	76.9	Confident	65 Å²	65	60.6 Å²	60.6	30%	0.301	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	163.2	175.7	-59.3	-83.5	0	0	0	111.6	F59 Y60 T62 T141	F59-H143 VanDerWaalsContact CA-O 3.27Å; F59-H143 WeakPolarHBondContact CA-O 3.45Å; Y60-H143 HydrophobicContact CD1-CB 4.14Å; Y60-H143 HydrophobicContact CD2-CB 4.16Å; Y60-H143 HydrophobicContact CE1-CB 3.63Å; Y60-H143 HydrophobicContact CE2-CB 3.66Å; Y60-H143 AromaticContact CE2-CD2 3.93Å; Y60-H143 HydrophobicContact CG-CB 4.4Å; Y60-H143 PolarHBondContact N-O 3.34Å; Y60-H143 PolarHBondContact O-N 2.92Å; T62-H143 PolarHBondContact OG1-CD2 2.92Å; T62-H143 PolarHBondContact OG1-NE2 2.94Å; T141-H143 PolarHBondContact O-CD2 3.29Å
144	M	81.9	Confident	77.9	Confident	123 Å²	123	56.8 Å²	56.8	61%	0.606	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.7	129.7	176.3	-172.3	-180	63.4	0	0	110.9	L58 F59	L58-M144 CarbonylContact O-C 3.44Å; L58-M144 VanDerWaalsContact O-CA 3.28Å; L58-M144 WeakPolarHBondContact O-CA 3.39Å; L58-M144 WeakPolarHBondContact O-CG 3.01Å; F59-M144 HydrophobicContact CD1-CB 4.26Å; F59-M144 HydrophobicContact CD1-CG 4.47Å; F59-M144 HydrophobicContact CE1-CB 4.26Å; F59-M144 HydrophobicContact CE1-CG 4.25Å
145	Q	82.3	Confident	78.6	Confident	57 Å²	57	57.5 Å²	57.5	27%	0.266	29%	0.293	S	S	.	.			trans	-85	159.2	177.5	-166	172.1	17.2	0	0	112	L58 Y60 G147	L58-Q145 PolarHBondContact O-N 3.27Å; Y60-Q145 HydrophobicContact CD1-CB 4.03Å; Y60-Q145 HydrophobicContact CE1-CB 4.15Å; Q145-G147 PolarHBondContact O-N 3.39Å
146	T	79.5	Confident	79.7	Confident	92 Å²	92	56.3 Å²	56.3	56%	0.564	29%	0.287	S	S	*	.			trans	-66.5	118.7	173.1	56.1	0	0	0	0	112.2
147	G	85.7	Confident	80.9	Confident	19 Å²	19	50 Å²	50	20%	0.196	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	-153.4	176.7	0	0	0	0	0	113.7	Q145 I168	Q145-G147 PolarHBondContact O-N 3.39Å; G147-I168 CarbonylContact C-O 3.6Å; G147-I168 WeakPolarHBondContact CA-O 3.45Å
148	G	87.1	Confident	81.8	Confident	13 Å²	13	46.6 Å²	46.6	13%	0.134	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.4	157.7	169.8	0	0	0	0	0	111.7	H167 I168	G148-H167 WeakPolarHBondContact O-CA 3.11Å; G148-I168 PolarHBondContact N-O 2.87Å; G148-I168 PolarHBondContact O-N 3.36Å
149	V	89.6	Confident	82.2	Confident	62 Å²	62	54 Å²	54	38%	0.376	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	117.8	179.1	-178.3	0	0	0	0	110.2	Q165 F166 F1018	V149-Q165 HydrophobicContact CG1-CB 4.25Å; V149-F166 WeakPolarHBondContact CA-O 3.45Å; V149-F1018 HydrophobicContact CB-CE1 4.13Å; V149-F1018 HydrophobicContact CB-CE2 4.47Å; V149-F1018 HydrophobicContact CB-CZ 3.92Å; V149-F1018 HydrophobicContact CG1-CE1 3.74Å; V149-F1018 HydrophobicContact CG1-CZ 3.91Å
150	L	89.9	Confident	82.6	Confident	5 Å²	5	54.4 Å²	54.4	3%	0.026	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	133.1	177.6	-166.6	66.1	0	0	0	110.6	I152 Q165 F166 I168 L177 P214 L215 V218 L227	L150-I152 HydrophobicContact CG-CG1 4.45Å; L150-Q165 WeakPolarHBondContact O-CA 3.27Å; L150-F166 PolarHBondContact N-O 3.02Å; L150-F166 PolarHBondContact O-N 2.65Å; L150-I168 HydrophobicContact CB-CD1 4.08Å; L150-I168 HydrophobicContact CB-CG1 4.43Å; L150-I168 HydrophobicContact CD2-CD1 3.6Å; L150-L177 HydrophobicContact CD2-CD2 3.56Å; L150-P214 HydrophobicContact CD2-CB 3.66Å; L150-L215 HydrophobicContact CD1-CD1 4.49Å; L150-V218 HydrophobicContact CD1-CB 4.09Å; L150-V218 HydrophobicContact CD1-CG1 4.39Å; L150-V218 HydrophobicContact CD1-CG2 3.94Å; L150-L227 HydrophobicContact CD1-CD1 3.86Å; L150-L227 HydrophobicContact CD2-CD1 3.74Å; L150-L227 HydrophobicContact CG-CD1 4.02Å
151	K	89.9	Confident	82.5	Confident	109 Å²	109	56 Å²	56	47%	0.474	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	128.5	177.7	-61.5	-177.2	179.6	172.3	0	109.5	I163 Q165 F1018	K151-I163 HydrophobicContact CB-CG2 4.15Å; K151-Q165 HydrophobicContact CG-CG 4.17Å; K151-F1018 VanDerWaalsContact CE-CE1 3.42Å
152	I	90.6	Very high	82.7	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.01	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	127.5	-175.8	-49.2	178	0	0	0	109.1	L150 D154 I163 R164 F166 L177 I181 L196 L227 L229	L150-I152 HydrophobicContact CG-CG1 4.45Å; I152-D154 PolarHBondContact O-N 3.09Å; I152-I163 WeakPolarHBondContact O-CA 3.43Å; I152-R164 PolarHBondContact N-O 2.73Å; I152-R164 PolarHBondContact O-N 2.91Å; I152-F166 HydrophobicContact CD1-CD2 3.6Å; I152-F166 HydrophobicContact CD1-CE2 3.88Å; I152-F166 HydrophobicContact CG1-CD2 4.16Å; I152-F166 HydrophobicContact CG1-CE2 4.49Å; I152-L177 HydrophobicContact CD1-CD1 3.92Å; I152-L177 HydrophobicContact CD1-CD2 3.74Å; I152-L177 HydrophobicContact CD1-CG 3.91Å; I152-I181 HydrophobicContact CD1-CD1 3.67Å; I152-I181 HydrophobicContact CD1-CG1 4.28Å; I152-I181 HydrophobicContact CG2-CD1 4.35Å; I152-L196 HydrophobicContact CG2-CD2 4.05Å; I152-L227 WeakPolarHBondContact CA-O 3.49Å; I152-L229 HydrophobicContact CG2-CB 4.24Å
153	Y	88.1	Confident	82.7	Confident	94 Å²	94	60.5 Å²	60.5	37%	0.369	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	100.7	173.8	-162	-104.4	0	0	0	109.6	S155 A161 I163 L227 V228 L229	Y153-S155 PolarHBondContact O-N 3.35Å; Y153-A161 HydrophobicContact CD1-CB 4.3Å; Y153-A161 HydrophobicContact CE1-CB 3.49Å; Y153-A161 VanDerWaalsContact CE1-CB 3.49Å; Y153-A161 HydrophobicContact CE2-CB 4.43Å; Y153-A161 WeakPolarHBondContact OH-CB 3.48Å; Y153-I163 HydrophobicContact CD2-CG1 3.76Å; Y153-I163 HydrophobicContact CE2-CG1 4.29Å; Y153-L227 PolarHBondContact N-O 3.18Å; Y153-V228 HydrophobicContact CD1-CG1 4.12Å; Y153-L229 PolarHBondContact O-N 3.41Å
154	D	83.9	Confident	82.9	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.011	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	104.2	173.7	174.4	11.4	0	0	0	109.5	I152 C156 F157 S158 A161 S162 R164	I152-D154 PolarHBondContact O-N 3.09Å; D154-C156 PolarHBondContact OD1-N 2.77Å; D154-F157 WeakPolarHBondContact OD1-CD2 3.36Å; D154-F157 PolarHBondContact OD1-N 2.85Å; D154-S158 PolarHBondContact OD2-OG 2.89Å; D154-A161 CarbonylContact O-C 3.54Å; D154-A161 VanDerWaalsContact O-CA 3.27Å; D154-A161 WeakPolarHBondContact O-CA 3.47Å; D154-A161 WeakPolarHBondContact O-CB 3.29Å; D154-S162 WeakPolarHBondContact CB-O 3.36Å; D154-S162 PolarHBondContact N-O 3.43Å; D154-S162 PolarHBondContact O-N 2.68Å; D154-R164 HydrophobicContact CB-CG 4.31Å; D154-R164 IonicContact OD2-CZ 2.73Å; D154-R164 IonicContact OD2-NE 3.02Å; D154-R164 PolarHBondContact OD2-NE 3.35Å; D154-R164 IonicContact OD2-NH2 3.28Å; D154-R164 PolarHBondContact OD2-NH2 3.28Å
155	S	75.9	Confident	83.3	Confident	43 Å²	43	60.1 Å²	60.1	30%	0.301	33%	0.33	S	S	.	.			trans	-103.8	7.7	173.6	69.6	0	0	0	0	113.6	Y153 L229	Y153-S155 PolarHBondContact O-N 3.35Å; S155-L229 PolarHBondContact OG-O 3.49Å
156	C	80.6	Confident	83.7	Confident	42 Å²	42	58.2 Å²	58.2	28%	0.284	32%	0.321	S	S	.	.	S	Bend	trans	-110.8	-37.5	-172.1	-67.2	0	0	0	0	113.8	D154 Y194 L229 R230	D154-C156 PolarHBondContact OD1-N 2.77Å; C156-Y194 HydrophobicContact CB-CE1 3.76Å; C156-L229 PolarHBondContact SG-O 2.85Å; C156-R230 VanDerWaalsContact SG-CA 3.56Å
157	F	81.2	Confident	84.2	Confident	62 Å²	62	57.3 Å²	57.3	27%	0.272	31%	0.31	S	S	.	.	S	Bend	trans	-106	-25	-178.7	-49.1	-73.9	0	0	0	112.6	D154 I181 L182 T185 Y194 L229	D154-F157 WeakPolarHBondContact OD1-CD2 3.36Å; D154-F157 PolarHBondContact OD1-N 2.85Å; F157-I181 HydrophobicContact CD2-CG2 4.47Å; F157-I181 HydrophobicContact CE2-CG2 4.11Å; F157-L182 HydrophobicContact CE1-CD2 4.23Å; F157-L182 HydrophobicContact CE2-CD2 4.47Å; F157-L182 HydrophobicContact CZ-CD2 3.58Å; F157-T185 HydrophobicContact CB-CG2 4.03Å; F157-T185 HydrophobicContact CD2-CG2 3.7Å; F157-T185 HydrophobicContact CE2-CG2 4.36Å; F157-T185 HydrophobicContact CG-CG2 3.92Å; F157-Y194 HydrophobicContact CE1-CE1 4.19Å; F157-Y194 AromaticContact CE1-CZ 3.83Å; F157-Y194 WeakPolarHBondContact CE1-OH 3.44Å; F157-Y194 AromaticContact CE2-CE1 3.99Å; F157-Y194 HydrophobicContact CE2-CE1 3.99Å; F157-Y194 HydrophobicContact CZ-CD1 4.38Å; F157-Y194 AromaticContact CZ-CE1 3.47Å; F157-Y194 HydrophobicContact CZ-CE1 3.47Å; F157-Y194 VanDerWaalsContact CZ-CE1 3.47Å; F157-Y194 HydrophobicContact CZ-CE2 4.3Å; F157-Y194 AromaticContact CZ-CZ 3.43Å; F157-Y194 VanDerWaalsContact CZ-CZ 3.43Å; F157-Y194 VanDerWaalsContact CZ-OH 3.26Å; F157-Y194 WeakPolarHBondContact CZ-OH 3.43Å; F157-L229 HydrophobicContact CD2-CD2 4.3Å; F157-L229 HydrophobicContact CE2-CD2 3.64Å
158	S	75.5	Confident	84.6	Confident	28 Å²	28	56.4 Å²	56.4	20%	0.196	30%	0.301	C	S	.	.			trans	-101.9	131.1	178.7	-62.6	0	0	0	0	112.2	D154 P160 A161 S162 R164	D154-S158 PolarHBondContact OD2-OG 2.89Å; S158-P160 CarbonylContact C-O 3.46Å; S158-P160 VanDerWaalsContact C-O 3.31Å; S158-P160 WeakPolarHBondContact CB-O 3.43Å; S158-P160 CarbonylContact O-C 3.4Å; S158-A161 WeakPolarHBondContact O-CA 3.42Å; S158-A161 PolarHBondContact O-N 2.94Å; S158-S162 WeakPolarHBondContact CB-OG 3.44Å; S158-S162 PolarHBondContact OG-OG 2.92Å; S158-R164 PolarHBondContact OG-NH2 3.03Å
159	N	74	Confident	84.7	Confident	164 Å²	164	55.8 Å²	55.8	88%	0.877	30%	0.295	S	S	*	.	S	Bend	trans	-132.2	109.7	167.2	-172.2	7.1	0	0	0	109.4
160	P	75.8	Confident	84.6	Confident	113 Å²	113	57.1 Å²	57.1	73%	0.734	30%	0.295	S	S	*	.	S	Bend	cis	-64.7	153.8	1.9	29.5	-36.8	0	0	0	113.1	S158	S158-P160 CarbonylContact C-O 3.46Å; S158-P160 VanDerWaalsContact C-O 3.31Å; S158-P160 WeakPolarHBondContact CB-O 3.43Å; S158-P160 CarbonylContact O-C 3.4Å
161	A	77.3	Confident	84.5	Confident	33 Å²	33	60.2 Å²	60.2	27%	0.273	31%	0.314	S	S	.	.			trans	-60.4	137.6	-179.5	0	0	0	0	0	112.2	Y153 D154 S158	Y153-A161 HydrophobicContact CD1-CB 4.3Å; Y153-A161 HydrophobicContact CE1-CB 3.49Å; Y153-A161 VanDerWaalsContact CE1-CB 3.49Å; Y153-A161 HydrophobicContact CE2-CB 4.43Å; Y153-A161 WeakPolarHBondContact OH-CB 3.48Å; D154-A161 CarbonylContact O-C 3.54Å; D154-A161 VanDerWaalsContact O-CA 3.27Å; D154-A161 WeakPolarHBondContact O-CA 3.47Å; D154-A161 WeakPolarHBondContact O-CB 3.29Å; S158-A161 WeakPolarHBondContact O-CA 3.42Å; S158-A161 PolarHBondContact O-N 2.94Å
162	S	81.9	Confident	84.6	Confident	33 Å²	33	55 Å²	55	23%	0.231	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	141.1	-166.5	64.2	0	0	0	0	112.5	D154 S158 R164	D154-S162 WeakPolarHBondContact CB-O 3.36Å; D154-S162 PolarHBondContact N-O 3.43Å; D154-S162 PolarHBondContact O-N 2.68Å; S158-S162 WeakPolarHBondContact CB-OG 3.44Å; S158-S162 PolarHBondContact OG-OG 2.92Å; S162-R164 PolarHBondContact O-N 3.44Å
163	I	85.3	Confident	84.7	Confident	110 Å²	110	55.7 Å²	55.7	56%	0.564	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.3	115.9	167.4	-61.7	166.5	0	0	0	108.5	K151 I152 Y153	K151-I163 HydrophobicContact CB-CG2 4.15Å; I152-I163 WeakPolarHBondContact O-CA 3.43Å; Y153-I163 HydrophobicContact CD2-CG1 3.76Å; Y153-I163 HydrophobicContact CE2-CG1 4.29Å
164	R	85.6	Confident	85	Confident	67 Å²	67	51.3 Å²	51.3	25%	0.253	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	150.2	167.6	-61.5	-174.2	-166.8	-88.7	-4.3	109.4	I152 D154 S158 S162 F166	I152-R164 PolarHBondContact N-O 2.73Å; I152-R164 PolarHBondContact O-N 2.91Å; D154-R164 HydrophobicContact CB-CG 4.31Å; D154-R164 IonicContact OD2-CZ 2.73Å; D154-R164 IonicContact OD2-NE 3.02Å; D154-R164 PolarHBondContact OD2-NE 3.35Å; D154-R164 IonicContact OD2-NH2 3.28Å; D154-R164 PolarHBondContact OD2-NH2 3.28Å; S158-R164 PolarHBondContact OG-NH2 3.03Å; S162-R164 PolarHBondContact O-N 3.44Å; R164-F166 HydrophobicContact CB-CD2 4.3Å; R164-F166 HydrophobicContact CB-CE2 3.49Å; R164-F166 VanDerWaalsContact CB-CE2 3.49Å; R164-F166 HydrophobicContact CB-CZ 4.07Å
165	Q	89.9	Confident	85.4	Confident	112 Å²	112	55.1 Å²	55.1	52%	0.523	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	127.2	178.6	-50.8	-164.2	55.8	0	0	109.1	V149 L150 K151	V149-Q165 HydrophobicContact CG1-CB 4.25Å; L150-Q165 WeakPolarHBondContact O-CA 3.27Å; K151-Q165 HydrophobicContact CG-CG 4.17Å
166	F	90.5	Very high	86.2	Confident	17 Å²	17	55.2 Å²	55.2	8%	0.075	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	129.2	-179	-63.7	-93.6	0	0	0	109.2	V149 L150 I152 R164 I168 L177 L180 I181 V184	V149-F166 WeakPolarHBondContact CA-O 3.45Å; L150-F166 PolarHBondContact N-O 3.02Å; L150-F166 PolarHBondContact O-N 2.65Å; I152-F166 HydrophobicContact CD1-CD2 3.6Å; I152-F166 HydrophobicContact CD1-CE2 3.88Å; I152-F166 HydrophobicContact CG1-CD2 4.16Å; I152-F166 HydrophobicContact CG1-CE2 4.49Å; R164-F166 HydrophobicContact CB-CD2 4.3Å; R164-F166 HydrophobicContact CB-CE2 3.49Å; R164-F166 VanDerWaalsContact CB-CE2 3.49Å; R164-F166 HydrophobicContact CB-CZ 4.07Å; F166-I168 HydrophobicContact CB-CG2 3.82Å; F166-L177 HydrophobicContact CB-CD1 4.42Å; F166-L177 HydrophobicContact CG-CD1 4.41Å; F166-L180 HydrophobicContact CD1-CD2 3.93Å; F166-L180 HydrophobicContact CD1-CG 4.17Å; F166-L180 HydrophobicContact CE1-CG 4.32Å; F166-I181 HydrophobicContact CE1-CG1 4.15Å; F166-I181 HydrophobicContact CE2-CG1 3.74Å; F166-I181 HydrophobicContact CZ-CB 4.22Å; F166-I181 HydrophobicContact CZ-CG1 3.52Å; F166-I181 HydrophobicContact CZ-CG2 4.41Å; F166-V184 HydrophobicContact CE1-CB 4.34Å; F166-V184 HydrophobicContact CE1-CG1 4.43Å; F166-V184 HydrophobicContact CE1-CG2 4.13Å
167	H	90.5	Very high	86.8	Confident	74 Å²	74	53.2 Å²	53.2	34%	0.343	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	120.6	165.3	-174.2	-110.2	0	0	0	107.8	L58 G148	L58-H167 VanDerWaalsContact CD1-ND1 3.3Å; L58-H167 WeakPolarHBondContact CD1-ND1 3.46Å; L58-H167 WeakPolarHBondContact CD1-O 3.5Å; G148-H167 WeakPolarHBondContact O-CA 3.11Å
168	I	92.6	Very high	87.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	158	-172.9	68.4	176.9	0	0	0	111.7	D55 G147 G148 L150 F166 L177 L180 L215	D55-I168 HydrophobicContact CB-CB 4.46Å; D55-I168 HydrophobicContact CB-CG2 4.26Å; D55-I168 WeakPolarHBondContact OD2-CA 3.03Å; D55-I168 VanDerWaalsContact OD2-CB 3.27Å; D55-I168 WeakPolarHBondContact OD2-CB 3.32Å; G147-I168 CarbonylContact C-O 3.6Å; G147-I168 WeakPolarHBondContact CA-O 3.45Å; G148-I168 PolarHBondContact N-O 2.87Å; G148-I168 PolarHBondContact O-N 3.36Å; L150-I168 HydrophobicContact CB-CD1 4.08Å; L150-I168 HydrophobicContact CB-CG1 4.43Å; L150-I168 HydrophobicContact CD2-CD1 3.6Å; F166-I168 HydrophobicContact CB-CG2 3.82Å; I168-L177 HydrophobicContact CD1-CD1 4.36Å; I168-L177 HydrophobicContact CD1-CD2 4.09Å; I168-L177 HydrophobicContact CG2-CD1 4.04Å; I168-L180 HydrophobicContact CG2-CD2 4.32Å; I168-L215 HydrophobicContact CD1-CB 4.19Å; I168-L215 HydrophobicContact CG1-CB 4.31Å; I168-L215 HydrophobicContact CG1-CD2 4.39Å
169	A	90.5	Very high	88.2	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	158.4	174.7	0	0	0	0	0	112.2	D55 N57 L58 T171 T172	D55-A169 PolarHBondContact OD2-N 3.16Å; N57-A169 HydrophobicContact CB-CB 3.86Å; N57-A169 VanDerWaalsContact O-CB 3.26Å; N57-A169 WeakPolarHBondContact O-CB 3.36Å; L58-A169 HydrophobicContact CD2-CB 4.21Å; A169-T171 WeakPolarHBondContact CB-OG1 3.34Å; A169-T171 PolarHBondContact O-N 2.85Å; A169-T172 PolarHBondContact O-N 3.05Å
170	K	88.1	Confident	89	Confident	90 Å²	90	45.2 Å²	45.2	39%	0.391	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-20	173.5	-66.7	168.8	-175.9	161.1	0	112.9	L215 L216	K170-L215 HydrophobicContact CG-CD2 3.95Å; K170-L216 HydrophobicContact CB-CD2 4.24Å; K170-L216 HydrophobicContact CG-CD2 4.38Å
171	T	87.6	Confident	89.8	Confident	69 Å²	69	39.9 Å²	39.9	42%	0.423	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-8.6	179	42.4	0	0	0	0	113.9	A169 C173 Y213	A169-T171 WeakPolarHBondContact CB-OG1 3.34Å; A169-T171 PolarHBondContact O-N 2.85Å; T171-C173 PolarHBondContact O-N 3.26Å; T171-Y213 VanDerWaalsContact O-CD1 3.29Å; T171-Y213 WeakPolarHBondContact O-CD1 3.45Å; T171-Y213 WeakPolarHBondContact O-CE1 3.21Å
172	T	91.4	Very high	90.4	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.006	19%	0.191	C	C	.	.			trans	-75.9	121.8	-178.4	-58.2	0	0	0	0	110.5	D55 N57 A169 E176 P214	D55-T172 VanDerWaalsContact CG-OG1 3.3Å; D55-T172 PolarHBondContact OD1-OG1 3.29Å; D55-T172 WeakPolarHBondContact OD2-CB 3.49Å; D55-T172 PolarHBondContact OD2-OG1 2.97Å; N57-T172 WeakPolarHBondContact CB-OG1 3.34Å; N57-T172 PolarHBondContact ND2-OG1 3.39Å; N57-T172 VanDerWaalsContact ND2-OG1 3.17Å; A169-T172 PolarHBondContact O-N 3.05Å; T172-E176 WeakPolarHBondContact CA-OE2 3.25Å; T172-E176 HydrophobicContact CG2-CB 3.89Å; T172-P214 WeakPolarHBondContact O-CD 3.48Å
173	C	92.9	Very high	90.7	Very high	15 Å²	15	40 Å²	40	10%	0.101	20%	0.198	C	C	.	.			trans	-86.9	171.1	-178.9	75.1	0	0	0	0	112.7	T171 E175 E176 L177 P210 D212 Y213	T171-C173 PolarHBondContact O-N 3.26Å; C173-E175 VanDerWaalsContact C-N 3.26Å; C173-E175 PolarHBondContact O-N 3.23Å; C173-E176 PolarHBondContact N-OE2 2.87Å; C173-E176 PolarHBondContact O-N 3.14Å; C173-E176 PolarHBondContact SG-OE2 3.34Å; C173-L177 WeakPolarHBondContact O-CB 3.43Å; C173-L177 PolarHBondContact O-N 3.33Å; C173-P210 WeakPolarHBondContact CB-O 3.49Å; C173-P210 PolarHBondContact SG-O 3.26Å; C173-D212 CarbonylContact C-O 3.58Å; C173-Y213 HydrophobicContact CB-CD1 4.14Å; C173-Y213 HydrophobicContact CB-CE1 4.24Å
174	S	93.5	Very high	90.7	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.014	18%	0.184	C	C	.	.	H	α-helix	trans	-61.1	-34.2	-177.5	-61.1	0	0	0	0	112.9	I178 R209 P210 D212 P214	S174-I178 WeakPolarHBondContact O-CD1 3.36Å; S174-I178 WeakPolarHBondContact O-CG1 3.43Å; S174-I178 PolarHBondContact O-N 3.39Å; S174-I178 VanDerWaalsContact O-N 3.1Å; S174-R209 WeakPolarHBondContact CB-O 3.47Å; S174-R209 PolarHBondContact OG-O 2.86Å; S174-P210 WeakPolarHBondContact CB-O 3.35Å; S174-P210 PolarHBondContact N-O 3.21Å; S174-P210 VanDerWaalsContact N-O 3.08Å; S174-D212 PolarHBondContact N-O 3.35Å; S174-D212 PolarHBondContact OG-O 3.48Å; S174-P214 WeakPolarHBondContact OG-CG 3.44Å
175	E	93.3	Very high	90.7	Very high	82 Å²	82	35.1 Å²	35.1	38%	0.383	18%	0.181	S	C	.	.	H	α-helix	trans	-69.3	-48.1	179.8	-161.9	164.1	-174.5	0	0	111.8	C173 L177 I178 D179 V191 P210	C173-E175 VanDerWaalsContact C-N 3.26Å; C173-E175 PolarHBondContact O-N 3.23Å; E175-L177 VanDerWaalsContact C-N 3.31Å; E175-L177 PolarHBondContact O-N 3.31Å; E175-I178 PolarHBondContact O-N 3.41Å; E175-D179 PolarHBondContact O-N 3.38Å; E175-V191 HydrophobicContact CG-CG1 3.71Å; E175-V191 WeakPolarHBondContact O-CG1 3.4Å; E175-P210 HydrophobicContact CB-CB 4.03Å; E175-P210 HydrophobicContact CG-CB 4.4Å; E175-P210 PolarHBondContact N-O 2.57Å; E175-P210 VanDerWaalsContact OE2-CB 3.29Å; E175-P210 WeakPolarHBondContact OE2-CB 3.4Å
176	E	92.2	Very high	90.5	Very high	45 Å²	45	35.6 Å²	35.6	21%	0.21	20%	0.195	C	C	.	.	H	α-helix	trans	-64	-35.4	175.5	-63.3	166.7	118.6	0	0	112.5	K39 N57 T172 C173 I178 D179 L180	K39-E176 WeakPolarHBondContact CE-OE1 3.46Å; K39-E176 IonicContact NZ-OE1 3.68Å; K39-E176 PolarHBondContact NZ-OE1 2.98Å; N57-E176 VanDerWaalsContact ND2-CD 3.28Å; N57-E176 PolarHBondContact ND2-OE1 2.92Å; N57-E176 PolarHBondContact ND2-OE2 3.18Å; T172-E176 WeakPolarHBondContact CA-OE2 3.25Å; T172-E176 HydrophobicContact CG2-CB 3.89Å; C173-E176 PolarHBondContact N-OE2 2.87Å; C173-E176 PolarHBondContact O-N 3.14Å; C173-E176 PolarHBondContact SG-OE2 3.34Å; E176-I178 VanDerWaalsContact C-N 3.34Å; E176-D179 WeakPolarHBondContact O-CB 3.44Å; E176-D179 PolarHBondContact O-N 3Å; E176-L180 WeakPolarHBondContact O-CB 3.45Å; E176-L180 PolarHBondContact O-N 3.04Å
177	L	93.6	Very high	90.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-67.6	-36.1	175.4	-177.5	54.8	0	0	0	111.6	L150 I152 F166 I168 C173 E175 L180 I181 L196 P214	L150-L177 HydrophobicContact CD2-CD2 3.56Å; I152-L177 HydrophobicContact CD1-CD1 3.92Å; I152-L177 HydrophobicContact CD1-CD2 3.74Å; I152-L177 HydrophobicContact CD1-CG 3.91Å; F166-L177 HydrophobicContact CB-CD1 4.42Å; F166-L177 HydrophobicContact CG-CD1 4.41Å; I168-L177 HydrophobicContact CD1-CD1 4.36Å; I168-L177 HydrophobicContact CD1-CD2 4.09Å; I168-L177 HydrophobicContact CG2-CD1 4.04Å; C173-L177 WeakPolarHBondContact O-CB 3.43Å; C173-L177 PolarHBondContact O-N 3.33Å; E175-L177 VanDerWaalsContact C-N 3.31Å; E175-L177 PolarHBondContact O-N 3.31Å; L177-L180 HydrophobicContact CD1-CD2 4.5Å; L177-L180 PolarHBondContact O-N 3.32Å; L177-I181 HydrophobicContact CG-CD1 4.35Å; L177-I181 WeakPolarHBondContact O-CD1 3.38Å; L177-I181 WeakPolarHBondContact O-CG1 3.39Å; L177-I181 PolarHBondContact O-N 3Å; L177-L196 HydrophobicContact CB-CD1 4.46Å; L177-L196 HydrophobicContact CD2-CD1 3.75Å; L177-L196 HydrophobicContact CG-CD1 4.27Å; L177-P214 HydrophobicContact CD2-CB 3.92Å; L177-P214 HydrophobicContact CD2-CG 3.78Å
178	I	93.6	Very high	90	Very high	8 Å²	8	38.5 Å²	38.5	4%	0.041	23%	0.226	C	C	.	.	H	α-helix	trans	-69.1	-42.2	174	-68.8	164.9	0	0	0	110.5	S174 E175 E176 L180 I181 L182 V191 Y194 L196 L229	S174-I178 WeakPolarHBondContact O-CD1 3.36Å; S174-I178 WeakPolarHBondContact O-CG1 3.43Å; S174-I178 PolarHBondContact O-N 3.39Å; S174-I178 VanDerWaalsContact O-N 3.1Å; E175-I178 PolarHBondContact O-N 3.41Å; E176-I178 VanDerWaalsContact C-N 3.34Å; I178-L180 VanDerWaalsContact C-N 3.32Å; I178-L180 PolarHBondContact O-N 2.93Å; I178-I181 PolarHBondContact O-N 2.98Å; I178-I181 VanDerWaalsContact O-N 3.17Å; I178-L182 HydrophobicContact CG2-CD1 3.79Å; I178-L182 HydrophobicContact CG2-CG 4.31Å; I178-L182 WeakPolarHBondContact O-CB 3.38Å; I178-L182 VanDerWaalsContact O-CG 3.3Å; I178-L182 WeakPolarHBondContact O-CG 3.28Å; I178-L182 PolarHBondContact O-N 3Å; I178-V191 HydrophobicContact CB-CG1 3.88Å; I178-V191 HydrophobicContact CG2-CB 4.41Å; I178-V191 HydrophobicContact CG2-CG1 3.68Å; I178-Y194 HydrophobicContact CG2-CG 4.43Å; I178-L196 HydrophobicContact CD1-CG 4.28Å; I178-L196 HydrophobicContact CG1-CG 4.18Å; I178-L229 HydrophobicContact CG1-CD1 4.01Å
179	D	92.1	Very high	89.9	Confident	64 Å²	64	41.3 Å²	41.3	34%	0.342	24%	0.241	S	C	.	.	H	α-helix	trans	-55.5	-44.5	172.4	-172.8	43.5	0	0	0	111.8	K43 E175 E176 L182 T183 V191	K43-D179 IonicContact NZ-OD2 3.44Å; E175-D179 PolarHBondContact O-N 3.38Å; E176-D179 WeakPolarHBondContact O-CB 3.44Å; E176-D179 PolarHBondContact O-N 3Å; D179-L182 PolarHBondContact O-N 2.95Å; D179-T183 WeakPolarHBondContact O-CB 3.33Å; D179-T183 PolarHBondContact O-N 2.82Å; D179-T183 PolarHBondContact O-OG1 2.87Å; D179-V191 HydrophobicContact CB-CG2 4.08Å
180	L	91.3	Very high	89.8	Confident	14 Å²	14	44.4 Å²	44.4	7%	0.073	26%	0.261	C	S	.	.	H	α-helix	trans	-65	-40.3	175.1	-176.2	64.2	0	0	0	112.7	D55 F166 I168 E176 L177 I178 V184	D55-L180 HydrophobicContact CB-CD2 4.01Å; F166-L180 HydrophobicContact CD1-CD2 3.93Å; F166-L180 HydrophobicContact CD1-CG 4.17Å; F166-L180 HydrophobicContact CE1-CG 4.32Å; I168-L180 HydrophobicContact CG2-CD2 4.32Å; E176-L180 WeakPolarHBondContact O-CB 3.45Å; E176-L180 PolarHBondContact O-N 3.04Å; L177-L180 HydrophobicContact CD1-CD2 4.5Å; L177-L180 PolarHBondContact O-N 3.32Å; I178-L180 VanDerWaalsContact C-N 3.32Å; I178-L180 PolarHBondContact O-N 2.93Å; L180-V184 WeakPolarHBondContact O-CB 3.45Å; L180-V184 WeakPolarHBondContact O-CG2 3.33Å; L180-V184 PolarHBondContact O-N 3.03Å
181	I	91.4	Very high	89.9	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.01	25%	0.252	C	S	.	.	H	α-helix	trans	-65.5	-46.8	175.7	-62.6	158.7	0	0	0	110.6	I152 F157 F166 L177 I178 T183 V184 T185 L196 L229	I152-I181 HydrophobicContact CD1-CD1 3.67Å; I152-I181 HydrophobicContact CD1-CG1 4.28Å; I152-I181 HydrophobicContact CG2-CD1 4.35Å; F157-I181 HydrophobicContact CD2-CG2 4.47Å; F157-I181 HydrophobicContact CE2-CG2 4.11Å; F166-I181 HydrophobicContact CE1-CG1 4.15Å; F166-I181 HydrophobicContact CE2-CG1 3.74Å; F166-I181 HydrophobicContact CZ-CB 4.22Å; F166-I181 HydrophobicContact CZ-CG1 3.52Å; F166-I181 HydrophobicContact CZ-CG2 4.41Å; L177-I181 HydrophobicContact CG-CD1 4.35Å; L177-I181 WeakPolarHBondContact O-CD1 3.38Å; L177-I181 WeakPolarHBondContact O-CG1 3.39Å; L177-I181 PolarHBondContact O-N 3Å; I178-I181 PolarHBondContact O-N 2.98Å; I178-I181 VanDerWaalsContact O-N 3.17Å; I181-T183 VanDerWaalsContact C-N 3.31Å; I181-T183 PolarHBondContact O-N 2.78Å; I181-V184 CarbonylContact O-C 3.55Å; I181-V184 PolarHBondContact O-N 3.37Å; I181-V184 VanDerWaalsContact O-N 3.15Å; I181-T185 HydrophobicContact CG2-CG2 4.3Å; I181-T185 WeakPolarHBondContact O-CG2 3.4Å; I181-T185 PolarHBondContact O-N 3.23Å; I181-T185 PolarHBondContact O-OG1 3.13Å; I181-T185 VanDerWaalsContact O-OG1 3.11Å; I181-L196 HydrophobicContact CD1-CD2 4.48Å; I181-L229 HydrophobicContact CD1-CD1 4.42Å; I181-L229 HydrophobicContact CD1-CD2 4.16Å; I181-L229 HydrophobicContact CG2-CD2 3.83Å
182	L	90.8	Very high	90	Very high	6 Å²	6	42.1 Å²	42.1	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-59.5	-42.3	178.7	-72.5	163.9	0	0	0	111.3	F157 I178 D179 T185 C186 S187 D189 V191 Y194	F157-L182 HydrophobicContact CE1-CD2 4.23Å; F157-L182 HydrophobicContact CE2-CD2 4.47Å; F157-L182 HydrophobicContact CZ-CD2 3.58Å; I178-L182 HydrophobicContact CG2-CD1 3.79Å; I178-L182 HydrophobicContact CG2-CG 4.31Å; I178-L182 WeakPolarHBondContact O-CB 3.38Å; I178-L182 VanDerWaalsContact O-CG 3.3Å; I178-L182 WeakPolarHBondContact O-CG 3.28Å; I178-L182 PolarHBondContact O-N 3Å; D179-L182 PolarHBondContact O-N 2.95Å; L182-T185 CarbonylContact O-C 3.31Å; L182-T185 PolarHBondContact O-N 2.59Å; L182-T185 PolarHBondContact O-OG1 3.38Å; L182-C186 PolarHBondContact O-N 2.82Å; L182-S187 PolarHBondContact O-N 3.44Å; L182-D189 HydrophobicContact CD2-CB 4.4Å; L182-V191 HydrophobicContact CD1-CB 4.33Å; L182-V191 HydrophobicContact CD1-CG2 3.94Å; L182-Y194 HydrophobicContact CD2-CD2 4.34Å; L182-Y194 HydrophobicContact CD2-CE2 4.06Å
183	T	87.3	Confident	89.9	Confident	61 Å²	61	45.8 Å²	45.8	37%	0.374	27%	0.274	S	S	.	.	H	α-helix	trans	-59.7	-47.3	173.4	-60.4	0	0	0	0	111.4	L53 D179 I181 T185 C186	L53-T183 HydrophobicContact CD2-CG2 4.13Å; D179-T183 WeakPolarHBondContact O-CB 3.33Å; D179-T183 PolarHBondContact O-N 2.82Å; D179-T183 PolarHBondContact O-OG1 2.87Å; I181-T183 VanDerWaalsContact C-N 3.31Å; I181-T183 PolarHBondContact O-N 2.78Å; T183-T185 VanDerWaalsContact C-N 3.34Å; T183-T185 PolarHBondContact O-N 2.89Å; T183-C186 PolarHBondContact O-N 3.48Å
184	V	86.7	Confident	89.9	Confident	45 Å²	45	45.6 Å²	45.6	27%	0.273	27%	0.272	S	S	.	.	H	α-helix	trans	-68.6	-28.1	178.7	166.2	0	0	0	0	113.1	L53 F166 L180 I181	L53-V184 HydrophobicContact CB-CG2 4.07Å; L53-V184 HydrophobicContact CD2-CG2 3.96Å; L53-V184 HydrophobicContact CG-CG2 4.42Å; F166-V184 HydrophobicContact CE1-CB 4.34Å; F166-V184 HydrophobicContact CE1-CG1 4.43Å; F166-V184 HydrophobicContact CE1-CG2 4.13Å; L180-V184 WeakPolarHBondContact O-CB 3.45Å; L180-V184 WeakPolarHBondContact O-CG2 3.33Å; L180-V184 PolarHBondContact O-N 3.03Å; I181-V184 CarbonylContact O-C 3.55Å; I181-V184 PolarHBondContact O-N 3.37Å; I181-V184 VanDerWaalsContact O-N 3.15Å
185	T	85.3	Confident	89.8	Confident	31 Å²	31	46 Å²	46	19%	0.19	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	2.7	174.8	60	0	0	0	0	113.8	F157 I181 L182 T183 S187	F157-T185 HydrophobicContact CB-CG2 4.03Å; F157-T185 HydrophobicContact CD2-CG2 3.7Å; F157-T185 HydrophobicContact CE2-CG2 4.36Å; F157-T185 HydrophobicContact CG-CG2 3.92Å; I181-T185 HydrophobicContact CG2-CG2 4.3Å; I181-T185 WeakPolarHBondContact O-CG2 3.4Å; I181-T185 PolarHBondContact O-N 3.23Å; I181-T185 PolarHBondContact O-OG1 3.13Å; I181-T185 VanDerWaalsContact O-OG1 3.11Å; L182-T185 CarbonylContact O-C 3.31Å; L182-T185 PolarHBondContact O-N 2.59Å; L182-T185 PolarHBondContact O-OG1 3.38Å; T183-T185 VanDerWaalsContact C-N 3.34Å; T183-T185 PolarHBondContact O-N 2.89Å; T185-S187 PolarHBondContact O-N 2.99Å
186	C	84.5	Confident	89.8	Confident	121 Å²	121	42.1 Å²	42.1	82%	0.818	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	34.2	-176	-56.5	0	0	0	0	113.5	L182 T183	L182-C186 PolarHBondContact O-N 2.82Å; T183-C186 PolarHBondContact O-N 3.48Å
187	S	86	Confident	89.6	Confident	30 Å²	30	40.2 Å²	40.2	21%	0.21	25%	0.247	C	C	.	.			trans	-85.8	137	178	-176.2	0	0	0	0	111.2	L182 T185 D189	L182-S187 PolarHBondContact O-N 3.44Å; T185-S187 PolarHBondContact O-N 2.99Å; S187-D189 PolarHBondContact OG-N 3.47Å
188	S	85.8	Confident	89.3	Confident	122 Å²	122	41.2 Å²	41.2	85%	0.853	25%	0.252	S	S	*	.			trans	-91.7	2.5	171.4	57.8	0	0	0	0	113.6
189	D	89.4	Confident	88.7	Confident	59 Å²	59	43.5 Å²	43.5	32%	0.316	26%	0.263	S	S	.	.	S	Bend	trans	-68.9	143.4	179.1	-71.7	3.1	0	0	0	110.3	L182 S187 Y194 K231	L182-D189 HydrophobicContact CD2-CB 4.4Å; S187-D189 PolarHBondContact OG-N 3.47Å; D189-Y194 HydrophobicContact CB-CE2 3.76Å; D189-Y194 PolarHBondContact OD2-OH 2.91Å; D189-K231 IonicContact OD2-NZ 3.88Å; D189-K231 PolarHBondContact OD2-NZ 3.26Å
190	P	89	Confident	87.7	Confident	66 Å²	66	41.5 Å²	41.5	43%	0.429	26%	0.258	S	S	.	.			trans	-72.1	142.1	-177.3	30.2	-35.3	0	0	0	112	T192 D193	P190-T192 PolarHBondContact O-N 2.82Å; P190-D193 HydrophobicContact CG-CB 4.33Å; P190-D193 PolarHBondContact O-N 2.82Å
191	V	90	Very high	86.3	Confident	33 Å²	33	47 Å²	47	20%	0.2	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-48.7	-34.7	177.2	-170.5	0	0	0	0	112.2	E175 I178 D179 L182 D193 Y194	E175-V191 HydrophobicContact CG-CG1 3.71Å; E175-V191 WeakPolarHBondContact O-CG1 3.4Å; I178-V191 HydrophobicContact CB-CG1 3.88Å; I178-V191 HydrophobicContact CG2-CB 4.41Å; I178-V191 HydrophobicContact CG2-CG1 3.68Å; D179-V191 HydrophobicContact CB-CG2 4.08Å; L182-V191 HydrophobicContact CD1-CB 4.33Å; L182-V191 HydrophobicContact CD1-CG2 3.94Å; V191-D193 PolarHBondContact O-N 3.46Å; V191-Y194 PolarHBondContact O-N 3.24Å
192	T	89.4	Confident	84.6	Confident	77 Å²	77	53.5 Å²	53.5	47%	0.472	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-62.8	-20.8	-178.8	53.4	0	0	0	0	115.6	P190 Y194 K232	P190-T192 PolarHBondContact O-N 2.82Å; T192-Y194 VanDerWaalsContact C-N 3.34Å; T192-K232 WeakPolarHBondContact O-CD 3.49Å; T192-K232 PolarHBondContact O-NZ 2.84Å
193	D	90.3	Very high	82.9	Confident	79 Å²	79	60.2 Å²	60.2	42%	0.422	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-89.2	-5.6	-174.9	-76.2	17.7	0	0	0	112.7	P190 V191 K231 K232	P190-D193 HydrophobicContact CG-CB 4.33Å; P190-D193 PolarHBondContact O-N 2.82Å; V191-D193 PolarHBondContact O-N 3.46Å; D193-K231 CarbonylContact O-C 3.52Å; D193-K231 WeakPolarHBondContact O-CA 3.38Å; D193-K232 VanDerWaalsContact O-CB 3.28Å; D193-K232 WeakPolarHBondContact O-CB 3.5Å; D193-K232 PolarHBondContact O-N 3.5Å
194	Y	92.8	Very high	81.5	Confident	11 Å²	11	65 Å²	65	4%	0.043	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	160.3	-178.5	-73.5	-97.6	0	0	0	111.5	C156 F157 I178 L182 D189 V191 T192 L229 R230 K231	C156-Y194 HydrophobicContact CB-CE1 3.76Å; F157-Y194 HydrophobicContact CE1-CE1 4.19Å; F157-Y194 AromaticContact CE1-CZ 3.83Å; F157-Y194 WeakPolarHBondContact CE1-OH 3.44Å; F157-Y194 AromaticContact CE2-CE1 3.99Å; F157-Y194 HydrophobicContact CE2-CE1 3.99Å; F157-Y194 HydrophobicContact CZ-CD1 4.38Å; F157-Y194 AromaticContact CZ-CE1 3.47Å; F157-Y194 HydrophobicContact CZ-CE1 3.47Å; F157-Y194 VanDerWaalsContact CZ-CE1 3.47Å; F157-Y194 HydrophobicContact CZ-CE2 4.3Å; F157-Y194 AromaticContact CZ-CZ 3.43Å; F157-Y194 VanDerWaalsContact CZ-CZ 3.43Å; F157-Y194 VanDerWaalsContact CZ-OH 3.26Å; F157-Y194 WeakPolarHBondContact CZ-OH 3.43Å; I178-Y194 HydrophobicContact CG2-CG 4.43Å; L182-Y194 HydrophobicContact CD2-CD2 4.34Å; L182-Y194 HydrophobicContact CD2-CE2 4.06Å; D189-Y194 HydrophobicContact CB-CE2 3.76Å; D189-Y194 PolarHBondContact OD2-OH 2.91Å; V191-Y194 PolarHBondContact O-N 3.24Å; T192-Y194 VanDerWaalsContact C-N 3.34Å; Y194-L229 HydrophobicContact CD1-CD1 4.09Å; Y194-L229 HydrophobicContact CD1-CD2 4.09Å; Y194-L229 HydrophobicContact CD1-CG 3.99Å; Y194-L229 HydrophobicContact CE1-CD2 4.44Å; Y194-R230 WeakPolarHBondContact CA-O 3.33Å; Y194-K231 HydrophobicContact CD1-CG 4.23Å; Y194-K231 HydrophobicContact CE1-CG 3.81Å; Y194-K231 HydrophobicContact CE2-CG 4.41Å; Y194-K231 WeakPolarHBondContact OH-CE 3.48Å; Y194-K231 PolarHBondContact OH-NZ 2.92Å; Y194-K231 VanDerWaalsContact OH-NZ 3.12Å
195	C	92	Very high	80.7	Confident	10 Å²	10	63.6 Å²	63.6	7%	0.068	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	148.9	169.5	61.2	0	0	0	0	111.1	I207 R230 A235	C195-I207 HydrophobicContact CB-CG2 3.91Å; C195-R230 PolarHBondContact N-O 2.85Å; C195-R230 PolarHBondContact O-N 2.62Å; C195-R230 VanDerWaalsContact O-N 3.09Å; C195-A235 WeakPolarHBondContact SG-CB 3.45Å
196	L	91.8	Very high	80.5	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.005	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	135.1	167.8	-64.1	169.3	0	0	0	109.4	I152 L177 I178 I181 L208 P214 L229	I152-L196 HydrophobicContact CG2-CD2 4.05Å; L177-L196 HydrophobicContact CB-CD1 4.46Å; L177-L196 HydrophobicContact CD2-CD1 3.75Å; L177-L196 HydrophobicContact CG-CD1 4.27Å; I178-L196 HydrophobicContact CD1-CG 4.28Å; I178-L196 HydrophobicContact CG1-CG 4.18Å; I181-L196 HydrophobicContact CD1-CD2 4.48Å; L196-L208 HydrophobicContact CB-CB 4.32Å; L196-L208 HydrophobicContact CB-CD2 4.25Å; L196-L208 PolarHBondContact O-N 3.07Å; L196-P214 HydrophobicContact CD1-CB 4.38Å; L196-P214 HydrophobicContact CD1-CG 3.91Å; L196-L229 HydrophobicContact CD2-CB 4.44Å; L196-L229 HydrophobicContact CD2-CD1 3.93Å
197	V	89.1	Confident	80.7	Confident	4 Å²	4	64.6 Å²	64.6	2%	0.024	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	120.1	177.4	-170.8	0	0	0	0	108.9	E199 R206 I207 L227 V228 R230 A235	V197-E199 HydrophobicContact CB-CG 4.31Å; V197-E199 HydrophobicContact CG1-CG 3.79Å; V197-E199 PolarHBondContact O-N 3.48Å; V197-R206 CarbonylContact C-O 3.57Å; V197-R206 WeakPolarHBondContact CA-O 3.15Å; V197-I207 HydrophobicContact CG2-CG1 4.28Å; V197-L227 WeakPolarHBondContact O-CA 3.44Å; V197-V228 PolarHBondContact N-O 3.18Å; V197-V228 PolarHBondContact O-N 3.34Å; V197-R230 HydrophobicContact CG2-CB 4.4Å; V197-R230 HydrophobicContact CG2-CG 4.23Å; V197-A235 HydrophobicContact CG2-CB 4.07Å
198	E	87.7	Confident	80.9	Confident	22 Å²	22	63.5 Å²	63.5	10%	0.103	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	102.6	168.6	177.8	-176.5	-167.9	0	0	108.4	G205 R206 L208 S221 L227	E198-G205 CarbonylContact O-C 3.52Å; E198-G205 VanDerWaalsContact O-CA 3.27Å; E198-G205 WeakPolarHBondContact O-CA 3.48Å; E198-R206 HydrophobicContact CB-CB 4.32Å; E198-R206 PolarHBondContact N-O 2.95Å; E198-R206 PolarHBondContact O-N 2.93Å; E198-L208 HydrophobicContact CB-CD1 3.89Å; E198-S221 WeakPolarHBondContact OE1-CB 3.44Å; E198-L227 HydrophobicContact CB-CD2 4.08Å
199	E	80.3	Confident	81.1	Confident	55 Å²	55	65.6 Å²	65.6	26%	0.257	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	98.3	177.8	-62.9	-165.5	165.6	0	0	109.7	V197 V226 V228 R230	V197-E199 HydrophobicContact CB-CG 4.31Å; V197-E199 HydrophobicContact CG1-CG 3.79Å; V197-E199 PolarHBondContact O-N 3.48Å; E199-V226 PolarHBondContact N-O 2.83Å; E199-V226 PolarHBondContact O-N 3.06Å; E199-V228 HydrophobicContact CB-CG2 4.12Å; E199-V228 HydrophobicContact CG-CB 4.42Å; E199-V228 HydrophobicContact CG-CG2 3.89Å; E199-R230 IonicContact OE1-CZ 3.22Å; E199-R230 IonicContact OE1-NE 2.77Å; E199-R230 PolarHBondContact OE1-NE 2.96Å; E199-R230 IonicContact OE1-NH2 2.85Å; E199-R230 PolarHBondContact OE1-NH2 2.81Å; E199-R230 IonicContact OE2-CZ 2.77Å; E199-R230 IonicContact OE2-NH2 3.68Å; E199-R230 PolarHBondContact OE2-NH2 3.32Å
200	G	71.3	Confident	81.1	Confident	23 Å²	23	66.4 Å²	66.4	24%	0.237	34%	0.341	C	S	.	.			trans	-88.5	168.7	175.5	0	0	0	0	0	113.9	N202 E203	G200-N202 PolarHBondContact O-N 2.68Å; G200-N202 VanDerWaalsContact O-N 3.11Å; G200-E203 PolarHBondContact O-N 3.18Å
201	I	61.3	Low	81.1	Confident	130 Å²	130	71.4 Å²	71.4	67%	0.667	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-30.1	-176.4	-57.8	173.4	0	0	0	113.1	E203 L224	I201-E203 VanDerWaalsContact C-N 3.32Å; I201-E203 PolarHBondContact O-N 2.76Å; I201-L224 HydrophobicContact CD1-CB 4.4Å; I201-L224 HydrophobicContact CD1-CD1 4.47Å
202	N	55.2	Low	81.2	Confident	138 Å²	138	70.5 Å²	70.5	74%	0.738	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	19.2	-169.8	-62.4	-11.6	0	0	0	114.6	G200 E204	G200-N202 PolarHBondContact O-N 2.68Å; G200-N202 VanDerWaalsContact O-N 3.11Å; N202-E204 PolarHBondContact O-N 3Å
203	E	55.4	Low	81.3	Confident	146 Å²	146	72.1 Å²	72.1	68%	0.682	35%	0.348	S	S	*	.	S	Bend	trans	59.6	-4.8	-175.5	-59.6	-171	-171.2	0	0	116.9	G200 I201 G205 R242	G200-E203 PolarHBondContact O-N 3.18Å; I201-E203 VanDerWaalsContact C-N 3.32Å; I201-E203 PolarHBondContact O-N 2.76Å; E203-G205 PolarHBondContact O-N 3.11Å; E203-G205 VanDerWaalsContact O-N 3.08Å; E203-R242 PolarHBondContact O-NH1 3.25Å
204	E	58.7	Low	81.4	Confident	162 Å²	162	68.3 Å²	68.3	76%	0.757	33%	0.328	S	S	*	.			trans	-81.5	80.4	173.2	-67.2	-172	169.4	0	0	110.9	N202 R206	N202-E204 PolarHBondContact O-N 3Å; E204-R206 PolarHBondContact O-N 3.18Å
205	G	70.7	Confident	81.2	Confident	16 Å²	16	68.1 Å²	68.1	17%	0.165	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-74.3	117.3	176.6	0	0	0	0	0	112.4	E198 E203	E198-G205 CarbonylContact O-C 3.52Å; E198-G205 VanDerWaalsContact O-CA 3.27Å; E198-G205 WeakPolarHBondContact O-CA 3.48Å; E203-G205 PolarHBondContact O-N 3.11Å; E203-G205 VanDerWaalsContact O-N 3.08Å
206	R	81.1	Confident	81	Confident	118 Å²	118	70.5 Å²	70.5	45%	0.445	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	125	179.5	174.5	-177.5	173.3	-172.2	-3.9	110.8	V197 E198 E204 D212	V197-R206 CarbonylContact C-O 3.57Å; V197-R206 WeakPolarHBondContact CA-O 3.15Å; E198-R206 HydrophobicContact CB-CB 4.32Å; E198-R206 PolarHBondContact N-O 2.95Å; E198-R206 PolarHBondContact O-N 2.93Å; E204-R206 PolarHBondContact O-N 3.18Å; R206-D212 IonicContact NH2-OD2 2.83Å
207	I	87.7	Confident	80.7	Confident	54 Å²	54	71.7 Å²	71.7	28%	0.277	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	128.4	168.9	-53.8	179.4	0	0	0	108.4	C195 V197 A235 L236	C195-I207 HydrophobicContact CB-CG2 3.91Å; V197-I207 HydrophobicContact CG2-CG1 4.28Å; I207-A235 HydrophobicContact CD1-CB 3.95Å; I207-A235 HydrophobicContact CG1-CB 4.48Å; I207-L236 HydrophobicContact CD1-CD2 4.48Å
208	L	89.6	Confident	80.4	Confident	8 Å²	8	73.9 Å²	73.9	4%	0.042	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-77.3	142.1	174	-79.2	66.7	0	0	0	109.9	L196 E198 D212 P214 I217 L227	L196-L208 HydrophobicContact CB-CB 4.32Å; L196-L208 HydrophobicContact CB-CD2 4.25Å; L196-L208 PolarHBondContact O-N 3.07Å; E198-L208 HydrophobicContact CB-CD1 3.89Å; L208-D212 HydrophobicContact CB-CB 4.47Å; L208-P214 HydrophobicContact CD2-CB 4.03Å; L208-P214 HydrophobicContact CD2-CG 4.11Å; L208-I217 HydrophobicContact CD2-CD1 3.97Å; L208-I217 HydrophobicContact CG-CD1 3.92Å; L208-L227 HydrophobicContact CD1-CD2 3.85Å; L208-L227 HydrophobicContact CD2-CD2 3.95Å
209	R	89.5	Confident	80.2	Confident	166 Å²	166	78 Å²	78	63%	0.626	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-79	153.7	175	-54.8	173.4	-63.2	178	7.4	109.5	S174 K211 D212	S174-R209 WeakPolarHBondContact CB-O 3.47Å; S174-R209 PolarHBondContact OG-O 2.86Å; R209-K211 PolarHBondContact O-N 2.96Å; R209-K211 VanDerWaalsContact O-N 3.11Å; R209-D212 HydrophobicContact CB-CB 4.47Å; R209-D212 WeakPolarHBondContact CB-OD2 3.24Å; R209-D212 WeakPolarHBondContact CG-OD2 3.39Å; R209-D212 IonicContact CZ-OD1 3.86Å; R209-D212 VanDerWaalsContact CZ-OD1 3.23Å; R209-D212 PolarHBondContact N-OD2 2.88Å; R209-D212 IonicContact NE-OD1 2.62Å; R209-D212 PolarHBondContact NE-OD1 3.16Å; R209-D212 IonicContact NE-OD2 2.62Å; R209-D212 PolarHBondContact NE-OD2 2.78Å; R209-D212 VanDerWaalsContact NE-OD2 3.16Å; R209-D212 IonicContact NH2-OD1 3.88Å; R209-D212 PolarHBondContact NH2-OD1 3.46Å; R209-D212 WeakPolarHBondContact O-CB 3.44Å; R209-D212 PolarHBondContact O-N 2.87Å
210	P	89.7	Confident	80.1	Confident	76 Å²	76	81.6 Å²	81.6	49%	0.494	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-40	-176.5	-27.5	34.7	0	0	0	114.1	C173 S174 E175	C173-P210 WeakPolarHBondContact CB-O 3.49Å; C173-P210 PolarHBondContact SG-O 3.26Å; S174-P210 WeakPolarHBondContact CB-O 3.35Å; S174-P210 PolarHBondContact N-O 3.21Å; S174-P210 VanDerWaalsContact N-O 3.08Å; E175-P210 HydrophobicContact CB-CB 4.03Å; E175-P210 HydrophobicContact CG-CB 4.4Å; E175-P210 PolarHBondContact N-O 2.57Å; E175-P210 VanDerWaalsContact OE2-CB 3.29Å; E175-P210 WeakPolarHBondContact OE2-CB 3.4Å
211	K	90.7	Very high	79.9	Confident	171 Å²	171	82 Å²	82	74%	0.743	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	7.5	178.3	-58.1	-170.5	177.9	-172.6	0	115.2	R209	R209-K211 PolarHBondContact O-N 2.96Å; R209-K211 VanDerWaalsContact O-N 3.11Å
212	D	91.3	Very high	79.9	Confident	13 Å²	13	85.7 Å²	85.7	7%	0.07	41%	0.412	C	S	.	.	S	Bend	trans	-79.8	136.1	172.4	-73.6	-19.1	0	0	0	110	C173 S174 R206 L208 R209 P214 I217	C173-D212 CarbonylContact C-O 3.58Å; S174-D212 PolarHBondContact N-O 3.35Å; S174-D212 PolarHBondContact OG-O 3.48Å; R206-D212 IonicContact NH2-OD2 2.83Å; L208-D212 HydrophobicContact CB-CB 4.47Å; R209-D212 HydrophobicContact CB-CB 4.47Å; R209-D212 WeakPolarHBondContact CB-OD2 3.24Å; R209-D212 WeakPolarHBondContact CG-OD2 3.39Å; R209-D212 IonicContact CZ-OD1 3.86Å; R209-D212 VanDerWaalsContact CZ-OD1 3.23Å; R209-D212 PolarHBondContact N-OD2 2.88Å; R209-D212 IonicContact NE-OD1 2.62Å; R209-D212 PolarHBondContact NE-OD1 3.16Å; R209-D212 IonicContact NE-OD2 2.62Å; R209-D212 PolarHBondContact NE-OD2 2.78Å; R209-D212 VanDerWaalsContact NE-OD2 3.16Å; R209-D212 IonicContact NH2-OD1 3.88Å; R209-D212 PolarHBondContact NH2-OD1 3.46Å; R209-D212 WeakPolarHBondContact O-CB 3.44Å; R209-D212 PolarHBondContact O-N 2.87Å; D212-P214 VanDerWaalsContact O-CD 3.27Å; D212-P214 WeakPolarHBondContact O-CD 3.24Å; D212-I217 HydrophobicContact CB-CD1 3.77Å
213	Y	92.1	Very high	79.9	Confident	111 Å²	111	81.8 Å²	81.8	44%	0.435	40%	0.396	S	S	.	.			trans	-85.2	107.3	-178.8	-54.1	-67.8	0	0	0	111.8	T171 C173 L215 L216 I217	T171-Y213 VanDerWaalsContact O-CD1 3.29Å; T171-Y213 WeakPolarHBondContact O-CD1 3.45Å; T171-Y213 WeakPolarHBondContact O-CE1 3.21Å; C173-Y213 HydrophobicContact CB-CD1 4.14Å; C173-Y213 HydrophobicContact CB-CE1 4.24Å; Y213-L215 PolarHBondContact O-N 3.42Å; Y213-L216 HydrophobicContact CD2-CD1 4.21Å; Y213-L216 HydrophobicContact CG-CD1 4.33Å; Y213-L216 PolarHBondContact O-N 2.94Å; Y213-I217 PolarHBondContact O-N 3.31Å
214	P	91.5	Very high	80.2	Confident	0 Å²	0	81.1 Å²	81.1	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-68.2	-35.3	-167.8	-24.8	38.7	0	0	0	113.9	L150 T172 S174 L177 L196 L208 D212 I217 V218 L227	L150-P214 HydrophobicContact CD2-CB 3.66Å; T172-P214 WeakPolarHBondContact O-CD 3.48Å; S174-P214 WeakPolarHBondContact OG-CG 3.44Å; L177-P214 HydrophobicContact CD2-CB 3.92Å; L177-P214 HydrophobicContact CD2-CG 3.78Å; L196-P214 HydrophobicContact CD1-CB 4.38Å; L196-P214 HydrophobicContact CD1-CG 3.91Å; L208-P214 HydrophobicContact CD2-CB 4.03Å; L208-P214 HydrophobicContact CD2-CG 4.11Å; D212-P214 VanDerWaalsContact O-CD 3.27Å; D212-P214 WeakPolarHBondContact O-CD 3.24Å; P214-I217 PolarHBondContact O-N 3.48Å; P214-V218 PolarHBondContact O-N 3.5Å; P214-L227 HydrophobicContact CB-CD1 3.93Å
215	L	88.7	Confident	80.5	Confident	7 Å²	7	74.1 Å²	74.1	4%	0.037	37%	0.367	C	S	.	.	H	α-helix	trans	-63.2	-43.1	176.9	-175.5	62.2	0	0	0	111.4	L150 I168 K170 Y213 Q219	L150-L215 HydrophobicContact CD1-CD1 4.49Å; I168-L215 HydrophobicContact CD1-CB 4.19Å; I168-L215 HydrophobicContact CG1-CB 4.31Å; I168-L215 HydrophobicContact CG1-CD2 4.39Å; K170-L215 HydrophobicContact CG-CD2 3.95Å; Y213-L215 PolarHBondContact O-N 3.42Å; L215-Q219 WeakPolarHBondContact O-CB 3.32Å; L215-Q219 VanDerWaalsContact O-CG 3.25Å; L215-Q219 WeakPolarHBondContact O-CG 3.3Å; L215-Q219 PolarHBondContact O-N 3.35Å
216	L	87.7	Confident	81.1	Confident	60 Å²	60	77 Å²	77	31%	0.314	38%	0.382	S	S	.	.	H	α-helix	trans	-71.2	-30.3	177.5	-62.7	-178.2	0	0	0	112.6	K170 Y213 N220	K170-L216 HydrophobicContact CB-CD2 4.24Å; K170-L216 HydrophobicContact CG-CD2 4.38Å; Y213-L216 HydrophobicContact CD2-CD1 4.21Å; Y213-L216 HydrophobicContact CG-CD1 4.33Å; Y213-L216 PolarHBondContact O-N 2.94Å; L216-N220 WeakPolarHBondContact O-CB 3.35Å; L216-N220 PolarHBondContact O-N 3.07Å; L216-N220 PolarHBondContact O-ND2 3.33Å
217	I	84.9	Confident	81.5	Confident	26 Å²	26	71.5 Å²	71.5	13%	0.133	36%	0.361	C	S	.	.	H	α-helix	trans	-65.5	-51.6	172.9	-75.1	178	0	0	0	110.3	L208 D212 Y213 P214 Q219 N220 S221	L208-I217 HydrophobicContact CD2-CD1 3.97Å; L208-I217 HydrophobicContact CG-CD1 3.92Å; D212-I217 HydrophobicContact CB-CD1 3.77Å; Y213-I217 PolarHBondContact O-N 3.31Å; P214-I217 PolarHBondContact O-N 3.48Å; I217-Q219 VanDerWaalsContact C-N 3.3Å; I217-Q219 PolarHBondContact O-N 2.89Å; I217-N220 CarbonylContact O-C 3.58Å; I217-N220 PolarHBondContact O-N 2.95Å; I217-N220 VanDerWaalsContact O-N 3.12Å; I217-S221 WeakPolarHBondContact O-CB 3.46Å; I217-S221 PolarHBondContact O-N 3.17Å
218	V	84.4	Confident	81.5	Confident	50 Å²	50	69.1 Å²	69.1	30%	0.303	35%	0.349	S	S	.	.	H	α-helix	trans	-68	-28.5	-178.6	175.2	0	0	0	0	112.6	L150 P214 S221 L227	L150-V218 HydrophobicContact CD1-CB 4.09Å; L150-V218 HydrophobicContact CD1-CG1 4.39Å; L150-V218 HydrophobicContact CD1-CG2 3.94Å; P214-V218 PolarHBondContact O-N 3.5Å; V218-S221 PolarHBondContact O-OG 3.18Å; V218-L227 HydrophobicContact CG2-CD1 3.67Å; V218-L227 HydrophobicContact CG2-CD2 4.36Å; V218-L227 HydrophobicContact CG2-CG 3.79Å
219	Q	81.8	Confident	81.6	Confident	109 Å²	109	68.9 Å²	68.9	51%	0.509	35%	0.348	S	S	.	.	H	α-helix	trans	-72.8	-27.7	172.8	-75.3	174.6	-10.2	0	0	113.3	L215 I217	L215-Q219 WeakPolarHBondContact O-CB 3.32Å; L215-Q219 VanDerWaalsContact O-CG 3.25Å; L215-Q219 WeakPolarHBondContact O-CG 3.3Å; L215-Q219 PolarHBondContact O-N 3.35Å; I217-Q219 VanDerWaalsContact C-N 3.3Å; I217-Q219 PolarHBondContact O-N 2.89Å
220	N	78.5	Confident	81.6	Confident	130 Å²	130	64 Å²	64	70%	0.695	33%	0.329	S	S	*	.	H	α-helix	trans	-98.7	-9.2	179.5	-69.1	-49.3	0	0	0	113.7	L216 I217 Q222	L216-N220 WeakPolarHBondContact O-CB 3.35Å; L216-N220 PolarHBondContact O-N 3.07Å; L216-N220 PolarHBondContact O-ND2 3.33Å; I217-N220 CarbonylContact O-C 3.58Å; I217-N220 PolarHBondContact O-N 2.95Å; I217-N220 VanDerWaalsContact O-N 3.12Å; N220-Q222 PolarHBondContact O-N 3.03Å
221	S	68.3	Low	81.6	Confident	30 Å²	30	63.6 Å²	63.6	21%	0.21	32%	0.32	C	S	.	.			trans	-72.5	111.9	-179.6	60.4	0	0	0	0	111.1	E198 I217 V218 S223	E198-S221 WeakPolarHBondContact OE1-CB 3.44Å; I217-S221 WeakPolarHBondContact O-CB 3.46Å; I217-S221 PolarHBondContact O-N 3.17Å; V218-S221 PolarHBondContact O-OG 3.18Å; S221-S223 PolarHBondContact O-N 2.76Å; S221-S223 PolarHBondContact OG-O 3.09Å
222	Q	59.8	Low	81.4	Confident	208 Å²	208	60.2 Å²	60.2	97%	0.972	31%	0.305	S	S	*	.	S	Bend	trans	-66.9	-16.5	173.5	-63.4	-178.3	-3.2	0	0	112.7	N220	N220-Q222 PolarHBondContact O-N 3.03Å
223	S	56.1	Low	81	Confident	57 Å²	57	65.5 Å²	65.5	40%	0.399	33%	0.329	S	S	.	.	S	Bend	trans	-92.6	145.6	172.5	45.8	0	0	0	0	111.7	S221 G225	S221-S223 PolarHBondContact O-N 2.76Å; S221-S223 PolarHBondContact OG-O 3.09Å; S223-G225 PolarHBondContact O-N 2.58Å
224	L	61	Low	80.6	Confident	132 Å²	132	64.1 Å²	64.1	69%	0.691	33%	0.329	S	S	*	.			trans	-69.2	75.2	163.5	-71.6	117.9	0	0	0	110.1	I201	I201-L224 HydrophobicContact CD1-CB 4.4Å; I201-L224 HydrophobicContact CD1-CD1 4.47Å
225	G	66.3	Low	80.2	Confident	15 Å²	15	64.3 Å²	64.3	16%	0.155	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-81.1	132.6	171.2	0	0	0	0	0	111	S223	S223-G225 PolarHBondContact O-N 2.58Å
226	V	81.4	Confident	79.7	Confident	77 Å²	77	67.4 Å²	67.4	47%	0.467	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	126.9	168.6	179.1	0	0	0	0	108.2	E199 V228	E199-V226 PolarHBondContact N-O 2.83Å; E199-V226 PolarHBondContact O-N 3.06Å; V226-V228 HydrophobicContact CG1-CG2 4.32Å; V226-V228 PolarHBondContact O-N 3.32Å
227	L	89.6	Confident	79.2	Confident	2 Å²	2	67.3 Å²	67.3	1%	0.01	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	119.9	170.1	-70.2	178.6	0	0	0	109.7	L150 I152 Y153 V197 E198 L208 P214 V218	L150-L227 HydrophobicContact CD1-CD1 3.86Å; L150-L227 HydrophobicContact CD2-CD1 3.74Å; L150-L227 HydrophobicContact CG-CD1 4.02Å; I152-L227 WeakPolarHBondContact CA-O 3.49Å; Y153-L227 PolarHBondContact N-O 3.18Å; V197-L227 WeakPolarHBondContact O-CA 3.44Å; E198-L227 HydrophobicContact CB-CD2 4.08Å; L208-L227 HydrophobicContact CD1-CD2 3.85Å; L208-L227 HydrophobicContact CD2-CD2 3.95Å; P214-L227 HydrophobicContact CB-CD1 3.93Å; V218-L227 HydrophobicContact CG2-CD1 3.67Å; V218-L227 HydrophobicContact CG2-CD2 4.36Å; V218-L227 HydrophobicContact CG2-CG 3.79Å
228	V	89.1	Confident	78.3	Confident	4 Å²	4	69.6 Å²	69.6	2%	0.024	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	128.7	178.3	-174.3	0	0	0	0	109.2	Y153 V197 E199 V226 R230	Y153-V228 HydrophobicContact CD1-CG1 4.12Å; V197-V228 PolarHBondContact N-O 3.18Å; V197-V228 PolarHBondContact O-N 3.34Å; E199-V228 HydrophobicContact CB-CG2 4.12Å; E199-V228 HydrophobicContact CG-CB 4.42Å; E199-V228 HydrophobicContact CG-CG2 3.89Å; V226-V228 HydrophobicContact CG1-CG2 4.32Å; V226-V228 PolarHBondContact O-N 3.32Å; V228-R230 HydrophobicContact CG1-CG 3.89Å
229	L	91.7	Very high	77.2	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.01	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	126.9	168.8	-172.8	68.1	0	0	0	109.2	I152 Y153 S155 C156 F157 I178 I181 Y194 L196	I152-L229 HydrophobicContact CG2-CB 4.24Å; Y153-L229 PolarHBondContact O-N 3.41Å; S155-L229 PolarHBondContact OG-O 3.49Å; C156-L229 PolarHBondContact SG-O 2.85Å; F157-L229 HydrophobicContact CD2-CD2 4.3Å; F157-L229 HydrophobicContact CE2-CD2 3.64Å; I178-L229 HydrophobicContact CG1-CD1 4.01Å; I181-L229 HydrophobicContact CD1-CD1 4.42Å; I181-L229 HydrophobicContact CD1-CD2 4.16Å; I181-L229 HydrophobicContact CG2-CD2 3.83Å; Y194-L229 HydrophobicContact CD1-CD1 4.09Å; Y194-L229 HydrophobicContact CD1-CD2 4.09Å; Y194-L229 HydrophobicContact CD1-CG 3.99Å; Y194-L229 HydrophobicContact CE1-CD2 4.44Å; L196-L229 HydrophobicContact CD2-CB 4.44Å; L196-L229 HydrophobicContact CD2-CD1 3.93Å
230	R	88.9	Confident	76.1	Confident	64 Å²	64	71.2 Å²	71.2	24%	0.242	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	151.2	176.5	-59.4	-165.3	177	-70.8	2.6	110.3	C156 Y194 C195 V197 E199 V228 A235	C156-R230 VanDerWaalsContact SG-CA 3.56Å; Y194-R230 WeakPolarHBondContact CA-O 3.33Å; C195-R230 PolarHBondContact N-O 2.85Å; C195-R230 PolarHBondContact O-N 2.62Å; C195-R230 VanDerWaalsContact O-N 3.09Å; V197-R230 HydrophobicContact CG2-CB 4.4Å; V197-R230 HydrophobicContact CG2-CG 4.23Å; E199-R230 IonicContact OE1-CZ 3.22Å; E199-R230 IonicContact OE1-NE 2.77Å; E199-R230 PolarHBondContact OE1-NE 2.96Å; E199-R230 IonicContact OE1-NH2 2.85Å; E199-R230 PolarHBondContact OE1-NH2 2.81Å; E199-R230 IonicContact OE2-CZ 2.77Å; E199-R230 IonicContact OE2-NH2 3.68Å; E199-R230 PolarHBondContact OE2-NH2 3.32Å; V228-R230 HydrophobicContact CG1-CG 3.89Å; R230-A235 HydrophobicContact CB-CB 4.33Å
231	K	89.1	Confident	74.8	Confident	68 Å²	68	72 Å²	72	30%	0.296	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	137.9	160.8	-72	-169.1	179.6	-105.1	0	108.8	D189 D193 Y194 Q233 D234 A235	D189-K231 IonicContact OD2-NZ 3.88Å; D189-K231 PolarHBondContact OD2-NZ 3.26Å; D193-K231 CarbonylContact O-C 3.52Å; D193-K231 WeakPolarHBondContact O-CA 3.38Å; Y194-K231 HydrophobicContact CD1-CG 4.23Å; Y194-K231 HydrophobicContact CE1-CG 3.81Å; Y194-K231 HydrophobicContact CE2-CG 4.41Å; Y194-K231 WeakPolarHBondContact OH-CE 3.48Å; Y194-K231 PolarHBondContact OH-NZ 2.92Å; Y194-K231 VanDerWaalsContact OH-NZ 3.12Å; K231-Q233 VanDerWaalsContact C-N 3.29Å; K231-Q233 PolarHBondContact O-N 3.43Å; K231-D234 PolarHBondContact O-N 2.72Å; K231-A235 PolarHBondContact O-N 3.19Å; K231-A235 VanDerWaalsContact O-N 3.11Å
232	K	86.8	Confident	73.9	Confident	100 Å²	100	75 Å²	75	44%	0.435	37%	0.365	S	S	.	.	H	α-helix	trans	-59.2	-37.6	-170.4	-175.7	172.7	178.2	179.7	0	112.8	T192 D193 A235 L236	T192-K232 WeakPolarHBondContact O-CD 3.49Å; T192-K232 PolarHBondContact O-NZ 2.84Å; D193-K232 VanDerWaalsContact O-CB 3.28Å; D193-K232 WeakPolarHBondContact O-CB 3.5Å; D193-K232 PolarHBondContact O-N 3.5Å; K232-A235 PolarHBondContact O-N 3.18Å; K232-L236 HydrophobicContact CG-CD1 4.37Å; K232-L236 WeakPolarHBondContact O-CB 3.37Å; K232-L236 VanDerWaalsContact O-CG 3.26Å; K232-L236 WeakPolarHBondContact O-CG 3.27Å; K232-L236 PolarHBondContact O-N 2.8Å
233	Q	83.9	Confident	73.3	Confident	123 Å²	123	68.3 Å²	68.3	58%	0.575	34%	0.341	S	S	*	.	H	α-helix	trans	-63	-41.3	174.8	-179.4	66.6	-19.7	0	0	112.1	K231 L236 L237	K231-Q233 VanDerWaalsContact C-N 3.29Å; K231-Q233 PolarHBondContact O-N 3.43Å; Q233-L236 PolarHBondContact O-N 2.8Å; Q233-L237 HydrophobicContact CG-CD1 4.17Å; Q233-L237 WeakPolarHBondContact O-CB 3.33Å; Q233-L237 VanDerWaalsContact O-CG 3.25Å; Q233-L237 WeakPolarHBondContact O-CG 3.23Å; Q233-L237 PolarHBondContact O-N 2.93Å
234	D	83.2	Confident	72.5	Confident	82 Å²	82	68.3 Å²	68.3	44%	0.439	35%	0.345	S	S	.	.	H	α-helix	trans	-70	-40.7	179	-65.9	-47.5	0	0	0	112	K231 L236 L237 M238	K231-D234 PolarHBondContact O-N 2.72Å; D234-L236 PolarHBondContact O-N 3.44Å; D234-L237 PolarHBondContact O-N 3.28Å; D234-M238 WeakPolarHBondContact O-CG 3.44Å; D234-M238 PolarHBondContact O-N 3.17Å
235	A	82.6	Confident	71.3	Confident	4 Å²	4	71.1 Å²	71.1	3%	0.033	35%	0.347	C	S	.	.	H	α-helix	trans	-58.6	-47.9	173.3	0	0	0	0	0	111.4	C195 V197 I207 R230 K231 K232 L237 M238 C239	C195-A235 WeakPolarHBondContact SG-CB 3.45Å; V197-A235 HydrophobicContact CG2-CB 4.07Å; I207-A235 HydrophobicContact CD1-CB 3.95Å; I207-A235 HydrophobicContact CG1-CB 4.48Å; R230-A235 HydrophobicContact CB-CB 4.33Å; K231-A235 PolarHBondContact O-N 3.19Å; K231-A235 VanDerWaalsContact O-N 3.11Å; K232-A235 PolarHBondContact O-N 3.18Å; A235-L237 VanDerWaalsContact C-N 3.33Å; A235-L237 PolarHBondContact O-N 3.18Å; A235-M238 PolarHBondContact O-N 3.36Å; A235-M238 VanDerWaalsContact O-N 3.15Å; A235-C239 PolarHBondContact O-N 3.26Å; A235-C239 PolarHBondContact O-SG 2.99Å; A235-C239 VanDerWaalsContact O-SG 3.4Å
236	L	79.4	Confident	70	Confident	73 Å²	73	77.1 Å²	77.1	38%	0.382	37%	0.372	S	S	.	.	H	α-helix	trans	-62.5	-37.1	175.8	-70.3	171.3	0	0	0	112.6	I207 K232 Q233 D234 C239 K240	I207-L236 HydrophobicContact CD1-CD2 4.48Å; K232-L236 HydrophobicContact CG-CD1 4.37Å; K232-L236 WeakPolarHBondContact O-CB 3.37Å; K232-L236 VanDerWaalsContact O-CG 3.26Å; K232-L236 WeakPolarHBondContact O-CG 3.27Å; K232-L236 PolarHBondContact O-N 2.8Å; Q233-L236 PolarHBondContact O-N 2.8Å; D234-L236 PolarHBondContact O-N 3.44Å; L236-C239 PolarHBondContact O-N 3.21Å; L236-K240 WeakPolarHBondContact O-CB 3.29Å; L236-K240 VanDerWaalsContact O-CG 3.32Å; L236-K240 WeakPolarHBondContact O-CG 3.48Å; L236-K240 PolarHBondContact O-N 3.37Å
237	L	75.6	Confident	68	Low	58 Å²	58	79.4 Å²	79.4	30%	0.304	38%	0.382	S	S	.	.	H	α-helix	trans	-66.3	-34.9	174	-75.7	169.7	0	0	0	112.4	Q233 D234 A235 R241	Q233-L237 HydrophobicContact CG-CD1 4.17Å; Q233-L237 WeakPolarHBondContact O-CB 3.33Å; Q233-L237 VanDerWaalsContact O-CG 3.25Å; Q233-L237 WeakPolarHBondContact O-CG 3.23Å; Q233-L237 PolarHBondContact O-N 2.93Å; D234-L237 PolarHBondContact O-N 3.28Å; A235-L237 VanDerWaalsContact C-N 3.33Å; A235-L237 PolarHBondContact O-N 3.18Å; L237-R241 WeakPolarHBondContact O-CB 3.38Å; L237-R241 WeakPolarHBondContact O-CG 3.28Å; L237-R241 PolarHBondContact O-N 2.85Å
238	M	66	Low	65.7	Low	74 Å²	74	86.5 Å²	86.5	37%	0.365	41%	0.412	S	S	.	.	H	α-helix	trans	-69.8	-40.6	174.5	-67.3	-55.2	150.8	0	0	112.4	D234 A235 R241 R242	D234-M238 WeakPolarHBondContact O-CG 3.44Å; D234-M238 PolarHBondContact O-N 3.17Å; A235-M238 PolarHBondContact O-N 3.36Å; A235-M238 VanDerWaalsContact O-N 3.15Å; M238-R241 PolarHBondContact O-N 3.15Å; M238-R242 PolarHBondContact O-N 3.44Å
239	C	61.9	Low	63.2	Low	53 Å²	53	92 Å²	92	36%	0.358	45%	0.446	S	S	.	.	H	α-helix	trans	-60.6	-46.6	172.1	-63.9	0	0	0	0	111.6	A235 L236 R241 R242 S243	A235-C239 PolarHBondContact O-N 3.26Å; A235-C239 PolarHBondContact O-SG 2.99Å; A235-C239 VanDerWaalsContact O-SG 3.4Å; L236-C239 PolarHBondContact O-N 3.21Å; C239-R241 PolarHBondContact O-N 3.01Å; C239-R242 PolarHBondContact O-N 2.95Å; C239-S243 PolarHBondContact O-N 3.23Å
240	K	58.9	Low	60.7	Low	140 Å²	140	99.3 Å²	99.3	61%	0.609	48%	0.478	S	S	*	.	H	α-helix	trans	-62.4	-40.7	176.3	-73	173.3	-179	177.2	0	112.4	L236 S243 A244	L236-K240 WeakPolarHBondContact O-CB 3.29Å; L236-K240 VanDerWaalsContact O-CG 3.32Å; L236-K240 WeakPolarHBondContact O-CG 3.48Å; L236-K240 PolarHBondContact O-N 3.37Å; K240-S243 PolarHBondContact O-N 3.11Å; K240-A244 PolarHBondContact O-N 3.33Å; K240-A244 VanDerWaalsContact O-N 3.1Å
241	R	52.3	Low	58.2	Low	146 Å²	146	101.5 Å²	101.5	55%	0.551	50%	0.501	S	S	*	.	H	α-helix	trans	-64.9	-42.3	177	-81	176.3	170.3	139	-1.8	112.5	L237 M238 C239 S243 A244 W245	L237-R241 WeakPolarHBondContact O-CB 3.38Å; L237-R241 WeakPolarHBondContact O-CG 3.28Å; L237-R241 PolarHBondContact O-N 2.85Å; M238-R241 PolarHBondContact O-N 3.15Å; C239-R241 PolarHBondContact O-N 3.01Å; R241-S243 PolarHBondContact O-N 3.36Å; R241-A244 PolarHBondContact O-N 3.13Å; R241-W245 PolarHBondContact O-N 3.35Å
242	R	49.4	Very low	55.6	Low	92 Å²	92	107.3 Å²	107.3	35%	0.347	52%	0.522	S	S	.	.	H	α-helix	trans	-58.7	-45.8	175.3	-78.1	-175.1	-102.4	-123.9	-2.4	111.7	E203 M238 C239 A244 W245 M246	E203-R242 PolarHBondContact O-NH1 3.25Å; M238-R242 PolarHBondContact O-N 3.44Å; C239-R242 PolarHBondContact O-N 2.95Å; R242-A244 PolarHBondContact O-N 3.02Å; R242-W245 PolarHBondContact O-N 2.75Å; R242-M246 PolarHBondContact O-N 3.05Å; R242-M246 VanDerWaalsContact O-N 3.09Å
243	S	45.3	Very low	52.9	Low	68 Å²	68	111.9 Å²	111.9	48%	0.476	54%	0.542	S	S	.	.	H	α-helix	trans	-59.4	-41.8	174.9	-173.2	0	0	0	0	113.2	C239 K240 R241 W245 N247	C239-S243 PolarHBondContact O-N 3.23Å; K240-S243 PolarHBondContact O-N 3.11Å; R241-S243 PolarHBondContact O-N 3.36Å; S243-W245 VanDerWaalsContact C-N 3.26Å; S243-W245 PolarHBondContact O-N 3.18Å; S243-N247 PolarHBondContact O-N 2.91Å; S243-N247 VanDerWaalsContact O-N 3.16Å; S243-N247 PolarHBondContact O-ND2 3.16Å
244	A	39.6	Very low	50.5	Low	58 Å²	58	116.1 Å²	116.1	48%	0.479	55%	0.553	S	S	.	*	H	α-helix	trans	-67.3	-21.5	179.2	0	0	0	0	0	114.5	K240 R241 R242	K240-A244 PolarHBondContact O-N 3.33Å; K240-A244 VanDerWaalsContact O-N 3.1Å; R241-A244 PolarHBondContact O-N 3.13Å; R242-A244 PolarHBondContact O-N 3.02Å
245	W	37.1	Very low	48.1	Very low	191 Å²	191	123.1 Å²	123.1	72%	0.723	57%	0.573	S	S	*	*	H	α-helix	trans	-90.7	-40.3	175.4	-81.6	78.2	0	0	0	112.8	R241 R242 S243 N247 K248	R241-W245 PolarHBondContact O-N 3.35Å; R242-W245 PolarHBondContact O-N 2.75Å; S243-W245 VanDerWaalsContact C-N 3.26Å; S243-W245 PolarHBondContact O-N 3.18Å; W245-N247 PolarHBondContact O-N 2.84Å; W245-K248 PolarHBondContact O-N 3.05Å; W245-K248 VanDerWaalsContact O-N 3.1Å
246	M	38.4	Very low	45.6	Very low	141 Å²	141	128.4 Å²	128.4	70%	0.695	61%	0.61	S	S	*	*	H	α-helix	trans	-60.6	-33.2	173	-80	-172.5	162.8	0	0	112.7	R242 K248 T249	R242-M246 PolarHBondContact O-N 3.05Å; R242-M246 VanDerWaalsContact O-N 3.09Å; M246-K248 PolarHBondContact O-N 3.03Å; M246-T249 PolarHBondContact O-N 3.1Å; M246-T249 PolarHBondContact O-OG1 3.19Å
247	N	39.9	Very low	43.5	Very low	124 Å²	124	132.8 Å²	132.8	66%	0.663	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	2.3	175.8	-77.2	-46.8	0	0	0	115.1	S243 W245	S243-N247 PolarHBondContact O-N 2.91Å; S243-N247 VanDerWaalsContact O-N 3.16Å; S243-N247 PolarHBondContact O-ND2 3.16Å; W245-N247 PolarHBondContact O-N 2.84Å
248	K	40.3	Very low	41.6	Very low	151 Å²	151	139.6 Å²	139.6	66%	0.657	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-16.7	173.7	-68.8	-178.1	179.3	175.7	0	114.4	W245 M246 K250	W245-K248 PolarHBondContact O-N 3.05Å; W245-K248 VanDerWaalsContact O-N 3.1Å; M246-K248 PolarHBondContact O-N 3.03Å; K248-K250 PolarHBondContact O-N 3.47Å
249	T	37.8	Very low	40.1	Very low	119 Å²	119	142.6 Å²	142.6	73%	0.73	67%	0.672	S	S	*	*			trans	-77.9	75.9	167.1	41.6	0	0	0	0	110.4	M246	M246-T249 PolarHBondContact O-N 3.1Å; M246-T249 PolarHBondContact O-OG1 3.19Å
250	K	37.7	Very low	39	Very low	156 Å²	156	149.9 Å²	149.9	68%	0.678	70%	0.698	S	S	*	*			trans	-53.9	126.8	163.9	-74.4	-171.4	177.1	-176.5	0	108.3	K248 Y252	K248-K250 PolarHBondContact O-N 3.47Å; K250-Y252 HydrophobicContact CB-CE2 4.39Å; K250-Y252 PolarHBondContact O-N 3.48Å
251	P	36.4	Very low	37.6	Very low	111 Å²	111	146.5 Å²	146.5	72%	0.721	70%	0.702	S	S	*	*			trans	-68.9	97.6	175.2	27.8	-33.2	0	0	0	108.7	F253	P251-F253 HydrophobicContact CB-CD2 4.42Å; P251-F253 PolarHBondContact O-N 3.1Å
252	Y	34.7	Very low	36.7	Very low	190 Å²	190	146.5 Å²	146.5	75%	0.745	72%	0.718	S	S	*	*			trans	-72.9	70	174.4	-83.3	-77.1	0	0	0	110.5	K250 R254	K250-Y252 HydrophobicContact CB-CE2 4.39Å; K250-Y252 PolarHBondContact O-N 3.48Å; Y252-R254 HydrophobicContact CD1-CG 4.24Å; Y252-R254 PolarHBondContact O-N 2.83Å
253	F	31.3	Very low	36	Very low	196 Å²	196	154 Å²	154	86%	0.86	75%	0.747	S	S	*	*			trans	-68.1	52.8	158.3	-94.1	-80.2	0	0	0	110.6	P251 R255	P251-F253 HydrophobicContact CB-CD2 4.42Å; P251-F253 PolarHBondContact O-N 3.1Å; F253-R255 PolarHBondContact O-N 3.28Å; F253-R255 VanDerWaalsContact O-N 3.15Å
254	R	32.8	Very low	35.7	Very low	212 Å²	212	157.4 Å²	157.4	80%	0.8	77%	0.765	S	S	*	*			trans	-67.8	104.8	162.6	-91.3	-79.9	-167.9	159.1	2.1	106.5	Y252 S256	Y252-R254 HydrophobicContact CD1-CG 4.24Å; Y252-R254 PolarHBondContact O-N 2.83Å; R254-S256 PolarHBondContact O-N 2.77Å
255	R	32.5	Very low	35.5	Very low	229 Å²	229	160.5 Å²	160.5	86%	0.864	78%	0.78	S	S	*	*			trans	-46.8	124.8	172.5	-69.4	-178.6	176.8	-177.5	-2.2	109.7	F253 L257	F253-R255 PolarHBondContact O-N 3.28Å; F253-R255 VanDerWaalsContact O-N 3.15Å; R255-L257 PolarHBondContact O-N 3.45Å
256	S	31	Very low	35.2	Very low	114 Å²	114	156.9 Å²	156.9	80%	0.797	78%	0.784	S	S	*	*			trans	-76.7	72	176.8	179.3	0	0	0	0	111	R254	R254-S256 PolarHBondContact O-N 2.77Å
257	L	34.9	Very low	35.3	Very low	165 Å²	165	155 Å²	155	86%	0.864	78%	0.782	S	S	*	*			trans	-83.9	109.9	161.8	-97.8	155.3	0	0	0	108.2	R255	R255-L257 PolarHBondContact O-N 3.45Å
258	R	35.8	Very low	35.1	Very low	201 Å²	201	154.9 Å²	154.9	76%	0.758	79%	0.785	S	S	*	*			trans	-140.7	111.6	177.3	178.3	-169.2	-69.7	-106.5	7.7	109.3
259	D	34	Very low	34.8	Very low	137 Å²	137	155.7 Å²	155.7	73%	0.733	79%	0.789	S	S	*	*			trans	55.2	135.9	160.9	-44.1	-35	0	0	0	116.6
260	K	38	Very low	34.8	Very low	207 Å²	207	157.9 Å²	157.9	90%	0.9	79%	0.791	S	S	*	*			cis	-141.3	165.8	32.7	-58.1	154.1	-167.6	171.3	0	107.8
261	G	31	Very low	34.6	Very low	68 Å²	68	156.1 Å²	156.1	70%	0.701	79%	0.793	S	S	*	*			cis	141.4	51.5	6.7	0	0	0	0	0	112
262	T	32.6	Very low	34.3	Very low	146 Å²	146	157.7 Å²	157.7	90%	0.896	80%	0.795	S	S	*	*			trans	-160.4	111.5	173.1	21.8	0	0	0	0	111.4
263	R	34.9	Very low	34.3	Very low	251 Å²	251	153.9 Å²	153.9	95%	0.947	79%	0.792	S	S	*	*			trans	-156.5	128.3	149.7	-144.5	173.4	-170.3	-178.1	2.8	110.7
264	T	39.2	Very low	34.6	Very low	138 Å²	138	151.5 Å²	151.5	85%	0.847	78%	0.784	S	S	*	*			trans	-80.7	148	179.7	33.7	0	0	0	0	111.8
265	P	35	Very low	34.6	Very low	124 Å²	124	151 Å²	151	81%	0.805	78%	0.782	S	S	*	*			trans	-101.2	152.9	-175.5	38.4	-34.7	0	0	0	113.6
266	S	31.6	Very low	34.4	Very low	114 Å²	114	147.1 Å²	147.1	80%	0.797	78%	0.777	S	S	*	*			trans	176.9	152.4	157.2	-158.9	0	0	0	0	109.7
267	P	39.3	Very low	34.5	Very low	102 Å²	102	148.6 Å²	148.6	66%	0.662	78%	0.776	S	S	*	*			cis	-139	174.8	-48.1	40.5	-26.1	0	0	0	113.6
268	V	36.4	Very low	34.6	Very low	121 Å²	121	145.3 Å²	145.3	73%	0.733	77%	0.765	S	S	*	*			trans	66.3	135.3	141.2	150.3	0	0	0	0	118.3
269	K	35	Very low	34.3	Very low	168 Å²	168	145.1 Å²	145.1	73%	0.73	77%	0.77	S	S	*	*			cis	-155.5	174.2	15.2	-133.8	166.1	-152.3	168.7	0	111.3
270	Q	36.9	Very low	34.3	Very low	165 Å²	165	143.6 Å²	143.6	77%	0.771	77%	0.767	S	S	*	*			trans	66.7	117.2	159.4	-75.9	166.3	-20.8	0	0	116
271	T	33.2	Very low	33.8	Very low	119 Å²	119	138.4 Å²	138.4	73%	0.73	76%	0.756	S	S	*	*			cis	122.7	139	28.2	36.8	0	0	0	0	107
272	L	30.1	Very low	33.7	Very low	144 Å²	144	141.4 Å²	141.4	75%	0.754	75%	0.754	S	S	*	*			cis	-163.8	165.8	-10.1	-164.8	69.2	0	0	0	109.1
273	T	35.3	Very low	33.5	Very low	111 Å²	111	142.5 Å²	142.5	68%	0.681	75%	0.747	S	S	*	*			trans	74.3	147	167.1	77.3	0	0	0	0	117.2
274	Q	37.7	Very low	33.3	Very low	146 Å²	146	139 Å²	139	68%	0.682	74%	0.739	S	S	*	*			cis	-168.4	153	-26.1	-106.8	-171.2	115	0	0	105.7
275	R	31.9	Very low	32.6	Very low	201 Å²	201	136.1 Å²	136.1	76%	0.758	74%	0.736	S	S	*	*			cis	-157.9	124.9	-12	-141	170.9	-177	145.7	-9.8	104.1
276	L	29.6	Very low	32.4	Very low	148 Å²	148	138 Å²	138	78%	0.775	74%	0.739	S	S	*	*				39	118.5	90.4	-65	176.6	0	0	0	112.9
277	N	33.3	Very low	32.3	Very low	144 Å²	144	137 Å²	137	77%	0.77	73%	0.731	S	S	*	*			cis	-149.9	163	36.3	-83.1	-37.5	0	0	0	115.1
278	P	37	Very low	31.7	Very low	96 Å²	96	141.4 Å²	141.4	62%	0.623	74%	0.74	S	S	*	*			trans	-92.6	176	167.5	38	-34.6	0	0	0	113.8
279	F	28.4	Very low	31.2	Very low	198 Å²	198	140.5 Å²	140.5	87%	0.868	74%	0.739	S	S	*	*			trans	71.8	155.4	171.1	-68.8	-66.8	0	0	0	117.5
280	P	33.9	Very low	31	Very low	104 Å²	104	144.4 Å²	144.4	68%	0.675	75%	0.749	S	S	*	*			cis	-134.6	-169.2	-11.8	36.4	-16.3	0	0	0	114.7
281	C	28.1	Very low	30.6	Very low	98 Å²	98	143.4 Å²	143.4	66%	0.662	75%	0.748	S	S	*	*			trans	76.3	116.2	139.1	-78.8	0	0	0	0	123.2
282	I	28.7	Very low	30.4	Very low	131 Å²	131	144.3 Å²	144.3	67%	0.672	75%	0.747	S	S	*	*				87.1	124.1	117.3	-68	173.3	0	0	0	120.7
283	F	28.6	Very low	30.4	Very low	169 Å²	169	145.3 Å²	145.3	74%	0.741	75%	0.748	S	S	*	*			trans	70.4	134.1	153.2	-76.1	-37.9	0	0	0	123.8
284	K	30.4	Very low	30	Very low	179 Å²	179	146.6 Å²	146.6	78%	0.778	75%	0.751	S	S	*	*			trans	60.4	100.5	139.2	-62.4	164.7	-169.5	173.3	0	117.8
285	G	24.5	Very low	29.7	Very low	76 Å²	76	146.4 Å²	146.4	78%	0.784	75%	0.753	S	S	*	*			trans	-81.5	163.7	158.2	0	0	0	0	0	112.9
286	L	31.6	Very low	29.5	Very low	165 Å²	165	141.5 Å²	141.5	86%	0.864	75%	0.749	S	S	*	*			trans	-150.6	139.8	168.6	-95.7	172.4	0	0	0	111.3
287	S	28.5	Very low	29.4	Very low	92 Å²	92	138.8 Å²	138.8	64%	0.643	74%	0.742	S	S	*	*			trans	53.7	105.4	142.6	-59.6	0	0	0	0	123
288	K	26.4	Very low	29.3	Very low	194 Å²	194	140.1 Å²	140.1	84%	0.843	74%	0.744	S	S	*	*				62.7	134.6	118.7	-69.5	-174.7	173.6	-174	0	122.7
289	S	25.7	Very low	28.9	Very low	102 Å²	102	141.1 Å²	141.1	71%	0.713	75%	0.748	S	S	*	*			trans	81.1	131	136.1	69.6	0	0	0	0	121.4
290	R	31.7	Very low	29	Very low	251 Å²	251	139.1 Å²	139.1	95%	0.947	75%	0.746	S	S	*	*				-150.6	170.2	123.9	-101.8	167.9	-154.4	-147.1	2.6	109.4
291	I	28	Very low	28.9	Very low	143 Å²	143	139.9 Å²	139.9	73%	0.733	75%	0.751	S	S	*	*			trans	-145	146.5	-158.7	-75.5	173.2	0	0	0	108.7
292	L	28.5	Very low	28.8	Very low	138 Å²	138	140.6 Å²	140.6	72%	0.723	76%	0.757	S	S	*	*			trans	63.9	166.5	172	-71.8	165.7	0	0	0	115.1
293	E	30.8	Very low	29	Very low	165 Å²	165	142.5 Å²	142.5	77%	0.771	77%	0.767	S	S	*	*			cis	-149.5	172.4	21.5	-147.5	133.7	-113.3	0	0	113.4
294	N	26.9	Very low	29.2	Very low	139 Å²	139	141.7 Å²	141.7	74%	0.743	77%	0.771	S	S	*	*			trans	-96.1	171	179.7	-72.9	-29.5	0	0	0	112.7
295	I	32.5	Very low	29.2	Very low	142 Å²	142	142.6 Å²	142.6	73%	0.728	77%	0.774	S	S	*	*				179	154.8	125.6	-90.4	154.7	0	0	0	110.9
296	S	26.6	Very low	29.7	Very low	97 Å²	97	144.6 Å²	144.6	68%	0.678	77%	0.771	S	S	*	*			trans	-100.1	172.3	-167.1	49.9	0	0	0	0	115.5
297	C	27.8	Very low	29.4	Very low	92 Å²	92	145.2 Å²	145.2	62%	0.622	77%	0.77	S	S	*	*				165.4	131.6	115.3	-86.9	0	0	0	0	115.3
298	E	31.1	Very low	29.6	Very low	172 Å²	172	149.5 Å²	149.5	80%	0.804	78%	0.777	S	S	*	*			trans	65	165.6	131.6	-59.6	168.4	145.9	0	0	123.7
299	T	28.6	Very low	29.7	Very low	116 Å²	116	147.4 Å²	147.4	71%	0.712	77%	0.774	S	S	*	*				-156.9	161.2	-66.3	-30.9	0	0	0	0	110.6
300	L	30.1	Very low	30	Very low	157 Å²	157	150.5 Å²	150.5	82%	0.822	78%	0.777	S	S	*	*			trans	68.9	162.2	158.9	-61.7	-177.5	0	0	0	119.5
301	P	30.9	Very low	30	Very low	120 Å²	120	143 Å²	143	78%	0.779	76%	0.763	S	S	*	*			cis	-126.2	-175.2	-23.9	28.9	-8	0	0	0	113.6
302	S	27.7	Very low	29.9	Very low	113 Å²	113	145 Å²	145	79%	0.79	77%	0.769	S	S	*	*			trans	-90.7	164.1	177.8	50.4	0	0	0	0	114.6
303	L	33.1	Very low	30.1	Very low	170 Å²	170	143.7 Å²	143.7	89%	0.89	77%	0.771	S	S	*	*			trans	-141.9	165.1	163.7	-143.9	78.8	0	0	0	111.2
304	D	32.2	Very low	30.1	Very low	152 Å²	152	142.6 Å²	142.6	81%	0.813	77%	0.771	S	S	*	*			trans	-91.1	175.6	-157.1	-83.4	-71	0	0	0	118.1
305	K	29.4	Very low	30.2	Very low	198 Å²	198	141.2 Å²	141.2	86%	0.861	77%	0.768	S	S	*	*			trans	-56.7	146.1	174	-56.4	170.9	-179.5	175.8	0	112.9
306	V	34.9	Very low	30.2	Very low	119 Å²	119	140.8 Å²	140.8	72%	0.721	77%	0.767	S	S	*	*			trans	-139.7	129.8	155.6	-178.3	0	0	0	0	108.3	F308	V306-F308 HydrophobicContact CG1-CD2 3.75Å; V306-F308 HydrophobicContact CG1-CE2 3.92Å
307	E	26.6	Very low	30.2	Very low	178 Å²	178	145 Å²	145	83%	0.832	78%	0.776	S	S	*	*			trans	-85.1	142.3	165	-65.7	174.8	125.1	0	0	109.2
308	F	32.8	Very low	30.4	Very low	182 Å²	182	144.4 Å²	144.4	80%	0.798	78%	0.777	S	S	*	*			trans	-135.7	122.2	160.2	-105	-79.9	0	0	0	110.7	V306	V306-F308 HydrophobicContact CG1-CD2 3.75Å; V306-F308 HydrophobicContact CG1-CE2 3.92Å
309	I	27.7	Very low	30.3	Very low	149 Å²	149	144 Å²	144	76%	0.764	78%	0.781	S	S	*	*			trans	-99.3	135.9	169.9	-62	163.7	0	0	0	106.5
310	E	32.5	Very low	30.3	Very low	168 Å²	168	141.6 Å²	141.6	79%	0.785	78%	0.779	S	S	*	*			trans	-172.3	110.6	152.5	-107.6	156.9	-148.9	0	0	107.5
311	S	32	Very low	30.2	Very low	92 Å²	92	141.2 Å²	141.2	64%	0.643	78%	0.778	S	S	*	*				93	103.1	90.6	70.5	0	0	0	0	111.5
312	E	25.9	Very low	30.1	Very low	186 Å²	186	144.1 Å²	144.1	87%	0.869	78%	0.781	S	S	*	*				64.2	94.5	90.1	-72.7	-161.4	151.6	0	0	115.6
313	S	31.9	Very low	30	Very low	110 Å²	110	143.9 Å²	143.9	77%	0.769	78%	0.778	S	S	*	*			trans	-171.4	107.4	140.6	58.2	0	0	0	0	108.6
314	N	31.1	Very low	30	Very low	142 Å²	142	142.3 Å²	142.3	76%	0.759	77%	0.769	S	S	*	*				85.6	126.7	70.7	-86.1	-35.6	0	0	0	115.3
315	T	29.7	Very low	29.9	Very low	111 Å²	111	141.4 Å²	141.4	68%	0.681	76%	0.764	S	S	*	*			trans	74.6	123.9	141.9	53.2	0	0	0	0	122.4
316	N	31.3	Very low	30.2	Very low	132 Å²	132	137 Å²	137	71%	0.706	75%	0.75	S	S	*	*			trans	80.7	97.6	131.1	-60.3	-4.7	0	0	0	120.8
317	Q	27.7	Very low	30.2	Very low	186 Å²	186	138.2 Å²	138.2	87%	0.869	75%	0.745	S	S	*	*				55.2	152	106.8	-71.3	-168.9	0.2	0	0	122.1
318	A	30.4	Very low	30.3	Very low	79 Å²	79	140.7 Å²	140.7	65%	0.653	75%	0.747	S	S	*	*			trans	92.4	112.5	149.1	0	0	0	0	0	118.6
319	N	29.4	Very low	30.1	Very low	164 Å²	164	137.4 Å²	137.4	88%	0.877	74%	0.744	S	S	*	*				42.5	115.1	125.7	-49.2	-13.9	0	0	0	117
320	G	29.1	Very low	30	Very low	65 Å²	65	141.5 Å²	141.5	67%	0.67	75%	0.75	S	S	*	*			cis	115.9	166.2	33.7	0	0	0	0	0	110.9
321	N	27.5	Very low	29.9	Very low	150 Å²	150	138.7 Å²	138.7	80%	0.802	75%	0.746	S	S	*	*			trans	72.6	148.5	166.8	-59.8	-5.2	0	0	0	119.3
322	E	29	Very low	29.9	Very low	181 Å²	181	140.7 Å²	140.7	85%	0.846	75%	0.749	S	S	*	*			trans	69.1	138.5	154.3	-76.5	175.8	-151.8	0	0	118.6
323	C	26.6	Very low	29.8	Very low	107 Å²	107	137.6 Å²	137.6	72%	0.723	75%	0.747	S	S	*	*			cis	-166	-164.9	-12.5	-161.5	0	0	0	0	109.3
324	I	31.4	Very low	29.7	Very low	138 Å²	138	138.4 Å²	138.4	71%	0.708	75%	0.748	S	S	*	*			trans	78	102.8	154.6	-63.8	160.7	0	0	0	116.7
325	D	32	Very low	29.5	Very low	133 Å²	133	141 Å²	141	71%	0.711	75%	0.752	S	S	*	*			trans	67.8	150.7	138.5	-63.5	3.3	0	0	0	120.4
326	D	35.1	Very low	29.7	Very low	104 Å²	104	140.9 Å²	140.9	56%	0.556	75%	0.753	S	S	*	*			cis	-146.4	167.5	5.2	-142	-5.8	0	0	0	117.1
327	K	33.9	Very low	29.5	Very low	145 Å²	145	142 Å²	142	63%	0.63	76%	0.758	S	S	*	*			trans	-2.4	135	150.6	-65.7	155	-156.6	87.4	0	115.3
328	R	29.7	Very low	29.6	Very low	230 Å²	230	138.1 Å²	138.1	87%	0.868	75%	0.749	S	S	*	*			cis	-172	150.4	22.4	-120.1	170.3	-174.9	172.3	1	111.4
329	P	28.6	Very low	29.4	Very low	113 Å²	113	142.1 Å²	142.1	73%	0.734	76%	0.759	S	S	*	*			trans	-100.6	174.1	170.8	38.2	-34.6	0	0	0	114.5
330	R	25.6	Very low	29.2	Very low	235 Å²	235	143.2 Å²	143.2	89%	0.887	76%	0.756	S	S	*	*			trans	73.9	170.4	172.7	-50.5	-177.4	175.3	-167	0.2	116
331	P	30.7	Very low	29.1	Very low	109 Å²	109	149.9 Å²	149.9	71%	0.708	76%	0.762	S	S	*	*			cis	-131.3	-158.3	-18.1	20.5	5.5	0	0	0	113.2
332	I	30.4	Very low	29	Very low	135 Å²	135	149.6 Å²	149.6	69%	0.692	76%	0.758	S	S	*	*			trans	90	107.6	158.7	-49.3	161.3	0	0	0	113.3
333	S	25.2	Very low	28.8	Very low	121 Å²	121	147.2 Å²	147.2	85%	0.846	75%	0.751	S	S	*	*			cis	70.7	65.9	21.3	-172	0	0	0	0	116.6
334	T	29.3	Very low	28.9	Very low	127 Å²	127	147.9 Å²	147.9	78%	0.779	75%	0.747	S	S	*	*			trans	-137.7	119.7	160.3	5.6	0	0	0	0	111.5
335	K	26.2	Very low	28.8	Very low	196 Å²	196	148.6 Å²	148.6	85%	0.852	75%	0.752	S	S	*	*			trans	-88.9	-173.8	158	-59.3	-177.6	174.1	179.9	0	108.3
336	P	35.6	Very low	28.6	Very low	108 Å²	108	148.7 Å²	148.7	70%	0.701	75%	0.753	S	S	*	*				-115.6	-148.5	-95.3	33.8	-14.1	0	0	0	111.2
337	L	26.4	Very low	28.3	Very low	155 Å²	155	148.9 Å²	148.9	81%	0.812	76%	0.762	S	S	*	*			trans	82.2	175.8	170.3	-42.7	176.8	0	0	0	114.2
338	P	28.9	Very low	28	Very low	105 Å²	105	150 Å²	150	68%	0.682	77%	0.769	S	S	*	*				-141	143.9	-95.2	38.6	-18.5	0	0	0	117.1
339	L	27.8	Very low	28.1	Very low	164 Å²	164	146.6 Å²	146.6	86%	0.859	77%	0.768	S	S	*	*			trans	-135.1	134.9	155.1	-69.3	104.4	0	0	0	108.4
340	K	24.4	Very low	28.1	Very low	186 Å²	186	146.4 Å²	146.4	81%	0.809	76%	0.756	S	S	*	*			cis	53.6	90.4	5.7	-96.7	-164.8	175.6	-172.4	0	114.9
341	Y	26.1	Very low	28.4	Very low	205 Å²	205	144.7 Å²	144.7	80%	0.804	76%	0.755	S	S	*	*				-169.8	150.5	119.6	-112.1	-74.1	0	0	0	111.4
342	M	26.8	Very low	28.3	Very low	144 Å²	144	145 Å²	145	71%	0.709	75%	0.747	S	S	*	*			trans	59.7	106.1	174.1	-52.6	-165.5	75.1	0	0	114.9
343	N	25.2	Very low	28.2	Very low	131 Å²	131	144.1 Å²	144.1	70%	0.701	74%	0.743	S	S	*	*			cis	72.9	152.4	44.5	-54.5	7.4	0	0	0	114.6
344	D	27.1	Very low	28.4	Very low	121 Å²	121	146.8 Å²	146.8	65%	0.647	74%	0.74	S	S	*	*			trans	81.4	139	156.4	-47.9	-42.5	0	0	0	118
345	L	29.8	Very low	28.6	Very low	154 Å²	154	146.1 Å²	146.1	81%	0.806	74%	0.74	S	S	*	*			trans	70.4	131.2	170.6	-44	-178.7	0	0	0	118.4
346	D	27.6	Very low	28.8	Very low	135 Å²	135	141.9 Å²	141.9	72%	0.722	73%	0.733	S	S	*	*			cis	-173.6	-172.5	-35	-118.5	-40.7	0	0	0	107.9
347	S	29.4	Very low	28.4	Very low	107 Å²	107	141.3 Å²	141.3	75%	0.748	73%	0.731	S	S	*	*			trans	63	94.4	164.3	51.6	0	0	0	0	115.9
348	E	26.8	Very low	28.7	Very low	168 Å²	168	141.9 Å²	141.9	79%	0.785	73%	0.729	S	S	*	*				-18.7	149	129	-46.7	-175.9	148.1	0	0	114.7
349	D	32.5	Very low	28.6	Very low	160 Å²	160	143.1 Å²	143.1	86%	0.856	73%	0.73	S	S	*	*				-140.8	136.9	122.5	-143.3	-15.4	0	0	0	111
350	K	28.4	Very low	28.6	Very low	108 Å²	108	140.8 Å²	140.8	47%	0.47	72%	0.719	S	S	.	*			trans	-86.3	150.2	-176.4	-80.4	173	150.8	-152.1	0	110.9	E352	K350-E352 HydrophobicContact CB-CB 4.46Å; K350-E352 WeakPolarHBondContact CD-OE2 3.04Å; K350-E352 VanDerWaalsContact CE-OE1 3.26Å; K350-E352 WeakPolarHBondContact CE-OE1 3.29Å; K350-E352 WeakPolarHBondContact CE-OE2 3.32Å; K350-E352 IonicContact NZ-OE1 2.74Å; K350-E352 PolarHBondContact NZ-OE1 3.44Å; K350-E352 IonicContact NZ-OE2 2.77Å; K350-E352 PolarHBondContact NZ-OE2 3.29Å
351	F	31	Very low	28.7	Very low	200 Å²	200	137.5 Å²	137.5	88%	0.877	71%	0.71	S	S	*	*			trans	-168.5	103.8	135.3	-81.7	-59.5	0	0	0	105.4
352	E	29.7	Very low	28.8	Very low	114 Å²	114	133.6 Å²	133.6	53%	0.533	70%	0.703	S	S	.	*			cis	54.9	126	33.4	-97	-165.6	-172.9	0	0	112	K350	K350-E352 HydrophobicContact CB-CB 4.46Å; K350-E352 WeakPolarHBondContact CD-OE2 3.04Å; K350-E352 VanDerWaalsContact CE-OE1 3.26Å; K350-E352 WeakPolarHBondContact CE-OE1 3.29Å; K350-E352 WeakPolarHBondContact CE-OE2 3.32Å; K350-E352 IonicContact NZ-OE1 2.74Å; K350-E352 PolarHBondContact NZ-OE1 3.44Å; K350-E352 IonicContact NZ-OE2 2.77Å; K350-E352 PolarHBondContact NZ-OE2 3.29Å
353	I	28.5	Very low	28.8	Very low	117 Å²	117	134.3 Å²	134.3	60%	0.6	71%	0.71	S	S	*	*			cis	-138.3	155	-2.8	-34	76.8	0	0	0	106
354	F	29.7	Very low	28.9	Very low	178 Å²	178	130.9 Å²	130.9	78%	0.781	71%	0.705	S	S	*	*				-175.2	145.3	80.5	-92.4	-77.1	0	0	0	112.8
355	S	32	Very low	28.8	Very low	112 Å²	112	134.1 Å²	134.1	78%	0.783	71%	0.714	S	S	*	*			trans	-148.5	142.9	155	-66.3	0	0	0	0	107.8
356	P	31.1	Very low	28.8	Very low	108 Å²	108	132.5 Å²	132.5	70%	0.701	71%	0.706	S	S	*	*			trans	-137.4	142.1	133.6	34.4	-21.6	0	0	0	111.1
357	S	27.4	Very low	28.9	Very low	95 Å²	95	134.3 Å²	134.3	66%	0.664	71%	0.707	S	S	*	*			cis	71.4	99.7	31.1	87.8	0	0	0	0	115.3
358	H	32	Very low	28.8	Very low	167 Å²	167	137.6 Å²	137.6	77%	0.773	72%	0.715	S	S	*	*			trans	-169.8	129.6	148.5	-94.9	-37.6	0	0	0	109.1
359	N	27.7	Very low	28.9	Very low	131 Å²	131	132.4 Å²	132.4	70%	0.701	71%	0.707	S	S	*	*				65.3	138	90	-89	-6.1	0	0	0	114.3
360	N	26.8	Very low	28.7	Very low	116 Å²	116	135.4 Å²	135.4	62%	0.62	71%	0.708	S	S	*	*			cis	-170.2	171.9	-11.5	-152.5	-4.7	0	0	0	109.5
361	N	27.5	Very low	28.6	Very low	117 Å²	117	137 Å²	137	63%	0.626	72%	0.721	S	S	*	*			trans	66.2	165.3	159.3	-56.5	-29.6	0	0	0	118
362	N	26.8	Very low	28.3	Very low	122 Å²	122	132.3 Å²	132.3	65%	0.652	71%	0.713	S	S	*	*			cis	-166.3	153.6	-33.2	-94.9	-22.7	0	0	0	110
363	N	27.6	Very low	28.1	Very low	160 Å²	160	135.6 Å²	135.6	86%	0.856	73%	0.729	S	S	*	*			trans	65.2	154.2	161.6	-50	-24.8	0	0	0	118.1
364	G	27	Very low	27.9	Very low	58 Å²	58	136.7 Å²	136.7	60%	0.598	74%	0.741	S	S	*	*			cis	152.4	138.3	-13.8	0	0	0	0	0	114.6
365	F	25.3	Very low	27.6	Very low	190 Å²	190	136 Å²	136	83%	0.833	75%	0.745	S	S	*	*			trans	63.3	159.6	164.2	-65.3	-96.3	0	0	0	116.9
366	D	29.9	Very low	27.7	Very low	120 Å²	120	135.9 Å²	135.9	64%	0.642	74%	0.742	S	S	*	*			cis	-142.8	144.9	-1.7	-106.1	-44.8	0	0	0	107.4
367	K	29	Very low	27.4	Very low	173 Å²	173	139 Å²	139	75%	0.752	74%	0.744	S	S	*	*				84.8	151.1	69.1	-82.5	-165.6	-174.6	167.1	0	117.6
368	L	29.1	Very low	27.5	Very low	176 Å²	176	143.3 Å²	143.3	92%	0.921	75%	0.747	S	S	*	*			trans	79.9	132.1	175.7	-50.8	168.5	0	0	0	116
369	G	28.7	Very low	27.8	Very low	59 Å²	59	142.2 Å²	142.2	61%	0.608	75%	0.747	S	S	*	*			cis	167.4	137.2	-18	0	0	0	0	0	115.6
370	Y	26.6	Very low	27.8	Very low	222 Å²	222	146.6 Å²	146.6	87%	0.871	75%	0.754	S	S	*	*			trans	60.9	140.5	160.3	-59.2	-80.3	0	0	0	118.8
371	N	26.9	Very low	27.9	Very low	141 Å²	141	147.2 Å²	147.2	75%	0.754	76%	0.756	S	S	*	*			cis	-151.3	147.4	31.1	-100.9	-32.9	0	0	0	115.4
372	S	24.5	Very low	27.9	Very low	102 Å²	102	148.6 Å²	148.6	71%	0.713	76%	0.764	S	S	*	*			trans	31.9	133.8	148	63.6	0	0	0	0	126
373	Q	26.1	Very low	28	Very low	183 Å²	183	146.3 Å²	146.3	86%	0.855	76%	0.762	S	S	*	*			trans	76.5	100.1	156.2	-63	-176.7	9.2	0	0	120.7
374	T	24.4	Very low	28	Very low	140 Å²	140	145.9 Å²	145.9	86%	0.859	76%	0.758	S	S	*	*			trans	172.2	145.4	133.8	25.5	0	0	0	0	114.2
375	L	24.3	Very low	28.1	Very low	165 Å²	165	153.8 Å²	153.8	86%	0.864	77%	0.77	S	S	*	*			trans	34.6	-142.4	156.8	-56.7	169.5	0	0	0	119
376	P	33.4	Very low	28.2	Very low	109 Å²	109	148.6 Å²	148.6	71%	0.708	76%	0.757	S	S	*	*			trans	-131	-164.5	-134.1	38.2	-13.4	0	0	0	116.1
377	F	25.2	Very low	28.1	Very low	174 Å²	174	149 Å²	149	76%	0.763	76%	0.764	S	S	*	*			trans	76.9	119	164.8	-88.9	-114.5	0	0	0	121.5
378	Y	29.9	Very low	28.2	Very low	185 Å²	185	145.1 Å²	145.1	73%	0.725	76%	0.758	S	S	*	*				62	146.9	129.5	-83.1	-109	0	0	0	125.6
379	N	37.9	Very low	28.2	Very low	143 Å²	143	143.1 Å²	143.1	77%	0.765	75%	0.749	S	S	*	*			trans	69.8	142.5	140.8	-80.6	-11.2	0	0	0	124.4
380	R	27.8	Very low	28.3	Very low	224 Å²	224	146.2 Å²	146.2	85%	0.845	75%	0.751	S	S	*	*			trans	-174.7	146.3	148.6	-110	-175.1	-174.1	-125.3	-3	108.6
381	L	28	Very low	28.5	Very low	128 Å²	128	141.1 Å²	141.1	67%	0.67	74%	0.739	S	S	*	*			cis	-136.9	162.1	4.2	-85.4	159.4	0	0	0	107.5
382	N	27.6	Very low	28.7	Very low	146 Å²	146	141.8 Å²	141.8	78%	0.781	74%	0.738	S	S	*	*			cis	-160.9	-170.3	37.6	-110.7	-14.3	0	0	0	106.9
383	A	29.2	Very low	28.9	Very low	74 Å²	74	143.3 Å²	143.3	61%	0.612	74%	0.742	S	S	*	*			cis	177.9	160	-32.7	0	0	0	0	0	106.9
384	I	28.2	Very low	29	Very low	151 Å²	151	138.3 Å²	138.3	77%	0.774	73%	0.732	S	S	*	*			cis	-159.6	144.4	1.8	-134.4	170.6	0	0	0	111
385	R	27.7	Very low	29.3	Very low	225 Å²	225	136.6 Å²	136.6	85%	0.849	73%	0.726	S	S	*	*			trans	48.8	149.6	138	-111.6	-173.6	-173.3	-167.6	2.5	121.8
386	S	28.1	Very low	29.7	Very low	81 Å²	81	135.2 Å²	135.2	57%	0.566	72%	0.715	S	S	*	*			cis	-161.2	147.5	12.2	-29.2	0	0	0	0	113.6
387	T	28.4	Very low	29.5	Very low	129 Å²	129	140 Å²	140	79%	0.791	72%	0.719	S	S	*	*			trans	41.7	147	131.3	59.7	0	0	0	0	123.3
388	S	30.4	Very low	29.7	Very low	90 Å²	90	136 Å²	136	63%	0.629	71%	0.713	S	S	*	*			cis	176.7	165.2	-7.6	53.6	0	0	0	0	113.4
389	N	30	Very low	29.7	Very low	135 Å²	135	135.6 Å²	135.6	72%	0.722	72%	0.722	S	S	*	*			trans	88	122.4	150.9	-66.6	4.4	0	0	0	123.2
390	N	29.6	Very low	29.3	Very low	123 Å²	123	133 Å²	133	66%	0.658	72%	0.721	S	S	*	*				65.3	147.8	129.9	-61.4	51.4	0	0	0	120.6
391	D	30.2	Very low	29.7	Very low	115 Å²	115	127.8 Å²	127.8	62%	0.615	72%	0.716	S	S	*	*			cis	-165	164.5	-4.2	-107.4	-19.6	0	0	0	112.8
392	H	31.1	Very low	29.7	Very low	156 Å²	156	126.2 Å²	126.2	72%	0.722	72%	0.715	S	S	*	*			trans	64.3	128.5	154.9	-68.9	-40.3	0	0	0	120.8
393	V	30.1	Very low	29.7	Very low	134 Å²	134	127.6 Å²	127.6	81%	0.812	72%	0.717	S	S	*	*				80.6	133.9	65.2	166	0	0	0	0	112
394	A	28.1	Very low	29.6	Very low	78 Å²	78	129.4 Å²	129.4	65%	0.645	72%	0.721	S	S	*	*			cis	-154.3	172.5	21.9	0	0	0	0	0	116.1
395	S	30.3	Very low	29.7	Very low	104 Å²	104	129.2 Å²	129.2	73%	0.727	72%	0.716	S	S	*	*			trans	65.4	156.9	137.3	-71.7	0	0	0	0	124.4
396	E	31.8	Very low	29.7	Very low	135 Å²	135	125.8 Å²	125.8	63%	0.631	71%	0.71	S	S	*	*			cis	176.5	170.4	-21.6	-165.4	172.8	-160.7	0	0	111.1
397	W	30.3	Very low	29.7	Very low	210 Å²	210	128.3 Å²	128.3	80%	0.795	72%	0.716	S	S	*	*			trans	69.5	150.9	168.1	-50.8	95.1	0	0	0	119.5
398	S	28.6	Very low	29.8	Very low	91 Å²	91	130.2 Å²	130.2	64%	0.636	72%	0.717	S	S	*	*			cis	-174.2	161.2	-35.1	-108.5	0	0	0	0	113.5
399	L	29.5	Very low	29.6	Very low	176 Å²	176	135.7 Å²	135.7	92%	0.921	73%	0.73	S	S	*	*			trans	77.7	158.8	155.1	-70.4	159.6	0	0	0	122.2
400	A	29.7	Very low	29.6	Very low	89 Å²	89	133.5 Å²	133.5	74%	0.736	73%	0.73	S	S	*	*			trans	-130	-153.8	-174.6	0	0	0	0	0	108.8
401	P	37	Very low	29.4	Very low	113 Å²	113	134 Å²	134	73%	0.734	74%	0.738	S	S	*	*			cis	-142.2	-163.3	-1.3	40	-16.3	0	0	0	116.2
402	S	27.4	Very low	29.3	Very low	95 Å²	95	133.5 Å²	133.5	66%	0.664	74%	0.744	S	S	*	*			trans	66.7	132.8	144.2	60.8	0	0	0	0	123.8
403	E	27.8	Very low	29.2	Very low	175 Å²	175	132.9 Å²	132.9	82%	0.818	75%	0.751	S	S	*	*			trans	55	123.9	143.8	-59.2	175.9	-165.5	0	0	119.8
404	T	28.1	Very low	29.2	Very low	113 Å²	113	132.7 Å²	132.7	69%	0.693	75%	0.75	S	S	*	*				173.8	166.2	87.9	33.9	0	0	0	0	111.9
405	H	28.9	Very low	29.7	Very low	146 Å²	146	134.3 Å²	134.3	68%	0.676	75%	0.754	S	S	*	*			trans	19	142.6	142.6	-55.6	-63.1	0	0	0	120.9
406	H	28.2	Very low	29.8	Very low	154 Å²	154	135.2 Å²	135.2	71%	0.713	76%	0.758	S	S	*	*			cis	-177.1	177.5	4.8	-118.4	-26.4	0	0	0	112.6
407	I	28.6	Very low	29.9	Very low	134 Å²	134	136.6 Å²	136.6	69%	0.687	77%	0.769	S	S	*	*			trans	80.4	118.6	144.7	-77.8	160.9	0	0	0	121.6
408	M	29.4	Very low	30.2	Very low	168 Å²	168	132.3 Å²	132.3	83%	0.828	77%	0.768	S	S	*	*			trans	57.9	127.4	152.2	-64.3	172.3	-172.3	0	0	120.4
409	K	25.8	Very low	30.4	Very low	205 Å²	205	133.9 Å²	133.9	89%	0.891	78%	0.776	S	S	*	*			cis	72.2	96	46.8	-75.1	-169.3	169	-179.9	0	116.2
410	A	30.3	Very low	30.3	Very low	89 Å²	89	135.2 Å²	135.2	74%	0.736	77%	0.774	S	S	*	*			trans	-168.2	88.7	147.8	0	0	0	0	0	110.1
411	T	26.5	Very low	30.4	Very low	133 Å²	133	136 Å²	136	82%	0.816	77%	0.774	S	S	*	*				66.3	112	99.9	58.1	0	0	0	0	118.2
412	S	26.6	Very low	30	Very low	106 Å²	106	136 Å²	136	74%	0.741	77%	0.772	S	S	*	*			trans	62.4	111.2	135.5	-166.6	0	0	0	0	121.1
413	T	31.1	Very low	29.9	Very low	142 Å²	142	139.3 Å²	139.3	87%	0.871	78%	0.783	S	S	*	*				179	160.3	108.4	27.7	0	0	0	0	113.4
414	T	28.5	Very low	29.9	Very low	130 Å²	130	136 Å²	136	80%	0.798	78%	0.779	S	S	*	*			trans	-107.2	178.6	-175.3	-14.2	0	0	0	0	111.4
415	P	39.1	Very low	29.7	Very low	112 Å²	112	142.8 Å²	142.8	73%	0.727	79%	0.792	S	S	*	*				-100.4	-151.9	-68.9	30	-8.7	0	0	0	111
416	P	33.1	Very low	29.8	Very low	123 Å²	123	139.3 Å²	139.3	80%	0.799	80%	0.796	S	S	*	*				-148.6	167.9	82.4	39	-20.3	0	0	0	116.8
417	L	34.4	Very low	29.7	Very low	164 Å²	164	141.7 Å²	141.7	86%	0.859	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-93.8	149.2	169.4	-76.6	164.8	0	0	0	112.1
418	P	35.8	Very low	29.9	Very low	121 Å²	121	143.6 Å²	143.6	79%	0.786	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-70	154.2	164.3	-16.9	32	0	0	0	112.8
419	P	32.1	Very low	30	Very low	123 Å²	123	142.2 Å²	142.2	80%	0.799	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-99.3	164.1	-157.1	37.7	-37.7	0	0	0	116.4
420	K	27.4	Very low	30.4	Very low	204 Å²	204	139.8 Å²	139.8	89%	0.887	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-102	132.6	157.9	-70.8	178.7	178.6	174	0	110.2
421	S	33.1	Very low	30.6	Very low	105 Å²	105	138.3 Å²	138.3	73%	0.734	78%	0.783	S	S	*	*			trans	-141.6	139.6	158.6	54.3	0	0	0	0	108.1
422	T	27.8	Very low	31	Very low	114 Å²	114	139.7 Å²	139.7	70%	0.699	78%	0.784	S	S	*	*			cis	77.6	92.1	30.3	76.2	0	0	0	0	115.4
423	N	25.6	Very low	31.4	Very low	164 Å²	164	142.3 Å²	142.3	88%	0.877	78%	0.784	S	S	*	*			trans	66.7	148.3	158.5	-58.3	-29.1	0	0	0	115.6
424	S	28	Very low	31.4	Very low	107 Å²	107	142.2 Å²	142.2	75%	0.748	77%	0.774	S	S	*	*			cis	-157.4	156.4	4.8	51.8	0	0	0	0	113.1	G426	S424-G426 PolarHBondContact O-N 2.89Å
425	R	24.4	Very low	31.7	Very low	254 Å²	254	145.7 Å²	145.7	96%	0.958	77%	0.772	S	S	*	*			trans	17.5	95.1	139.8	-164.1	-175.1	-160.6	176.8	5	118.1
426	G	29.8	Very low	31.4	Very low	73 Å²	73	144.8 Å²	144.8	75%	0.753	76%	0.758	S	S	*	*			trans	-142.8	162	168.9	0	0	0	0	0	113	S424	S424-G426 PolarHBondContact O-N 2.89Å
427	R	27.5	Very low	31.4	Very low	204 Å²	204	147.6 Å²	147.6	77%	0.77	75%	0.754	S	S	*	*			trans	-138.6	168.9	-175.1	-81.4	-172.3	176	-177.5	-1.8	112.6
428	Y	31.6	Very low	31.4	Very low	175 Å²	175	145 Å²	145	69%	0.686	74%	0.741	S	S	*	*			trans	105	117.7	150.9	-58.8	-55.6	0	0	0	116
429	I	32.2	Very low	31	Very low	138 Å²	138	142.3 Å²	142.3	71%	0.708	73%	0.725	S	S	*	*				92.9	134.4	96.5	-80.8	175	0	0	0	110.6
430	N	34	Very low	30.9	Very low	154 Å²	154	146.1 Å²	146.1	82%	0.824	73%	0.725	S	S	*	*			cis	-152	168.9	-5.6	-105.3	-7.2	0	0	0	106.9
431	G	34.2	Very low	30.9	Very low	59 Å²	59	144.8 Å²	144.8	61%	0.608	72%	0.722	S	S	*	*			cis	162.6	-172.8	0.3	0	0	0	0	0	110.4
432	I	34.1	Very low	31	Very low	161 Å²	161	144 Å²	144	83%	0.826	71%	0.714	S	S	*	*			trans	73.4	129.5	164.2	-61.5	172.1	0	0	0	115.4
433	Q	34.9	Very low	30.8	Very low	162 Å²	162	143.1 Å²	143.1	76%	0.757	71%	0.713	S	S	*	*			cis	-154.8	139.1	2.7	-131.7	166.2	24.8	0	0	113.3
434	H	32.2	Very low	30.7	Very low	140 Å²	140	144.7 Å²	144.7	65%	0.648	71%	0.712	S	S	*	*			trans	47.2	151.2	139.5	-80.6	-105.4	0	0	0	123.2	Q436	H434-Q436 PolarHBondContact ND1-OE1 2.62Å; H434-Q436 VanDerWaalsContact ND1-OE1 3.14Å
435	R	34.2	Very low	30.8	Very low	202 Å²	202	150.5 Å²	150.5	76%	0.762	72%	0.719	S	S	*	*			cis	-127.7	138.1	3.4	-72.2	-162	173.8	-165.8	-3.5	110.5
436	Q	33.7	Very low	30.8	Very low	94 Å²	94	145.3 Å²	145.3	44%	0.439	71%	0.706	S	S	.	*				53.1	139.9	91.4	-45.4	167.1	-82	0	0	114.5	H434	H434-Q436 PolarHBondContact ND1-OE1 2.62Å; H434-Q436 VanDerWaalsContact ND1-OE1 3.14Å
437	Y	33.1	Very low	30.7	Very low	182 Å²	182	149.8 Å²	149.8	71%	0.714	71%	0.705	S	S	*	*			cis	-143.1	169.5	23.3	-84.2	-98.7	0	0	0	110.4
438	N	33.5	Very low	30.6	Very low	109 Å²	109	147.6 Å²	147.6	58%	0.583	70%	0.703	S	S	*	*			cis	178.5	163.1	-33.2	-101.6	17.2	0	0	0	107.2
439	S	28.7	Very low	30.5	Very low	64 Å²	64	144.5 Å²	144.5	45%	0.448	71%	0.707	S	S	.	*			cis	176.5	164.7	-36.8	49.7	0	0	0	0	110
440	Y	29.3	Very low	30.3	Very low	203 Å²	203	143.9 Å²	143.9	80%	0.796	71%	0.705	S	S	*	*			trans	74.5	136.4	166.9	-45.5	-57.3	0	0	0	117.1
441	H	27.5	Very low	30	Very low	176 Å²	176	142.9 Å²	142.9	82%	0.815	70%	0.696	S	S	*	*			cis	75.2	146.6	23	-144.7	-121.5	0	0	0	112.9
442	P	34	Very low	29.9	Very low	88 Å²	88	147.4 Å²	147.4	57%	0.571	70%	0.701	S	S	*	*			cis	-133.5	-166.8	-16.8	30.1	-6.7	0	0	0	114.3
443	S	24.9	Very low	29.6	Very low	97 Å²	97	145.8 Å²	145.8	68%	0.678	69%	0.69	S	S	*	*			trans	72.1	146.3	140	56.3	0	0	0	0	122.3
444	F	24.1	Very low	29.5	Very low	197 Å²	197	147.4 Å²	147.4	86%	0.864	69%	0.689	S	S	*	*			trans	-12.8	123.6	155.3	-60.9	-102.8	0	0	0	116.3
445	Y	28.9	Very low	29.4	Very low	229 Å²	229	147.9 Å²	147.9	90%	0.898	69%	0.691	S	S	*	*				-155.7	150.2	106	-114.2	-75.6	0	0	0	112.8
446	E	23.9	Very low	28.9	Very low	145 Å²	145	143.7 Å²	143.7	68%	0.678	69%	0.692	S	S	*	*			trans	-77.1	129.5	174.7	179.7	-161.2	178	0	0	111.2
447	K	27.9	Very low	28.5	Very low	167 Å²	167	144.3 Å²	144.3	73%	0.726	71%	0.706	S	S	*	*				175.9	121.2	124.5	-97.2	165.1	-174.1	177.2	0	114.8
448	Q	26.7	Very low	28.1	Very low	158 Å²	158	140.8 Å²	140.8	74%	0.738	71%	0.708	S	S	*	*				38.1	155.7	123.7	-67.5	180	-32.6	0	0	122.6
449	S	28.1	Very low	27.8	Very low	110 Å²	110	141.2 Å²	141.2	77%	0.769	71%	0.714	S	S	*	*			trans	81.9	132	163.1	84.3	0	0	0	0	115.9
450	N	27.8	Very low	27.8	Very low	125 Å²	125	143.5 Å²	143.5	67%	0.668	73%	0.726	S	S	*	*			cis	-155.8	161.1	-11.7	-135.5	18.5	0	0	0	113.8
451	E	28.5	Very low	27.7	Very low	133 Å²	133	142.9 Å²	142.9	62%	0.621	73%	0.73	S	S	*	*			trans	36.7	131.2	131.8	-92.8	177.5	-118.2	0	0	119.8
452	Q	31.9	Very low	27.8	Very low	153 Å²	153	138.1 Å²	138.1	72%	0.715	73%	0.729	S	S	*	*				-174.1	163.3	53.2	-82.1	-139.8	-0.7	0	0	109.5
453	H	29.1	Very low	27.7	Very low	128 Å²	128	139.6 Å²	139.6	59%	0.593	73%	0.732	S	S	*	*			cis	-173.9	152.3	-23.9	-149.4	-31.9	0	0	0	107.9
454	R	31.2	Very low	28.1	Very low	195 Å²	195	143.8 Å²	143.8	74%	0.736	74%	0.738	S	S	*	*			trans	70.3	160.8	160.9	-54.1	174.8	-171	-155	2.3	117
455	Q	30.7	Very low	28.3	Very low	151 Å²	151	141.2 Å²	141.2	71%	0.706	73%	0.732	S	S	*	*			cis	-153.2	126.6	-31.6	-108.8	160.1	-45.6	0	0	105.6
456	C	23.8	Very low	28.5	Very low	114 Å²	114	136.6 Å²	136.6	77%	0.77	73%	0.732	S	S	*	*				65.1	128.5	96.7	-65	0	0	0	0	117.3
457	S	24.7	Very low	28.8	Very low	107 Å²	107	138.7 Å²	138.7	75%	0.748	74%	0.738	S	S	*	*			trans	90.3	93.4	143.4	-55.7	0	0	0	0	122.2
458	S	24.7	Very low	29	Very low	107 Å²	107	136.2 Å²	136.2	75%	0.748	74%	0.739	S	S	*	*				81.1	163.7	109.5	68.7	0	0	0	0	123.9
459	V	26.9	Very low	29.3	Very low	118 Å²	118	136 Å²	136	72%	0.715	74%	0.738	S	S	*	*			trans	86.4	129.3	157.9	-134.6	0	0	0	0	120.8
460	T	29.6	Very low	29.4	Very low	112 Å²	112	140.6 Å²	140.6	69%	0.687	74%	0.739	S	S	*	*			trans	50.6	108.1	152.1	42.8	0	0	0	0	122.7
461	E	26.4	Very low	29.5	Very low	190 Å²	190	140 Å²	140	89%	0.888	74%	0.744	S	S	*	*				47.3	125.9	94.4	-162.4	168.3	-134.2	0	0	119.9
462	G	31	Very low	29.5	Very low	76 Å²	76	138.1 Å²	138.1	78%	0.784	75%	0.751	S	S	*	*			trans	172.7	115	171.2	0	0	0	0	0	115.5
463	N	31.4	Very low	29.2	Very low	119 Å²	119	136 Å²	136	64%	0.636	75%	0.754	S	S	*	*			trans	-87.5	151.5	-176.5	-77.7	-53.4	0	0	0	114.7
464	K	33.4	Very low	29.3	Very low	185 Å²	185	135.4 Å²	135.4	80%	0.804	76%	0.761	S	S	*	*				163	122	115.1	-86.5	169.7	-175.2	179.4	0	117
465	I	29.1	Very low	29	Very low	144 Å²	144	133.7 Å²	133.7	74%	0.738	77%	0.765	S	S	*	*				61.1	120.2	129.6	-55.6	166.5	0	0	0	121.4
466	C	31	Very low	28.9	Very low	132 Å²	132	133.9 Å²	133.9	89%	0.892	77%	0.77	S	S	*	*				-159.6	163.5	127.9	-128.1	0	0	0	0	112.3
467	K	30.6	Very low	28.8	Very low	189 Å²	189	131.9 Å²	131.9	82%	0.822	76%	0.761	S	S	*	*			trans	-115.7	-165.8	-164.5	-62	-175.2	179	-178.7	0	113.1
468	P	33.3	Very low	28.9	Very low	114 Å²	114	136.2 Å²	136.2	74%	0.74	77%	0.767	S	S	*	*				-131.5	178.9	-73.6	40.2	-25.2	0	0	0	114.2
469	E	31.9	Very low	29.1	Very low	155 Å²	155	137.9 Å²	137.9	72%	0.724	77%	0.768	S	S	*	*			trans	-167.8	132.7	131.8	-112.3	-162.7	141.7	0	0	116.7
470	R	30.9	Very low	29	Very low	205 Å²	205	135.4 Å²	135.4	77%	0.774	76%	0.76	S	S	*	*			trans	50.8	108	143.4	-78.6	179.7	164.7	134.3	-9.7	124.4
471	S	29.9	Very low	28.8	Very low	112 Å²	112	137.1 Å²	137.1	78%	0.783	76%	0.764	S	S	*	*				56.4	139.7	124.1	62.6	0	0	0	0	122.4
472	A	29	Very low	28.9	Very low	94 Å²	94	139.4 Å²	139.4	78%	0.777	77%	0.765	S	S	*	*			cis	-164.3	156.9	-11.4	0	0	0	0	0	111.3
473	S	25.8	Very low	28.6	Very low	109 Å²	109	142 Å²	142	76%	0.762	76%	0.759	S	S	*	*			trans	-114.9	175.5	153.3	-53.4	0	0	0	0	108.2
474	P	29.4	Very low	28.5	Very low	115 Å²	115	142.8 Å²	142.8	75%	0.747	77%	0.772	S	S	*	*				-135.4	151.2	113.3	37.1	-29.1	0	0	0	113.9
475	I	25	Very low	28.2	Very low	159 Å²	159	140.3 Å²	140.3	82%	0.815	76%	0.763	S	S	*	*			trans	-87.9	135.6	153.6	-64.8	167.4	0	0	0	106
476	L	28.4	Very low	28.3	Very low	156 Å²	156	138.7 Å²	138.7	82%	0.817	76%	0.764	S	S	*	*			trans	-126.8	125.1	159.6	-76.2	174.9	0	0	0	108.8
477	A	23.3	Very low	28.2	Very low	71 Å²	71	142.8 Å²	142.8	59%	0.587	76%	0.761	S	S	*	*			trans	-91.8	176.1	153.1	0	0	0	0	0	108.2
478	F	25.6	Very low	28.1	Very low	199 Å²	199	141.5 Å²	141.5	87%	0.873	76%	0.758	S	S	*	*			trans	67	148.2	-164.8	-48.9	-85.3	0	0	0	111.8
479	D	28.5	Very low	27.8	Very low	142 Å²	142	142 Å²	142	76%	0.759	76%	0.764	S	S	*	*			cis	-131.7	163.3	15.7	-156.9	5.4	0	0	0	113.3
480	A	25.7	Very low	27.5	Very low	66 Å²	66	138.9 Å²	138.9	55%	0.545	77%	0.765	S	S	.	*			trans	-105.6	145	169.3	0	0	0	0	0	110.1
481	N	25.8	Very low	27.3	Very low	147 Å²	147	134.4 Å²	134.4	79%	0.786	76%	0.76	S	S	*	*			trans	71.9	89.2	177.3	-44	-53.8	0	0	0	116.7
482	R	27.2	Very low	27.2	Very low	239 Å²	239	136 Å²	136	90%	0.902	75%	0.749	S	S	*	*			trans	-169.5	100.5	142	-98.8	149	-163.7	-101	4.1	106.8
483	M	26	Very low	27.1	Very low	131 Å²	131	137.6 Å²	137.6	65%	0.645	74%	0.739	S	S	*	*				58.5	94.7	57	-65.7	-60.6	-67.2	0	0	113.9	E485	M483-E485 HydrophobicContact CE-CB 4.05Å; M483-E485 HydrophobicContact CE-CG 4.11Å; M483-E485 WeakPolarHBondContact CE-OE1 3.16Å
484	C	28.4	Very low	27.2	Very low	135 Å²	135	139 Å²	139	91%	0.912	73%	0.733	S	S	*	*			trans	-171	67.6	161	-88.9	0	0	0	0	104.5
485	E	27.2	Very low	27.1	Very low	132 Å²	132	140.2 Å²	140.2	62%	0.617	73%	0.729	S	S	*	*				67.1	97.3	57.9	-164.4	174.1	-114.8	0	0	113.4	M483	M483-E485 HydrophobicContact CE-CB 4.05Å; M483-E485 HydrophobicContact CE-CG 4.11Å; M483-E485 WeakPolarHBondContact CE-OE1 3.16Å
486	S	31.1	Very low	27.3	Very low	110 Å²	110	139.1 Å²	139.1	77%	0.769	73%	0.725	S	S	*	*			trans	-148.7	72.9	160.6	179.8	0	0	0	0	110.9
487	R	30	Very low	27.3	Very low	219 Å²	219	136.4 Å²	136.4	83%	0.826	71%	0.714	S	S	*	*			trans	58.1	110.5	145.2	-62.4	168	177.2	-172.9	-4.2	117.3
488	Q	28.2	Very low	27.6	Very low	162 Å²	162	139.6 Å²	139.6	76%	0.757	72%	0.721	S	S	*	*				57.5	126.4	68.4	-55.8	174.6	12.4	0	0	111.8
489	S	27.5	Very low	27.8	Very low	124 Å²	124	135.8 Å²	135.8	87%	0.867	72%	0.715	S	S	*	*				-152.7	167.9	63.8	52	0	0	0	0	114.5
490	A	24.3	Very low	27.7	Very low	89 Å²	89	134.3 Å²	134.3	74%	0.736	72%	0.715	S	S	*	*			trans	-152.7	-157.6	-177.3	0	0	0	0	0	111
491	V	27.6	Very low	27.9	Very low	111 Å²	111	134.5 Å²	134.5	67%	0.673	72%	0.724	S	S	*	*			trans	71.4	146.7	171.9	-124.4	0	0	0	0	113.5	F493	V491-F493 HydrophobicContact CG1-CD2 3.87Å; V491-F493 HydrophobicContact CG1-CE2 3.44Å; V491-F493 VanDerWaalsContact CG1-CE2 3.44Å; V491-F493 HydrophobicContact CG1-CZ 3.98Å
492	R	27.6	Very low	27.9	Very low	145 Å²	145	134.5 Å²	134.5	55%	0.547	72%	0.723	S	S	.	*			cis	-158.2	130.8	43.7	-70.5	-165.2	173.9	-141.9	-4	112.3
493	F	27.2	Very low	27.8	Very low	129 Å²	129	133.9 Å²	133.9	57%	0.566	72%	0.72	S	S	*	*				71.9	148.7	97.7	-67.3	-52.6	0	0	0	116.5	V491	V491-F493 HydrophobicContact CG1-CD2 3.87Å; V491-F493 HydrophobicContact CG1-CE2 3.44Å; V491-F493 VanDerWaalsContact CG1-CE2 3.44Å; V491-F493 HydrophobicContact CG1-CZ 3.98Å
494	Q	27.4	Very low	27.8	Very low	137 Å²	137	132.6 Å²	132.6	64%	0.64	72%	0.72	S	S	*	*			cis	-173.6	149.8	-4.8	163.8	172.9	-1.9	0	0	113.1
495	E	27.1	Very low	27.7	Very low	142 Å²	142	133.5 Å²	133.5	66%	0.664	71%	0.709	S	S	*	*			trans	32.5	137.8	156.6	-65.7	161.5	167.2	0	0	124.3
496	N	29.7	Very low	27.7	Very low	136 Å²	136	133.8 Å²	133.8	73%	0.727	71%	0.71	S	S	*	*				-171.9	111.7	101.5	-103	-61.2	0	0	0	117.7
497	T	27.9	Very low	27.6	Very low	98 Å²	98	135.5 Å²	135.5	60%	0.601	71%	0.71	S	S	*	*			trans	39.7	147.2	131.9	63.5	0	0	0	0	125
498	N	29	Very low	27.4	Very low	138 Å²	138	133.7 Å²	133.7	74%	0.738	71%	0.711	S	S	*	*			trans	88.5	137.6	157.3	-51.3	-45.6	0	0	0	118.2
499	T	30.3	Very low	27.2	Very low	119 Å²	119	132 Å²	132	73%	0.73	72%	0.716	S	S	*	*			cis	-157.3	143.8	-5.4	5.1	0	0	0	0	113.3
500	S	27.3	Very low	27.1	Very low	111 Å²	111	130.8 Å²	130.8	78%	0.776	71%	0.707	S	S	*	*			trans	18.4	140	146.8	62.8	0	0	0	0	123.6
501	G	28.4	Very low	27.3	Very low	70 Å²	70	133 Å²	133	72%	0.722	71%	0.706	S	S	*	*			trans	133.9	94.1	147.7	0	0	0	0	0	114
502	I	26.1	Very low	27.2	Very low	148 Å²	148	135.1 Å²	135.1	76%	0.759	71%	0.709	S	S	*	*				81.7	95.5	60.8	-62.5	-178.9	0	0	0	113.9
503	W	25.4	Very low	27.2	Very low	226 Å²	226	135 Å²	135	86%	0.856	72%	0.719	S	S	*	*			trans	99	130.6	136.9	-80.9	36.3	0	0	0	123.6
504	T	26.7	Very low	27.3	Very low	104 Å²	104	135.1 Å²	135.1	64%	0.638	73%	0.73	S	S	*	*			trans	73.1	119.1	140	50.3	0	0	0	0	122.9
505	K	26.6	Very low	27.4	Very low	154 Å²	154	134 Å²	134	67%	0.67	73%	0.733	S	S	*	*				64.9	120.2	129.8	-81.8	175.3	154.7	-82.7	0	120.4
506	E	26	Very low	27.5	Very low	138 Å²	138	138 Å²	138	65%	0.645	74%	0.742	S	S	*	*				77.9	147.4	126.5	-69.9	161.6	177.8	0	0	119.6
507	N	28.8	Very low	27.4	Very low	145 Å²	145	137 Å²	137	78%	0.775	74%	0.741	S	S	*	*			trans	68.4	108.6	165.8	-57.1	-3.9	0	0	0	117.5
508	E	25.5	Very low	27.6	Very low	182 Å²	182	136.8 Å²	136.8	85%	0.85	75%	0.749	S	S	*	*				8.4	115.4	117.7	-55.6	-179.5	162.3	0	0	115.9
509	C	25.1	Very low	27.7	Very low	126 Å²	126	138.4 Å²	138.4	85%	0.851	75%	0.752	S	S	*	*				-162.7	171.2	103.7	-113.1	0	0	0	0	114
510	S	25.6	Very low	27.7	Very low	99 Å²	99	139.2 Å²	139.2	69%	0.692	75%	0.751	S	S	*	*			trans	-76.2	-179	-173	49.7	0	0	0	0	115.3
511	L	27.5	Very low	28	Very low	134 Å²	134	141.7 Å²	141.7	70%	0.702	76%	0.755	S	S	*	*			trans	95	91.9	143.3	-133	70.3	0	0	0	118.7
512	E	26.8	Very low	28	Very low	157 Å²	157	141.8 Å²	141.8	73%	0.734	76%	0.756	S	S	*	*				59.5	146.6	124.2	-60.8	173.9	163.5	0	0	122.3
513	D	26.6	Very low	28.2	Very low	143 Å²	143	145 Å²	145	77%	0.765	77%	0.765	S	S	*	*			trans	41.8	120.5	145.5	-67.9	4.7	0	0	0	121
514	T	30.6	Very low	28.5	Very low	131 Å²	131	142 Å²	142	80%	0.804	76%	0.757	S	S	*	*				-174.7	140.4	92.5	-74.1	0	0	0	0	112.6
515	T	28.2	Very low	28.7	Very low	112 Å²	112	142.9 Å²	142.9	69%	0.687	77%	0.765	S	S	*	*			trans	-49	153.6	176.1	60.8	0	0	0	0	117
516	R	29.3	Very low	28.8	Very low	227 Å²	227	142.9 Å²	142.9	86%	0.857	77%	0.765	S	S	*	*				-172.7	116.1	106.8	-104.6	175.9	172.4	164	-0.9	117.9
517	T	28	Very low	28.9	Very low	116 Å²	116	141.4 Å²	141.4	71%	0.712	77%	0.765	S	S	*	*			trans	24.6	117.9	136.9	52.3	0	0	0	0	122.9
518	A	31.5	Very low	28.9	Very low	92 Å²	92	143.5 Å²	143.5	76%	0.76	77%	0.768	S	S	*	*				-149.8	119.4	109	0	0	0	0	0	107.2
519	Q	30.7	Very low	28.9	Very low	172 Å²	172	142 Å²	142	80%	0.804	76%	0.764	S	S	*	*				60.7	129	80	-65.7	-171.1	-5.6	0	0	112.1
520	I	31.8	Very low	29.1	Very low	137 Å²	137	143.8 Å²	143.8	70%	0.703	77%	0.765	S	S	*	*			cis	-144.2	141	29.3	-66.2	174.4	0	0	0	111.4
521	N	32	Very low	29.1	Very low	163 Å²	163	150.1 Å²	150.1	87%	0.872	77%	0.774	S	S	*	*			trans	41.4	144.9	159.8	-52.7	-11.9	0	0	0	120.9
522	G	29.8	Very low	29	Very low	71 Å²	71	148 Å²	148	73%	0.732	78%	0.776	S	S	*	*			cis	155.6	144	2.5	0	0	0	0	0	107.5
523	F	30.7	Very low	29	Very low	217 Å²	217	149.1 Å²	149.1	95%	0.952	78%	0.781	S	S	*	*			cis	-134.9	-178.5	17.4	-116.9	-104.8	0	0	0	112.6
524	K	30.3	Very low	29	Very low	162 Å²	162	147.5 Å²	147.5	70%	0.704	78%	0.781	S	S	*	*			trans	-131.4	163.5	-177	-108	169.8	-178.4	152.5	0	109.8	K526	K524-K526 HydrophobicContact CD-CB 4.2Å; K524-K526 HydrophobicContact CD-CD 4.39Å; K524-K526 HydrophobicContact CD-CG 4.45Å; K524-K526 HydrophobicContact CG-CB 4.15Å
525	P	31.3	Very low	29	Very low	123 Å²	123	147 Å²	147	80%	0.799	78%	0.783	S	S	*	*				-134.4	161.1	51.7	41.6	-26	0	0	0	114.7
526	K	28.8	Very low	29	Very low	153 Å²	153	149.6 Å²	149.6	67%	0.665	79%	0.792	S	S	*	*			cis	81.2	153.2	17.2	-142.6	-145.3	177.1	-164.9	0	116.4	K524	K524-K526 HydrophobicContact CD-CB 4.2Å; K524-K526 HydrophobicContact CD-CD 4.39Å; K524-K526 HydrophobicContact CD-CG 4.45Å; K524-K526 HydrophobicContact CG-CB 4.15Å
527	V	27.8	Very low	29	Very low	107 Å²	107	144.5 Å²	144.5	65%	0.648	79%	0.792	S	S	*	*			trans	87.7	128.7	168	-175.2	0	0	0	0	113.6
528	F	29.1	Very low	29	Very low	190 Å²	190	146.6 Å²	146.6	83%	0.833	80%	0.797	S	S	*	*			cis	-136.3	169.1	-7.2	-116.1	-49.2	0	0	0	110.6
529	I	25.9	Very low	28.9	Very low	150 Å²	150	150.6 Å²	150.6	77%	0.769	80%	0.8	S	S	*	*			trans	-111.8	141	164.5	-63.2	167.7	0	0	0	106.2
530	D	29.4	Very low	28.6	Very low	164 Å²	164	148.1 Å²	148.1	88%	0.877	80%	0.796	S	S	*	*			trans	-152.1	169.6	148.3	-130.7	-37.7	0	0	0	113.7
531	R	24.6	Very low	28.4	Very low	232 Å²	232	150.3 Å²	150.3	88%	0.875	80%	0.801	S	S	*	*			trans	-130.3	109	-157.5	170.8	-164.9	-179.4	160	0.1	112.6
532	A	25.9	Very low	28.2	Very low	89 Å²	89	148.5 Å²	148.5	74%	0.736	80%	0.796	S	S	*	*			trans	-173.3	142.3	151.9	0	0	0	0	0	115
533	Q	27.5	Very low	28.4	Very low	180 Å²	180	150.4 Å²	150.4	84%	0.841	80%	0.796	S	S	*	*			trans	43.5	105.4	134.3	-61.8	173.5	-6.3	0	0	121.2
534	S	26.2	Very low	28.4	Very low	110 Å²	110	144.3 Å²	144.3	77%	0.769	79%	0.785	S	S	*	*				22.3	116.8	127	59.7	0	0	0	0	120.4
535	S	30	Very low	28.3	Very low	120 Å²	120	143.5 Å²	143.5	84%	0.839	79%	0.789	S	S	*	*				-169	149.4	122.9	29.1	0	0	0	0	111.2
536	D	27.5	Very low	28.4	Very low	166 Å²	166	149.6 Å²	149.6	89%	0.888	80%	0.796	S	S	*	*			trans	-76.7	141	-178	-51.5	-87.3	0	0	0	112.8
537	S	30.9	Very low	28.6	Very low	121 Å²	121	149.5 Å²	149.5	85%	0.846	80%	0.803	S	S	*	*			trans	-157.2	141.1	142.9	49.6	0	0	0	0	111.3
538	I	27	Very low	28.7	Very low	160 Å²	160	150.9 Å²	150.9	82%	0.821	81%	0.807	S	S	*	*			trans	-88.5	129.7	178.8	-62.2	165.3	0	0	0	108.5
539	Q	30.1	Very low	28.7	Very low	175 Å²	175	150.9 Å²	150.9	82%	0.818	81%	0.806	S	S	*	*			trans	-145.8	127.2	156.5	-120.2	174	43.9	0	0	112.6
540	T	24.6	Very low	28.9	Very low	120 Å²	120	149.4 Å²	149.4	74%	0.736	81%	0.805	S	S	*	*			trans	-77.9	120.8	-175.2	-50	0	0	0	0	111.5
541	F	28.1	Very low	28.9	Very low	183 Å²	183	147.3 Å²	147.3	80%	0.803	80%	0.798	S	S	*	*			trans	-145.8	117.1	162.9	-86.4	-70.5	0	0	0	113.5
542	T	27.4	Very low	29.1	Very low	125 Å²	125	140.5 Å²	140.5	77%	0.767	79%	0.785	S	S	*	*			trans	-131.5	169	155.8	54.3	0	0	0	0	107
543	P	32.4	Very low	29.4	Very low	111 Å²	111	144.8 Å²	144.8	72%	0.721	79%	0.79	S	S	*	*			cis	-118.7	-174.3	-22.8	38.9	-25	0	0	0	111.3
544	A	31.2	Very low	29.5	Very low	89 Å²	89	144.2 Å²	144.2	74%	0.736	79%	0.787	S	S	*	*			trans	-156	103	160.3	0	0	0	0	0	111.7
545	D	28.8	Very low	29.8	Very low	146 Å²	146	148.1 Å²	148.1	78%	0.781	79%	0.791	S	S	*	*			trans	-76.7	134.9	169.1	-54.5	-70.8	0	0	0	110.6
546	W	34.4	Very low	29.6	Very low	250 Å²	250	147.1 Å²	147.1	95%	0.947	78%	0.779	S	S	*	*			trans	-130.3	108.6	167.8	-91.6	60.1	0	0	0	109.6
547	D	32.4	Very low	29.9	Very low	151 Å²	151	145.9 Å²	145.9	81%	0.807	78%	0.778	S	S	*	*			trans	-68.6	161.6	-178.7	-76.8	-44.9	0	0	0	114.3
548	D	28.8	Very low	29.7	Very low	137 Å²	137	146.9 Å²	146.9	73%	0.733	77%	0.773	S	S	*	*			trans	5.4	134.4	149.6	-70.2	-20	0	0	0	119
549	K	30.2	Very low	29.9	Very low	190 Å²	190	144.6 Å²	144.6	83%	0.826	77%	0.772	S	S	*	*				-172.7	154.9	103.4	-102.7	152.7	-166.2	151.4	0	118.1
550	T	30.3	Very low	29.9	Very low	119 Å²	119	140.1 Å²	140.1	73%	0.73	77%	0.765	S	S	*	*			trans	74.8	97.9	143.8	44.5	0	0	0	0	121.7
551	T	29.5	Very low	30.1	Very low	120 Å²	120	142.1 Å²	142.1	74%	0.736	77%	0.771	S	S	*	*				65.8	112.8	123.9	37.1	0	0	0	0	121.8
552	S	27.9	Very low	30.3	Very low	88 Å²	88	139.7 Å²	139.7	62%	0.615	77%	0.771	S	S	*	*				45.7	126.4	124.2	69.3	0	0	0	0	120.5
553	H	33.1	Very low	30.5	Very low	180 Å²	180	136.5 Å²	136.5	83%	0.833	76%	0.763	S	S	*	*				-150	111.7	102.7	-111.8	-65.1	0	0	0	112.3
554	E	28.8	Very low	30.5	Very low	167 Å²	167	137.3 Å²	137.3	78%	0.78	77%	0.766	S	S	*	*			trans	-71.7	130.7	161.6	176.9	-179.4	-150	0	0	108.8
555	K	32.1	Very low	30.5	Very low	193 Å²	193	137.6 Å²	137.6	84%	0.839	76%	0.758	S	S	*	*			trans	-156.2	100.7	157.7	-125	173.3	-173.4	179.2	0	113.8
556	V	26.6	Very low	30.6	Very low	99 Å²	99	140.3 Å²	140.3	60%	0.6	76%	0.759	S	S	*	*			trans	-38.8	136.3	154.1	177	0	0	0	0	111.9	D558	V556-D558 WeakPolarHBondContact CG1-OD2 3.26Å
557	T	33.3	Very low	30.4	Very low	139 Å²	139	134.1 Å²	134.1	85%	0.853	75%	0.745	S	S	*	*			trans	-152.3	117.1	142.7	3.9	0	0	0	0	110.3
558	D	26.7	Very low	30.4	Very low	142 Å²	142	134.4 Å²	134.4	76%	0.759	75%	0.746	S	S	*	*			trans	-78.5	143.5	176.1	-49.8	-94.5	0	0	0	112.7	V556	V556-D558 WeakPolarHBondContact CG1-OD2 3.26Å
559	S	32	Very low	30.5	Very low	112 Å²	112	130.9 Å²	130.9	78%	0.783	74%	0.742	S	S	*	*			trans	-168.2	102.4	147.5	48.5	0	0	0	0	107.3
560	A	30	Very low	30.3	Very low	82 Å²	82	127.7 Å²	127.7	68%	0.678	74%	0.743	S	S	*	*			cis	74.3	142.8	49.8	0	0	0	0	0	113.8
561	N	29	Very low	30.2	Very low	161 Å²	161	126.8 Å²	126.8	86%	0.861	74%	0.741	S	S	*	*			trans	70.7	132.8	178.3	-53.9	-31.3	0	0	0	114.4
562	V	32.5	Very low	30.2	Very low	133 Å²	133	127.8 Å²	127.8	81%	0.806	74%	0.742	S	S	*	*			cis	-142	144.2	-2.5	-175.4	0	0	0	0	106.6
563	G	31	Very low	30.1	Very low	58 Å²	58	128.8 Å²	128.8	60%	0.598	74%	0.744	S	S	*	*			cis	142.9	174.6	-0.5	0	0	0	0	0	110.6
564	T	32.8	Very low	30	Very low	127 Å²	127	126.8 Å²	126.8	78%	0.779	74%	0.744	S	S	*	*			trans	69.5	138.1	169.7	71.3	0	0	0	0	117
565	T	31.2	Very low	29.9	Very low	95 Å²	95	123.5 Å²	123.5	58%	0.583	74%	0.736	S	S	*	*			cis	-162	146.8	-12.9	13.5	0	0	0	0	110.3
566	Y	31	Very low	29.7	Very low	204 Å²	204	123.3 Å²	123.3	80%	0.8	74%	0.738	S	S	*	*			trans	57.8	152.9	145.1	-59.6	-41.8	0	0	0	120.7
567	D	29.3	Very low	29.8	Very low	120 Å²	120	128.3 Å²	128.3	64%	0.642	75%	0.747	S	S	*	*			cis	173.6	166.5	-36.7	-116.7	-13.8	0	0	0	106.4
568	N	32.9	Very low	29.6	Very low	157 Å²	157	129 Å²	129	84%	0.84	75%	0.746	S	S	*	*			trans	66.9	145.7	167.9	-48.3	-54.8	0	0	0	116
569	G	31.1	Very low	29.9	Very low	62 Å²	62	128 Å²	128	64%	0.639	74%	0.744	S	S	*	*			cis	-150.8	146.9	-10.7	0	0	0	0	0	107.9
570	C	26.2	Very low	30.2	Very low	124 Å²	124	128.2 Å²	128.2	84%	0.838	74%	0.743	S	S	*	*				58.3	117.3	65.5	-73.2	0	0	0	0	113.7
571	S	27.1	Very low	30.1	Very low	100 Å²	100	128.2 Å²	128.2	70%	0.699	74%	0.744	S	S	*	*			trans	51.2	112.7	147.9	58.5	0	0	0	0	119.5
572	N	30.1	Very low	30.3	Very low	141 Å²	141	127.4 Å²	127.4	75%	0.754	74%	0.739	S	S	*	*				-175	113.6	106.4	-86.9	-9.6	0	0	0	108.5
573	T	26.4	Very low	30.2	Very low	108 Å²	108	126.7 Å²	126.7	66%	0.663	73%	0.731	S	S	*	*				52.5	111.8	92.7	64.4	0	0	0	0	114.5
574	V	29.5	Very low	30.2	Very low	138 Å²	138	134 Å²	134	84%	0.836	74%	0.742	S	S	*	*				178.6	137.2	125	152.3	0	0	0	0	108.1
575	T	27.4	Very low	30.1	Very low	98 Å²	98	133.5 Å²	133.5	60%	0.601	74%	0.738	S	S	*	*			trans	-87.4	138	167.5	45.8	0	0	0	0	110.1
576	E	28.9	Very low	29.9	Very low	190 Å²	190	135.2 Å²	135.2	89%	0.888	74%	0.744	S	S	*	*			trans	-155.3	158.9	142.2	-127.3	160.1	-165.9	0	0	112.3
577	Y	26.9	Very low	29.7	Very low	203 Å²	203	136 Å²	136	80%	0.796	75%	0.746	S	S	*	*			trans	-92.8	152.4	176.9	-78.2	-117.9	0	0	0	109
578	D	29.9	Very low	29.7	Very low	155 Å²	155	139.1 Å²	139.1	83%	0.829	75%	0.754	S	S	*	*				-172.6	160.5	103.4	-105	-23.1	0	0	0	115.1
579	V	32.8	Very low	29.4	Very low	119 Å²	119	139.2 Å²	139.2	72%	0.721	75%	0.748	S	S	*	*			trans	-158.4	167.1	-161.2	-175.7	0	0	0	0	107.1
580	P	37.7	Very low	29.3	Very low	117 Å²	117	141.1 Å²	141.1	76%	0.76	75%	0.752	S	S	*	*			cis	-114.1	-166.4	-45.2	38.2	-23.8	0	0	0	111.4
581	A	29.2	Very low	29.4	Very low	83 Å²	83	141.9 Å²	141.9	69%	0.686	75%	0.747	S	S	*	*			trans	-146	141	139	0	0	0	0	0	112.2
582	D	32.1	Very low	29.3	Very low	143 Å²	143	142.3 Å²	142.3	77%	0.765	75%	0.747	S	S	*	*			trans	58.3	145	158.1	-64	-35.4	0	0	0	123.3
583	N	31.2	Very low	29.3	Very low	119 Å²	119	141.4 Å²	141.4	64%	0.636	75%	0.749	S	S	*	*			cis	-165.5	176.1	-40.3	-129	-52.1	0	0	0	110.6
584	Y	30.1	Very low	29.3	Very low	212 Å²	212	141 Å²	141	83%	0.831	75%	0.748	S	S	*	*			trans	64.1	91.9	179	-76.4	-85.8	0	0	0	115.9
585	V	30.9	Very low	29.1	Very low	115 Å²	115	140 Å²	140	70%	0.697	74%	0.737	S	S	*	*				71	100.3	54	-171.8	0	0	0	0	114.4
586	D	27.4	Very low	29.1	Very low	131 Å²	131	142.9 Å²	142.9	70%	0.701	75%	0.747	S	S	*	*				-149.6	107.4	107	-159.3	-0.3	0	0	0	110
587	W	26.2	Very low	29	Very low	221 Å²	221	143 Å²	143	84%	0.837	74%	0.741	S	S	*	*			trans	-114.8	111.7	173.1	-102.7	41.6	0	0	0	108.3	H589	W587-H589 AromaticContact CE3-CE1 3.75Å; W587-H589 AromaticContact CZ3-CE1 3.94Å
588	K	29.2	Very low	29	Very low	186 Å²	186	140.3 Å²	140.3	81%	0.809	74%	0.741	S	S	*	*			trans	-120.1	106.7	165.7	-76.4	-170.6	178.4	178.3	0	110.7	S590	K588-S590 PolarHBondContact O-N 3.12Å
589	H	28.3	Very low	28.9	Very low	158 Å²	158	136.6 Å²	136.6	73%	0.731	73%	0.727	S	S	*	*			trans	-57.5	131.7	157.2	-48	-49.5	0	0	0	109.2	W587	W587-H589 AromaticContact CE3-CE1 3.75Å; W587-H589 AromaticContact CZ3-CE1 3.94Å
590	S	28.7	Very low	28.7	Very low	103 Å²	103	140 Å²	140	72%	0.72	73%	0.728	S	S	*	*			trans	-167	105.5	153.5	-83.7	0	0	0	0	110.4	K588	K588-S590 PolarHBondContact O-N 3.12Å
591	I	28.2	Very low	28.2	Very low	140 Å²	140	139.4 Å²	139.4	72%	0.718	73%	0.727	S	S	*	*			trans	60.7	128.2	139.3	-53.1	165.6	0	0	0	116.3
592	P	24.4	Very low	28.3	Very low	109 Å²	109	143.7 Å²	143.7	71%	0.708	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-57.8	130.5	171	26.4	-34.5	0	0	0	109.7	P594	P592-P594 WeakPolarHBondContact O-CD 3.13Å; P592-P594 VanDerWaalsContact O-N 3.15Å
593	P	30.8	Very low	28.1	Very low	122 Å²	122	144.7 Å²	144.7	79%	0.792	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-62.7	120.2	-175.8	25	-33.3	0	0	0	109.3
594	P	26.2	Very low	28	Very low	100 Å²	100	148.7 Å²	148.7	65%	0.649	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-65.6	150.8	-179.1	27.8	-35	0	0	0	110.4	P592 L596	P592-P594 WeakPolarHBondContact O-CD 3.13Å; P592-P594 VanDerWaalsContact O-N 3.15Å; P594-L596 PolarHBondContact O-N 3.33Å
595	I	25.7	Very low	27.9	Very low	116 Å²	116	143.4 Å²	143.4	60%	0.595	74%	0.735	S	S	*	*			trans	-49.6	104.6	176.4	-56.5	160.8	0	0	0	109.7	Y597 D734	I595-Y597 HydrophobicContact CG2-CD2 4.3Å; I595-D734 WeakPolarHBondContact CD1-OD2 3.41Å
596	L	27.3	Very low	27.8	Very low	158 Å²	158	143.3 Å²	143.3	83%	0.827	74%	0.739	S	S	*	*			trans	-108.3	94.6	171.2	-78.2	177.8	0	0	0	109.6	P594 D598	P594-L596 PolarHBondContact O-N 3.33Å; L596-D598 PolarHBondContact O-N 3.02Å
597	Y	26.7	Very low	27.9	Very low	194 Å²	194	143.9 Å²	143.9	76%	0.761	74%	0.742	S	S	*	*			trans	-44	127.2	159.9	-95.6	-102.2	0	0	0	110.7	I595 S599	I595-Y597 HydrophobicContact CG2-CD2 4.3Å; Y597-S599 WeakPolarHBondContact CD1-OG 3.42Å; Y597-S599 PolarHBondContact O-N 3.21Å
598	D	26.9	Very low	28.1	Very low	146 Å²	146	143.2 Å²	143.2	78%	0.781	75%	0.745	S	S	*	*			trans	-79.3	49	168.3	-136.2	-5.1	0	0	0	110.9	L596 Y600	L596-D598 PolarHBondContact O-N 3.02Å; D598-Y600 VanDerWaalsContact C-N 3.27Å; D598-Y600 PolarHBondContact O-N 3.44Å; D598-Y600 VanDerWaalsContact OD1-CD2 3.26Å; D598-Y600 WeakPolarHBondContact OD1-CD2 3.49Å
599	S	26.9	Very low	28.1	Very low	77 Å²	77	139.5 Å²	139.5	54%	0.538	74%	0.74	S	S	.	*			trans	-81	72.2	174.5	-69.9	0	0	0	0	110	Y597 S601	Y597-S599 WeakPolarHBondContact CD1-OG 3.42Å; Y597-S599 PolarHBondContact O-N 3.21Å; S599-S601 PolarHBondContact O-N 3.01Å
600	Y	28.2	Very low	28.2	Very low	189 Å²	189	138.7 Å²	138.7	74%	0.741	74%	0.741	S	S	*	*			trans	-74.5	52.3	174.6	-102.2	-83.5	0	0	0	113.9	D598	D598-Y600 VanDerWaalsContact C-N 3.27Å; D598-Y600 PolarHBondContact O-N 3.44Å; D598-Y600 VanDerWaalsContact OD1-CD2 3.26Å; D598-Y600 WeakPolarHBondContact OD1-CD2 3.49Å
601	S	28.4	Very low	28.1	Very low	106 Å²	106	139.7 Å²	139.7	74%	0.741	74%	0.739	S	S	*	*			trans	-107.7	60.1	159	-164.3	0	0	0	0	109.6	S599 Q603	S599-S601 PolarHBondContact O-N 3.01Å; S601-Q603 PolarHBondContact O-N 3.1Å
602	K	30.3	Very low	28.2	Very low	172 Å²	172	138 Å²	138	75%	0.748	73%	0.731	S	S	*	*			trans	-81.3	74.1	174.4	-81.6	-173.9	175.2	172.9	0	110.9	K604	K602-K604 PolarHBondContact O-N 2.87Å; K602-K604 VanDerWaalsContact O-N 3.16Å
603	Q	28	Very low	28.6	Very low	164 Å²	164	141.4 Å²	141.4	77%	0.766	73%	0.731	S	S	*	*			trans	-51.8	112.2	166.7	-170.2	172.1	14	0	0	109.6	S601 C605	S601-Q603 PolarHBondContact O-N 3.1Å; Q603-C605 PolarHBondContact O-N 3.17Å; Q603-C605 VanDerWaalsContact O-N 3.12Å
604	K	30.4	Very low	28.3	Very low	203 Å²	203	141.4 Å²	141.4	88%	0.883	73%	0.732	S	S	*	*			trans	-76.3	96.5	169.6	-85.6	-168.4	173.4	-175.5	0	109	K602 S606	K602-K604 PolarHBondContact O-N 2.87Å; K602-K604 VanDerWaalsContact O-N 3.16Å; K604-S606 PolarHBondContact O-N 3.41Å
605	C	26	Very low	28.4	Very low	102 Å²	102	142.8 Å²	142.8	69%	0.689	73%	0.733	S	S	*	*			trans	-61.4	130.4	161.8	-62.1	0	0	0	0	109.5	Q603	Q603-C605 PolarHBondContact O-N 3.17Å; Q603-C605 VanDerWaalsContact O-N 3.12Å
606	S	30.6	Very low	28.4	Very low	112 Å²	112	144.1 Å²	144.1	78%	0.783	74%	0.741	S	S	*	*			trans	-133.9	118.1	159.1	50.8	0	0	0	0	107	K604	K604-S606 PolarHBondContact O-N 3.41Å
607	D	28.7	Very low	28.4	Very low	144 Å²	144	147.8 Å²	147.8	77%	0.77	74%	0.744	S	S	*	*			trans	-74.8	144.7	-155	-51.8	-84.2	0	0	0	114.3
608	K	30.7	Very low	28.4	Very low	206 Å²	206	150 Å²	150	90%	0.896	75%	0.751	S	S	*	*			trans	-144	103.7	150.3	-114.2	177.1	-178	178.1	0	109.1
609	P	29.1	Very low	28.6	Very low	109 Å²	109	149 Å²	149	71%	0.708	75%	0.753	S	S	*	*			trans	-77.8	150.2	177.4	32.9	-34.8	0	0	0	110.9
610	N	29.4	Very low	28.6	Very low	141 Å²	141	150.6 Å²	150.6	75%	0.754	76%	0.764	S	S	*	*				-179	130.9	124.4	-92	-5.2	0	0	0	110
611	N	28.3	Very low	28.4	Very low	124 Å²	124	151.4 Å²	151.4	66%	0.663	77%	0.767	S	S	*	*			trans	56.6	138.2	140.2	-62.3	56.2	0	0	0	119.2
612	D	29.8	Very low	28.2	Very low	105 Å²	105	152.3 Å²	152.3	56%	0.561	76%	0.763	S	S	*	*			cis	-164.9	159.7	6.1	-120.2	-19.9	0	0	0	111.5
613	Y	31.4	Very low	28.1	Very low	180 Å²	180	150.4 Å²	150.4	71%	0.706	76%	0.76	S	S	*	*			trans	41.8	113	167.2	-56.5	-71	0	0	0	118.5	I615	Y613-I615 HydrophobicContact CD1-CD1 4.27Å
614	C	24.8	Very low	28	Very low	121 Å²	121	149 Å²	149	82%	0.818	76%	0.758	S	S	*	*			cis	60.6	150.3	39.1	-57.8	0	0	0	0	116.7
615	I	29.4	Very low	27.7	Very low	130 Å²	130	144.3 Å²	144.3	67%	0.667	75%	0.751	S	S	*	*			trans	97	88.7	165.5	-49.7	167.7	0	0	0	117.8	Y613	Y613-I615 HydrophobicContact CD1-CD1 4.27Å
616	N	25.3	Very low	27.7	Very low	144 Å²	144	144.8 Å²	144.8	77%	0.77	75%	0.751	S	S	*	*				31.4	120	121.8	-54.3	-29.6	0	0	0	121.5
617	R	27.3	Very low	27.6	Very low	235 Å²	235	147 Å²	147	89%	0.887	75%	0.749	S	S	*	*				-168.8	117.7	127.8	-94.9	144.9	-153.3	-115.1	6.6	107.9
618	R	26.2	Very low	27.5	Very low	239 Å²	239	146.8 Å²	146.8	90%	0.902	75%	0.747	S	S	*	*				68	129.9	88.9	-82.6	-165.2	177.4	-171.8	0.2	114.3
619	P	31.7	Very low	27.3	Very low	126 Å²	126	141.7 Å²	141.7	82%	0.818	74%	0.736	S	S	*	*			trans	-86.9	144.8	-178.2	35.3	-35	0	0	0	113.6
620	S	26.5	Very low	27.3	Very low	110 Å²	110	143 Å²	143	77%	0.769	73%	0.733	S	S	*	*			trans	-146.9	123.5	151.4	-76.1	0	0	0	0	104.9
621	Y	24.4	Very low	27.2	Very low	207 Å²	207	143.8 Å²	143.8	81%	0.812	73%	0.729	S	S	*	*				60.3	121.6	86.3	-86.3	-77.3	0	0	0	114.7
622	D	25	Very low	27.2	Very low	124 Å²	124	147.1 Å²	147.1	66%	0.663	74%	0.738	S	S	*	*			trans	87.3	124.4	137.9	-72.5	-19.1	0	0	0	123.6
623	I	26.4	Very low	27.4	Very low	133 Å²	133	147.7 Å²	147.7	68%	0.682	75%	0.747	S	S	*	*				74.9	112.4	125.6	-65	171.1	0	0	0	118.3
624	N	26.2	Very low	27.3	Very low	135 Å²	135	147.2 Å²	147.2	72%	0.722	75%	0.752	S	S	*	*			trans	44	104.5	141.4	-58.9	-15.7	0	0	0	119.3
625	S	24.7	Very low	27.4	Very low	104 Å²	104	147.1 Å²	147.1	73%	0.727	74%	0.741	S	S	*	*				70.4	160.9	113.4	-54.5	0	0	0	0	120.2
626	T	26.9	Very low	27.6	Very low	112 Å²	112	149.8 Å²	149.8	69%	0.687	75%	0.751	S	S	*	*			trans	81.2	80.5	156.7	-29.9	0	0	0	0	117
627	Q	27.2	Very low	27.9	Very low	158 Å²	158	150.3 Å²	150.3	74%	0.738	75%	0.749	S	S	*	*				83.3	132.9	127.9	-68.5	-177.4	26.2	0	0	121.7
628	L	27.6	Very low	28.2	Very low	140 Å²	140	148.5 Å²	148.5	73%	0.733	75%	0.747	S	S	*	*			trans	75.4	127.6	136.8	-93.6	69.5	0	0	0	121.6
629	C	26.7	Very low	28.4	Very low	99 Å²	99	144.8 Å²	144.8	67%	0.669	74%	0.738	S	S	*	*			trans	84.7	97.5	133	-69.6	0	0	0	0	121.5
630	E	28.1	Very low	28.6	Very low	137 Å²	137	145.6 Å²	145.6	64%	0.64	73%	0.731	S	S	*	*				84.1	112.3	111.4	-62.9	-140.1	138.5	0	0	121.1
631	K	27.7	Very low	28.9	Very low	156 Å²	156	146.3 Å²	146.3	68%	0.678	72%	0.722	S	S	*	*				66	121.3	120.4	-66.2	176.1	-176.7	155.9	0	120.2
632	K	28.5	Very low	29	Very low	195 Å²	195	146.7 Å²	146.7	85%	0.848	72%	0.722	S	S	*	*			trans	98.7	140.1	133.6	-80	177.7	174.2	-175.7	0	118.1
633	P	34	Very low	29.3	Very low	116 Å²	116	144.5 Å²	144.5	75%	0.753	73%	0.729	S	S	*	*			trans	-91.7	164.5	175.3	38.8	-35.6	0	0	0	111.6
634	Q	28.4	Very low	29.5	Very low	171 Å²	171	143.4 Å²	143.4	80%	0.799	72%	0.724	S	S	*	*				-176.8	141.3	125.6	-102.5	-178.7	-3.5	0	0	113.2
635	I	28.4	Very low	29.7	Very low	118 Å²	118	147.1 Å²	147.1	61%	0.605	73%	0.728	S	S	*	*			trans	38	112.5	133.7	-53.4	163.7	0	0	0	118
636	Q	33.5	Very low	29.9	Very low	186 Å²	186	145.9 Å²	145.9	87%	0.869	72%	0.72	S	S	*	*				-156.5	160.3	106.6	-133.7	130.2	127.7	0	0	116.3
637	Q	30.8	Very low	30	Very low	155 Å²	155	148.9 Å²	148.9	72%	0.724	73%	0.726	S	S	*	*			trans	-96.4	146.7	-178.3	-53.6	167	0.9	0	0	111.5
638	K	33	Very low	30	Very low	197 Å²	197	148.6 Å²	148.6	86%	0.857	72%	0.724	S	S	*	*				-165.9	107.9	126.8	-102.3	153.6	-176.1	175.6	0	108.7
639	K	31.4	Very low	30.1	Very low	161 Å²	161	147.5 Å²	147.5	70%	0.7	72%	0.719	S	S	*	*				62.6	105.5	62.3	-168.4	-173.4	-174.9	174.7	0	110.2
640	H	34.2	Very low	30.1	Very low	144 Å²	144	151 Å²	151	67%	0.667	72%	0.723	S	S	*	*				-169.4	117.1	121	-103.6	65.1	0	0	0	115.4
641	Q	32.8	Very low	30.1	Very low	124 Å²	124	153.1 Å²	153.1	58%	0.579	73%	0.733	S	S	*	*			trans	70.8	117.4	135.7	-69	-168.5	31.6	0	0	124.5
642	R	28.3	Very low	30.2	Very low	215 Å²	215	148.6 Å²	148.6	81%	0.811	73%	0.73	S	S	*	*				73.6	142	123.5	-65.3	176	178.8	178.2	-4.6	119.9
643	G	31.1	Very low	30.2	Very low	79 Å²	79	144.3 Å²	144.3	81%	0.814	73%	0.725	S	S	*	*			trans	169.3	45.1	174.9	0	0	0	0	0	114.1
644	D	30	Very low	30	Very low	109 Å²	109	144.9 Å²	144.9	58%	0.583	72%	0.721	S	S	*	*			trans	-31.4	133.5	175.9	-85.1	-99.2	0	0	0	118.6
645	R	29.7	Very low	30.1	Very low	213 Å²	213	143.6 Å²	143.6	80%	0.804	72%	0.718	S	S	*	*			trans	85.3	156.8	132.6	-66.5	166.8	-156.6	-165	2.3	123.2
646	S	28.9	Very low	30.1	Very low	79 Å²	79	143.9 Å²	143.9	55%	0.552	72%	0.717	S	S	*	*			trans	69.8	126.2	137.3	53.9	0	0	0	0	119.7
647	E	29.1	Very low	30	Very low	174 Å²	174	139.8 Å²	139.8	81%	0.813	72%	0.716	S	S	*	*				51.5	141.6	128.6	-64.6	131.5	-122.1	0	0	118.9
648	E	27.4	Very low	30	Very low	152 Å²	152	138.8 Å²	138.8	71%	0.71	71%	0.71	S	S	*	*			cis	173.3	-166.6	-1.9	-106.5	-159.3	159.1	0	0	103.2
649	N	29.7	Very low	30	Very low	117 Å²	117	136 Å²	136	63%	0.626	70%	0.704	S	S	*	*			trans	58.9	88.8	148.3	-61.1	-41.4	0	0	0	119.1
650	K	28.1	Very low	29.8	Very low	172 Å²	172	134.8 Å²	134.8	75%	0.748	71%	0.705	S	S	*	*				11.3	136.6	117.1	-46.7	163.2	-172.8	157.5	0	117.2
651	H	27.9	Very low	29.6	Very low	183 Å²	183	137.3 Å²	137.3	85%	0.847	71%	0.714	S	S	*	*			trans	138.9	165.3	133.5	-78.7	-73.1	0	0	0	112.3
652	G	28.7	Very low	29.4	Very low	60 Å²	60	136.2 Å²	136.2	62%	0.619	72%	0.719	S	S	*	*			trans	87	127.3	-157.7	0	0	0	0	0	110.1
653	S	27.9	Very low	29.4	Very low	106 Å²	106	130.5 Å²	130.5	74%	0.741	71%	0.712	S	S	*	*			cis	56.8	130.7	23.8	91.3	0	0	0	0	111.7
654	D	29.7	Very low	29.2	Very low	127 Å²	127	135.6 Å²	135.6	68%	0.679	71%	0.712	S	S	*	*				-160.4	154.6	64.1	-92.9	-17.1	0	0	0	114.1
655	I	31	Very low	29.1	Very low	144 Å²	144	135.6 Å²	135.6	74%	0.738	72%	0.716	S	S	*	*			trans	62.4	145	130.3	-64.9	171.5	0	0	0	119.9
656	Q	28.3	Very low	29	Very low	124 Å²	124	132.9 Å²	132.9	58%	0.579	72%	0.717	S	S	*	*			cis	-177	128.1	-19.1	-178.1	72.1	-8.7	0	0	108.4	H658	Q656-H658 HydrophobicContact CG-CB 3.96Å; Q656-H658 PolarHBondContact NE2-CD2 2.96Å; Q656-H658 PolarHBondContact NE2-CE1 3.1Å; Q656-H658 VanDerWaalsContact NE2-CG 3.33Å; Q656-H658 PolarHBondContact NE2-ND1 3.17Å; Q656-H658 PolarHBondContact NE2-NE2 3.42Å
657	A	33	Very low	29	Very low	101 Å²	101	132 Å²	132	84%	0.835	72%	0.72	S	S	*	*			trans	-178.2	63.5	166.2	0	0	0	0	0	110.4
658	H	30.4	Very low	29	Very low	133 Å²	133	130.7 Å²	130.7	62%	0.616	72%	0.719	S	S	*	*				80.7	141.1	55.7	-153.4	11.4	0	0	0	113.6	Q656	Q656-H658 HydrophobicContact CG-CB 3.96Å; Q656-H658 PolarHBondContact NE2-CD2 2.96Å; Q656-H658 PolarHBondContact NE2-CE1 3.1Å; Q656-H658 VanDerWaalsContact NE2-CG 3.33Å; Q656-H658 PolarHBondContact NE2-ND1 3.17Å; Q656-H658 PolarHBondContact NE2-NE2 3.42Å
659	I	33	Very low	29.2	Very low	139 Å²	139	133.7 Å²	133.7	71%	0.713	73%	0.726	S	S	*	*			trans	89.4	67.2	172.4	-48.5	167.4	0	0	0	113.6
660	D	26.1	Very low	29.2	Very low	136 Å²	136	134 Å²	134	73%	0.727	73%	0.727	S	S	*	*			trans	-36.2	154.8	135.9	-34.1	-112.2	0	0	0	113.2
661	F	30.1	Very low	29.3	Very low	197 Å²	197	132.6 Å²	132.6	86%	0.864	72%	0.723	S	S	*	*			trans	-158	150.7	133.4	-116.3	-74.9	0	0	0	112.1
662	C	29.2	Very low	29.4	Very low	100 Å²	100	128.6 Å²	128.6	68%	0.676	72%	0.716	S	S	*	*			trans	12.5	119.7	176.1	-70	0	0	0	0	119.2
663	S	27.4	Very low	29.5	Very low	95 Å²	95	132.3 Å²	132.3	66%	0.664	72%	0.721	S	S	*	*			cis	71.9	122.5	39.7	98.1	0	0	0	0	116.6
664	K	27.6	Very low	29.6	Very low	186 Å²	186	132 Å²	132	81%	0.809	71%	0.71	S	S	*	*			trans	80.9	133	147.2	-70.7	-179.2	172.4	-178.8	0	121.5
665	T	28.2	Very low	29.6	Very low	109 Å²	109	131.4 Å²	131.4	67%	0.669	71%	0.707	S	S	*	*			trans	69.6	114.8	135.9	55.4	0	0	0	0	122.1
666	N	26.4	Very low	29.5	Very low	156 Å²	156	132 Å²	132	83%	0.834	71%	0.705	S	S	*	*				67.8	160	125.7	-53.1	15.7	0	0	0	119.1
667	G	30.9	Very low	29.5	Very low	60 Å²	60	134.1 Å²	134.1	62%	0.619	72%	0.715	S	S	*	*			trans	94.8	106.3	-159.1	0	0	0	0	0	108.1
668	D	27.5	Very low	29.6	Very low	147 Å²	147	134.5 Å²	134.5	79%	0.786	71%	0.709	S	S	*	*			cis	54.3	91.3	40	-44.8	-47.9	0	0	0	111.3
669	Y	31.2	Very low	29.6	Very low	216 Å²	216	134.4 Å²	134.4	85%	0.847	72%	0.718	S	S	*	*				-177.6	94.7	124.8	-103.1	-72.1	0	0	0	109.4
670	D	29.8	Very low	29.3	Very low	124 Å²	124	136.9 Å²	136.9	66%	0.663	72%	0.723	S	S	*	*				36.3	158	113.7	-141.1	-4.4	0	0	0	121.6
671	Q	31	Very low	29.5	Very low	142 Å²	142	134.7 Å²	134.7	66%	0.664	72%	0.718	S	S	*	*			trans	66.6	95.1	154.2	-76.6	158.2	46.5	0	0	120.4
672	S	29.5	Very low	29.4	Very low	98 Å²	98	132.3 Å²	132.3	69%	0.685	71%	0.714	S	S	*	*				100.9	156.8	98.6	79.8	0	0	0	0	121.8
673	L	30.7	Very low	29.3	Very low	139 Å²	139	133.9 Å²	133.9	73%	0.728	72%	0.716	S	S	*	*			trans	59.6	100.9	147	-95.8	79.9	0	0	0	120.6
674	N	30.2	Very low	29.4	Very low	98 Å²	98	134.5 Å²	134.5	52%	0.524	71%	0.712	S	S	.	*				81.6	151.1	102.4	-85.1	37.5	0	0	0	124.2
675	D	31.2	Very low	29.5	Very low	115 Å²	115	134.9 Å²	134.9	62%	0.615	71%	0.708	S	S	*	*			trans	69.4	90.5	139.7	-58.5	-19.7	0	0	0	121.2
676	F	28.1	Very low	29.5	Very low	158 Å²	158	134.7 Å²	134.7	69%	0.693	70%	0.702	S	S	*	*				71.5	127.8	112.1	-87.4	-70.9	0	0	0	121.9
677	H	28.9	Very low	29.5	Very low	168 Å²	168	135.2 Å²	135.2	78%	0.778	70%	0.697	S	S	*	*			trans	82.1	153.2	141	-80.5	-34.3	0	0	0	120.5
678	P	33.8	Very low	29.4	Very low	109 Å²	109	137.8 Å²	137.8	71%	0.708	70%	0.695	S	S	*	*			trans	-122.6	154.8	-160.3	40.4	-25.3	0	0	0	114.6
679	T	31.5	Very low	29.6	Very low	131 Å²	131	137.9 Å²	137.9	80%	0.804	69%	0.691	S	S	*	*			trans	-138.3	123.9	145.9	26.5	0	0	0	0	106.6
680	K	26.6	Very low	29.5	Very low	191 Å²	191	133.4 Å²	133.4	83%	0.83	68%	0.682	S	S	*	*				75.2	150.1	59.8	-158	-171.8	-171.3	-171.8	0	111.2
681	S	29.1	Very low	29.6	Very low	89 Å²	89	131.6 Å²	131.6	62%	0.622	68%	0.679	S	S	*	*			trans	64.8	123.7	179.8	43.3	0	0	0	0	116.1
682	D	28.1	Very low	29.5	Very low	147 Å²	147	134.1 Å²	134.1	79%	0.786	68%	0.684	S	S	*	*				67	141.9	123.6	-52.5	-5.7	0	0	0	118.3
683	L	28.6	Very low	29.6	Very low	134 Å²	134	134.8 Å²	134.8	70%	0.702	68%	0.684	S	S	*	*			cis	-154.4	175.6	3.3	-155.9	61.1	0	0	0	109.7
684	D	28.9	Very low	29.5	Very low	108 Å²	108	136.9 Å²	136.9	58%	0.578	69%	0.69	S	S	*	*			trans	62	124.3	139.9	-100.4	1.6	0	0	0	120.3
685	R	28.8	Very low	29.2	Very low	193 Å²	193	139.8 Å²	139.8	73%	0.728	70%	0.702	S	S	*	*				86.6	126.7	121.9	-79	173.8	175.8	-141.2	-6.4	120.8
686	I	28	Very low	29.2	Very low	106 Å²	106	142.2 Å²	142.2	54%	0.544	72%	0.715	S	S	.	*				84.2	103.6	122.3	-73.1	176.6	0	0	0	117.2
687	K	28	Very low	29.1	Very low	167 Å²	167	139.6 Å²	139.6	73%	0.726	72%	0.716	S	S	*	*				72.6	161.8	127	-64.6	-171.5	-147.7	169.3	0	115.8
688	L	28.9	Very low	29.4	Very low	113 Å²	113	137.4 Å²	137.4	59%	0.592	72%	0.717	S	S	*	*			cis	-157.3	170.8	-12.5	-118.2	168.8	0	0	0	107.8
689	Q	31.3	Very low	29.2	Very low	149 Å²	149	138.1 Å²	138.1	70%	0.696	72%	0.72	S	S	*	*			trans	68.4	143	145.1	-83.1	145.3	-11.2	0	0	119.7
690	N	28.3	Very low	29	Very low	123 Å²	123	140.7 Å²	140.7	66%	0.658	72%	0.72	S	S	*	*			cis	-171.4	154.1	-27.1	-123.7	11.4	0	0	0	111.2
691	S	31.5	Very low	28.9	Very low	85 Å²	85	139.5 Å²	139.5	59%	0.594	72%	0.721	S	S	*	*			trans	69.5	165.2	139.1	76.3	0	0	0	0	118.6
692	Y	29.5	Very low	28.8	Very low	195 Å²	195	142.2 Å²	142.2	77%	0.765	73%	0.728	S	S	*	*			cis	-144.5	130.8	14	-120.2	-62.9	0	0	0	113.5
693	T	30.9	Very low	28.6	Very low	113 Å²	113	142 Å²	142	69%	0.693	73%	0.725	S	S	*	*			trans	63.5	158.3	151.6	33.4	0	0	0	0	120.6
694	Q	29.2	Very low	28.5	Very low	182 Å²	182	142.9 Å²	142.9	85%	0.85	73%	0.731	S	S	*	*			cis	-139.4	166.3	4.4	-151.9	153.6	11.6	0	0	114.4
695	M	24.2	Very low	28.2	Very low	160 Å²	160	142.3 Å²	142.3	79%	0.788	73%	0.732	S	S	*	*			trans	-73.1	156.1	-166.1	-55.7	179.9	172.1	0	0	117.3
696	N	30	Very low	28.1	Very low	166 Å²	166	143.8 Å²	143.8	89%	0.888	74%	0.739	S	S	*	*				-152.9	158.5	106.2	-97.1	-29.8	0	0	0	111.5
697	S	28	Very low	27.9	Very low	102 Å²	102	144.9 Å²	144.9	71%	0.713	75%	0.746	S	S	*	*			trans	-123.9	162.4	-148	53.6	0	0	0	0	116.8
698	P	33.8	Very low	28	Very low	122 Å²	122	142.4 Å²	142.4	79%	0.792	75%	0.745	S	S	*	*			trans	-101.4	179.2	-166	41.1	-37.5	0	0	0	114.7
699	T	29.8	Very low	27.9	Very low	125 Å²	125	143.3 Å²	143.3	77%	0.767	75%	0.75	S	S	*	*			trans	-142.3	117.7	170.7	-52.1	0	0	0	0	114.9
700	K	28.7	Very low	27.8	Very low	184 Å²	184	143 Å²	143	80%	0.8	75%	0.754	S	S	*	*			trans	52.3	113.1	152.1	-64.3	175.9	-178.7	175.6	0	121.8
701	L	22.8	Very low	27.8	Very low	166 Å²	166	142 Å²	142	87%	0.869	76%	0.756	S	S	*	*			trans	-64	151.6	139.8	-71.9	161.4	0	0	0	111.1
702	I	27.6	Very low	27.5	Very low	146 Å²	146	145 Å²	145	75%	0.749	77%	0.765	S	S	*	*			trans	-134.3	119.3	158	-65.3	-178.9	0	0	0	107.7
703	L	23.1	Very low	27.5	Very low	142 Å²	142	144.6 Å²	144.6	74%	0.743	77%	0.77	S	S	*	*			trans	-76.4	146.6	164	-75.2	95.6	0	0	0	109.4
704	N	27.1	Very low	27.2	Very low	154 Å²	154	146.6 Å²	146.6	82%	0.824	78%	0.775	S	S	*	*			trans	-132.3	98.5	156.6	-109.7	-17.3	0	0	0	108.8
705	T	23.2	Very low	27.2	Very low	95 Å²	95	147.8 Å²	147.8	58%	0.583	78%	0.781	S	S	*	*			trans	-68.3	139.8	175.7	-42.7	0	0	0	0	110.5
706	Y	26.8	Very low	27.4	Very low	224 Å²	224	143.9 Å²	143.9	88%	0.878	78%	0.781	S	S	*	*			trans	-136.7	133.4	146.2	-87.9	-76.8	0	0	0	108.9
707	N	23.8	Very low	27.1	Very low	129 Å²	129	145.2 Å²	145.2	69%	0.69	79%	0.785	S	S	*	*			trans	-68.8	164.1	179.5	-63.8	-15.9	0	0	0	109.4
708	T	29	Very low	27.2	Very low	116 Å²	116	149.1 Å²	149.1	71%	0.712	79%	0.789	S	S	*	*			cis	-159.8	141.9	49.6	46.9	0	0	0	0	114.6
709	N	27.3	Very low	27	Very low	131 Å²	131	151 Å²	151	70%	0.701	79%	0.787	S	S	*	*			trans	58.1	133.7	131.3	-54.7	10.3	0	0	0	119
710	N	28.9	Very low	26.8	Very low	144 Å²	144	152.1 Å²	152.1	77%	0.77	79%	0.787	S	S	*	*			cis	-160.9	157.9	9	-103.9	-8.3	0	0	0	112
711	S	28.8	Very low	26.9	Very low	101 Å²	101	153 Å²	153	71%	0.706	79%	0.791	S	S	*	*			trans	61.1	125.4	160.2	-140.9	0	0	0	0	117.9
712	L	25.3	Very low	27.1	Very low	148 Å²	148	150.4 Å²	150.4	78%	0.775	79%	0.786	S	S	*	*				59.5	130.4	53.1	-64.8	151.7	0	0	0	111.9
713	E	29.2	Very low	27.1	Very low	186 Å²	186	153.1 Å²	153.1	87%	0.869	79%	0.793	S	S	*	*			cis	-135.3	168.7	41.5	-64.6	179	125.2	0	0	116.4
714	L	24.1	Very low	27.3	Very low	156 Å²	156	155.2 Å²	155.2	82%	0.817	80%	0.799	S	S	*	*			trans	-110.7	142.1	166.9	-79.8	83.3	0	0	0	110.4
715	Q	28.7	Very low	27.3	Very low	207 Å²	207	153.3 Å²	153.3	97%	0.967	79%	0.793	S	S	*	*			trans	-163.6	157.1	145.9	-114.5	171.4	24.3	0	0	112
716	G	28.9	Very low	27.3	Very low	77 Å²	77	156.1 Å²	156.1	79%	0.794	80%	0.803	S	S	*	*			trans	116.5	43.7	164.2	0	0	0	0	0	119
717	M	24.2	Very low	27.3	Very low	195 Å²	195	151.2 Å²	151.2	96%	0.961	80%	0.796	S	S	*	*			trans	-78.2	122.8	164.9	-95.3	-168.3	169.8	0	0	112
718	K	30.2	Very low	27.3	Very low	183 Å²	183	150.3 Å²	150.3	80%	0.796	80%	0.796	S	S	*	*			trans	-179.6	146.8	151.3	-101.1	168.6	179.5	-170.9	0	108.2
719	E	29.5	Very low	27.2	Very low	162 Å²	162	150.4 Å²	150.4	76%	0.757	80%	0.801	S	S	*	*			cis	-145.4	163.1	3.5	-146.3	151.7	-120.2	0	0	110.4
720	I	26.3	Very low	27.1	Very low	149 Å²	149	152.2 Å²	152.2	76%	0.764	81%	0.805	S	S	*	*			trans	-116.5	124.6	-173.7	-61.9	168.2	0	0	0	110.7
721	K	29.8	Very low	27	Very low	203 Å²	203	150.5 Å²	150.5	88%	0.883	81%	0.805	S	S	*	*			trans	179.6	149.4	147.6	-89.8	136.9	-165	174.7	0	108.1
722	S	28.1	Very low	26.9	Very low	110 Å²	110	151.3 Å²	151.3	77%	0.769	81%	0.809	S	S	*	*			cis	-132.8	140.2	4.7	46.3	0	0	0	0	111.4
723	F	26	Very low	27	Very low	203 Å²	203	152.6 Å²	152.6	89%	0.89	81%	0.811	S	S	*	*			trans	-74.8	140.8	159	-93.5	-105.8	0	0	0	109
724	E	27.5	Very low	26.9	Very low	187 Å²	187	149 Å²	149	87%	0.874	80%	0.797	S	S	*	*			trans	-116.1	145.3	153.2	-168.8	160.9	-131.5	0	0	108.4
725	T	26.5	Very low	27.1	Very low	113 Å²	113	150.7 Å²	150.7	69%	0.693	80%	0.799	S	S	*	*			trans	-83.5	128.9	-155	-56.2	0	0	0	0	112.9	T727	T725-T727 HydrophobicContact CG2-CG2 4.4Å; T725-T727 PolarHBondContact O-N 3.02Å
726	I	24.1	Very low	27	Very low	154 Å²	154	146.2 Å²	146.2	79%	0.79	79%	0.79	S	S	*	*			trans	-69.2	96.6	166.5	-58.1	173.6	0	0	0	108.8	T728	I726-T728 HydrophobicContact CG2-CG2 4Å; I726-T728 PolarHBondContact O-N 2.78Å
727	T	26	Very low	26.9	Very low	121 Å²	121	150.1 Å²	150.1	74%	0.742	79%	0.792	S	S	*	*			trans	-86.7	91.2	164.9	50.9	0	0	0	0	109.9	T725 S729	T725-T727 HydrophobicContact CG2-CG2 4.4Å; T725-T727 PolarHBondContact O-N 3.02Å; T727-S729 PolarHBondContact O-N 3.35Å
728	T	24.8	Very low	27.1	Very low	111 Å²	111	151.2 Å²	151.2	68%	0.681	79%	0.787	S	S	*	*			trans	-66	114.4	167	45.8	0	0	0	0	110.6	I726	I726-T728 HydrophobicContact CG2-CG2 4Å; I726-T728 PolarHBondContact O-N 2.78Å
729	S	26.3	Very low	26.8	Very low	117 Å²	117	153.8 Å²	153.8	82%	0.818	79%	0.792	S	S	*	*			trans	-114.9	78.2	163.7	62.9	0	0	0	0	109.9	T727	T727-S729 PolarHBondContact O-N 3.35Å
730	Q	26.2	Very low	26.8	Very low	169 Å²	169	153.6 Å²	153.6	79%	0.79	79%	0.791	S	S	*	*			trans	-72.7	132.8	166.1	-66.6	171.3	-75.6	0	0	109.1
731	S	26.7	Very low	26.7	Very low	109 Å²	109	152.8 Å²	152.8	76%	0.762	78%	0.784	S	S	*	*			trans	-123.7	58.2	162.1	66.6	0	0	0	0	109.6	E733	S731-E733 VanDerWaalsContact C-N 3.25Å; S731-E733 PolarHBondContact O-N 3.43Å
732	C	26.6	Very low	26.5	Very low	118 Å²	118	153.3 Å²	153.3	80%	0.797	79%	0.786	S	S	*	*			trans	-84.4	71.5	169.7	-69.7	0	0	0	0	109.4
733	E	26.8	Very low	26.4	Very low	175 Å²	175	155.3 Å²	155.3	82%	0.818	79%	0.785	S	S	*	*			trans	-104.8	93.1	173.5	-66.3	-169.7	153.1	0	0	110	S731	S731-E733 VanDerWaalsContact C-N 3.25Å; S731-E733 PolarHBondContact O-N 3.43Å
734	D	28.2	Very low	26.3	Very low	109 Å²	109	150.7 Å²	150.7	58%	0.583	78%	0.778	S	S	*	*			trans	-173.5	166.5	133.4	-106.7	-31.2	0	0	0	111.5	I595	I595-D734 WeakPolarHBondContact CD1-OD2 3.41Å
735	F	27.7	Very low	26.3	Very low	192 Å²	192	150 Å²	150	84%	0.842	78%	0.78	S	S	*	*			trans	68.8	51.1	178.7	-53.3	-70.2	0	0	0	117.2
736	S	25.9	Very low	26.2	Very low	113 Å²	113	149.2 Å²	149.2	79%	0.79	78%	0.78	S	S	*	*			trans	-77.8	160.8	136.3	-77.1	0	0	0	0	110.5
737	L	26.9	Very low	26.5	Very low	160 Å²	160	151 Å²	151	84%	0.838	79%	0.785	S	S	*	*			trans	71.7	116.4	-167.3	-44.8	171.6	0	0	0	111.5
738	Y	28.1	Very low	26.4	Very low	218 Å²	218	151.7 Å²	151.7	86%	0.855	78%	0.784	S	S	*	*			cis	-119.4	143.2	32.6	-103.1	-112.2	0	0	0	114.5
739	R	24.1	Very low	26.6	Very low	236 Å²	236	154.3 Å²	154.3	89%	0.891	79%	0.794	S	S	*	*			trans	-131.2	105.9	166.1	-168.6	-171.9	-160.4	-157.1	8.9	109.1
740	H	29.7	Very low	26.5	Very low	158 Å²	158	157.6 Å²	157.6	73%	0.731	79%	0.794	S	S	*	*			trans	-125	65.1	175.1	-123.3	-64.1	0	0	0	112.8	F742	H740-F742 PolarHBondContact O-N 2.81Å
741	Q	24.9	Very low	26.6	Very low	133 Å²	133	158.7 Å²	158.7	62%	0.621	80%	0.799	S	S	*	*			trans	11.7	109.9	137.7	-177.5	-178.9	5.9	0	0	116.6	M743	Q741-M743 HydrophobicContact CG-CG 4.3Å
742	F	25.6	Very low	26.5	Very low	214 Å²	214	160.8 Å²	160.8	94%	0.939	80%	0.801	S	S	*	*			trans	-127.6	144.9	133.8	-95.4	-78.7	0	0	0	109.2	H740	H740-F742 PolarHBondContact O-N 2.81Å
743	M	26.1	Very low	26.5	Very low	151 Å²	151	164.6 Å²	164.6	74%	0.744	81%	0.807	S	S	*	*			trans	-98.7	142.7	-166.7	-71.8	163.9	55.3	0	0	111.7	Q741	Q741-M743 HydrophobicContact CG-CG 4.3Å
744	S	23.9	Very low	26.3	Very low	107 Å²	107	161.3 Å²	161.3	75%	0.748	80%	0.804	S	S	*	*			trans	-54.6	136.9	164.3	52.6	0	0	0	0	111.6
745	N	28.2	Very low	26.2	Very low	171 Å²	171	167.2 Å²	167.2	91%	0.914	82%	0.82	S	S	*	*			trans	-121.3	97.7	156.6	-120.9	7.4	0	0	0	108.4
746	S	24	Very low	25.9	Very low	97 Å²	97	163.5 Å²	163.5	68%	0.678	82%	0.817	S	S	*	*			trans	-71.3	139.5	171.8	53.3	0	0	0	0	110.7
747	Q	29.3	Very low	25.9	Very low	193 Å²	193	163.7 Å²	163.7	90%	0.902	82%	0.819	S	S	*	*			trans	-159.3	135.2	137.3	-113.6	153.4	11.7	0	0	113.6
748	N	25.1	Very low	25.8	Very low	135 Å²	135	162.4 Å²	162.4	72%	0.722	82%	0.818	S	S	*	*			trans	-62.7	155.1	-179.6	-45.7	-44.4	0	0	0	111.8
749	N	28.7	Very low	25.7	Very low	165 Å²	165	157 Å²	157	88%	0.882	81%	0.812	S	S	*	*				-154.7	142.1	109.9	-101.2	-27.4	0	0	0	112.5
750	F	24.3	Very low	25.8	Very low	187 Å²	187	153.5 Å²	153.5	82%	0.82	81%	0.805	S	S	*	*			trans	-75.6	142.6	166.3	-78.2	-111.1	0	0	0	109.3
751	Q	28.5	Very low	25.6	Very low	192 Å²	192	153.8 Å²	153.8	90%	0.897	81%	0.811	S	S	*	*				-159.9	141.9	122.1	-110.9	162.8	3.9	0	0	111.1
752	N	23	Very low	25.7	Very low	152 Å²	152	152 Å²	152	81%	0.813	81%	0.814	S	S	*	*			trans	-80.8	129.9	171.3	-65.6	-28.6	0	0	0	108.5
753	E	27.1	Very low	26	Very low	198 Å²	198	148 Å²	148	93%	0.925	81%	0.807	S	S	*	*			trans	-145.4	121.8	152.2	-127	165.9	-130	0	0	110.1
754	S	22.6	Very low	26.1	Very low	107 Å²	107	146.7 Å²	146.7	75%	0.748	81%	0.809	S	S	*	*			trans	-104.9	107.1	-179.5	-52.9	0	0	0	0	109
755	Y	25.9	Very low	26.2	Very low	233 Å²	233	146.1 Å²	146.1	91%	0.914	80%	0.801	S	S	*	*			trans	-153.4	149.7	155.9	-96	-62.9	0	0	0	112.4
756	S	22.3	Very low	26.3	Very low	113 Å²	113	143.8 Å²	143.8	79%	0.79	80%	0.795	S	S	*	*			trans	-67.7	137.1	-176.1	-46.1	0	0	0	0	112.5
757	S	26.6	Very low	26.5	Very low	118 Å²	118	148.3 Å²	148.3	83%	0.825	80%	0.803	S	S	*	*			trans	-152.7	128.6	157.2	-81.7	0	0	0	0	110.9
758	T	23.1	Very low	26.4	Very low	133 Å²	133	146.8 Å²	146.8	82%	0.816	80%	0.796	S	S	*	*			trans	-90.9	120.7	179.6	45.5	0	0	0	0	110.6
759	S	27.3	Very low	26.5	Very low	105 Å²	105	146.5 Å²	146.5	73%	0.734	79%	0.794	S	S	*	*			trans	-150.4	80.5	171.2	62.9	0	0	0	0	113.7
760	H	25.9	Very low	26.3	Very low	161 Å²	161	143.8 Å²	143.8	75%	0.745	79%	0.789	S	S	*	*			trans	37.2	151.5	131.9	-57	-75	0	0	0	123.4
761	L	25.4	Very low	26.5	Very low	164 Å²	164	142.4 Å²	142.4	86%	0.859	79%	0.79	S	S	*	*			trans	81.9	122.5	159.2	-57.3	133.7	0	0	0	116.3
762	S	26.9	Very low	26.3	Very low	97 Å²	97	139.5 Å²	139.5	68%	0.678	79%	0.785	S	S	*	*			cis	-152.3	130.7	-4.5	-75.5	0	0	0	0	112.6
763	V	32.1	Very low	26.4	Very low	129 Å²	129	138 Å²	138	78%	0.782	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-103.3	124.2	155.4	174.4	0	0	0	0	107.4
764	P	28.2	Very low	26.3	Very low	123 Å²	123	135 Å²	135	80%	0.799	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-72.1	123.1	166.5	-17.4	32.7	0	0	0	110.3
765	T	26.3	Very low	26.4	Very low	95 Å²	95	135 Å²	135	58%	0.583	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-84.5	160.4	-173.8	47.3	0	0	0	0	113.4	F767	T765-F767 WeakPolarHBondContact OG1-CE2 3.44Å
766	P	30	Very low	26.5	Very low	122 Å²	122	132.3 Å²	132.3	79%	0.792	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-64.3	152.8	165.3	30.8	-36.8	0	0	0	111
767	F	28.4	Very low	26.6	Very low	192 Å²	192	132.2 Å²	132.2	84%	0.842	77%	0.773	S	S	*	*			trans	-142.2	154.1	168.5	-94.4	-75.5	0	0	0	112.2	T765	T765-F767 WeakPolarHBondContact OG1-CE2 3.44Å
768	H	26.6	Very low	26.7	Very low	161 Å²	161	132.1 Å²	132.1	75%	0.745	77%	0.773	S	S	*	*			trans	-90.6	166	-165.9	-99.1	-105.5	0	0	0	114.4
769	D	26.2	Very low	26.7	Very low	129 Å²	129	137 Å²	137	69%	0.69	78%	0.776	S	S	*	*			trans	35.3	128.2	143.4	-46.7	-29.9	0	0	0	118.2
770	S	25.7	Very low	26.7	Very low	109 Å²	109	140.3 Å²	140.3	76%	0.762	78%	0.78	S	S	*	*				-164.9	-170.1	68.9	-61.7	0	0	0	0	113.1
771	D	27.5	Very low	26.9	Very low	158 Å²	158	140.3 Å²	140.3	85%	0.845	79%	0.786	S	S	*	*			trans	77.3	69.3	164	-61.4	-5.8	0	0	0	118.3
772	V	25.2	Very low	26.8	Very low	131 Å²	131	140.6 Å²	140.6	79%	0.794	78%	0.784	S	S	*	*			trans	-45.3	133.8	157.3	173.7	0	0	0	0	113.4	V774	V772-V774 HydrophobicContact CG1-CG2 4.25Å
773	S	25	Very low	26.8	Very low	120 Å²	120	142.5 Å²	142.5	84%	0.839	79%	0.786	S	S	*	*			trans	-144.8	82.7	146.7	48.3	0	0	0	0	111.7
774	V	25.5	Very low	26.6	Very low	134 Å²	134	141.5 Å²	141.5	81%	0.812	78%	0.781	S	S	*	*			trans	-81.2	124.7	174.9	173.7	0	0	0	0	110.3	V772	V772-V774 HydrophobicContact CG1-CG2 4.25Å
775	S	25.2	Very low	26.3	Very low	107 Å²	107	143.6 Å²	143.6	75%	0.748	78%	0.784	S	S	*	*			trans	-148.8	136.5	155.6	64.6	0	0	0	0	114.1
776	M	26.2	Very low	26.2	Very low	178 Å²	178	142.4 Å²	142.4	88%	0.877	78%	0.784	S	S	*	*			trans	60.8	74.9	156.7	-55.6	-112.8	64.3	0	0	118.5
777	V	26.2	Very low	26	Very low	111 Å²	111	142.9 Å²	142.9	67%	0.673	79%	0.785	S	S	*	*			trans	-71.2	139.8	156.5	169.5	0	0	0	0	110.8
778	S	26.7	Very low	25.9	Very low	116 Å²	116	142 Å²	142	81%	0.811	78%	0.783	S	S	*	*			trans	-100.5	139.1	153.9	59.9	0	0	0	0	109.5	E780	S778-E780 PolarHBondContact O-N 3.25Å
779	R	24.8	Very low	25.9	Very low	234 Å²	234	141.3 Å²	141.3	88%	0.883	78%	0.784	S	S	*	*	S	Bend	trans	-99.2	17.1	-131.2	-150.4	177.7	-176.5	171.7	0.9	116.2
780	E	27.4	Very low	25.8	Very low	175 Å²	175	141 Å²	141	82%	0.818	79%	0.79	S	S	*	*	S	Bend	trans	-127.9	3.4	-153.2	-68.3	170.9	162.3	0	0	115.9	S778	S778-E780 PolarHBondContact O-N 3.25Å
781	N	28.9	Very low	25.9	Very low	162 Å²	162	142.6 Å²	142.6	87%	0.866	79%	0.788	S	S	*	*	S	Bend	trans	-136.1	35.2	-171.8	-83.6	-52.4	0	0	0	116
782	M	24.2	Very low	25.9	Very low	169 Å²	169	142.4 Å²	142.4	83%	0.833	78%	0.782	S	S	*	*			trans	-141.3	90.9	173.9	-71.8	-152.8	-53.8	0	0	115.3
783	L	26.3	Very low	26.1	Very low	138 Å²	138	142.1 Å²	142.1	72%	0.723	78%	0.783	S	S	*	*			trans	-154.9	131.5	152.3	-76.3	176.2	0	0	0	107.7	F842	L783-F842 HydrophobicContact CD1-CE1 4.45Å; L783-F842 HydrophobicContact CD1-CE2 4.3Å; L783-F842 HydrophobicContact CD1-CZ 3.67Å
784	T	27.1	Very low	26.2	Very low	108 Å²	108	142.2 Å²	142.2	66%	0.663	77%	0.774	S	S	*	*			cis	-151.4	128.5	-24.8	-64.3	0	0	0	0	107.6	A786	T784-A786 HydrophobicContact CG2-CB 4.27Å
785	L	22.6	Very low	26.4	Very low	166 Å²	166	144.7 Å²	144.7	87%	0.869	78%	0.777	S	S	*	*			trans	-126	86.4	163.2	-93.1	174.5	0	0	0	108.6
786	A	24.9	Very low	26.6	Very low	70 Å²	70	148.6 Å²	148.6	58%	0.579	78%	0.781	S	S	*	*			trans	-156.3	109.2	176.7	0	0	0	0	0	110	T784	T784-A786 HydrophobicContact CG2-CB 4.27Å
787	T	25.4	Very low	26.5	Very low	132 Å²	132	148.9 Å²	148.9	81%	0.81	78%	0.777	S	S	*	*				21.7	133.2	122.4	57	0	0	0	0	119.4
788	E	25.7	Very low	26.5	Very low	173 Å²	173	152.2 Å²	152.2	81%	0.808	79%	0.785	S	S	*	*				-156.8	166.6	119.1	-121.3	170.1	-136	0	0	114.2
789	L	26.5	Very low	26.5	Very low	147 Å²	147	158 Å²	158	77%	0.77	79%	0.791	S	S	*	*			trans	-93.2	165.1	-162.1	-71	154.6	0	0	0	113.1	I791	L789-I791 PolarHBondContact O-N 3.17Å
790	P	24.4	Very low	26.5	Very low	123 Å²	123	155.2 Å²	155.2	80%	0.799	79%	0.788	S	S	*	*			trans	-69.3	100.9	167.8	29.6	-34.5	0	0	0	110.9	Q792	P790-Q792 PolarHBondContact O-N 3.41Å
791	I	28.9	Very low	26.5	Very low	142 Å²	142	153 Å²	153	73%	0.728	79%	0.786	S	S	*	*			trans	-74.2	118.3	173.9	-62.1	175.8	0	0	0	109.4	L789	L789-I791 PolarHBondContact O-N 3.17Å
792	Q	26.5	Very low	26.4	Very low	155 Å²	155	153.1 Å²	153.1	72%	0.724	78%	0.781	S	S	*	*			trans	-76.5	136	169.4	-69.2	-174.4	-8.8	0	0	110.8	P790 N794	P790-Q792 PolarHBondContact O-N 3.41Å; Q792-N794 PolarHBondContact O-N 2.88Å
793	P	29.3	Very low	26.6	Very low	124 Å²	124	151.6 Å²	151.6	81%	0.805	78%	0.776	S	S	*	*			trans	-75.9	89.9	168.4	31.5	-32.7	0	0	0	109.6	E795	P793-E795 PolarHBondContact O-N 2.59Å
794	N	28.1	Very low	26.7	Very low	122 Å²	122	150.6 Å²	150.6	65%	0.652	77%	0.771	S	S	*	*			trans	-98.5	81.9	-179.9	-147.3	5.3	0	0	0	109.8	Q792 F796	Q792-N794 PolarHBondContact O-N 2.88Å; N794-F796 PolarHBondContact O-N 3Å; N794-F796 VanDerWaalsContact O-N 3.1Å
795	E	29.1	Very low	26.8	Very low	187 Å²	187	153.3 Å²	153.3	87%	0.874	77%	0.774	S	S	*	*			trans	-65.1	106.4	179.5	-68.4	-171.5	145.7	0	0	111.2	P793	P793-E795 PolarHBondContact O-N 2.59Å
796	F	28.7	Very low	27.1	Very low	189 Å²	189	152.9 Å²	152.9	83%	0.829	77%	0.772	S	S	*	*			trans	-81.4	138.5	176.1	-112.4	-92.5	0	0	0	112.1	N794	N794-F796 PolarHBondContact O-N 3Å; N794-F796 VanDerWaalsContact O-N 3.1Å
797	K	25.1	Very low	27.6	Very low	184 Å²	184	154 Å²	154	80%	0.8	77%	0.773	S	S	*	*			trans	-75.6	169.9	177.4	-64.9	178.1	177.6	176.3	0	112.1
798	Q	25.6	Very low	27.7	Very low	181 Å²	181	154 Å²	154	85%	0.846	77%	0.768	S	S	*	*			trans	80.9	111.3	174.4	-51.3	177.4	-51	0	0	112.3
799	Y	27.6	Very low	27.9	Very low	237 Å²	237	151.8 Å²	151.8	93%	0.929	77%	0.767	S	S	*	*				-124.1	159.1	59.2	-95	-89.1	0	0	0	116.8
800	E	23.7	Very low	27.9	Very low	175 Å²	175	149.4 Å²	149.4	82%	0.818	76%	0.762	S	S	*	*			trans	-112.6	113.6	-172.1	170.3	-180	-139.1	0	0	110.3
801	T	28.8	Very low	28.2	Very low	128 Å²	128	149.2 Å²	149.2	79%	0.785	76%	0.759	S	S	*	*			trans	-158.9	97.7	159.6	14.9	0	0	0	0	112.9
802	H	26.1	Very low	28.1	Very low	166 Å²	166	150 Å²	150	77%	0.769	76%	0.759	S	S	*	*				65.2	138	124.6	-98	-78.4	0	0	0	123.3
803	L	28.3	Very low	28.2	Very low	137 Å²	137	148 Å²	148	72%	0.717	75%	0.754	S	S	*	*			trans	91.5	75.4	152.8	-59.1	169.2	0	0	0	120.6
804	D	27.7	Very low	28.1	Very low	116 Å²	116	148 Å²	148	62%	0.62	75%	0.746	S	S	*	*				91.2	140.8	98.9	-76	11.7	0	0	0	125.6
805	F	30	Very low	28.2	Very low	165 Å²	165	150 Å²	150	72%	0.724	75%	0.752	S	S	*	*			trans	62.9	88	152.5	-63.7	-56.8	0	0	0	123.3
806	L	28.2	Very low	28.2	Very low	157 Å²	157	145.1 Å²	145.1	82%	0.822	74%	0.738	S	S	*	*				61.3	162.9	108.2	-90.8	86.6	0	0	0	121.8
807	P	34.8	Very low	28.2	Very low	93 Å²	93	142.8 Å²	142.8	60%	0.604	73%	0.734	S	S	*	*			trans	-117.8	-167.4	-158.6	44.5	-33.6	0	0	0	113.6
808	N	27.5	Very low	28.5	Very low	133 Å²	133	140.3 Å²	140.3	71%	0.711	73%	0.73	S	S	*	*				172.2	148.6	120.7	-93.5	-45.4	0	0	0	115.5
809	T	31.1	Very low	28.7	Very low	126 Å²	126	136.9 Å²	136.9	77%	0.773	73%	0.726	S	S	*	*			trans	62.1	157.1	144.5	54.2	0	0	0	0	122
810	S	27	Very low	28.9	Very low	97 Å²	97	129.3 Å²	129.3	68%	0.678	72%	0.72	S	S	*	*			cis	-178.2	178.2	-30	61.3	0	0	0	0	111.2
811	V	28.9	Very low	29.2	Very low	119 Å²	119	128.2 Å²	128.2	72%	0.721	72%	0.719	S	S	*	*			trans	77.3	94.4	152	173.6	0	0	0	0	119
812	H	28.4	Very low	29.3	Very low	158 Å²	158	129.3 Å²	129.3	73%	0.731	72%	0.72	S	S	*	*				65.6	135.8	118.9	-83.6	-74.1	0	0	0	126
813	N	27.7	Very low	29.5	Very low	115 Å²	115	128 Å²	128	62%	0.615	72%	0.719	S	S	*	*			trans	90.4	118.9	131.8	-71.8	-8.2	0	0	0	122.5
814	N	27	Very low	29.5	Very low	122 Å²	122	128 Å²	128	65%	0.652	72%	0.72	S	S	*	*				47.3	126.7	125.2	-44.6	-12.6	0	0	0	118.2
815	H	30.6	Very low	29.5	Very low	166 Å²	166	129.4 Å²	129.4	77%	0.769	73%	0.727	S	S	*	*				-170.9	146	75.1	-110.1	-81.7	0	0	0	115.1
816	S	30	Very low	29.4	Very low	83 Å²	83	129.3 Å²	129.3	58%	0.58	73%	0.733	S	S	*	*			trans	36.4	132.9	142.1	62.5	0	0	0	0	123.5
817	N	28.5	Very low	29.3	Very low	140 Å²	140	127.7 Å²	127.7	75%	0.749	74%	0.735	S	S	*	*			trans	70.5	155.4	137.7	-67	42.8	0	0	0	118
818	D	31.5	Very low	28.9	Very low	132 Å²	132	128.5 Å²	128.5	71%	0.706	74%	0.739	S	S	*	*			cis	-148.4	179.9	1.4	-133.8	-47.7	0	0	0	113
819	S	29.7	Very low	28.8	Very low	109 Å²	109	128.8 Å²	128.8	76%	0.762	74%	0.74	S	S	*	*			trans	-24	143	174.3	64.8	0	0	0	0	120.4
820	G	31.4	Very low	28.5	Very low	78 Å²	78	131.8 Å²	131.8	80%	0.804	74%	0.742	S	S	*	*			trans	177	97.7	160.7	0	0	0	0	0	117.6
821	N	29.2	Very low	28.5	Very low	152 Å²	152	136.4 Å²	136.4	81%	0.813	75%	0.753	S	S	*	*			trans	-38	135.7	167.6	-77.4	-15.2	0	0	0	113.9
822	N	32.6	Very low	28.4	Very low	151 Å²	151	139.4 Å²	139.4	81%	0.807	76%	0.759	S	S	*	*				-170.2	168.4	75.9	-99.1	-47.4	0	0	0	113.9
823	N	29.9	Very low	28.2	Very low	140 Å²	140	142.8 Å²	142.8	75%	0.749	77%	0.766	S	S	*	*			trans	-81.6	142.4	-167.7	-73.4	-19.9	0	0	0	116.6
824	N	28.7	Very low	28.3	Very low	136 Å²	136	143.8 Å²	143.8	73%	0.727	78%	0.778	S	S	*	*			trans	76.3	141.3	138.5	-63.7	-2	0	0	0	122.2
825	N	27.5	Very low	28.1	Very low	145 Å²	145	142.2 Å²	142.2	78%	0.775	78%	0.777	S	S	*	*			trans	69.3	84.4	152.7	-59.8	-4.3	0	0	0	119.1
826	L	27.4	Very low	27.8	Very low	163 Å²	163	139.2 Å²	139.2	85%	0.853	78%	0.775	S	S	*	*				-155.9	115.3	111.7	-134.9	71.8	0	0	0	111.2
827	S	25.6	Very low	27.6	Very low	123 Å²	123	143.4 Å²	143.4	86%	0.86	79%	0.785	S	S	*	*			trans	-91.5	115.1	178.7	54.6	0	0	0	0	111.1
828	T	26.6	Very low	27.5	Very low	110 Å²	110	143.3 Å²	143.3	68%	0.675	79%	0.79	S	S	*	*			trans	-137.8	149.8	176.7	55.4	0	0	0	0	112.6
829	L	24.9	Very low	27.2	Very low	140 Å²	140	145.6 Å²	145.6	73%	0.733	80%	0.795	S	S	*	*			trans	73.6	129.6	163.1	-97	56.2	0	0	0	120.3
830	F	25.6	Very low	27	Very low	188 Å²	188	149.7 Å²	149.7	83%	0.825	80%	0.8	S	S	*	*			trans	64.1	89.3	156.2	-55.9	-56.8	0	0	0	121.1
831	Q	26.8	Very low	26.6	Very low	195 Å²	195	152.3 Å²	152.3	91%	0.911	80%	0.795	S	S	*	*				-143.1	158.7	115.3	-147.4	155	9.6	0	0	111.2
832	Q	27.4	Very low	26.4	Very low	182 Å²	182	152.7 Å²	152.7	85%	0.85	79%	0.789	S	S	*	*			trans	-91.2	134.9	-157.2	-67	157.1	-59.2	0	0	114.1
833	R	24.2	Very low	25.9	Very low	228 Å²	228	149.9 Å²	149.9	86%	0.86	78%	0.777	S	S	*	*			trans	-90.2	134.5	158.4	-68.8	177.4	175.6	168.3	-3	109.7	S835	R833-S835 PolarHBondContact O-N 3.28Å
834	P	29	Very low	25.7	Very low	136 Å²	136	152.3 Å²	152.3	88%	0.883	78%	0.777	S	S	*	*			trans	-80.3	85.8	155.7	32.3	-29.8	0	0	0	109
835	S	23.7	Very low	25.3	Very low	89 Å²	89	152 Å²	152	62%	0.622	78%	0.776	S	S	*	*			trans	-81.4	132.9	167.6	53.2	0	0	0	0	110.8	R833	R833-S835 PolarHBondContact O-N 3.28Å
836	S	24.2	Very low	25.2	Very low	104 Å²	104	154.3 Å²	154.3	73%	0.727	78%	0.779	S	S	*	*			trans	68.6	152.5	163	75.4	0	0	0	0	119.4
837	Q	25.2	Very low	25	Very low	170 Å²	170	154.7 Å²	154.7	79%	0.794	78%	0.777	S	S	*	*			trans	110.4	99.9	158	-61	-178.9	21.1	0	0	116.9
838	V	25.3	Very low	24.9	Very low	139 Å²	139	153.2 Å²	153.2	84%	0.842	77%	0.772	S	S	*	*				-140.1	110.8	97.4	-179.3	0	0	0	0	109
839	H	25.3	Very low	24.8	Very low	179 Å²	179	155 Å²	155	83%	0.829	78%	0.776	S	S	*	*			trans	-78.4	140.9	159.2	-89.6	-101.5	0	0	0	109.1
840	K	25.3	Very low	24.8	Very low	195 Å²	195	154.8 Å²	154.8	85%	0.848	78%	0.775	S	S	*	*			trans	-153.7	130.1	147.7	-112.8	158.4	-172.2	178.1	0	111.6
841	L	23.3	Very low	24.9	Very low	134 Å²	134	153.1 Å²	153.1	70%	0.702	78%	0.775	S	S	*	*			trans	-62.6	149.1	-159.3	-59.4	71.8	0	0	0	114.7
842	F	24.8	Very low	24.8	Very low	160 Å²	160	151.5 Å²	151.5	70%	0.702	77%	0.767	S	S	*	*				-133.7	101.2	114.9	-105.3	-78.7	0	0	0	109.5	L783 Y844	L783-F842 HydrophobicContact CD1-CE1 4.45Å; L783-F842 HydrophobicContact CD1-CE2 4.3Å; L783-F842 HydrophobicContact CD1-CZ 3.67Å; F842-Y844 HydrophobicContact CD1-CE2 4.27Å
843	T	22.6	Very low	24.8	Very low	91 Å²	91	150 Å²	150	56%	0.558	76%	0.764	S	S	*	*			trans	-94	107.2	176.9	-46.7	0	0	0	0	108.9	N845	T843-N845 WeakPolarHBondContact CG2-OD1 3.29Å
844	Y	25.3	Very low	24.9	Very low	191 Å²	191	145.8 Å²	145.8	75%	0.749	76%	0.758	S	S	*	*			trans	-96.3	97.8	163.9	-97.4	-80.5	0	0	0	109.8	F842 F846	F842-Y844 HydrophobicContact CD1-CE2 4.27Å; Y844-F846 PolarHBondContact O-N 2.84Å
845	N	22	Very low	24.7	Very low	129 Å²	129	143.8 Å²	143.8	69%	0.69	75%	0.748	S	S	*	*			trans	-67.4	118.1	168.1	-66.5	-20.8	0	0	0	108.7	T843	T843-N845 WeakPolarHBondContact CG2-OD1 3.29Å
846	F	25.1	Very low	24.9	Very low	194 Å²	194	148.2 Å²	148.2	85%	0.851	76%	0.758	S	S	*	*			trans	-107.1	118.9	147.5	-86.6	-80.3	0	0	0	107.7	Y844 A848	Y844-F846 PolarHBondContact O-N 2.84Å; F846-A848 PolarHBondContact O-N 3.01Å
847	E	22.9	Very low	25	Very low	172 Å²	172	148.2 Å²	148.2	80%	0.804	76%	0.758	S	S	*	*			trans	-67.4	127.7	-170.1	-62.5	177.3	120.3	0	0	110.7	I849	E847-I849 PolarHBondContact O-N 2.77Å
848	A	23.2	Very low	25	Very low	92 Å²	92	145.4 Å²	145.4	76%	0.76	76%	0.757	S	S	*	*			trans	-64.5	102.3	164.4	0	0	0	0	0	108.3	F846 N850	F846-A848 PolarHBondContact O-N 3.01Å; A848-N850 VanDerWaalsContact C-N 3.32Å; A848-N850 PolarHBondContact O-N 2.73Å
849	I	25.4	Very low	25	Very low	147 Å²	147	146.5 Å²	146.5	75%	0.754	76%	0.757	S	S	*	*			trans	-68.6	93.1	178.4	-60.7	-178.4	0	0	0	108.6	E847 N851	E847-I849 PolarHBondContact O-N 2.77Å; I849-N851 PolarHBondContact O-N 3.46Å
850	N	23.5	Very low	24.9	Very low	135 Å²	135	145.7 Å²	145.7	72%	0.722	75%	0.754	S	S	*	*			trans	-51.4	122	169.3	-87.3	-47	0	0	0	110.4	A848	A848-N850 VanDerWaalsContact C-N 3.32Å; A848-N850 PolarHBondContact O-N 2.73Å
851	N	28.2	Very low	24.9	Very low	153 Å²	153	143.5 Å²	143.5	82%	0.818	75%	0.751	S	S	*	*			trans	-118.3	106.6	147.5	-86.5	-69.9	0	0	0	108	I849	I849-N851 PolarHBondContact O-N 3.46Å
852	H	24.6	Very low	24.9	Very low	162 Å²	162	142.5 Å²	142.5	75%	0.75	75%	0.75	S	S	*	*			trans	-53.7	149	168.4	-74.9	-102.7	0	0	0	110.8
853	I	27.5	Very low	24.9	Very low	150 Å²	150	139.7 Å²	139.7	77%	0.769	75%	0.751	S	S	*	*				-166.9	123.9	110.8	-95.6	151.9	0	0	0	109
854	N	25.8	Very low	25.2	Very low	140 Å²	140	143.2 Å²	143.2	75%	0.749	76%	0.764	S	S	*	*			trans	41.1	137.1	150.1	-56	-5.9	0	0	0	120.8
855	S	26.5	Very low	25.2	Very low	94 Å²	94	141.6 Å²	141.6	66%	0.657	76%	0.764	S	S	*	*			cis	179.7	148.8	-0.7	43.9	0	0	0	0	112.7
856	Q	27.2	Very low	25.4	Very low	182 Å²	182	142.7 Å²	142.7	85%	0.85	77%	0.77	S	S	*	*			trans	85.5	141.7	144.4	-79.7	174.9	-7.5	0	0	123.3
857	S	26.8	Very low	25.5	Very low	104 Å²	104	136.9 Å²	136.9	73%	0.727	76%	0.764	S	S	*	*			trans	62.2	78.8	154.4	49.9	0	0	0	0	119.5
858	S	23.7	Very low	25.8	Very low	110 Å²	110	140.5 Å²	140.5	77%	0.769	77%	0.771	S	S	*	*				9.7	133.4	105.7	-31.7	0	0	0	0	118
859	L	27.2	Very low	25.9	Very low	162 Å²	162	145 Å²	145	85%	0.848	78%	0.776	S	S	*	*				-168.3	162.8	97	-103.1	164.9	0	0	0	112.5
860	E	22.6	Very low	26.2	Very low	162 Å²	162	143 Å²	143	76%	0.757	78%	0.781	S	S	*	*			trans	-77.5	157	176	-56.8	156.6	121.4	0	0	111
861	L	24.3	Very low	26.2	Very low	150 Å²	150	142.5 Å²	142.5	79%	0.785	78%	0.783	S	S	*	*				173.3	126.7	114	-91.3	167.7	0	0	0	113.4
862	T	23.8	Very low	26.4	Very low	112 Å²	112	142.8 Å²	142.8	69%	0.687	78%	0.783	S	S	*	*			trans	30.7	119.8	142.5	58.5	0	0	0	0	121.4
863	S	24.1	Very low	26.5	Very low	102 Å²	102	141.1 Å²	141.1	71%	0.713	78%	0.78	S	S	*	*			trans	41.4	130.7	133.1	65.7	0	0	0	0	121.5
864	I	29	Very low	26.5	Very low	164 Å²	164	140.9 Å²	140.9	84%	0.841	78%	0.781	S	S	*	*				-164.8	152.1	122.4	-103.6	153.5	0	0	0	109.9
865	E	25.1	Very low	26.7	Very low	157 Å²	157	139.6 Å²	139.6	73%	0.734	78%	0.782	S	S	*	*			trans	-72	152.8	176.7	-56.4	147.5	112.6	0	0	112.1
866	N	28.1	Very low	26.8	Very low	153 Å²	153	139 Å²	139	82%	0.818	78%	0.779	S	S	*	*				150.7	134.7	123.3	-83.3	-74.4	0	0	0	111.1
867	G	25.6	Very low	26.9	Very low	71 Å²	71	138.3 Å²	138.3	73%	0.732	78%	0.775	S	S	*	*			trans	-83.8	161.1	177.8	0	0	0	0	0	113.6
868	R	30.3	Very low	27.2	Very low	249 Å²	249	141.4 Å²	141.4	94%	0.94	78%	0.782	S	S	*	*			trans	-160.6	130.1	155.4	-106.9	170.6	-158.5	-149.4	2.7	109.8
869	E	25.6	Very low	27.5	Very low	187 Å²	187	144.3 Å²	144.3	87%	0.874	78%	0.781	S	S	*	*			trans	-72.1	154.5	165.1	-62.8	-178	100.5	0	0	111.2
870	A	30.3	Very low	27.8	Very low	103 Å²	103	143.2 Å²	143.2	85%	0.851	77%	0.771	S	S	*	*			trans	-152.5	79.5	168.2	0	0	0	0	0	111.1
871	T	25.2	Very low	28.3	Very low	126 Å²	126	141.7 Å²	141.7	77%	0.773	76%	0.764	S	S	*	*			trans	-70.9	139.2	167	48.7	0	0	0	0	110.7
872	L	30.8	Very low	28.5	Very low	158 Å²	158	141.4 Å²	141.4	83%	0.827	76%	0.757	S	S	*	*			trans	-159.6	89.5	163.5	-111.5	175.5	0	0	0	115.3
873	N	28	Very low	28.8	Very low	127 Å²	127	144.4 Å²	144.4	68%	0.679	76%	0.76	S	S	*	*			trans	41.2	111.5	134.4	-65.7	-27.5	0	0	0	123.7
874	N	26.6	Very low	29	Very low	146 Å²	146	144 Å²	144	78%	0.781	76%	0.757	S	S	*	*				63.5	143.7	112.6	-68.8	-37	0	0	0	124.8
875	S	29.6	Very low	29	Very low	112 Å²	112	140.6 Å²	140.6	78%	0.783	75%	0.748	S	S	*	*			trans	81.7	156.1	149.3	124.4	0	0	0	0	118.5
876	S	28.5	Very low	29.3	Very low	83 Å²	83	143.9 Å²	143.9	58%	0.58	76%	0.756	S	S	*	*			cis	-174.1	155.6	-25.4	51.8	0	0	0	0	111.5
877	H	30.2	Very low	29.3	Very low	166 Å²	166	140.3 Å²	140.3	77%	0.769	74%	0.743	S	S	*	*			trans	62.8	165.5	169.1	-62.8	-62.3	0	0	0	116
878	L	33.4	Very low	29.5	Very low	169 Å²	169	145.8 Å²	145.8	89%	0.885	75%	0.746	S	S	*	*			cis	-131.8	-178.6	18.6	-112.6	103.9	0	0	0	114.6
879	K	30.3	Very low	29.4	Very low	171 Å²	171	140.6 Å²	140.6	74%	0.743	73%	0.73	S	S	*	*			trans	-99.1	162.7	-175.7	-53	161.7	-179	169.5	0	112.9
880	H	33.6	Very low	29.7	Very low	139 Å²	139	140 Å²	140	64%	0.644	73%	0.727	S	S	*	*				154.9	119.6	124.2	-91.3	-90.3	0	0	0	110.3
881	E	31.3	Very low	29.7	Very low	130 Å²	130	141 Å²	141	61%	0.607	72%	0.718	S	S	*	*				69.7	145.3	98.9	-66.5	-164.7	144.7	0	0	115.9
882	K	28.9	Very low	29.7	Very low	144 Å²	144	145.1 Å²	145.1	63%	0.626	72%	0.72	S	S	*	*			cis	-165.5	159.2	-5.1	-118.8	170.1	178.7	154.7	0	110.7
883	K	30.2	Very low	29.5	Very low	175 Å²	175	144.4 Å²	144.4	76%	0.761	72%	0.722	S	S	*	*			trans	67.7	118	142	-77.6	-178.3	175.8	-173.6	0	123.1
884	S	29.1	Very low	29.4	Very low	94 Å²	94	142.1 Å²	142.1	66%	0.657	73%	0.728	S	S	*	*				89.6	103.7	111.2	77.3	0	0	0	0	123.9
885	S	29.2	Very low	29.4	Very low	93 Å²	93	143 Å²	143	65%	0.65	73%	0.731	S	S	*	*				79.9	145.8	107.4	-54.1	0	0	0	0	123.1
886	Y	30.2	Very low	29.1	Very low	226 Å²	226	145 Å²	145	89%	0.886	73%	0.733	S	S	*	*			trans	72.5	147.4	160	-59.3	-57.7	0	0	0	117.8
887	S	28.5	Very low	28.9	Very low	78 Å²	78	147 Å²	147	55%	0.545	74%	0.741	S	S	.	*			cis	-171.4	164.4	-20.2	64.5	0	0	0	0	111
888	K	30	Very low	28.7	Very low	185 Å²	185	148 Å²	148	80%	0.804	75%	0.745	S	S	*	*			trans	66.1	159.1	154.8	-70.4	168.2	-178.8	167.3	0	114.8
889	K	28.7	Very low	28.2	Very low	141 Å²	141	143 Å²	143	61%	0.613	74%	0.735	S	S	*	*			cis	-167.8	167.1	-12.2	-124.9	179.6	156	-153.9	0	107.9
890	H	30.8	Very low	28	Very low	175 Å²	175	140.2 Å²	140.2	81%	0.81	74%	0.736	S	S	*	*			trans	66.8	154.3	157	-62.8	-45.6	0	0	0	115.8
891	D	31.6	Very low	27.7	Very low	123 Å²	123	142.8 Å²	142.8	66%	0.658	75%	0.745	S	S	*	*			cis	-146.5	-171.6	-12.7	-136.2	-52.4	0	0	0	112.4
892	R	25	Very low	27.4	Very low	212 Å²	212	144.9 Å²	144.9	80%	0.8	75%	0.752	S	S	*	*			trans	-71.3	156.4	-170.8	-68.8	159.5	159.5	175.9	-5.7	117.4
893	T	25.7	Very low	27.3	Very low	143 Å²	143	143 Å²	143	88%	0.877	75%	0.753	S	S	*	*			trans	59.9	115	144.6	48.9	0	0	0	0	119.9
894	G	26.9	Very low	27	Very low	79 Å²	79	141.7 Å²	141.7	81%	0.814	75%	0.754	S	S	*	*			trans	-160.3	99.1	173.2	0	0	0	0	0	114
895	I	24.9	Very low	26.8	Very low	164 Å²	164	141.9 Å²	141.9	84%	0.841	76%	0.762	S	S	*	*			trans	-51	120.5	178.7	-71.2	163.6	0	0	0	114.9
896	L	23.6	Very low	26.7	Very low	156 Å²	156	143.1 Å²	143.1	82%	0.817	77%	0.77	S	S	*	*			trans	65	155.9	135.3	-117.9	164.3	0	0	0	121.8
897	V	25.7	Very low	26.5	Very low	123 Å²	123	138 Å²	138	75%	0.745	77%	0.768	S	S	*	*			trans	95.7	138.5	163.4	-171.1	0	0	0	0	118.9
898	H	25	Very low	26.7	Very low	187 Å²	187	139.2 Å²	139.2	87%	0.866	78%	0.776	S	S	*	*			trans	-29.2	150	177.2	-71.4	-83.3	0	0	0	120.3
899	G	24	Very low	26.4	Very low	65 Å²	65	137.7 Å²	137.7	67%	0.67	78%	0.777	S	S	*	*				136.6	107.8	100.7	0	0	0	0	0	119.6
900	C	24.1	Very low	26.4	Very low	112 Å²	112	138.7 Å²	138.7	76%	0.757	79%	0.787	S	S	*	*			trans	52.4	121.2	145.8	-70.3	0	0	0	0	121.8
901	K	27.9	Very low	26.2	Very low	193 Å²	193	138.6 Å²	138.6	84%	0.839	79%	0.787	S	S	*	*				57	137.1	127.4	-59.2	176.3	-179.6	179.6	0	117.5
902	K	25.8	Very low	26	Very low	174 Å²	174	137.8 Å²	137.8	76%	0.757	79%	0.791	S	S	*	*			cis	-176.1	167.5	45.4	-146.1	-178.8	-178.2	-174.1	0	109.3
903	T	25.4	Very low	26.2	Very low	106 Å²	106	133.9 Å²	133.9	65%	0.65	79%	0.79	S	S	*	*			trans	63.1	148.5	157.3	53.1	0	0	0	0	118.4
904	N	25	Very low	26.3	Very low	146 Å²	146	134.7 Å²	134.7	78%	0.781	78%	0.784	S	S	*	*			cis	-160.6	157	-2.1	-115.2	1.7	0	0	0	111.5
905	A	24.9	Very low	26.6	Very low	98 Å²	98	136.3 Å²	136.3	81%	0.81	78%	0.783	S	S	*	*			trans	58.4	144.5	155	0	0	0	0	0	118.8
906	S	26.5	Very low	26.7	Very low	119 Å²	119	138.2 Å²	138.2	83%	0.832	78%	0.781	S	S	*	*			cis	-153.7	139.2	6.9	47.1	0	0	0	0	111
907	S	25.8	Very low	27.1	Very low	120 Å²	120	133.6 Å²	133.6	84%	0.839	76%	0.761	S	S	*	*			trans	-140.9	114.1	171	55.1	0	0	0	0	109
908	S	32.2	Very low	27.6	Very low	103 Å²	103	130.2 Å²	130.2	72%	0.72	74%	0.742	S	S	*	*			trans	-97.1	117.8	-177.7	52.6	0	0	0	0	111.5
909	D	24.9	Very low	28.3	Very low	152 Å²	152	123.9 Å²	123.9	81%	0.813	72%	0.715	S	S	*	*			trans	46	89.3	130.1	-40.8	-41.2	0	0	0	117.8
910	I	28.9	Very low	28.9	Very low	163 Å²	163	124.3 Å²	124.3	84%	0.836	70%	0.698	S	S	*	*			trans	-125.8	142	136.7	-63.4	-175.8	0	0	0	106.8
911	E	26.9	Very low	29.7	Very low	173 Å²	173	122.6 Å²	122.6	81%	0.808	68%	0.681	S	S	*	*			trans	-61.3	161.2	-161.1	-68.1	135.4	133.1	0	0	116	V913	E911-V913 PolarHBondContact O-N 2.77Å
912	S	26.9	Very low	30.3	Very low	105 Å²	105	113.9 Å²	113.9	73%	0.734	64%	0.644	S	S	*	*			trans	1	110.2	169.7	51.7	0	0	0	0	116.7	E914	S912-E914 PolarHBondContact O-N 2.97Å
913	V	28.7	Very low	31.1	Very low	130 Å²	130	106.7 Å²	106.7	79%	0.788	61%	0.614	S	S	*	*			trans	-62.6	98.4	165.8	-179.4	0	0	0	0	108.4	E911 S915	E911-V913 PolarHBondContact O-N 2.77Å; V913-S915 PolarHBondContact O-N 3.29Å
914	E	27.7	Very low	32	Very low	161 Å²	161	108 Å²	108	75%	0.752	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-53.5	129.1	169.4	-67.2	-170.7	135.9	0	0	108.9	S912 Y916	S912-E914 PolarHBondContact O-N 2.97Å; E914-Y916 PolarHBondContact O-N 3.41Å
915	S	34.1	Very low	32.8	Very low	113 Å²	113	108 Å²	108	79%	0.79	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-53.2	124.9	177.5	-62.2	0	0	0	0	109.6	V913 P917	V913-S915 PolarHBondContact O-N 3.29Å; S915-P917 VanDerWaalsContact O-CD 3.32Å; S915-P917 WeakPolarHBondContact O-CD 3.37Å
916	Y	26.8	Very low	33.3	Very low	203 Å²	203	103.6 Å²	103.6	80%	0.796	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-53.9	117.4	176.5	-78.6	-93.8	0	0	0	108.8	E914 S918	E914-Y916 PolarHBondContact O-N 3.41Å; Y916-S918 PolarHBondContact O-N 2.75Å
917	P	31.7	Very low	33.6	Very low	60 Å²	60	102.5 Å²	102.5	39%	0.39	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-60.7	120.4	175.6	24.4	-32.4	0	0	0	107.5	S915 D921 V922	S915-P917 VanDerWaalsContact O-CD 3.32Å; S915-P917 WeakPolarHBondContact O-CD 3.37Å; P917-D921 HydrophobicContact CB-CB 3.78Å; P917-V922 HydrophobicContact CB-CG2 4.35Å
918	S	35.8	Very low	33.9	Very low	51 Å²	51	98.2 Å²	98.2	36%	0.357	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-61.4	167	174.9	68.8	0	0	0	0	109.9	Y916 F920 D921 V922	Y916-S918 PolarHBondContact O-N 2.75Å; S918-F920 PolarHBondContact O-N 2.88Å; S918-F920 WeakPolarHBondContact OG-CB 3.39Å; S918-F920 PolarHBondContact OG-N 2.9Å; S918-D921 VanDerWaalsContact CB-OD2 3.24Å; S918-D921 WeakPolarHBondContact CB-OD2 3.46Å; S918-D921 PolarHBondContact N-OD2 3.08Å; S918-D921 PolarHBondContact O-N 3.05Å; S918-D921 VanDerWaalsContact O-N 3.09Å; S918-D921 VanDerWaalsContact OG-CG 3.3Å; S918-D921 PolarHBondContact OG-N 3.31Å; S918-D921 PolarHBondContact OG-OD2 2.69Å; S918-V922 PolarHBondContact O-N 3.24Å; S918-V922 VanDerWaalsContact O-N 3.07Å
919	L	39.6	Very low	33.9	Very low	55 Å²	55	101.5 Å²	101.5	29%	0.288	52%	0.521	S	S	.	.	H	α-helix	trans	-56	-32.8	170.1	-179.3	60.9	0	0	0	110.8	L923 L946 L1076	L919-L923 HydrophobicContact CD1-CD1 4.34Å; L919-L923 HydrophobicContact CD1-CG 4.35Å; L919-L923 HydrophobicContact CG-CD1 3.9Å; L919-L923 HydrophobicContact CG-CG 4.38Å; L919-L923 WeakPolarHBondContact O-CB 3.44Å; L919-L923 WeakPolarHBondContact O-CD1 3.18Å; L919-L923 WeakPolarHBondContact O-CG 3.43Å; L919-L923 PolarHBondContact O-N 2.99Å; L919-L946 HydrophobicContact CD2-CD1 4.5Å; L919-L1076 HydrophobicContact CD1-CD1 4.16Å; L919-L1076 HydrophobicContact CD1-CD2 3.61Å
920	F	36.3	Very low	34.1	Very low	74 Å²	74	102 Å²	102	33%	0.325	51%	0.511	S	S	.	.	H	α-helix	trans	-66.7	-45	174.3	174.1	-107.2	0	0	0	112.6	S918 V922 L923 H924 I1026	S918-F920 PolarHBondContact O-N 2.88Å; S918-F920 WeakPolarHBondContact OG-CB 3.39Å; S918-F920 PolarHBondContact OG-N 2.9Å; F920-V922 VanDerWaalsContact C-N 3.26Å; F920-V922 PolarHBondContact O-N 3.01Å; F920-L923 PolarHBondContact O-N 3.24Å; F920-H924 HydrophobicContact CE2-CB 4.46Å; F920-H924 HydrophobicContact CZ-CB 4.39Å; F920-H924 AromaticContact CZ-CD2 3.67Å; F920-H924 WeakPolarHBondContact O-CB 3.27Å; F920-H924 PolarHBondContact O-N 3.32Å; F920-I1026 HydrophobicContact CB-CD1 3.89Å; F920-I1026 HydrophobicContact CD1-CD1 3.71Å; F920-I1026 HydrophobicContact CD2-CD1 3.31Å; F920-I1026 HydrophobicContact CE1-CD1 4.01Å; F920-I1026 HydrophobicContact CE2-CD1 3.64Å; F920-I1026 HydrophobicContact CG-CD1 3.33Å; F920-I1026 HydrophobicContact CZ-CD1 3.97Å
921	D	41	Very low	34.2	Very low	76 Å²	76	97 Å²	97	41%	0.406	49%	0.489	S	S	.	.	H	α-helix	trans	-60.8	-37.7	176.9	-59.9	-64.1	0	0	0	111.5	P917 S918 H925	P917-D921 HydrophobicContact CB-CB 3.78Å; S918-D921 VanDerWaalsContact CB-OD2 3.24Å; S918-D921 WeakPolarHBondContact CB-OD2 3.46Å; S918-D921 PolarHBondContact N-OD2 3.08Å; S918-D921 PolarHBondContact O-N 3.05Å; S918-D921 VanDerWaalsContact O-N 3.09Å; S918-D921 VanDerWaalsContact OG-CG 3.3Å; S918-D921 PolarHBondContact OG-N 3.31Å; S918-D921 PolarHBondContact OG-OD2 2.69Å; D921-H925 WeakPolarHBondContact O-CB 3.26Å; D921-H925 PolarHBondContact O-N 2.96Å
922	V	41.7	Very low	34.4	Very low	9 Å²	9	95.8 Å²	95.8	6%	0.055	49%	0.486	C	S	.	.	H	α-helix	trans	-66.5	-48	173.8	178.8	0	0	0	0	111.2	P917 S918 F920 H924 H925 C926	P917-V922 HydrophobicContact CB-CG2 4.35Å; S918-V922 PolarHBondContact O-N 3.24Å; S918-V922 VanDerWaalsContact O-N 3.07Å; F920-V922 VanDerWaalsContact C-N 3.26Å; F920-V922 PolarHBondContact O-N 3.01Å; V922-H924 VanDerWaalsContact C-N 3.34Å; V922-H924 PolarHBondContact O-N 3.4Å; V922-H925 PolarHBondContact O-N 2.78Å; V922-C926 WeakPolarHBondContact O-CB 3.18Å; V922-C926 PolarHBondContact O-N 3.23Å; V922-C926 PolarHBondContact O-SG 3.28Å
923	L	42.6	Very low	34.7	Very low	24 Å²	24	95.7 Å²	95.7	13%	0.126	48%	0.477	C	S	.	.	H	α-helix	trans	-62.8	-39.8	178.7	-69.6	165.7	0	0	0	112.2	L919 F920 C926 D927 I928 V931	L919-L923 HydrophobicContact CD1-CD1 4.34Å; L919-L923 HydrophobicContact CD1-CG 4.35Å; L919-L923 HydrophobicContact CG-CD1 3.9Å; L919-L923 HydrophobicContact CG-CG 4.38Å; L919-L923 WeakPolarHBondContact O-CB 3.44Å; L919-L923 WeakPolarHBondContact O-CD1 3.18Å; L919-L923 WeakPolarHBondContact O-CG 3.43Å; L919-L923 PolarHBondContact O-N 2.99Å; F920-L923 PolarHBondContact O-N 3.24Å; L923-C926 PolarHBondContact O-N 2.83Å; L923-D927 PolarHBondContact O-N 2.78Å; L923-I928 HydrophobicContact CB-CB 4.37Å; L923-I928 HydrophobicContact CD2-CB 3.68Å; L923-I928 HydrophobicContact CD2-CD1 4.15Å; L923-I928 HydrophobicContact CD2-CG1 4.49Å; L923-I928 HydrophobicContact CD2-CG2 3.54Å; L923-I928 PolarHBondContact O-N 3.02Å; L923-V931 HydrophobicContact CD1-CG2 3.69Å; L923-V931 HydrophobicContact CD2-CG2 3.7Å; L923-V931 HydrophobicContact CG-CG2 4.38Å
924	H	43.7	Very low	34.7	Very low	134 Å²	134	93.2 Å²	93.2	62%	0.62	46%	0.459	S	S	*	.	H	α-helix	trans	-71.2	-33.7	179.2	-171.3	-65	0	0	0	112.2	F920 V922 C926	F920-H924 HydrophobicContact CE2-CB 4.46Å; F920-H924 HydrophobicContact CZ-CB 4.39Å; F920-H924 AromaticContact CZ-CD2 3.67Å; F920-H924 WeakPolarHBondContact O-CB 3.27Å; F920-H924 PolarHBondContact O-N 3.32Å; V922-H924 VanDerWaalsContact C-N 3.34Å; V922-H924 PolarHBondContact O-N 3.4Å; H924-C926 VanDerWaalsContact C-N 3.26Å; H924-C926 PolarHBondContact O-N 3.45Å
925	H	41.3	Very low	34.9	Very low	144 Å²	144	91.5 Å²	91.5	67%	0.667	46%	0.462	S	S	*	.	H	α-helix	trans	-74.5	-15.2	172.1	-115.2	-26.6	0	0	0	113.8	D921 V922	D921-H925 WeakPolarHBondContact O-CB 3.26Å; D921-H925 PolarHBondContact O-N 2.96Å; V922-H925 PolarHBondContact O-N 2.78Å
926	C	35.6	Very low	34.7	Very low	7 Å²	7	92.4 Å²	92.4	5%	0.047	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	7.9	-177	-59.4	0	0	0	0	113.9	V922 L923 H924 I928 A1083	V922-C926 WeakPolarHBondContact O-CB 3.18Å; V922-C926 PolarHBondContact O-N 3.23Å; V922-C926 PolarHBondContact O-SG 3.28Å; L923-C926 PolarHBondContact O-N 2.83Å; H924-C926 VanDerWaalsContact C-N 3.26Å; H924-C926 PolarHBondContact O-N 3.45Å; C926-I928 HydrophobicContact CB-CD1 3.53Å; C926-I928 HydrophobicContact CB-CG1 3.63Å; C926-I928 WeakPolarHBondContact O-CG1 3.32Å; C926-I928 PolarHBondContact O-N 2.92Å; C926-A1083 WeakPolarHBondContact SG-CB 3.45Å
927	D	34.1	Very low	35	Very low	95 Å²	95	87.7 Å²	87.7	51%	0.508	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	33.1	-173.3	-85.1	-58	0	0	0	114	L923 Y929	L923-D927 PolarHBondContact O-N 2.78Å; D927-Y929 HydrophobicContact CB-CE2 3.84Å; D927-Y929 WeakPolarHBondContact O-CD2 3.47Å; D927-Y929 VanDerWaalsContact O-CE2 3.27Å; D927-Y929 WeakPolarHBondContact O-CE2 3.3Å; D927-Y929 PolarHBondContact O-N 3.11Å; D927-Y929 VanDerWaalsContact O-N 3.16Å; D927-Y929 VanDerWaalsContact OD1-CE2 3.29Å; D927-Y929 WeakPolarHBondContact OD1-CE2 3.49Å; D927-Y929 VanDerWaalsContact OD1-CZ 3.28Å; D927-Y929 PolarHBondContact OD1-OH 3.32Å
928	I	31.3	Very low	34.8	Very low	31 Å²	31	90 Å²	90	16%	0.159	46%	0.461	C	S	.	.			trans	-92.7	80.7	-174.8	-55.4	176.7	0	0	0	110.8	L923 C926 R930 I1091	L923-I928 HydrophobicContact CB-CB 4.37Å; L923-I928 HydrophobicContact CD2-CB 3.68Å; L923-I928 HydrophobicContact CD2-CD1 4.15Å; L923-I928 HydrophobicContact CD2-CG1 4.49Å; L923-I928 HydrophobicContact CD2-CG2 3.54Å; L923-I928 PolarHBondContact O-N 3.02Å; C926-I928 HydrophobicContact CB-CD1 3.53Å; C926-I928 HydrophobicContact CB-CG1 3.63Å; C926-I928 WeakPolarHBondContact O-CG1 3.32Å; C926-I928 PolarHBondContact O-N 2.92Å; I928-R930 WeakPolarHBondContact CG2-O 3.45Å; I928-R930 PolarHBondContact O-N 3Å; I928-R930 VanDerWaalsContact O-N 3.16Å; I928-I1091 HydrophobicContact CD1-CB 3.81Å; I928-I1091 HydrophobicContact CD1-CD1 3.44Å; I928-I1091 VanDerWaalsContact CD1-CD1 3.44Å; I928-I1091 HydrophobicContact CD1-CG1 3.46Å; I928-I1091 VanDerWaalsContact CD1-CG1 3.46Å
929	Y	32	Very low	34.6	Very low	172 Å²	172	92.9 Å²	92.9	68%	0.675	48%	0.481	S	S	*	.			trans	-69.6	-2.8	179.6	-60.6	-80.5	0	0	0	115.2	D927	D927-Y929 HydrophobicContact CB-CE2 3.84Å; D927-Y929 WeakPolarHBondContact O-CD2 3.47Å; D927-Y929 VanDerWaalsContact O-CE2 3.27Å; D927-Y929 WeakPolarHBondContact O-CE2 3.3Å; D927-Y929 PolarHBondContact O-N 3.11Å; D927-Y929 VanDerWaalsContact O-N 3.16Å; D927-Y929 VanDerWaalsContact OD1-CE2 3.29Å; D927-Y929 WeakPolarHBondContact OD1-CE2 3.49Å; D927-Y929 VanDerWaalsContact OD1-CZ 3.28Å; D927-Y929 PolarHBondContact OD1-OH 3.32Å
930	R	28.7	Very low	34	Very low	162 Å²	162	97.5 Å²	97.5	61%	0.611	51%	0.505	S	S	*	.			trans	-145.9	127.9	-179.7	-75.5	-175.2	167.5	169.9	-3.2	112.4	I928	I928-R930 WeakPolarHBondContact CG2-O 3.45Å; I928-R930 PolarHBondContact O-N 3Å; I928-R930 VanDerWaalsContact O-N 3.16Å
931	V	32.5	Very low	33.9	Very low	59 Å²	59	96.3 Å²	96.3	36%	0.358	51%	0.506	S	S	.	.			trans	-114.8	124.9	163.4	-179.9	0	0	0	0	107.9	L923 L933 I1093	L923-V931 HydrophobicContact CD1-CG2 3.69Å; L923-V931 HydrophobicContact CD2-CG2 3.7Å; L923-V931 HydrophobicContact CG-CG2 4.38Å; V931-L933 HydrophobicContact CG1-CD2 4.05Å; V931-L933 HydrophobicContact CG1-CG 4.27Å; V931-I1093 HydrophobicContact CG1-CD1 3.72Å; V931-I1093 HydrophobicContact CG1-CG1 4.14Å
932	I	31.3	Very low	33.5	Very low	146 Å²	146	96.5 Å²	96.5	75%	0.749	51%	0.507	S	S	*	.			trans	-95.7	119.6	176.7	-58.5	173.8	0	0	0	108.1
933	L	31.4	Very low	33	Very low	104 Å²	104	101.4 Å²	101.4	55%	0.545	53%	0.529	S	S	.	.			trans	-109.5	146	175	-62.1	176.4	0	0	0	110.1	V931 P935	V931-L933 HydrophobicContact CG1-CD2 4.05Å; V931-L933 HydrophobicContact CG1-CG 4.27Å; L933-P935 WeakPolarHBondContact O-CD 3.43Å
934	D	29.5	Very low	32.4	Very low	78 Å²	78	106.5 Å²	106.5	42%	0.417	56%	0.556	S	S	.	*			trans	-73.2	120.9	179.8	-170.1	-35.8	0	0	0	110.7	N936 L937	D934-N936 PolarHBondContact O-N 3.11Å; D934-N936 VanDerWaalsContact O-N 3.08Å; D934-N936 VanDerWaalsContact OD1-CB 3.32Å; D934-N936 WeakPolarHBondContact OD1-CB 3.15Å; D934-N936 PolarHBondContact OD1-N 2.89Å; D934-N936 PolarHBondContact OD1-ND2 3.08Å; D934-L937 HydrophobicContact CB-CD1 4.21Å; D934-L937 HydrophobicContact CB-CG 4.44Å; D934-L937 PolarHBondContact O-N 3.28Å
935	P	31.5	Very low	31.6	Very low	125 Å²	125	103.9 Å²	103.9	81%	0.812	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-1.7	-178.4	30.4	-37.1	0	0	0	114.6	L933	L933-P935 WeakPolarHBondContact O-CD 3.43Å
936	N	29.4	Very low	31	Very low	132 Å²	132	100.7 Å²	100.7	71%	0.706	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	1	176.6	-58.1	-81	0	0	0	113.6	D934 P938	D934-N936 PolarHBondContact O-N 3.11Å; D934-N936 VanDerWaalsContact O-N 3.08Å; D934-N936 VanDerWaalsContact OD1-CB 3.32Å; D934-N936 WeakPolarHBondContact OD1-CB 3.15Å; D934-N936 PolarHBondContact OD1-N 2.89Å; D934-N936 PolarHBondContact OD1-ND2 3.08Å; N936-P938 VanDerWaalsContact O-CD 3.29Å; N936-P938 WeakPolarHBondContact O-CD 3.36Å
937	L	33.9	Very low	30.6	Very low	103 Å²	103	108 Å²	108	54%	0.539	58%	0.579	S	S	.	*			trans	-80	114	177.9	-75.3	164.5	0	0	0	111.8	D934 S939 A1095	D934-L937 HydrophobicContact CB-CD1 4.21Å; D934-L937 HydrophobicContact CB-CG 4.44Å; D934-L937 PolarHBondContact O-N 3.28Å; L937-S939 PolarHBondContact O-N 3.09Å; L937-A1095 HydrophobicContact CD1-CB 4.46Å
938	P	28.6	Very low	30.3	Very low	109 Å²	109	107.5 Å²	107.5	71%	0.708	58%	0.576	S	S	*	*			trans	-73	116.8	173.8	29.4	-33.3	0	0	0	110.8	N936 L940	N936-P938 VanDerWaalsContact O-CD 3.29Å; N936-P938 WeakPolarHBondContact O-CD 3.36Å; P938-L940 VanDerWaalsContact C-N 3.34Å; P938-L940 PolarHBondContact O-N 3.44Å
939	S	29.7	Very low	30	Very low	111 Å²	111	107.2 Å²	107.2	78%	0.776	58%	0.577	S	S	*	*			trans	-70.6	82.7	176.6	40.8	0	0	0	0	112.1	L937	L937-S939 PolarHBondContact O-N 3.09Å
940	L	28.7	Very low	29.7	Very low	153 Å²	153	103.1 Å²	103.1	80%	0.801	57%	0.566	S	S	*	*			trans	-128	37.1	167.1	-69.6	174.1	0	0	0	110.9	P938	P938-L940 VanDerWaalsContact C-N 3.34Å; P938-L940 PolarHBondContact O-N 3.44Å
941	S	33	Very low	29.5	Very low	49 Å²	49	97.5 Å²	97.5	34%	0.343	55%	0.55	S	S	.	*			trans	-144.9	149.5	158.4	-176.3	0	0	0	0	108.2	G1036	S941-G1036 WeakPolarHBondContact CB-O 3.4Å; S941-G1036 VanDerWaalsContact OG-CA 3.27Å; S941-G1036 WeakPolarHBondContact OG-CA 3.41Å; S941-G1036 PolarHBondContact OG-N 3.23Å; S941-G1036 PolarHBondContact OG-O 3.42Å
942	D	32.4	Very low	29.3	Very low	80 Å²	80	100.7 Å²	100.7	43%	0.428	56%	0.559	S	S	.	*			trans	-131.9	-18.2	-146.1	-105.8	-9.8	0	0	0	108.5	L944 F1034	D942-L944 VanDerWaalsContact C-N 3.32Å; D942-L944 PolarHBondContact O-N 2.76Å; D942-F1034 HydrophobicContact CB-CB 3.57Å; D942-F1034 HydrophobicContact CB-CD1 3.49Å; D942-F1034 VanDerWaalsContact CB-CD1 3.49Å; D942-F1034 HydrophobicContact CB-CD2 4Å; D942-F1034 HydrophobicContact CB-CE1 4.09Å; D942-F1034 HydrophobicContact CB-CG 3.44Å; D942-F1034 VanDerWaalsContact CB-CG 3.44Å; D942-F1034 VanDerWaalsContact CG-CD1 3.46Å; D942-F1034 WeakPolarHBondContact O-CB 3.25Å; D942-F1034 WeakPolarHBondContact O-CD2 3.46Å; D942-F1034 WeakPolarHBondContact O-CG 3.43Å; D942-F1034 WeakPolarHBondContact OD2-CD1 3.26Å; D942-F1034 VanDerWaalsContact OD2-CE1 3.3Å; D942-F1034 WeakPolarHBondContact OD2-CE1 3.28Å
943	Q	31.6	Very low	29	Very low	111 Å²	111	99.4 Å²	99.4	52%	0.519	55%	0.548	S	S	.	.			trans	-84.4	36.6	-157.7	-164.8	163.5	59.6	0	0	115.4	F1034	Q943-F1034 WeakPolarHBondContact CB-O 3.43Å; Q943-F1034 VanDerWaalsContact CD-O 3.23Å; Q943-F1034 WeakPolarHBondContact CG-O 3.49Å; Q943-F1034 PolarHBondContact NE2-O 2.88Å
944	L	29.4	Very low	28.8	Very low	131 Å²	131	99.2 Å²	99.2	69%	0.686	55%	0.553	S	S	*	*	S	Bend	trans	-136.6	133.7	176.4	-69.6	171.8	0	0	0	110.1	D942 L946	D942-L944 VanDerWaalsContact C-N 3.32Å; D942-L944 PolarHBondContact O-N 2.76Å; L944-L946 PolarHBondContact O-N 2.88Å
945	G	28.3	Very low	28.7	Very low	80 Å²	80	103.1 Å²	103.1	83%	0.825	57%	0.573	S	S	*	*			trans	-71.4	67	-177.6	0	0	0	0	0	113.6
946	L	28.4	Very low	28.7	Very low	77 Å²	77	102.9 Å²	102.9	40%	0.403	57%	0.565	S	S	.	*			trans	-131.1	95.6	-178.6	-69.8	173.4	0	0	0	109.3	L919 L944 L948	L919-L946 HydrophobicContact CD2-CD1 4.5Å; L944-L946 PolarHBondContact O-N 2.88Å; L946-L948 VanDerWaalsContact C-N 3.31Å; L946-L948 HydrophobicContact CB-CD2 4.19Å; L946-L948 HydrophobicContact CB-CG 4.33Å; L946-L948 PolarHBondContact O-N 2.94Å
947	R	27	Very low	29.1	Very low	160 Å²	160	99.1 Å²	99.1	60%	0.604	55%	0.545	S	S	*	.			trans	-77.5	83.9	173	-172.5	176.3	175.7	179.3	-4.3	109.6	C949 E1027	R947-C949 PolarHBondContact O-N 2.93Å; R947-E1027 IonicContact NH1-OE1 2.92Å; R947-E1027 PolarHBondContact NH1-OE1 3.27Å
948	L	27.7	Very low	28.9	Very low	85 Å²	85	96.8 Å²	96.8	45%	0.445	54%	0.535	S	S	.	.			trans	-73.4	90.7	179.4	-60.7	-174.9	0	0	0	110.7	L946 V1021	L946-L948 VanDerWaalsContact C-N 3.31Å; L946-L948 HydrophobicContact CB-CD2 4.19Å; L946-L948 HydrophobicContact CB-CG 4.33Å; L946-L948 PolarHBondContact O-N 2.94Å; L948-V1021 HydrophobicContact CB-CG1 3.75Å; L948-V1021 HydrophobicContact CD1-CG1 4.22Å; L948-V1021 HydrophobicContact CD2-CG1 3.83Å; L948-V1021 HydrophobicContact CG-CG1 4.12Å
949	C	25.5	Very low	29.1	Very low	25 Å²	25	97.6 Å²	97.6	17%	0.169	53%	0.529	C	S	.	.			trans	-73.4	161	168.9	-72.6	0	0	0	0	111.9	R947 T1022 E1024	R947-C949 PolarHBondContact O-N 2.93Å; C949-T1022 CarbonylContact C-O 3.56Å; C949-T1022 PolarHBondContact O-N 3.34Å; C949-T1022 VanDerWaalsContact O-O 3.12Å; C949-E1024 HydrophobicContact CB-CB 4.34Å; C949-E1024 HydrophobicContact CB-CG 4.19Å; C949-E1024 WeakPolarHBondContact CB-OE2 3.45Å
950	L	24.8	Very low	29.4	Very low	86 Å²	86	98.8 Å²	98.8	45%	0.45	52%	0.517	S	S	.	.	B	Isolated β-bridge	trans	-116.8	98.2	-173.6	-65.3	172.1	0	0	0	109.7	D1019 V1020 V1021	L950-D1019 HydrophobicContact CD1-CB 4.24Å; L950-D1019 HydrophobicContact CD2-CB 3.62Å; L950-V1020 WeakPolarHBondContact CA-O 3.2Å; L950-V1021 HydrophobicContact CD2-CG2 3.77Å
951	T	25.3	Very low	29.7	Very low	44 Å²	44	93.6 Å²	93.6	27%	0.27	50%	0.495	S	S	.	.			trans	-93.4	129	178	80.9	0	0	0	0	111.8	V1020 T1022 E1024	T951-V1020 PolarHBondContact N-O 2.75Å; T951-T1022 WeakPolarHBondContact OG1-CB 3.38Å; T951-T1022 PolarHBondContact OG1-OG1 3.25Å; T951-E1024 VanDerWaalsContact CG2-CD 3.48Å; T951-E1024 HydrophobicContact CG2-CG 3.3Å; T951-E1024 WeakPolarHBondContact CG2-OE1 3.45Å
952	K	26.9	Very low	30	Very low	125 Å²	125	94.8 Å²	94.8	54%	0.543	50%	0.498	S	S	.	.			trans	-86.3	118.7	-175.8	-105.6	-171.1	178.1	178.8	0	110.6	V958	K952-V958 HydrophobicContact CB-CG2 3.88Å; K952-V958 WeakPolarHBondContact O-CG2 3.46Å
953	F	26.9	Very low	30.6	Very low	120 Å²	120	94.8 Å²	94.8	53%	0.526	50%	0.501	S	S	.	.	S	Bend	trans	63.2	161.6	159.2	-67.1	-97.1	0	0	0	118.5	D957 V958	F953-D957 HydrophobicContact CB-CB 4.19Å; F953-D957 HydrophobicContact CD1-CB 3.58Å; F953-D957 HydrophobicContact CE1-CB 4.13Å; F953-D957 HydrophobicContact CG-CB 3.99Å; F953-V958 HydrophobicContact CB-CG2 3.94Å; F953-V958 HydrophobicContact CD2-CG2 4.35Å
954	P	25.9	Very low	31.1	Very low	99 Å²	99	94.2 Å²	94.2	64%	0.643	50%	0.501	S	S	*	.	S	Bend	trans	-58.3	146.8	148.4	29.4	-35.6	0	0	0	110.5	D956 D957	P954-D956 VanDerWaalsContact C-N 3.25Å; P954-D956 PolarHBondContact O-N 3.38Å; P954-D957 PolarHBondContact O-N 3.31Å
955	L	28.9	Very low	31.8	Very low	160 Å²	160	93.3 Å²	93.3	84%	0.838	49%	0.494	S	S	*	.	H	α-helix	trans	-57.4	-23.6	-158.2	-79.5	148.5	0	0	0	116.9
956	D	30.5	Very low	32.9	Very low	120 Å²	120	95.2 Å²	95.2	64%	0.642	48%	0.479	S	S	*	.	H	α-helix	trans	-73	-31.8	-176.5	-60.4	-43.2	0	0	0	114.3	P954 R960	P954-D956 VanDerWaalsContact C-N 3.25Å; P954-D956 PolarHBondContact O-N 3.38Å; D956-R960 PolarHBondContact O-N 2.94Å
957	D	36.8	Very low	34	Very low	54 Å²	54	96.2 Å²	96.2	29%	0.289	48%	0.484	S	S	.	.	H	α-helix	trans	-86.9	-19.2	-169.1	-87	-6.6	0	0	0	113.9	F953 P954 R960 A961	F953-D957 HydrophobicContact CB-CB 4.19Å; F953-D957 HydrophobicContact CD1-CB 3.58Å; F953-D957 HydrophobicContact CE1-CB 4.13Å; F953-D957 HydrophobicContact CG-CB 3.99Å; P954-D957 PolarHBondContact O-N 3.31Å; D957-R960 PolarHBondContact O-N 3.32Å; D957-R960 IonicContact OD1-CZ 3.23Å; D957-R960 IonicContact OD1-NE 3.16Å; D957-R960 PolarHBondContact OD1-NE 2.89Å; D957-R960 IonicContact OD1-NH2 2.69Å; D957-R960 PolarHBondContact OD1-NH2 2.82Å; D957-A961 VanDerWaalsContact O-CB 3.28Å; D957-A961 WeakPolarHBondContact O-CB 3.34Å; D957-A961 PolarHBondContact O-N 2.85Å
958	V	31.1	Very low	35	Very low	54 Å²	54	94.2 Å²	94.2	33%	0.327	48%	0.482	S	S	.	.	H	α-helix	trans	-68.8	-47.7	171.9	-169.7	0	0	0	0	110.3	K952 F953 R960 A961 D962	K952-V958 HydrophobicContact CB-CG2 3.88Å; K952-V958 WeakPolarHBondContact O-CG2 3.46Å; F953-V958 HydrophobicContact CB-CG2 3.94Å; F953-V958 HydrophobicContact CD2-CG2 4.35Å; V958-R960 VanDerWaalsContact C-N 3.29Å; V958-R960 PolarHBondContact O-N 2.86Å; V958-A961 PolarHBondContact O-N 2.86Å; V958-D962 WeakPolarHBondContact O-CB 3.46Å; V958-D962 PolarHBondContact O-N 3.3Å
959	Q	33	Very low	36	Very low	125 Å²	125	93.6 Å²	93.6	58%	0.584	48%	0.479	S	S	*	.	H	α-helix	trans	-60.6	-42.2	174.5	-65.6	-169.1	2.5	0	0	110.6	A961 D962 T963	Q959-A961 PolarHBondContact O-N 2.96Å; Q959-D962 PolarHBondContact O-N 3.36Å; Q959-T963 VanDerWaalsContact O-CB 3.3Å; Q959-T963 WeakPolarHBondContact O-CB 3.13Å; Q959-T963 PolarHBondContact O-N 2.84Å; Q959-T963 PolarHBondContact O-OG1 3.43Å
960	R	35	Very low	37	Very low	137 Å²	137	97 Å²	97	52%	0.517	50%	0.495	S	S	.	.	H	α-helix	trans	-60.2	-43.9	176.4	-142.1	-171.2	-43.8	-79.6	-2.2	112.6	D956 D957 V958 L964	D956-R960 PolarHBondContact O-N 2.94Å; D957-R960 PolarHBondContact O-N 3.32Å; D957-R960 IonicContact OD1-CZ 3.23Å; D957-R960 IonicContact OD1-NE 3.16Å; D957-R960 PolarHBondContact OD1-NE 2.89Å; D957-R960 IonicContact OD1-NH2 2.69Å; D957-R960 PolarHBondContact OD1-NH2 2.82Å; V958-R960 VanDerWaalsContact C-N 3.29Å; V958-R960 PolarHBondContact O-N 2.86Å; R960-L964 WeakPolarHBondContact O-CB 3.39Å; R960-L964 VanDerWaalsContact O-CG 3.28Å; R960-L964 WeakPolarHBondContact O-CG 3.21Å; R960-L964 PolarHBondContact O-N 2.92Å
961	A	35.6	Very low	38.1	Very low	43 Å²	43	98.9 Å²	98.9	36%	0.355	50%	0.502	S	S	.	.	H	α-helix	trans	-67.7	-42.4	177.7	0	0	0	0	0	112.3	D957 V958 Q959 L964 Q965	D957-A961 VanDerWaalsContact O-CB 3.28Å; D957-A961 WeakPolarHBondContact O-CB 3.34Å; D957-A961 PolarHBondContact O-N 2.85Å; V958-A961 PolarHBondContact O-N 2.86Å; Q959-A961 PolarHBondContact O-N 2.96Å; A961-L964 PolarHBondContact O-N 3.48Å; A961-Q965 WeakPolarHBondContact O-CB 3.21Å; A961-Q965 PolarHBondContact O-N 3.3Å
962	D	39.4	Very low	39	Very low	74 Å²	74	100.4 Å²	100.4	40%	0.396	51%	0.508	S	S	.	.	H	α-helix	trans	-69.1	-36	179.4	-150.6	64.5	0	0	0	111.3	V958 Q959 Q965 K966	V958-D962 WeakPolarHBondContact O-CB 3.46Å; V958-D962 PolarHBondContact O-N 3.3Å; Q959-D962 PolarHBondContact O-N 3.36Å; D962-Q965 PolarHBondContact O-N 2.98Å; D962-K966 VanDerWaalsContact O-CB 3.32Å; D962-K966 WeakPolarHBondContact O-CB 3.27Å; D962-K966 WeakPolarHBondContact O-CD 3.11Å; D962-K966 VanDerWaalsContact O-CG 3.26Å; D962-K966 WeakPolarHBondContact O-CG 3.35Å; D962-K966 PolarHBondContact O-N 2.76Å; D962-K966 VanDerWaalsContact OD2-CE 3.31Å; D962-K966 WeakPolarHBondContact OD2-CE 3.37Å; D962-K966 IonicContact OD2-NZ 2.62Å; D962-K966 PolarHBondContact OD2-NZ 2.89Å
963	T	44.3	Very low	39.6	Very low	80 Å²	80	101.3 Å²	101.3	49%	0.491	51%	0.512	S	S	.	.	H	α-helix	trans	-66.8	-43.6	170.2	-62.1	0	0	0	0	111.9	Q959 Q965 K966 L967	Q959-T963 VanDerWaalsContact O-CB 3.3Å; Q959-T963 WeakPolarHBondContact O-CB 3.13Å; Q959-T963 PolarHBondContact O-N 2.84Å; Q959-T963 PolarHBondContact O-OG1 3.43Å; T963-Q965 VanDerWaalsContact C-N 3.34Å; T963-Q965 PolarHBondContact O-N 2.98Å; T963-K966 PolarHBondContact O-N 3.01Å; T963-L967 HydrophobicContact CG2-CD1 4.09Å; T963-L967 WeakPolarHBondContact O-CB 3.44Å; T963-L967 VanDerWaalsContact O-CG 3.29Å; T963-L967 WeakPolarHBondContact O-CG 3.27Å; T963-L967 PolarHBondContact O-N 2.73Å
964	L	43.4	Very low	40.2	Very low	100 Å²	100	101 Å²	101	52%	0.524	52%	0.516	S	S	.	.	H	α-helix	trans	-63	-39.3	174.4	-78.1	166	0	0	0	112	R960 A961 L967 Q968	R960-L964 WeakPolarHBondContact O-CB 3.39Å; R960-L964 VanDerWaalsContact O-CG 3.28Å; R960-L964 WeakPolarHBondContact O-CG 3.21Å; R960-L964 PolarHBondContact O-N 2.92Å; A961-L964 PolarHBondContact O-N 3.48Å; L964-L967 PolarHBondContact O-N 2.75Å; L964-Q968 WeakPolarHBondContact O-CG 3.35Å; L964-Q968 PolarHBondContact O-N 3.25Å
965	Q	43	Very low	41	Very low	112 Å²	112	102.8 Å²	102.8	52%	0.523	52%	0.519	S	S	.	.	H	α-helix	trans	-72.2	-33.4	177.5	-167	164.6	10	0	0	112	A961 D962 T963 N969	A961-Q965 WeakPolarHBondContact O-CB 3.21Å; A961-Q965 PolarHBondContact O-N 3.3Å; D962-Q965 PolarHBondContact O-N 2.98Å; T963-Q965 VanDerWaalsContact C-N 3.34Å; T963-Q965 PolarHBondContact O-N 2.98Å; Q965-N969 VanDerWaalsContact O-CB 3.26Å; Q965-N969 WeakPolarHBondContact O-CB 3.29Å; Q965-N969 PolarHBondContact O-N 3.49Å; Q965-N969 PolarHBondContact O-ND2 3.45Å; Q965-N969 VanDerWaalsContact O-ND2 3.14Å
966	K	52.1	Low	41.4	Very low	119 Å²	119	102.7 Å²	102.7	52%	0.517	51%	0.511	S	S	.	.	H	α-helix	trans	-67.8	-40.2	169.4	-77.9	162.6	176.8	158.5	0	112.3	D962 T963 N969 N970	D962-K966 VanDerWaalsContact O-CB 3.32Å; D962-K966 WeakPolarHBondContact O-CB 3.27Å; D962-K966 WeakPolarHBondContact O-CD 3.11Å; D962-K966 VanDerWaalsContact O-CG 3.26Å; D962-K966 WeakPolarHBondContact O-CG 3.35Å; D962-K966 PolarHBondContact O-N 2.76Å; D962-K966 VanDerWaalsContact OD2-CE 3.31Å; D962-K966 WeakPolarHBondContact OD2-CE 3.37Å; D962-K966 IonicContact OD2-NZ 2.62Å; D962-K966 PolarHBondContact OD2-NZ 2.89Å; T963-K966 PolarHBondContact O-N 3.01Å; K966-N969 PolarHBondContact O-N 2.91Å; K966-N970 WeakPolarHBondContact O-CB 3.49Å; K966-N970 PolarHBondContact O-N 2.69Å; K966-N970 PolarHBondContact O-OD1 3.42Å
967	L	51	Low	41.5	Very low	99 Å²	99	101.4 Å²	101.4	52%	0.518	51%	0.512	S	S	.	.	H	α-helix	trans	-61.8	-50.2	173.6	-75.5	165.6	0	0	0	111.3	T963 L964 N969 N970 E971	T963-L967 HydrophobicContact CG2-CD1 4.09Å; T963-L967 WeakPolarHBondContact O-CB 3.44Å; T963-L967 VanDerWaalsContact O-CG 3.29Å; T963-L967 WeakPolarHBondContact O-CG 3.27Å; T963-L967 PolarHBondContact O-N 2.73Å; L964-L967 PolarHBondContact O-N 2.75Å; L967-N969 VanDerWaalsContact C-N 3.34Å; L967-N969 PolarHBondContact O-N 3.47Å; L967-N970 PolarHBondContact O-N 3.22Å; L967-E971 PolarHBondContact O-N 3.19Å
968	Q	48.9	Very low	41.2	Very low	117 Å²	117	103 Å²	103	55%	0.547	53%	0.527	S	S	.	.	H	α-helix	trans	-61.3	-40.2	175.9	-75.2	-176.1	-16.2	0	0	112.5	L964 I972	L964-Q968 WeakPolarHBondContact O-CG 3.35Å; L964-Q968 PolarHBondContact O-N 3.25Å; Q968-I972 WeakPolarHBondContact O-CB 3.44Å; Q968-I972 WeakPolarHBondContact O-CD1 3.09Å; Q968-I972 WeakPolarHBondContact O-CG1 3.46Å; Q968-I972 PolarHBondContact O-N 2.92Å
969	N	46.8	Very low	41.4	Very low	72 Å²	72	108.7 Å²	108.7	39%	0.385	56%	0.556	S	S	.	*	H	α-helix	trans	-64.3	-41.8	175.2	-78.4	-29.5	0	0	0	111.7	Q965 K966 L967 I972 F973	Q965-N969 VanDerWaalsContact O-CB 3.26Å; Q965-N969 WeakPolarHBondContact O-CB 3.29Å; Q965-N969 PolarHBondContact O-N 3.49Å; Q965-N969 PolarHBondContact O-ND2 3.45Å; Q965-N969 VanDerWaalsContact O-ND2 3.14Å; K966-N969 PolarHBondContact O-N 2.91Å; L967-N969 VanDerWaalsContact C-N 3.34Å; L967-N969 PolarHBondContact O-N 3.47Å; N969-I972 CarbonylContact O-C 3.53Å; N969-I972 PolarHBondContact O-N 3.49Å; N969-F973 VanDerWaalsContact O-CD2 3.29Å; N969-F973 WeakPolarHBondContact O-CD2 3.42Å; N969-F973 PolarHBondContact O-N 3.49Å
970	N	47.7	Very low	41.2	Very low	96 Å²	96	105.8 Å²	105.8	51%	0.513	56%	0.559	S	S	.	*	H	α-helix	trans	-64.8	-45.9	177.6	-70.3	-0.1	0	0	0	111.3	K966 L967 I972 F973 D974	K966-N970 WeakPolarHBondContact O-CB 3.49Å; K966-N970 PolarHBondContact O-N 2.69Å; K966-N970 PolarHBondContact O-OD1 3.42Å; L967-N970 PolarHBondContact O-N 3.22Å; N970-I972 PolarHBondContact O-N 3.03Å; N970-F973 PolarHBondContact O-N 3.16Å; N970-D974 PolarHBondContact O-N 2.92Å
971	E	46.9	Very low	41	Very low	126 Å²	126	104.7 Å²	104.7	59%	0.589	57%	0.573	S	S	*	*	H	α-helix	trans	-55.2	-39.9	171.3	-71	-178.1	145.3	0	0	111.7	L967 I975	L967-E971 PolarHBondContact O-N 3.19Å; E971-I975 WeakPolarHBondContact O-CB 3.35Å; E971-I975 WeakPolarHBondContact O-CD1 3.49Å; E971-I975 WeakPolarHBondContact O-CG1 3.05Å; E971-I975 PolarHBondContact O-N 2.93Å; E971-I975 VanDerWaalsContact O-N 3.14Å
972	I	45.4	Very low	40.7	Very low	77 Å²	77	108.4 Å²	108.4	40%	0.395	59%	0.591	S	S	.	*	H	α-helix	trans	-73.3	-25.2	178.6	-70.9	166.3	0	0	0	113	Q968 N969 N970 K976	Q968-I972 WeakPolarHBondContact O-CB 3.44Å; Q968-I972 WeakPolarHBondContact O-CD1 3.09Å; Q968-I972 WeakPolarHBondContact O-CG1 3.46Å; Q968-I972 PolarHBondContact O-N 2.92Å; N969-I972 CarbonylContact O-C 3.53Å; N969-I972 PolarHBondContact O-N 3.49Å; N970-I972 PolarHBondContact O-N 3.03Å; I972-K976 HydrophobicContact CG2-CD 4.24Å; I972-K976 VanDerWaalsContact CG2-NZ 3.26Å; I972-K976 WeakPolarHBondContact O-CB 3.37Å; I972-K976 VanDerWaalsContact O-CD 3.26Å; I972-K976 WeakPolarHBondContact O-CD 3.1Å; I972-K976 WeakPolarHBondContact O-CG 3.27Å
973	F	40.2	Very low	40.2	Very low	143 Å²	143	112.4 Å²	112.4	63%	0.627	61%	0.607	S	S	*	*	H	α-helix	trans	-86.8	-36.9	176	-89.7	-73.9	0	0	0	112.7	N969 N970 I975 K976 S977	N969-F973 VanDerWaalsContact O-CD2 3.29Å; N969-F973 WeakPolarHBondContact O-CD2 3.42Å; N969-F973 PolarHBondContact O-N 3.49Å; N970-F973 PolarHBondContact O-N 3.16Å; F973-I975 VanDerWaalsContact C-N 3.32Å; F973-I975 PolarHBondContact O-N 2.87Å; F973-K976 PolarHBondContact O-N 3.39Å; F973-K976 VanDerWaalsContact O-N 3.09Å; F973-S977 WeakPolarHBondContact O-CB 3.16Å; F973-S977 PolarHBondContact O-N 2.92Å; F973-S977 VanDerWaalsContact O-N 3.14Å; F973-S977 PolarHBondContact O-OG 2.94Å
974	D	39.4	Very low	39.4	Very low	115 Å²	115	115.5 Å²	115.5	62%	0.615	63%	0.626	S	S	*	*	H	α-helix	trans	-64	-38.7	172.6	-71.2	-22.1	0	0	0	110.9	N970 K976 S977	N970-D974 PolarHBondContact O-N 2.92Å; D974-K976 PolarHBondContact O-N 3.28Å; D974-S977 PolarHBondContact O-OG 2.76Å
975	I	41.8	Very low	38.8	Very low	136 Å²	136	118.8 Å²	118.8	70%	0.697	64%	0.64	S	S	*	*	H	α-helix	trans	-69.5	-12.9	174	-69.4	169.4	0	0	0	113.2	E971 F973	E971-I975 WeakPolarHBondContact O-CB 3.35Å; E971-I975 WeakPolarHBondContact O-CD1 3.49Å; E971-I975 WeakPolarHBondContact O-CG1 3.05Å; E971-I975 PolarHBondContact O-N 2.93Å; E971-I975 VanDerWaalsContact O-N 3.14Å; F973-I975 VanDerWaalsContact C-N 3.32Å; F973-I975 PolarHBondContact O-N 2.87Å
976	K	37.2	Very low	38	Very low	157 Å²	157	120.8 Å²	120.8	68%	0.683	66%	0.655	S	S	*	*	H	α-helix	trans	-115.1	0.5	-175.3	-73.3	178.4	-172.2	165.5	0	115.2	I972 F973 D974	I972-K976 HydrophobicContact CG2-CD 4.24Å; I972-K976 VanDerWaalsContact CG2-NZ 3.26Å; I972-K976 WeakPolarHBondContact O-CB 3.37Å; I972-K976 VanDerWaalsContact O-CD 3.26Å; I972-K976 WeakPolarHBondContact O-CD 3.1Å; I972-K976 WeakPolarHBondContact O-CG 3.27Å; F973-K976 PolarHBondContact O-N 3.39Å; F973-K976 VanDerWaalsContact O-N 3.09Å; D974-K976 PolarHBondContact O-N 3.28Å
977	S	32.2	Very low	36.8	Very low	93 Å²	93	121.1 Å²	121.1	65%	0.65	67%	0.667	S	S	*	*	H	α-helix	trans	-107.5	-7.7	-178.2	48.1	0	0	0	0	113.8	F973 D974	F973-S977 WeakPolarHBondContact O-CB 3.16Å; F973-S977 PolarHBondContact O-N 2.92Å; F973-S977 VanDerWaalsContact O-N 3.14Å; F973-S977 PolarHBondContact O-OG 2.94Å; D974-S977 PolarHBondContact O-OG 2.76Å
978	S	31.2	Very low	35.7	Very low	89 Å²	89	124.4 Å²	124.4	62%	0.622	68%	0.682	S	S	*	*			trans	-115.3	76.7	178	68.7	0	0	0	0	113.4
979	D	35.3	Very low	34.8	Very low	173 Å²	173	126.6 Å²	126.6	93%	0.925	70%	0.697	S	S	*	*			trans	-162.3	128.9	134.7	-110.8	-19	0	0	0	109.9
980	G	28.9	Very low	33.8	Very low	63 Å²	63	128.9 Å²	128.9	65%	0.649	72%	0.719	S	S	*	*			trans	-122.7	179.2	-173.3	0	0	0	0	0	113.2
981	S	29.7	Very low	33.2	Very low	115 Å²	115	130 Å²	130	80%	0.804	73%	0.731	S	S	*	*			trans	82.1	116.9	171.6	82.6	0	0	0	0	118
982	V	30	Very low	32.4	Very low	121 Å²	121	133.7 Å²	133.7	73%	0.733	75%	0.745	S	S	*	*				89.5	125	128.6	171.8	0	0	0	0	120
983	E	29	Very low	31.7	Very low	158 Å²	158	133.1 Å²	133.1	74%	0.738	76%	0.759	S	S	*	*			trans	61.7	88.3	156.3	-75	159.9	-141.5	0	0	120.4	M985	E983-M985 PolarHBondContact O-N 3.05Å; E983-M985 VanDerWaalsContact O-N 3.14Å
984	T	28.2	Very low	31.3	Very low	144 Å²	144	132.9 Å²	132.9	88%	0.883	77%	0.771	S	S	*	*			trans	-47.1	109	137.5	47.3	0	0	0	0	112.1
985	M	30	Very low	30.9	Very low	169 Å²	169	136.6 Å²	136.6	83%	0.833	78%	0.782	S	S	*	*			trans	-133.4	153	151.3	-87.5	-133.7	-81	0	0	111.6	E983	E983-M985 PolarHBondContact O-N 3.05Å; E983-M985 VanDerWaalsContact O-N 3.14Å
986	N	26.9	Very low	30.2	Very low	154 Å²	154	135.8 Å²	135.8	82%	0.824	79%	0.785	S	S	*	*			trans	-85.5	179.2	-165.3	-68.9	-67.5	0	0	0	113
987	T	27.3	Very low	29.8	Very low	126 Å²	126	138.7 Å²	138.7	77%	0.773	79%	0.794	S	S	*	*			trans	96	113	154.1	-24.7	0	0	0	0	116.7
988	M	26.5	Very low	29.6	Very low	168 Å²	168	142 Å²	142	83%	0.828	80%	0.802	S	S	*	*			trans	9	113.9	149.9	-50.2	179.6	-169.4	0	0	118.1
989	N	30.2	Very low	29.6	Very low	164 Å²	164	140 Å²	140	88%	0.877	80%	0.796	S	S	*	*				-178.2	139.8	116.7	-91.6	-43.5	0	0	0	111.6
990	S	26.4	Very low	29.4	Very low	119 Å²	119	137.9 Å²	137.9	83%	0.832	79%	0.792	S	S	*	*			trans	-110.8	147.4	177.7	-47.6	0	0	0	0	112.2
991	P	34.5	Very low	29.3	Very low	119 Å²	119	146 Å²	146	77%	0.773	80%	0.803	S	S	*	*			trans	-132.6	99.9	149.3	33	-17.4	0	0	0	114.3
992	K	30.9	Very low	29.3	Very low	204 Å²	204	147.7 Å²	147.7	89%	0.887	80%	0.803	S	S	*	*			trans	43.9	97.6	134.6	-59.7	170.3	-177.5	169.5	0	119.5
993	G	29.4	Very low	29.3	Very low	66 Å²	66	149.7 Å²	149.7	68%	0.68	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-82.1	161	136.5	0	0	0	0	0	111.4
994	P	32.8	Very low	29.1	Very low	137 Å²	137	145.5 Å²	145.5	89%	0.89	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-73.4	137.7	-173.5	28.8	-34.4	0	0	0	113.5
995	K	29.6	Very low	29	Very low	194 Å²	194	144.6 Å²	144.6	84%	0.843	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-83.9	147.1	172.8	-77.7	-175.6	173	-177.3	0	111.6
996	P	28.9	Very low	28.8	Very low	118 Å²	118	146 Å²	146	77%	0.766	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-65.2	140.7	169.8	28.7	-34.7	0	0	0	111.1
997	Y	28.4	Very low	28.8	Very low	218 Å²	218	147.6 Å²	147.6	86%	0.855	80%	0.804	S	S	*	*			trans	-91.2	111.1	-177.4	-168.8	-88.7	0	0	0	111.2	G999	Y997-G999 PolarHBondContact O-N 3.33Å
998	I	27.5	Very low	28.7	Very low	162 Å²	162	147.3 Å²	147.3	83%	0.831	81%	0.805	S	S	*	*			trans	-86.7	101.8	178.5	-60.5	174	0	0	0	109.3
999	G	32.1	Very low	28.9	Very low	47 Å²	47	147 Å²	147	49%	0.485	81%	0.805	S	S	.	*	P	Polyproline II helix	trans	-81.4	152	169.7	0	0	0	0	0	112.7	Y997	Y997-G999 PolarHBondContact O-N 3.33Å
1000	P	29.7	Very low	28.6	Very low	130 Å²	130	147.9 Å²	147.9	84%	0.844	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-77.2	141.9	-175.1	30.9	-35.1	0	0	0	113.3
1001	R	28.4	Very low	28.6	Very low	232 Å²	232	150 Å²	150	88%	0.875	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-61.8	141.5	169.6	-74.9	179.4	170.5	167.4	-0.8	111.8
1002	N	29.1	Very low	28.3	Very low	152 Å²	152	153.1 Å²	153.1	81%	0.813	80%	0.804	S	S	*	*			trans	-157	129.8	138.3	-93.7	-37.3	0	0	0	110
1003	N	28.8	Very low	28	Very low	163 Å²	163	154.4 Å²	154.4	87%	0.872	80%	0.803	S	S	*	*	S	Bend	trans	51.4	113.9	166.7	-57.9	-8.8	0	0	0	119.2
1004	G	25.9	Very low	28	Very low	69 Å²	69	155.5 Å²	155.5	71%	0.711	80%	0.801	S	S	*	*			trans	128.5	103.3	155.9	0	0	0	0	0	116
1005	T	25.8	Very low	27.8	Very low	126 Å²	126	156.1 Å²	156.1	77%	0.773	80%	0.796	S	S	*	*			trans	65.9	142.1	142.2	-30.4	0	0	0	0	119.7
1006	F	26	Very low	27.7	Very low	197 Å²	197	154.8 Å²	154.8	86%	0.864	80%	0.795	S	S	*	*			trans	45.4	122.2	178.1	-67.5	-66.3	0	0	0	119.8
1007	K	27.5	Very low	27.6	Very low	188 Å²	188	152.4 Å²	152.4	82%	0.817	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-84.5	133.7	154.9	-66.8	179.3	-178.9	176.3	0	108.3
1008	P	25.2	Very low	27.5	Very low	121 Å²	121	147.5 Å²	147.5	79%	0.786	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-64.9	138.6	157.8	29.9	-32.6	0	0	0	108.7
1009	I	29.1	Very low	27.5	Very low	161 Å²	161	145.6 Å²	145.6	83%	0.826	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-80.4	127.8	164.9	-64.8	176.2	0	0	0	106.4	M1011	I1009-M1011 PolarHBondContact O-N 2.93Å
1010	E	24.4	Very low	27.2	Very low	182 Å²	182	147.8 Å²	147.8	85%	0.85	76%	0.764	S	S	*	*			trans	-66.6	99.2	174	-70.1	-178.6	142	0	0	109.1	K1012	E1010-K1012 VanDerWaalsContact C-N 3.28Å; E1010-K1012 PolarHBondContact O-N 2.82Å
1011	M	26.1	Very low	27	Very low	164 Å²	164	145.3 Å²	145.3	81%	0.808	75%	0.746	S	S	*	*			trans	-73.5	85.4	178.4	-163.3	147.8	76.7	0	0	109.2	I1009 R1013	I1009-M1011 PolarHBondContact O-N 2.93Å; M1011-R1013 PolarHBondContact O-N 3.4Å
1012	K	28.3	Very low	26.9	Very low	185 Å²	185	136.9 Å²	136.9	80%	0.804	72%	0.721	S	S	*	*			trans	-50.2	134.1	165.4	-73.5	-175.9	174.6	-177.3	0	108.3	E1010 S1014	E1010-K1012 VanDerWaalsContact C-N 3.28Å; E1010-K1012 PolarHBondContact O-N 2.82Å; K1012-S1014 PolarHBondContact O-N 3.06Å
1013	R	25.5	Very low	26.9	Very low	230 Å²	230	134.7 Å²	134.7	87%	0.868	71%	0.707	S	S	*	*			trans	-55.1	115	168.6	-79.8	-177.6	169.3	141.6	-5.9	108.6	M1011	M1011-R1013 PolarHBondContact O-N 3.4Å
1014	S	28.9	Very low	26.9	Very low	90 Å²	90	133.2 Å²	133.2	63%	0.629	70%	0.696	S	S	*	*			trans	-111.3	84.8	171.1	57.8	0	0	0	0	107.2	K1012 M1016	K1012-S1014 PolarHBondContact O-N 3.06Å; S1014-M1016 PolarHBondContact O-N 3Å
1015	D	28.8	Very low	27	Very low	149 Å²	149	133.1 Å²	133.1	80%	0.797	68%	0.684	S	S	*	*			trans	-74.8	60.2	176	-55.9	-55.7	0	0	0	109.5
1016	M	28.2	Very low	27.3	Very low	167 Å²	167	130.7 Å²	130.7	82%	0.823	67%	0.665	S	S	*	*			trans	-113.2	124.5	-172.9	-74.9	-178.6	156.7	0	0	110.5	S1014	S1014-M1016 PolarHBondContact O-N 3Å
1017	A	25.9	Very low	27.5	Very low	67 Å²	67	126.2 Å²	126.2	55%	0.554	65%	0.647	S	S	*	*			trans	-71.3	178.5	174.6	0	0	0	0	0	111.3
1018	F	26.2	Very low	27.6	Very low	115 Å²	115	122.7 Å²	122.7	50%	0.504	64%	0.644	S	S	.	*			trans	-80.7	125	172.2	-62.5	-96.4	0	0	0	109.9	V149 K151 V1020	V149-F1018 HydrophobicContact CB-CE1 4.13Å; V149-F1018 HydrophobicContact CB-CE2 4.47Å; V149-F1018 HydrophobicContact CB-CZ 3.92Å; V149-F1018 HydrophobicContact CG1-CE1 3.74Å; V149-F1018 HydrophobicContact CG1-CZ 3.91Å; K151-F1018 VanDerWaalsContact CE-CE1 3.42Å; F1018-V1020 PolarHBondContact O-N 2.72Å
1019	D	26.5	Very low	27.9	Very low	123 Å²	123	124.1 Å²	124.1	66%	0.658	64%	0.644	S	S	*	*			trans	-83.1	102.2	178.1	-77.1	-9.7	0	0	0	110.1	L950	L950-D1019 HydrophobicContact CD1-CB 4.24Å; L950-D1019 HydrophobicContact CD2-CB 3.62Å
1020	V	26.3	Very low	27.8	Very low	92 Å²	92	119.6 Å²	119.6	56%	0.558	63%	0.627	S	S	*	*			trans	-93.9	122.7	168	177.9	0	0	0	0	107.7	L950 T951 F1018	L950-V1020 WeakPolarHBondContact CA-O 3.2Å; T951-V1020 PolarHBondContact N-O 2.75Å; F1018-V1020 PolarHBondContact O-N 2.72Å
1021	V	26.9	Very low	27.7	Very low	78 Å²	78	116.9 Å²	116.9	47%	0.473	63%	0.625	S	S	.	*	B	Isolated β-bridge	trans	-91.7	127.9	-176.2	173.2	0	0	0	0	110.3	L948 L950	L948-V1021 HydrophobicContact CB-CG1 3.75Å; L948-V1021 HydrophobicContact CD1-CG1 4.22Å; L948-V1021 HydrophobicContact CD2-CG1 3.83Å; L948-V1021 HydrophobicContact CG-CG1 4.12Å; L950-V1021 HydrophobicContact CD2-CG2 3.77Å
1022	T	26.2	Very low	27.6	Very low	56 Å²	56	112.5 Å²	112.5	34%	0.344	62%	0.616	S	S	.	*			trans	-149.2	131	-176.2	-14.7	0	0	0	0	109.2	C949 T951 E1024	C949-T1022 CarbonylContact C-O 3.56Å; C949-T1022 PolarHBondContact O-N 3.34Å; C949-T1022 VanDerWaalsContact O-O 3.12Å; T951-T1022 WeakPolarHBondContact OG1-CB 3.38Å; T951-T1022 PolarHBondContact OG1-OG1 3.25Å; T1022-E1024 PolarHBondContact O-N 3.49Å
1023	I	28.8	Very low	27.3	Very low	105 Å²	105	108.9 Å²	108.9	54%	0.538	61%	0.613	S	S	.	*			trans	-81.1	105.4	-170.7	-56.2	173.6	0	0	0	109.3	I1026	I1023-I1026 HydrophobicContact CG2-CD1 4.01Å; I1023-I1026 HydrophobicContact CG2-CG1 3.98Å
1024	E	28.3	Very low	27.3	Very low	133 Å²	133	103.2 Å²	103.2	62%	0.621	60%	0.595	S	S	*	*			trans	-84.7	-41.8	179.5	-72	-176.9	127.6	0	0	113.6	C949 T951 T1022	C949-E1024 HydrophobicContact CB-CB 4.34Å; C949-E1024 HydrophobicContact CB-CG 4.19Å; C949-E1024 WeakPolarHBondContact CB-OE2 3.45Å; T951-E1024 VanDerWaalsContact CG2-CD 3.48Å; T951-E1024 HydrophobicContact CG2-CG 3.3Å; T951-E1024 WeakPolarHBondContact CG2-OE1 3.45Å; T1022-E1024 PolarHBondContact O-N 3.49Å
1025	S	28.9	Very low	27	Very low	67 Å²	67	106.6 Å²	106.6	47%	0.469	60%	0.601	S	S	.	*			trans	-158	159.2	176.7	70.4	0	0	0	0	111.8
1026	I	31	Very low	26.8	Very low	74 Å²	74	101 Å²	101	38%	0.379	58%	0.579	S	S	.	*			trans	-131.3	120.3	175.6	-65.3	177	0	0	0	107	F920 I1023 P1028	F920-I1026 HydrophobicContact CB-CD1 3.89Å; F920-I1026 HydrophobicContact CD1-CD1 3.71Å; F920-I1026 HydrophobicContact CD2-CD1 3.31Å; F920-I1026 HydrophobicContact CE1-CD1 4.01Å; F920-I1026 HydrophobicContact CE2-CD1 3.64Å; F920-I1026 HydrophobicContact CG-CD1 3.33Å; F920-I1026 HydrophobicContact CZ-CD1 3.97Å; I1023-I1026 HydrophobicContact CG2-CD1 4.01Å; I1023-I1026 HydrophobicContact CG2-CG1 3.98Å; I1026-P1028 WeakPolarHBondContact O-CD 3.31Å
1027	E	30.5	Very low	26.6	Very low	103 Å²	103	98.4 Å²	98.4	48%	0.481	58%	0.577	S	S	.	*			trans	-84	111.9	170.7	-70.6	166	-159.4	0	0	107.9	R947 D1029 S1030	R947-E1027 IonicContact NH1-OE1 2.92Å; R947-E1027 PolarHBondContact NH1-OE1 3.27Å; E1027-D1029 PolarHBondContact O-N 3.43Å; E1027-S1030 VanDerWaalsContact OE2-CB 3.31Å; E1027-S1030 WeakPolarHBondContact OE2-CB 3.3Å; E1027-S1030 PolarHBondContact OE2-OG 2.88Å
1028	P	29.2	Very low	26.7	Very low	115 Å²	115	100.1 Å²	100.1	75%	0.747	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-23.3	-171.7	24.9	-33.6	0	0	0	114	I1026	I1026-P1028 WeakPolarHBondContact O-CD 3.31Å
1029	D	31.1	Very low	26.7	Very low	150 Å²	150	98.2 Å²	98.2	80%	0.802	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	9	-170.8	-58.4	-66.3	0	0	0	114.6	E1027 P1031	E1027-D1029 PolarHBondContact O-N 3.43Å; D1029-P1031 VanDerWaalsContact O-CD 3.3Å; D1029-P1031 WeakPolarHBondContact O-CD 3.39Å
1030	S	27	Very low	26.6	Very low	66 Å²	66	98.6 Å²	98.6	46%	0.462	59%	0.591	S	S	.	*			trans	-86.5	110.7	-166.4	-148.5	0	0	0	0	113.1	E1027 A1032	E1027-S1030 VanDerWaalsContact OE2-CB 3.31Å; E1027-S1030 WeakPolarHBondContact OE2-CB 3.3Å; E1027-S1030 PolarHBondContact OE2-OG 2.88Å; S1030-A1032 PolarHBondContact O-N 3.02Å
1031	P	23.4	Very low	26.7	Very low	125 Å²	125	95.2 Å²	95.2	81%	0.812	58%	0.575	S	S	*	*			trans	-86.9	68.2	-168.2	35.7	-35.8	0	0	0	113.1	D1029 S1033	D1029-P1031 VanDerWaalsContact O-CD 3.3Å; D1029-P1031 WeakPolarHBondContact O-CD 3.39Å; P1031-S1033 PolarHBondContact O-N 3.36Å
1032	A	24	Very low	26.9	Very low	73 Å²	73	95.4 Å²	95.4	60%	0.603	57%	0.57	S	S	*	*			trans	-84.2	91.5	180	0	0	0	0	0	112.8	S1030	S1030-A1032 PolarHBondContact O-N 3.02Å
1033	S	21.3	Very low	27.1	Very low	109 Å²	109	95.1 Å²	95.1	76%	0.762	57%	0.566	S	S	*	*			trans	-77.4	148.7	172.1	64.5	0	0	0	0	112.9	P1031	P1031-S1033 PolarHBondContact O-N 3.36Å
1034	F	25.2	Very low	27.3	Very low	110 Å²	110	92.2 Å²	92.2	48%	0.482	55%	0.552	S	S	.	*			trans	-168.2	174.8	-171	-107.6	-33.9	0	0	0	111.2	D942 Q943	D942-F1034 HydrophobicContact CB-CB 3.57Å; D942-F1034 HydrophobicContact CB-CD1 3.49Å; D942-F1034 VanDerWaalsContact CB-CD1 3.49Å; D942-F1034 HydrophobicContact CB-CD2 4Å; D942-F1034 HydrophobicContact CB-CE1 4.09Å; D942-F1034 HydrophobicContact CB-CG 3.44Å; D942-F1034 VanDerWaalsContact CB-CG 3.44Å; D942-F1034 VanDerWaalsContact CG-CD1 3.46Å; D942-F1034 WeakPolarHBondContact O-CB 3.25Å; D942-F1034 WeakPolarHBondContact O-CD2 3.46Å; D942-F1034 WeakPolarHBondContact O-CG 3.43Å; D942-F1034 WeakPolarHBondContact OD2-CD1 3.26Å; D942-F1034 VanDerWaalsContact OD2-CE1 3.3Å; D942-F1034 WeakPolarHBondContact OD2-CE1 3.28Å; Q943-F1034 WeakPolarHBondContact CB-O 3.43Å; Q943-F1034 VanDerWaalsContact CD-O 3.23Å; Q943-F1034 WeakPolarHBondContact CG-O 3.49Å; Q943-F1034 PolarHBondContact NE2-O 2.88Å
1035	E	23.4	Very low	27.6	Very low	161 Å²	161	86.2 Å²	86.2	75%	0.752	52%	0.524	S	S	*	.			trans	-157	140.3	-168.9	-168.8	173.3	-161.2	0	0	114.8
1036	G	25.6	Very low	28	Very low	32 Å²	32	84.4 Å²	84.4	33%	0.33	51%	0.508	S	S	.	.			trans	165.8	151.1	170.2	0	0	0	0	0	116.3	S941	S941-G1036 WeakPolarHBondContact CB-O 3.4Å; S941-G1036 VanDerWaalsContact OG-CA 3.27Å; S941-G1036 WeakPolarHBondContact OG-CA 3.41Å; S941-G1036 PolarHBondContact OG-N 3.23Å; S941-G1036 PolarHBondContact OG-O 3.42Å
1037	S	23.5	Very low	28.1	Very low	113 Å²	113	81.4 Å²	81.4	79%	0.79	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-92.8	123.2	-171.4	60.5	0	0	0	0	114.8
1038	L	27.1	Very low	28.3	Very low	102 Å²	102	81 Å²	81	53%	0.534	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-62.2	138.2	162.8	-74.2	167.3	0	0	0	111.1	I1043	L1038-I1043 HydrophobicContact CD1-CD1 4.17Å
1039	A	26.1	Very low	28.6	Very low	76 Å²	76	78.5 Å²	78.5	63%	0.628	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-65.7	152.7	165	0	0	0	0	0	110.3	G1041	A1039-G1041 PolarHBondContact O-N 2.98Å
1040	P	25.1	Very low	28.8	Very low	131 Å²	131	78.3 Å²	78.3	85%	0.851	48%	0.481	S	S	*	.	S	Bend	trans	-74.1	69.8	-178.3	31.1	-36.4	0	0	0	112.7
1041	G	27.6	Very low	29.8	Very low	21 Å²	21	78.2 Å²	78.2	22%	0.216	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-102.1	163.9	161.6	0	0	0	0	0	110.7	A1039 I1068 A1096	A1039-G1041 PolarHBondContact O-N 2.98Å; G1041-I1068 VanDerWaalsContact O-CD1 3.29Å; G1041-I1068 WeakPolarHBondContact O-CD1 3.35Å; G1041-A1096 VanDerWaalsContact CA-O 3.23Å; G1041-A1096 WeakPolarHBondContact CA-O 3.4Å
1042	H	30.9	Very low	30.7	Very low	81 Å²	81	74 Å²	74	38%	0.375	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	124.9	176.4	-70.5	74.8	0	0	0	109.7	I1044 A1096 Y1098	H1042-I1044 HydrophobicContact CB-CG1 4.22Å; H1042-A1096 HydrophobicContact CB-CB 4.46Å; H1042-A1096 PolarHBondContact N-O 2.89Å; H1042-A1096 VanDerWaalsContact N-O 3.1Å; H1042-A1096 PolarHBondContact O-N 2.86Å; H1042-Y1098 AromaticContact ND1-CD2 3.98Å; H1042-Y1098 AromaticContact ND1-CE2 3.81Å
1043	I	31	Very low	31.8	Very low	50 Å²	50	73 Å²	73	26%	0.256	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	116.7	158.8	-60.9	171.2	0	0	0	106	L1038 L1045 I1068 I1093	L1038-I1043 HydrophobicContact CD1-CD1 4.17Å; I1043-L1045 HydrophobicContact CG2-CG 4.45Å; I1043-I1068 HydrophobicContact CD1-CD1 4.31Å; I1043-I1068 HydrophobicContact CD1-CG1 4.35Å; I1043-I1068 HydrophobicContact CG1-CD1 4.26Å; I1043-I1093 HydrophobicContact CG2-CG2 4.16Å
1044	I	33.8	Very low	33	Very low	45 Å²	45	73.6 Å²	73.6	23%	0.231	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	115.5	172	-48.4	177.2	0	0	0	106.5	H1042 E1046 D1051 T1094 A1096	H1042-I1044 HydrophobicContact CB-CG1 4.22Å; I1044-E1046 HydrophobicContact CG2-CG 3.8Å; I1044-D1051 WeakPolarHBondContact CG2-OD1 3.35Å; I1044-T1094 PolarHBondContact N-O 3.47Å; I1044-T1094 PolarHBondContact O-N 3.42Å; I1044-A1096 HydrophobicContact CD1-CB 4.41Å
1045	L	35.2	Very low	33.9	Very low	6 Å²	6	71.7 Å²	71.7	3%	0.031	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	99.4	165.5	-75.1	163	0	0	0	107.4	I1043 L1052 Q1075 L1076 I1091 R1092 I1093	I1043-L1045 HydrophobicContact CG2-CG 4.45Å; L1045-L1052 HydrophobicContact CB-CD1 3.93Å; L1045-L1052 PolarHBondContact O-N 3.29Å; L1045-Q1075 HydrophobicContact CB-CB 4.14Å; L1045-Q1075 HydrophobicContact CD1-CB 3.48Å; L1045-Q1075 VanDerWaalsContact CD1-CB 3.48Å; L1045-Q1075 HydrophobicContact CD1-CG 4.45Å; L1045-Q1075 HydrophobicContact CG-CB 4.38Å; L1045-L1076 HydrophobicContact CD1-CD2 4.28Å; L1045-L1076 HydrophobicContact CD1-CG 4.2Å; L1045-I1091 HydrophobicContact CD2-CG2 3.57Å; L1045-R1092 WeakPolarHBondContact CA-O 3.39Å; L1045-I1093 HydrophobicContact CD2-CB 4.22Å; L1045-I1093 HydrophobicContact CD2-CD1 4.22Å; L1045-I1093 HydrophobicContact CD2-CG1 3.69Å; L1045-I1093 HydrophobicContact CD2-CG2 4.15Å
1046	E	36.2	Very low	34.9	Very low	29 Å²	29	71.7 Å²	71.7	14%	0.136	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	139.1	172	-56	161.7	-138.4	0	0	108.6	I1044 K1050 I1091 R1092 T1094	I1044-E1046 HydrophobicContact CG2-CG 3.8Å; E1046-K1050 CarbonylContact C-O 3.6Å; E1046-K1050 WeakPolarHBondContact CA-O 3.5Å; E1046-I1091 WeakPolarHBondContact O-CA 3.33Å; E1046-R1092 HydrophobicContact CB-CB 4.23Å; E1046-R1092 PolarHBondContact N-O 3.15Å; E1046-R1092 PolarHBondContact O-N 3.47Å; E1046-R1092 IonicContact OE1-CZ 2.68Å; E1046-R1092 IonicContact OE1-NH1 3.43Å; E1046-R1092 PolarHBondContact OE1-NH1 2.93Å; E1046-R1092 WeakPolarHBondContact OE2-CD 3.34Å; E1046-R1092 IonicContact OE2-CZ 2.94Å; E1046-R1092 IonicContact OE2-NE 2.75Å; E1046-R1092 IonicContact OE2-NH1 3.85Å; E1046-R1092 PolarHBondContact OE2-NH1 3.19Å; E1046-T1094 WeakPolarHBondContact OE1-CB 3.46Å; E1046-T1094 PolarHBondContact OE1-OG1 3.4Å
1047	V	33.3	Very low	35.8	Very low	11 Å²	11	74.3 Å²	74.3	7%	0.067	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	118.8	-177.8	167.9	0	0	0	0	107.8	G1049 K1050 L1052 P1089 I1091	V1047-G1049 PolarHBondContact O-N 3.04Å; V1047-K1050 PolarHBondContact N-O 3.44Å; V1047-K1050 WeakPolarHBondContact O-CB 3.25Å; V1047-K1050 PolarHBondContact O-N 2.83Å; V1047-L1052 HydrophobicContact CB-CD1 4.44Å; V1047-L1052 HydrophobicContact CB-CD2 3.69Å; V1047-L1052 HydrophobicContact CB-CG 3.85Å; V1047-L1052 HydrophobicContact CG1-CD2 4.01Å; V1047-L1052 HydrophobicContact CG2-CD1 3.56Å; V1047-L1052 HydrophobicContact CG2-CD2 3.68Å; V1047-L1052 HydrophobicContact CG2-CG 3.49Å; V1047-L1052 VanDerWaalsContact CG2-CG 3.49Å; V1047-P1089 HydrophobicContact CG1-CB 3.41Å; V1047-P1089 VanDerWaalsContact CG1-CB 3.41Å; V1047-P1089 HydrophobicContact CG1-CG 3.51Å; V1047-I1091 HydrophobicContact CG2-CB 4.33Å; V1047-I1091 HydrophobicContact CG2-CG1 3.9Å; V1047-I1091 HydrophobicContact CG2-CG2 4.39Å
1048	D	35.3	Very low	37	Very low	95 Å²	95	71.5 Å²	71.5	51%	0.508	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	33.8	-161.1	-75.4	-57.2	0	0	0	113.1	K1050 P1089 P1090	D1048-K1050 PolarHBondContact O-N 2.94Å; D1048-P1089 VanDerWaalsContact OD2-CB 3.24Å; D1048-P1089 WeakPolarHBondContact OD2-CB 3.37Å; D1048-P1090 VanDerWaalsContact OD1-CD 3.25Å; D1048-P1090 WeakPolarHBondContact OD1-CD 3.45Å
1049	G	33.8	Very low	38.1	Very low	63 Å²	63	72.6 Å²	72.6	65%	0.649	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	11.1	-175	0	0	0	0	0	115	V1047	V1047-G1049 PolarHBondContact O-N 3.04Å
1050	K	37.1	Very low	39.3	Very low	145 Å²	145	71.5 Å²	71.5	63%	0.63	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	135.7	175.7	-55.1	162	-171.1	158.2	0	110	E1046 V1047 D1048 L1052	E1046-K1050 CarbonylContact C-O 3.6Å; E1046-K1050 WeakPolarHBondContact CA-O 3.5Å; V1047-K1050 PolarHBondContact N-O 3.44Å; V1047-K1050 WeakPolarHBondContact O-CB 3.25Å; V1047-K1050 PolarHBondContact O-N 2.83Å; D1048-K1050 PolarHBondContact O-N 2.94Å; K1050-L1052 PolarHBondContact O-N 2.81Å
1051	D	46.8	Very low	40.5	Very low	65 Å²	65	69.3 Å²	69.3	35%	0.348	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	120	168.9	-74.2	-5.6	0	0	0	110.2	I1044 L1053 H1054	I1044-D1051 WeakPolarHBondContact CG2-OD1 3.35Å; D1051-L1053 PolarHBondContact O-N 2.81Å; D1051-H1054 IonicContact OD2-CE1 3.83Å; D1051-H1054 IonicContact OD2-CG 2.81Å; D1051-H1054 IonicContact OD2-ND1 3.6Å; D1051-H1054 PolarHBondContact OD2-ND1 2.8Å
1052	L	42.2	Very low	41.5	Very low	37 Å²	37	78.5 Å²	78.5	19%	0.194	42%	0.42	C	S	.	.	S	Bend	trans	-60.8	-33.7	174.1	-78.8	178	0	0	0	113.2	L1045 V1047 K1050 Q1075 A1078 A1079	L1045-L1052 HydrophobicContact CB-CD1 3.93Å; L1045-L1052 PolarHBondContact O-N 3.29Å; V1047-L1052 HydrophobicContact CB-CD1 4.44Å; V1047-L1052 HydrophobicContact CB-CD2 3.69Å; V1047-L1052 HydrophobicContact CB-CG 3.85Å; V1047-L1052 HydrophobicContact CG1-CD2 4.01Å; V1047-L1052 HydrophobicContact CG2-CD1 3.56Å; V1047-L1052 HydrophobicContact CG2-CD2 3.68Å; V1047-L1052 HydrophobicContact CG2-CG 3.49Å; V1047-L1052 VanDerWaalsContact CG2-CG 3.49Å; K1050-L1052 PolarHBondContact O-N 2.81Å; L1052-Q1075 HydrophobicContact CB-CB 4.23Å; L1052-Q1075 HydrophobicContact CB-CG 4.01Å; L1052-Q1075 HydrophobicContact CD1-CB 4.11Å; L1052-Q1075 WeakPolarHBondContact CD1-O 3.28Å; L1052-A1078 HydrophobicContact CD2-CB 4.49Å; L1052-A1079 HydrophobicContact CD1-CB 3.89Å
1053	L	46.9	Very low	42.4	Very low	51 Å²	51	76.4 Å²	76.4	27%	0.267	42%	0.421	S	S	.	.	S	Bend	trans	-145.5	116.8	172.4	-65.9	175.1	0	0	0	108.2	D1051 L1058 N1074 Q1075	D1051-L1053 PolarHBondContact O-N 2.81Å; L1053-L1058 HydrophobicContact CB-CD1 4.11Å; L1053-L1058 HydrophobicContact CD1-CD1 3.71Å; L1053-L1058 HydrophobicContact CG-CD1 4.38Å; L1053-N1074 HydrophobicContact CD1-CB 3.74Å; L1053-Q1075 HydrophobicContact CB-CG 3.87Å; L1053-Q1075 HydrophobicContact CD1-CG 3.73Å; L1053-Q1075 HydrophobicContact CG-CG 3.82Å; L1053-Q1075 PolarHBondContact O-NE2 2.73Å
1054	H	47.4	Very low	43.5	Very low	121 Å²	121	78.5 Å²	78.5	56%	0.56	43%	0.433	S	S	*	.			trans	-57.7	131.4	168.1	-87.2	-26.3	0	0	0	110	D1051 K1056	D1051-H1054 IonicContact OD2-CE1 3.83Å; D1051-H1054 IonicContact OD2-CG 2.81Å; D1051-H1054 IonicContact OD2-ND1 3.6Å; D1051-H1054 PolarHBondContact OD2-ND1 2.8Å; H1054-K1056 PolarHBondContact O-N 2.85Å
1055	P	43.1	Very low	44.4	Very low	71 Å²	71	85 Å²	85	46%	0.461	46%	0.459	S	S	.	.			trans	-72.5	19.1	-177	29.1	-35.8	0	0	0	114.8	C1057	P1055-C1057 VanDerWaalsContact C-N 3.28Å; P1055-C1057 PolarHBondContact O-N 2.87Å
1056	K	44.4	Very low	45.3	Very low	160 Å²	160	86.6 Å²	86.6	70%	0.696	47%	0.468	S	S	*	.	S	Bend	trans	-74.4	76	179.4	-73.3	-178.1	178	172.3	0	111.5	H1054	H1054-K1056 PolarHBondContact O-N 2.85Å
1057	C	44.2	Very low	45.8	Very low	88 Å²	88	89.5 Å²	89.5	60%	0.595	48%	0.484	S	S	*	.			trans	55.8	53.8	167.4	-62.7	0	0	0	0	115.5	P1055 K1059	P1055-C1057 VanDerWaalsContact C-N 3.28Å; P1055-C1057 PolarHBondContact O-N 2.87Å; C1057-K1059 PolarHBondContact O-N 3.02Å
1058	L	48.8	Very low	46.3	Very low	53 Å²	53	91.6 Å²	91.6	28%	0.277	49%	0.494	S	S	.	.			trans	-54.1	110.4	155.8	-85.3	166.1	0	0	0	109.4	L1053 L1066 I1071	L1053-L1058 HydrophobicContact CB-CD1 4.11Å; L1053-L1058 HydrophobicContact CD1-CD1 3.71Å; L1053-L1058 HydrophobicContact CG-CD1 4.38Å; L1058-L1066 HydrophobicContact CB-CD1 4Å; L1058-L1066 PolarHBondContact O-N 3.01Å; L1058-L1066 VanDerWaalsContact O-N 3.14Å; L1058-I1071 HydrophobicContact CD1-CG1 4.44Å; L1058-I1071 HydrophobicContact CD1-CG2 4.44Å
1059	K	50.7	Low	46.8	Very low	126 Å²	126	91 Å²	91	55%	0.548	49%	0.491	S	S	.	.	B	Isolated β-bridge	trans	-107.2	153.5	176.9	-73.4	172.1	169.9	-172	0	110	C1057 G1063 N1064 L1066	C1057-K1059 PolarHBondContact O-N 3.02Å; K1059-G1063 WeakPolarHBondContact CD-O 3.36Å; K1059-G1063 WeakPolarHBondContact CE-O 3.3Å; K1059-G1063 WeakPolarHBondContact CG-O 3.27Å; K1059-N1064 CarbonylContact C-O 3.48Å; K1059-N1064 WeakPolarHBondContact CA-O 3.34Å; K1059-N1064 WeakPolarHBondContact CB-O 3.27Å; K1059-L1066 WeakPolarHBondContact O-CD1 3.47Å
1060	D	51.6	Low	47.5	Very low	52 Å²	52	90 Å²	90	28%	0.278	47%	0.472	S	S	.	.			trans	-71.3	174.4	165.1	71.6	3.7	0	0	0	111	Y1062 G1063 N1064 L1066	D1060-Y1062 PolarHBondContact O-N 3.36Å; D1060-Y1062 VanDerWaalsContact OD1-C 3.25Å; D1060-Y1062 WeakPolarHBondContact OD1-CA 3.41Å; D1060-Y1062 WeakPolarHBondContact OD1-CB 3.32Å; D1060-Y1062 PolarHBondContact OD1-N 2.88Å; D1060-G1063 PolarHBondContact O-N 3.37Å; D1060-G1063 PolarHBondContact OD1-N 3.18Å; D1060-N1064 PolarHBondContact N-O 2.82Å; D1060-N1064 WeakPolarHBondContact OD1-CB 3.46Å; D1060-N1064 PolarHBondContact OD1-N 2.93Å; D1060-N1064 PolarHBondContact OD1-ND2 3.12Å; D1060-N1064 WeakPolarHBondContact OD2-CB 3.32Å; D1060-N1064 PolarHBondContact OD2-ND2 2.84Å; D1060-L1066 HydrophobicContact CB-CD2 4.14Å; D1060-L1066 HydrophobicContact CB-CG 4.41Å
1061	G	51.1	Low	48.2	Very low	85 Å²	85	84.9 Å²	84.9	88%	0.876	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-4.1	176.1	0	0	0	0	0	115.1
1062	Y	47.1	Very low	48.2	Very low	214 Å²	214	82.7 Å²	82.7	84%	0.839	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	0.1	177.1	-61.6	-79.3	0	0	0	112.7	D1060	D1060-Y1062 PolarHBondContact O-N 3.36Å; D1060-Y1062 VanDerWaalsContact OD1-C 3.25Å; D1060-Y1062 WeakPolarHBondContact OD1-CA 3.41Å; D1060-Y1062 WeakPolarHBondContact OD1-CB 3.32Å; D1060-Y1062 PolarHBondContact OD1-N 2.88Å
1063	G	51.4	Low	48.5	Very low	38 Å²	38	86.3 Å²	86.3	39%	0.392	46%	0.458	S	S	.	.	S	Bend	trans	88.9	1.7	177.1	0	0	0	0	0	115.6	K1059 D1060	K1059-G1063 WeakPolarHBondContact CD-O 3.36Å; K1059-G1063 WeakPolarHBondContact CE-O 3.3Å; K1059-G1063 WeakPolarHBondContact CG-O 3.27Å; D1060-G1063 PolarHBondContact O-N 3.37Å; D1060-G1063 PolarHBondContact OD1-N 3.18Å
1064	N	52.9	Low	48.8	Very low	94 Å²	94	85.8 Å²	85.8	50%	0.503	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-73.9	150.3	177.1	-52.3	-61.7	0	0	0	110.5	K1059 D1060 L1066	K1059-N1064 CarbonylContact C-O 3.48Å; K1059-N1064 WeakPolarHBondContact CA-O 3.34Å; K1059-N1064 WeakPolarHBondContact CB-O 3.27Å; D1060-N1064 PolarHBondContact N-O 2.82Å; D1060-N1064 WeakPolarHBondContact OD1-CB 3.46Å; D1060-N1064 PolarHBondContact OD1-N 2.93Å; D1060-N1064 PolarHBondContact OD1-ND2 3.12Å; D1060-N1064 WeakPolarHBondContact OD2-CB 3.32Å; D1060-N1064 PolarHBondContact OD2-ND2 2.84Å; N1064-L1066 PolarHBondContact O-N 3.36Å
1065	K	52.5	Low	49.1	Very low	180 Å²	180	80.3 Å²	80.3	78%	0.783	43%	0.43	S	S	*	.	B	Isolated β-bridge	trans	-62.7	128	169.9	-71.2	-177.2	176.6	-178.2	0	109.6
1066	L	53.4	Low	49.6	Very low	41 Å²	41	79 Å²	79	22%	0.215	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-64.2	144.2	172.1	-80.5	160.7	0	0	0	110.9	L1058 K1059 D1060 N1064 T1070 I1071	L1058-L1066 HydrophobicContact CB-CD1 4Å; L1058-L1066 PolarHBondContact O-N 3.01Å; L1058-L1066 VanDerWaalsContact O-N 3.14Å; K1059-L1066 WeakPolarHBondContact O-CD1 3.47Å; D1060-L1066 HydrophobicContact CB-CD2 4.14Å; D1060-L1066 HydrophobicContact CB-CG 4.41Å; N1064-L1066 PolarHBondContact O-N 3.36Å; L1066-T1070 HydrophobicContact CD2-CG2 3.79Å; L1066-I1071 HydrophobicContact CB-CG1 4.18Å
1067	N	48.2	Very low	50.1	Low	90 Å²	90	77.8 Å²	77.8	48%	0.481	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-63.3	146.5	175.5	-175.1	-4.5	0	0	0	109.7	L1069 T1070 I1071	N1067-L1069 PolarHBondContact O-N 2.88Å; N1067-L1069 PolarHBondContact OD1-N 3.27Å; N1067-T1070 WeakPolarHBondContact O-CA 3.44Å; N1067-T1070 WeakPolarHBondContact O-CB 3.35Å; N1067-T1070 PolarHBondContact O-N 2.84Å; N1067-I1071 PolarHBondContact O-N 3.44Å
1068	I	44.3	Very low	50.7	Low	55 Å²	55	75 Å²	75	28%	0.282	39%	0.393	S	S	.	.	H	α-helix	trans	-56.8	-34.5	178.1	-166.6	169.8	0	0	0	111.9	G1041 I1043 T1070 I1071 A1072	G1041-I1068 VanDerWaalsContact O-CD1 3.29Å; G1041-I1068 WeakPolarHBondContact O-CD1 3.35Å; I1043-I1068 HydrophobicContact CD1-CD1 4.31Å; I1043-I1068 HydrophobicContact CD1-CG1 4.35Å; I1043-I1068 HydrophobicContact CG1-CD1 4.26Å; I1068-T1070 VanDerWaalsContact C-N 3.35Å; I1068-T1070 PolarHBondContact O-N 2.62Å; I1068-I1071 PolarHBondContact O-N 3.05Å; I1068-A1072 PolarHBondContact O-N 3.38Å
1069	L	44.4	Very low	50.7	Low	82 Å²	82	72.6 Å²	72.6	43%	0.429	38%	0.381	S	S	.	.	H	α-helix	trans	-61.2	-40.9	171.8	-66.6	173.3	0	0	0	112.2	N1067 A1072 Q1073	N1067-L1069 PolarHBondContact O-N 2.88Å; N1067-L1069 PolarHBondContact OD1-N 3.27Å; L1069-A1072 PolarHBondContact O-N 2.89Å; L1069-Q1073 WeakPolarHBondContact O-CB 3.44Å; L1069-Q1073 VanDerWaalsContact O-CG 3.24Å; L1069-Q1073 WeakPolarHBondContact O-CG 3.28Å; L1069-Q1073 PolarHBondContact O-N 2.97Å
1070	T	49.4	Very low	50.5	Low	43 Å²	43	71.4 Å²	71.4	26%	0.264	37%	0.373	S	S	.	.	H	α-helix	trans	-74.4	-29.7	178.6	-39.9	0	0	0	0	112.1	L1066 N1067 I1068 N1074	L1066-T1070 HydrophobicContact CD2-CG2 3.79Å; N1067-T1070 WeakPolarHBondContact O-CA 3.44Å; N1067-T1070 WeakPolarHBondContact O-CB 3.35Å; N1067-T1070 PolarHBondContact O-N 2.84Å; I1068-T1070 VanDerWaalsContact C-N 3.35Å; I1068-T1070 PolarHBondContact O-N 2.62Å; T1070-N1074 WeakPolarHBondContact O-CB 3.3Å; T1070-N1074 PolarHBondContact O-N 3.1Å; T1070-N1074 PolarHBondContact O-ND2 2.8Å; T1070-N1074 PolarHBondContact O-OD1 3.31Å
1071	I	50.6	Low	50.8	Low	37 Å²	37	74.5 Å²	74.5	19%	0.19	39%	0.386	C	S	.	.	H	α-helix	trans	-65.8	-47.2	170.5	-63.8	171.2	0	0	0	109.9	L1058 L1066 N1067 I1068 N1074 Q1075	L1058-I1071 HydrophobicContact CD1-CG1 4.44Å; L1058-I1071 HydrophobicContact CD1-CG2 4.44Å; L1066-I1071 HydrophobicContact CB-CG1 4.18Å; N1067-I1071 PolarHBondContact O-N 3.44Å; I1068-I1071 PolarHBondContact O-N 3.05Å; I1071-N1074 PolarHBondContact O-N 2.82Å; I1071-Q1075 PolarHBondContact O-N 3.05Å
1072	A	46.7	Very low	50.9	Low	19 Å²	19	71.2 Å²	71.2	16%	0.157	35%	0.351	C	S	.	.	H	α-helix	trans	-61.7	-43.2	175.7	0	0	0	0	0	112.3	I1068 L1069 N1074 Q1075 L1076	I1068-A1072 PolarHBondContact O-N 3.38Å; L1069-A1072 PolarHBondContact O-N 2.89Å; A1072-N1074 VanDerWaalsContact C-N 3.31Å; A1072-N1074 PolarHBondContact O-N 3.45Å; A1072-Q1075 PolarHBondContact O-N 3.4Å; A1072-L1076 WeakPolarHBondContact O-CB 3.39Å; A1072-L1076 WeakPolarHBondContact O-CG 3.33Å; A1072-L1076 PolarHBondContact O-N 3.08Å
1073	Q	48.2	Very low	50.9	Low	112 Å²	112	62.1 Å²	62.1	52%	0.523	32%	0.32	S	S	.	.	H	α-helix	trans	-59.8	-38.7	173.1	-75.5	169.2	-21.3	0	0	112.6	L1069 R1077	L1069-Q1073 WeakPolarHBondContact O-CB 3.44Å; L1069-Q1073 VanDerWaalsContact O-CG 3.24Å; L1069-Q1073 WeakPolarHBondContact O-CG 3.28Å; L1069-Q1073 PolarHBondContact O-N 2.97Å; Q1073-R1077 WeakPolarHBondContact O-CB 3.33Å; Q1073-R1077 PolarHBondContact O-N 3.47Å
1074	N	54.6	Low	50.9	Low	41 Å²	41	65.3 Å²	65.3	22%	0.219	33%	0.327	C	S	.	.	H	α-helix	trans	-71.6	-39	177.6	-71.7	-13.8	0	0	0	112.1	L1053 T1070 I1071 A1072 R1077 A1078	L1053-N1074 HydrophobicContact CD1-CB 3.74Å; T1070-N1074 WeakPolarHBondContact O-CB 3.3Å; T1070-N1074 PolarHBondContact O-N 3.1Å; T1070-N1074 PolarHBondContact O-ND2 2.8Å; T1070-N1074 PolarHBondContact O-OD1 3.31Å; I1071-N1074 PolarHBondContact O-N 2.82Å; A1072-N1074 VanDerWaalsContact C-N 3.31Å; A1072-N1074 PolarHBondContact O-N 3.45Å; N1074-R1077 PolarHBondContact O-N 3.25Å; N1074-R1077 PolarHBondContact OD1-NH1 3.46Å; N1074-A1078 PolarHBondContact O-N 2.91Å
1075	Q	53.5	Low	51.2	Low	5 Å²	5	67 Å²	67	2%	0.023	34%	0.336	C	S	.	.	H	α-helix	trans	-64	-46.3	172.7	-74.1	178.1	-25.6	0	0	111.2	L1045 L1052 L1053 I1071 A1072 R1077 A1078 A1079	L1045-Q1075 HydrophobicContact CB-CB 4.14Å; L1045-Q1075 HydrophobicContact CD1-CB 3.48Å; L1045-Q1075 VanDerWaalsContact CD1-CB 3.48Å; L1045-Q1075 HydrophobicContact CD1-CG 4.45Å; L1045-Q1075 HydrophobicContact CG-CB 4.38Å; L1052-Q1075 HydrophobicContact CB-CB 4.23Å; L1052-Q1075 HydrophobicContact CB-CG 4.01Å; L1052-Q1075 HydrophobicContact CD1-CB 4.11Å; L1052-Q1075 WeakPolarHBondContact CD1-O 3.28Å; L1053-Q1075 HydrophobicContact CB-CG 3.87Å; L1053-Q1075 HydrophobicContact CD1-CG 3.73Å; L1053-Q1075 HydrophobicContact CG-CG 3.82Å; L1053-Q1075 PolarHBondContact O-NE2 2.73Å; I1071-Q1075 PolarHBondContact O-N 3.05Å; A1072-Q1075 PolarHBondContact O-N 3.4Å; Q1075-R1077 VanDerWaalsContact C-N 3.29Å; Q1075-R1077 PolarHBondContact O-N 3.02Å; Q1075-A1078 WeakPolarHBondContact O-CB 3.26Å; Q1075-A1078 PolarHBondContact O-N 3.11Å; Q1075-A1078 VanDerWaalsContact O-N 3.09Å; Q1075-A1079 PolarHBondContact O-N 2.81Å
1076	L	53.6	Low	50.6	Low	45 Å²	45	61.3 Å²	61.3	24%	0.236	33%	0.329	C	S	.	.	H	α-helix	trans	-61.1	-35.6	175.2	-71.3	171.3	0	0	0	112.9	L919 L1045 A1072 A1079 R1080	L919-L1076 HydrophobicContact CD1-CD1 4.16Å; L919-L1076 HydrophobicContact CD1-CD2 3.61Å; L1045-L1076 HydrophobicContact CD1-CD2 4.28Å; L1045-L1076 HydrophobicContact CD1-CG 4.2Å; A1072-L1076 WeakPolarHBondContact O-CB 3.39Å; A1072-L1076 WeakPolarHBondContact O-CG 3.33Å; A1072-L1076 PolarHBondContact O-N 3.08Å; L1076-A1079 PolarHBondContact O-N 3.25Å; L1076-R1080 PolarHBondContact O-N 3.26Å
1077	R	54	Low	50.2	Low	134 Å²	134	65.4 Å²	65.4	51%	0.506	35%	0.346	S	S	.	.	H	α-helix	trans	-65.8	-39.8	172.9	-166.2	-177.4	-59.9	102.7	1.2	112.1	Q1073 N1074 Q1075 R1080 Q1081	Q1073-R1077 WeakPolarHBondContact O-CB 3.33Å; Q1073-R1077 PolarHBondContact O-N 3.47Å; N1074-R1077 PolarHBondContact O-N 3.25Å; N1074-R1077 PolarHBondContact OD1-NH1 3.46Å; Q1075-R1077 VanDerWaalsContact C-N 3.29Å; Q1075-R1077 PolarHBondContact O-N 3.02Å; R1077-R1080 PolarHBondContact O-N 2.94Å; R1077-Q1081 WeakPolarHBondContact O-CG 3.31Å; R1077-Q1081 PolarHBondContact O-N 3.39Å; R1077-Q1081 VanDerWaalsContact O-N 3.08Å
1078	A	56.8	Low	49.8	Very low	29 Å²	29	67 Å²	67	24%	0.24	35%	0.353	C	S	.	.	H	α-helix	trans	-65.7	-42.8	175.2	0	0	0	0	0	111.9	L1052 N1074 Q1075 R1080 Q1081 A1082	L1052-A1078 HydrophobicContact CD2-CB 4.49Å; N1074-A1078 PolarHBondContact O-N 2.91Å; Q1075-A1078 WeakPolarHBondContact O-CB 3.26Å; Q1075-A1078 PolarHBondContact O-N 3.11Å; Q1075-A1078 VanDerWaalsContact O-N 3.09Å; A1078-R1080 PolarHBondContact O-N 2.92Å; A1078-Q1081 PolarHBondContact O-N 3.32Å; A1078-Q1081 VanDerWaalsContact O-N 3.1Å; A1078-A1082 PolarHBondContact O-N 3.35Å
1079	A	49.7	Very low	49.3	Very low	2 Å²	2	64.6 Å²	64.6	2%	0.017	34%	0.342	C	S	.	.	H	α-helix	trans	-58.4	-46.1	174.4	0	0	0	0	0	112.1	L1052 Q1075 L1076 Q1081 A1082 A1083 I1091	L1052-A1079 HydrophobicContact CD1-CB 3.89Å; Q1075-A1079 PolarHBondContact O-N 2.81Å; L1076-A1079 PolarHBondContact O-N 3.25Å; A1079-Q1081 VanDerWaalsContact C-N 3.28Å; A1079-Q1081 PolarHBondContact O-N 2.84Å; A1079-A1082 PolarHBondContact O-N 3.49Å; A1079-A1083 PolarHBondContact O-N 3.49Å; A1079-I1091 HydrophobicContact CB-CD1 3.79Å; A1079-I1091 HydrophobicContact CB-CG1 4.5Å
1080	R	46.8	Very low	48.8	Very low	102 Å²	102	64.7 Å²	64.7	39%	0.385	35%	0.347	S	S	.	.	H	α-helix	trans	-60	-36.3	174.3	-176.3	178.7	-179.3	-102.2	10.1	112.2	L1076 R1077 A1078 L1084	L1076-R1080 PolarHBondContact O-N 3.26Å; R1077-R1080 PolarHBondContact O-N 2.94Å; A1078-R1080 PolarHBondContact O-N 2.92Å; R1080-L1084 HydrophobicContact CG-CD1 3.97Å; R1080-L1084 HydrophobicContact CG-CG 4.44Å; R1080-L1084 WeakPolarHBondContact O-CB 3.43Å; R1080-L1084 WeakPolarHBondContact O-CD1 3.29Å; R1080-L1084 WeakPolarHBondContact O-CG 3.45Å; R1080-L1084 PolarHBondContact O-N 3.43Å
1081	Q	56.5	Low	48.2	Very low	117 Å²	117	63.6 Å²	63.6	55%	0.547	34%	0.339	S	S	.	.	H	α-helix	trans	-71.7	-37.4	177.4	-75.2	-179.6	-46.2	0	0	112.8	R1077 A1078 A1079 N1085	R1077-Q1081 WeakPolarHBondContact O-CG 3.31Å; R1077-Q1081 PolarHBondContact O-N 3.39Å; R1077-Q1081 VanDerWaalsContact O-N 3.08Å; A1078-Q1081 PolarHBondContact O-N 3.32Å; A1078-Q1081 VanDerWaalsContact O-N 3.1Å; A1079-Q1081 VanDerWaalsContact C-N 3.28Å; A1079-Q1081 PolarHBondContact O-N 2.84Å; Q1081-N1085 PolarHBondContact O-N 2.98Å; Q1081-N1085 PolarHBondContact O-ND2 3.3Å; Q1081-N1085 PolarHBondContact O-OD1 3.2Å
1082	A	54.3	Low	47.3	Very low	16 Å²	16	69 Å²	69	13%	0.132	36%	0.358	C	S	.	.	H	α-helix	trans	-62.6	-48.8	172.1	0	0	0	0	0	111.5	A1078 A1079 L1084 N1085 G1086 E1087 P1089	A1078-A1082 PolarHBondContact O-N 3.35Å; A1079-A1082 PolarHBondContact O-N 3.49Å; A1082-L1084 PolarHBondContact O-N 3.04Å; A1082-N1085 WeakPolarHBondContact O-CA 3.26Å; A1082-N1085 WeakPolarHBondContact O-CB 3.43Å; A1082-N1085 PolarHBondContact O-N 2.96Å; A1082-G1086 PolarHBondContact O-N 2.87Å; A1082-E1087 CarbonylContact C-O 3.55Å; A1082-E1087 HydrophobicContact CB-CB 4.38Å; A1082-E1087 PolarHBondContact O-N 3.4Å; A1082-P1089 HydrophobicContact CB-CG 4.35Å
1083	A	47.3	Very low	46.7	Very low	23 Å²	23	70.3 Å²	70.3	19%	0.19	36%	0.361	C	S	.	.	H	α-helix	trans	-60.9	-41	178.8	0	0	0	0	0	112.9	C926 A1079 N1085 G1086 E1087	C926-A1083 WeakPolarHBondContact SG-CB 3.45Å; A1079-A1083 PolarHBondContact O-N 3.49Å; A1083-N1085 PolarHBondContact O-N 3.09Å; A1083-G1086 PolarHBondContact O-N 3.23Å; A1083-E1087 WeakPolarHBondContact CA-O 3.32Å; A1083-E1087 PolarHBondContact N-O 3.22Å
1084	L	50.8	Low	45.9	Very low	104 Å²	104	66.8 Å²	66.8	55%	0.545	35%	0.348	S	S	.	.	H	α-helix	trans	-65.4	-20.8	174.4	-75.1	170	0	0	0	113.7	R1080 A1082 G1086	R1080-L1084 HydrophobicContact CG-CD1 3.97Å; R1080-L1084 HydrophobicContact CG-CG 4.44Å; R1080-L1084 WeakPolarHBondContact O-CB 3.43Å; R1080-L1084 WeakPolarHBondContact O-CD1 3.29Å; R1080-L1084 WeakPolarHBondContact O-CG 3.45Å; R1080-L1084 PolarHBondContact O-N 3.43Å; A1082-L1084 PolarHBondContact O-N 3.04Å; L1084-G1086 VanDerWaalsContact C-N 3.33Å
1085	N	59.4	Low	44.7	Very low	131 Å²	131	67 Å²	67	70%	0.701	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	0.6	174	-65	-18.1	0	0	0	113	Q1081 A1082 A1083 E1087	Q1081-N1085 PolarHBondContact O-N 2.98Å; Q1081-N1085 PolarHBondContact O-ND2 3.3Å; Q1081-N1085 PolarHBondContact O-OD1 3.2Å; A1082-N1085 WeakPolarHBondContact O-CA 3.26Å; A1082-N1085 WeakPolarHBondContact O-CB 3.43Å; A1082-N1085 PolarHBondContact O-N 2.96Å; A1083-N1085 PolarHBondContact O-N 3.09Å; N1085-E1087 VanDerWaalsContact C-N 3.34Å
1086	G	40.1	Very low	43.4	Very low	60 Å²	60	68.3 Å²	68.3	62%	0.619	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	2.7	-177.2	0	0	0	0	0	114.8	A1082 A1083 L1084 I1088	A1082-G1086 PolarHBondContact O-N 2.87Å; A1083-G1086 PolarHBondContact O-N 3.23Å; L1084-G1086 VanDerWaalsContact C-N 3.33Å; G1086-I1088 PolarHBondContact O-N 3.16Å
1087	E	44.2	Very low	42.1	Very low	126 Å²	126	73.4 Å²	73.4	59%	0.589	39%	0.389	S	S	*	.			trans	-78.9	97.1	166.4	-61.1	-177	142	0	0	107.5	A1082 A1083 N1085 P1089	A1082-E1087 CarbonylContact C-O 3.55Å; A1082-E1087 HydrophobicContact CB-CB 4.38Å; A1082-E1087 PolarHBondContact O-N 3.4Å; A1083-E1087 WeakPolarHBondContact CA-O 3.32Å; A1083-E1087 PolarHBondContact N-O 3.22Å; N1085-E1087 VanDerWaalsContact C-N 3.34Å; E1087-P1089 WeakPolarHBondContact O-CD 3.15Å; E1087-P1089 VanDerWaalsContact O-CG 3.28Å; E1087-P1089 WeakPolarHBondContact O-CG 3.34Å
1088	I	39.9	Very low	40.7	Very low	123 Å²	123	74.6 Å²	74.6	63%	0.631	40%	0.395	S	S	*	.			trans	-86.8	103.4	177.9	-56	175.2	0	0	0	109.1	G1086	G1086-I1088 PolarHBondContact O-N 3.16Å
1089	P	33.8	Very low	39.1	Very low	6 Å²	6	80.2 Å²	80.2	4%	0.039	42%	0.416	C	S	.	.			trans	-129.9	130.2	-159.6	40.7	-21.4	0	0	0	112.3	V1047 D1048 A1082 E1087 I1091	V1047-P1089 HydrophobicContact CG1-CB 3.41Å; V1047-P1089 VanDerWaalsContact CG1-CB 3.41Å; V1047-P1089 HydrophobicContact CG1-CG 3.51Å; D1048-P1089 VanDerWaalsContact OD2-CB 3.24Å; D1048-P1089 WeakPolarHBondContact OD2-CB 3.37Å; A1082-P1089 HydrophobicContact CB-CG 4.35Å; E1087-P1089 WeakPolarHBondContact O-CD 3.15Å; E1087-P1089 VanDerWaalsContact O-CG 3.28Å; E1087-P1089 WeakPolarHBondContact O-CG 3.34Å; P1089-I1091 PolarHBondContact O-N 3.31Å
1090	P	34.9	Very low	38	Very low	84 Å²	84	86.7 Å²	86.7	55%	0.545	45%	0.45	S	S	.	.			trans	-66.5	105.5	-167	26.4	-34.5	0	0	0	111.8	D1048 R1092	D1048-P1090 VanDerWaalsContact OD1-CD 3.25Å; D1048-P1090 WeakPolarHBondContact OD1-CD 3.45Å; P1090-R1092 PolarHBondContact O-N 2.98Å
1091	I	36.7	Very low	36.9	Very low	19 Å²	19	88.3 Å²	88.3	10%	0.097	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	114.9	177.6	-52.6	176.4	0	0	0	109.7	I928 L1045 E1046 V1047 A1079 P1089	I928-I1091 HydrophobicContact CD1-CB 3.81Å; I928-I1091 HydrophobicContact CD1-CD1 3.44Å; I928-I1091 VanDerWaalsContact CD1-CD1 3.44Å; I928-I1091 HydrophobicContact CD1-CG1 3.46Å; I928-I1091 VanDerWaalsContact CD1-CG1 3.46Å; L1045-I1091 HydrophobicContact CD2-CG2 3.57Å; E1046-I1091 WeakPolarHBondContact O-CA 3.33Å; V1047-I1091 HydrophobicContact CG2-CB 4.33Å; V1047-I1091 HydrophobicContact CG2-CG1 3.9Å; V1047-I1091 HydrophobicContact CG2-CG2 4.39Å; A1079-I1091 HydrophobicContact CB-CD1 3.79Å; A1079-I1091 HydrophobicContact CB-CG1 4.5Å; P1089-I1091 PolarHBondContact O-N 3.31Å
1092	R	32	Very low	35.4	Very low	152 Å²	152	90.1 Å²	90.1	57%	0.574	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.9	128	172.2	-173.5	-160.4	-169.6	-172.6	3.6	109.5	L1045 E1046 P1090 T1094	L1045-R1092 WeakPolarHBondContact CA-O 3.39Å; E1046-R1092 HydrophobicContact CB-CB 4.23Å; E1046-R1092 PolarHBondContact N-O 3.15Å; E1046-R1092 PolarHBondContact O-N 3.47Å; E1046-R1092 IonicContact OE1-CZ 2.68Å; E1046-R1092 IonicContact OE1-NH1 3.43Å; E1046-R1092 PolarHBondContact OE1-NH1 2.93Å; E1046-R1092 WeakPolarHBondContact OE2-CD 3.34Å; E1046-R1092 IonicContact OE2-CZ 2.94Å; E1046-R1092 IonicContact OE2-NE 2.75Å; E1046-R1092 IonicContact OE2-NH1 3.85Å; E1046-R1092 PolarHBondContact OE2-NH1 3.19Å; P1090-R1092 PolarHBondContact O-N 2.98Å; R1092-T1094 WeakPolarHBondContact CD-OG1 3.26Å
1093	I	34	Very low	33.9	Very low	45 Å²	45	93.4 Å²	93.4	23%	0.231	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	92.4	179.6	-40.1	-168.6	0	0	0	109.3	V931 I1043 L1045	V931-I1093 HydrophobicContact CG1-CD1 3.72Å; V931-I1093 HydrophobicContact CG1-CG1 4.14Å; I1043-I1093 HydrophobicContact CG2-CG2 4.16Å; L1045-I1093 HydrophobicContact CD2-CB 4.22Å; L1045-I1093 HydrophobicContact CD2-CD1 4.22Å; L1045-I1093 HydrophobicContact CD2-CG1 3.69Å; L1045-I1093 HydrophobicContact CD2-CG2 4.15Å
1094	T	31.7	Very low	32.8	Very low	39 Å²	39	100.1 Å²	100.1	24%	0.239	54%	0.54	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	109.7	-179.3	-55.4	0	0	0	0	110.2	I1044 E1046 R1092 A1096	I1044-T1094 PolarHBondContact N-O 3.47Å; I1044-T1094 PolarHBondContact O-N 3.42Å; E1046-T1094 WeakPolarHBondContact OE1-CB 3.46Å; E1046-T1094 PolarHBondContact OE1-OG1 3.4Å; R1092-T1094 WeakPolarHBondContact CD-OG1 3.26Å; T1094-A1096 PolarHBondContact O-N 3.4Å
1095	A	29.1	Very low	31.4	Very low	44 Å²	44	99.7 Å²	99.7	36%	0.364	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.2	93.2	177.1	0	0	0	0	0	111.2	L937 Q1097	L937-A1095 HydrophobicContact CD1-CB 4.46Å; A1095-Q1097 PolarHBondContact O-N 3.14Å
1096	A	26.5	Very low	29.8	Very low	33 Å²	33	100.2 Å²	100.2	27%	0.273	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.9	103.6	-175.4	0	0	0	0	0	112.7	G1041 H1042 I1044 T1094 Y1098	G1041-A1096 VanDerWaalsContact CA-O 3.23Å; G1041-A1096 WeakPolarHBondContact CA-O 3.4Å; H1042-A1096 HydrophobicContact CB-CB 4.46Å; H1042-A1096 PolarHBondContact N-O 2.89Å; H1042-A1096 VanDerWaalsContact N-O 3.1Å; H1042-A1096 PolarHBondContact O-N 2.86Å; I1044-A1096 HydrophobicContact CD1-CB 4.41Å; T1094-A1096 PolarHBondContact O-N 3.4Å; A1096-Y1098 PolarHBondContact O-N 3.41Å
1097	Q	24.9	Very low	29.1	Very low	153 Å²	153	104.1 Å²	104.1	72%	0.715	56%	0.56	S	S	*	*			trans	-75.4	116.9	169.7	-170.8	175.7	49.3	0	0	110.7	A1095 H1099	A1095-Q1097 PolarHBondContact O-N 3.14Å; Q1097-H1099 PolarHBondContact O-N 2.92Å
1098	Y	24.6	Very low	28.2	Very low	159 Å²	159	104 Å²	104	62%	0.624	57%	0.567	S	S	*	*			trans	-74.8	95.8	178.9	-111	-99.7	0	0	0	111.5	H1042 A1096 N1100	H1042-Y1098 AromaticContact ND1-CD2 3.98Å; H1042-Y1098 AromaticContact ND1-CE2 3.81Å; A1096-Y1098 PolarHBondContact O-N 3.41Å; Y1098-N1100 PolarHBondContact O-N 3.29Å; Y1098-N1100 VanDerWaalsContact O-N 3.16Å
1099	H	24.5	Very low	27.5	Very low	146 Å²	146	103.7 Å²	103.7	68%	0.676	57%	0.567	S	S	*	*			trans	-68.3	104.3	161.6	-85.4	-92.8	0	0	0	109.6	Q1097 N1101	Q1097-H1099 PolarHBondContact O-N 2.92Å; H1099-N1101 PolarHBondContact O-N 3.22Å
1100	N	25.5	Very low	27	Very low	138 Å²	138	111.7 Å²	111.7	74%	0.738	61%	0.609	S	S	*	*			trans	-73.1	70.3	179.2	-89.3	-15.8	0	0	0	112.7	Y1098 F1102	Y1098-N1100 PolarHBondContact O-N 3.29Å; Y1098-N1100 VanDerWaalsContact O-N 3.16Å; N1100-F1102 PolarHBondContact O-N 3.12Å
1101	N	24.7	Very low	26.6	Very low	137 Å²	137	114.2 Å²	114.2	73%	0.733	62%	0.618	S	S	*	*			trans	-81.7	52.4	171.4	-78	0.2	0	0	0	112.3	H1099	H1099-N1101 PolarHBondContact O-N 3.22Å
1102	F	24.8	Very low	26.1	Very low	154 Å²	154	119.9 Å²	119.9	68%	0.675	64%	0.644	S	S	*	*	S	Bend	trans	-139.1	120.5	163.8	-83.9	-77.8	0	0	0	110.1	N1100 L1104	N1100-F1102 PolarHBondContact O-N 3.12Å; F1102-L1104 PolarHBondContact O-N 3.16Å
1103	G	21.5	Very low	25.7	Very low	85 Å²	85	124.8 Å²	124.8	88%	0.876	66%	0.662	S	S	*	*			trans	-73.2	104.8	-178.4	0	0	0	0	0	112.4
1104	L	25.3	Very low	25.3	Very low	164 Å²	164	128.8 Å²	128.8	86%	0.859	68%	0.683	S	S	*	*			trans	-134.4	127.5	156.9	-89	172.8	0	0	0	108.3	F1102 N1106	F1102-L1104 PolarHBondContact O-N 3.16Å; L1104-N1106 PolarHBondContact O-N 2.96Å
1105	A	22.2	Very low	25	Very low	95 Å²	95	132.4 Å²	132.4	79%	0.785	71%	0.71	S	S	*	*			trans	-71.6	110.4	178.1	0	0	0	0	0	109.4
1106	N	24.7	Very low	24.8	Very low	143 Å²	143	136.2 Å²	136.2	77%	0.765	73%	0.729	S	S	*	*			trans	-106.2	90.3	174.1	-133.9	-24.2	0	0	0	109.8	L1104 V1108	L1104-N1106 PolarHBondContact O-N 2.96Å; N1106-V1108 PolarHBondContact O-N 3.29Å
1107	I	24.5	Very low	24.7	Very low	142 Å²	142	146.1 Å²	146.1	73%	0.728	76%	0.759	S	S	*	*			trans	-72	80.3	175.8	-57.2	170.1	0	0	0	107.9
1108	V	25.9	Very low	24.6	Very low	123 Å²	123	143.8 Å²	143.8	75%	0.745	76%	0.757	S	S	*	*			trans	-92.8	110.8	172.1	-176.1	0	0	0	0	108.2	N1106	N1106-V1108 PolarHBondContact O-N 3.29Å
1109	N	25.7	Very low	24.8	Very low	116 Å²	116	146.2 Å²	146.2	62%	0.62	77%	0.771	S	S	*	*			trans	-61.6	154.1	-164.5	-71.9	-62.5	0	0	0	115.1	L1111	N1109-L1111 PolarHBondContact O-N 3.01Å
1110	N	23.6	Very low	25	Very low	174 Å²	174	146.6 Å²	146.6	93%	0.93	78%	0.778	S	S	*	*			trans	-68.5	76.1	167.4	-74.9	-78.8	0	0	0	111.5
1111	L	25.2	Very low	25.1	Very low	138 Å²	138	143.5 Å²	143.5	72%	0.723	78%	0.779	S	S	*	*			trans	-146.4	125.4	176.2	-113.2	60.2	0	0	0	106.4	N1109	N1109-L1111 PolarHBondContact O-N 3.01Å
1112	E	26.2	Very low	25.3	Very low	138 Å²	138	144.8 Å²	144.8	65%	0.645	79%	0.785	S	S	*	*			cis	-141.9	122.9	0.4	-69.3	-176.9	158.7	0	0	111.6	L1114	E1112-L1114 HydrophobicContact CB-CB 4.49Å; E1112-L1114 HydrophobicContact CB-CG 4.07Å; E1112-L1114 HydrophobicContact CG-CD1 4.08Å; E1112-L1114 HydrophobicContact CG-CG 4.02Å; E1112-L1114 VanDerWaalsContact OE1-CD1 3.27Å; E1112-L1114 WeakPolarHBondContact OE1-CD1 3.17Å
1113	R	24.5	Very low	25.4	Very low	255 Å²	255	144 Å²	144	96%	0.962	79%	0.788	S	S	*	*			trans	-108.9	70.5	142.8	-90.1	-166.8	174.7	-173.1	0.8	108.3	S1115	R1113-S1115 PolarHBondContact O-N 3.32Å
1114	L	25.4	Very low	25.6	Very low	128 Å²	128	150.8 Å²	150.8	67%	0.67	79%	0.787	S	S	*	*			trans	-69.5	68.7	175.1	-80	-177.6	0	0	0	112.1	E1112 V1116	E1112-L1114 HydrophobicContact CB-CB 4.49Å; E1112-L1114 HydrophobicContact CB-CG 4.07Å; E1112-L1114 HydrophobicContact CG-CD1 4.08Å; E1112-L1114 HydrophobicContact CG-CG 4.02Å; E1112-L1114 VanDerWaalsContact OE1-CD1 3.27Å; E1112-L1114 WeakPolarHBondContact OE1-CD1 3.17Å; L1114-V1116 PolarHBondContact O-N 3.1Å
1115	S	24.9	Very low	25.8	Very low	116 Å²	116	149.6 Å²	149.6	81%	0.811	78%	0.782	S	S	*	*			trans	-81.9	73.2	161.2	-160.5	0	0	0	0	109.9	R1113 R1117	R1113-S1115 PolarHBondContact O-N 3.32Å; S1115-R1117 PolarHBondContact O-N 3.26Å
1116	V	24.8	Very low	25.9	Very low	124 Å²	124	152.9 Å²	152.9	75%	0.752	78%	0.783	S	S	*	*	S	Bend	trans	18.7	96.2	157.2	-171.2	0	0	0	0	116.5	L1114	L1114-V1116 PolarHBondContact O-N 3.1Å
1117	R	24.4	Very low	26	Very low	240 Å²	240	152.7 Å²	152.7	91%	0.906	78%	0.777	S	S	*	*			trans	-157	101.5	139.9	-117.8	172	-173.9	-171.4	1.3	111.7	S1115	S1115-R1117 PolarHBondContact O-N 3.26Å
1118	P	24.1	Very low	25.9	Very low	105 Å²	105	151.1 Å²	151.1	68%	0.682	77%	0.774	S	S	*	*			trans	-70.8	136.6	178.4	29.3	-33.7	0	0	0	110.9
1119	K	28.8	Very low	26	Very low	209 Å²	209	150.8 Å²	150.8	91%	0.909	77%	0.773	S	S	*	*			trans	-125.1	63.1	161.4	-83.3	-166.4	170.2	-172.3	0	109.8
1120	N	28.1	Very low	25.9	Very low	154 Å²	154	150.9 Å²	150.9	82%	0.824	78%	0.778	S	S	*	*			trans	-63.1	165.2	159.6	-71.1	9	0	0	0	109.8
1121	G	28.7	Very low	25.9	Very low	74 Å²	74	148.6 Å²	148.6	76%	0.763	77%	0.765	S	S	*	*			trans	89.3	70.8	156.8	0	0	0	0	0	115	N1123	G1121-N1123 PolarHBondContact O-N 3.18Å
1122	L	28.1	Very low	26	Very low	164 Å²	164	149.7 Å²	149.7	86%	0.859	77%	0.766	S	S	*	*			trans	-60.2	111.7	138.8	-107.2	167.8	0	0	0	108
1123	N	26.3	Very low	26.1	Very low	138 Å²	138	150 Å²	150	74%	0.738	77%	0.772	S	S	*	*	S	Bend	trans	59.9	148.1	153.6	-76.9	-30.9	0	0	0	121.7	G1121	G1121-N1123 PolarHBondContact O-N 3.18Å
1124	R	26.7	Very low	26.1	Very low	226 Å²	226	143.5 Å²	143.5	85%	0.853	76%	0.761	S	S	*	*			trans	81.9	126.4	157.2	-74.8	174.5	-177.8	-179.7	0.5	119.8
1125	N	28.1	Very low	26.1	Very low	140 Å²	140	145.6 Å²	145.6	75%	0.749	77%	0.765	S	S	*	*			trans	74.8	89.8	140.1	-59.6	11.8	0	0	0	118.5
1126	M	25.1	Very low	26.2	Very low	163 Å²	163	145.1 Å²	145.1	80%	0.803	75%	0.754	S	S	*	*				47.4	136.5	107	-87	-174.8	147.6	0	0	120.7
1127	H	26	Very low	26.3	Very low	139 Å²	139	146.8 Å²	146.8	64%	0.644	75%	0.751	S	S	*	*			trans	77.4	75.1	144.6	-78	-61.8	0	0	0	120.4
1128	T	24.4	Very low	26.5	Very low	110 Å²	110	141.6 Å²	141.6	68%	0.675	74%	0.74	S	S	*	*				68.8	169.7	109.9	51.8	0	0	0	0	120.2
1129	T	26.8	Very low	26.6	Very low	116 Å²	116	145.2 Å²	145.2	71%	0.712	74%	0.742	S	S	*	*			trans	67.4	97.3	162.4	35.5	0	0	0	0	117
1130	T	23.9	Very low	26.6	Very low	118 Å²	118	143.2 Å²	143.2	72%	0.724	73%	0.733	S	S	*	*				14.7	140.8	118.6	17.2	0	0	0	0	119.1
1131	N	24.3	Very low	26.4	Very low	125 Å²	125	140.8 Å²	140.8	67%	0.668	72%	0.724	S	S	*	*			trans	104.8	127.1	144.2	-66.5	-8.1	0	0	0	119.5
1132	H	26.2	Very low	26.3	Very low	162 Å²	162	144.6 Å²	144.6	75%	0.75	73%	0.727	S	S	*	*			trans	74.4	156.6	143	-68.9	-47.3	0	0	0	120.8
1133	N	28.4	Very low	26.2	Very low	144 Å²	144	140 Å²	140	77%	0.77	72%	0.719	S	S	*	*			trans	69.5	85.9	159.3	-58.9	-13.4	0	0	0	117.7
1134	T	24.7	Very low	26.1	Very low	119 Å²	119	141.3 Å²	141.3	73%	0.73	72%	0.724	S	S	*	*				-0.7	124.2	104.2	-40.7	0	0	0	0	115.2
1135	F	24.5	Very low	26.1	Very low	172 Å²	172	137.1 Å²	137.1	75%	0.754	72%	0.718	S	S	*	*			trans	156.9	103.3	133.5	-97.2	-87.7	0	0	0	105.7
1136	D	27.3	Very low	26	Very low	106 Å²	106	136.1 Å²	136.1	57%	0.567	71%	0.712	S	S	*	*				85.8	160.7	81.1	-175.9	28.9	0	0	0	111.1
1137	K	28.4	Very low	26.2	Very low	158 Å²	158	135.8 Å²	135.8	69%	0.687	71%	0.709	S	S	*	*			trans	74.1	144.8	169.5	-58.3	178.9	-174.1	165.4	0	116.7
1138	L	28.1	Very low	26.2	Very low	131 Å²	131	135.4 Å²	135.4	69%	0.686	71%	0.711	S	S	*	*			cis	-146.5	106.9	-7.7	-113.3	155.6	0	0	0	110.1
1139	Y	26.8	Very low	26.5	Very low	181 Å²	181	135.4 Å²	135.4	71%	0.71	71%	0.707	S	S	*	*				64.7	143	124.3	-80.6	-144.5	0	0	0	123
1140	K	27.4	Very low	26.6	Very low	168 Å²	168	136.8 Å²	136.8	73%	0.73	71%	0.706	S	S	*	*			trans	99	97.3	130.3	-88	178.1	174.1	179.8	0	121.8
1141	T	25.4	Very low	26.9	Very low	102 Å²	102	138 Å²	138	63%	0.626	70%	0.703	S	S	*	*				50.5	129.5	112.9	62.1	0	0	0	0	121.2
1142	N	25.2	Very low	27.2	Very low	154 Å²	154	141 Å²	141	82%	0.824	71%	0.706	S	S	*	*				48.2	97.1	126.7	-48.7	3.6	0	0	0	118
1143	G	26.2	Very low	27.3	Very low	68 Å²	68	138.2 Å²	138.2	70%	0.701	70%	0.701	S	S	*	*				87.6	131.7	112.1	0	0	0	0	0	119.3
1144	I	25.1	Very low	27.3	Very low	166 Å²	166	136.7 Å²	136.7	85%	0.851	69%	0.692	S	S	*	*			trans	69.3	150.5	155.5	-14.9	-178.5	0	0	0	117
1145	I	26.1	Very low	27.6	Very low	138 Å²	138	138.8 Å²	138.8	71%	0.708	69%	0.692	S	S	*	*			trans	81.9	86.1	162.7	-56.2	-177.9	0	0	0	116.3
1146	N	25.7	Very low	27.9	Very low	119 Å²	119	136.1 Å²	136.1	64%	0.636	69%	0.686	S	S	*	*				80.9	149.6	122.6	-69.2	23.1	0	0	0	122.7
1147	E	29	Very low	28.1	Very low	156 Å²	156	136.8 Å²	136.8	73%	0.729	70%	0.696	S	S	*	*			trans	68	132.9	141.2	-76.6	159.1	-115.9	0	0	118.8
1148	N	26.4	Very low	28.2	Very low	130 Å²	130	135.4 Å²	135.4	70%	0.695	69%	0.694	S	S	*	*			cis	-163.4	-175.8	-11.6	-138.1	13.8	0	0	0	111.5
1149	D	30.4	Very low	28.1	Very low	111 Å²	111	135.6 Å²	135.6	59%	0.594	70%	0.696	S	S	*	*			trans	76.9	113.9	149.8	-73.4	-51	0	0	0	121.6
1150	Q	30.4	Very low	28.2	Very low	145 Å²	145	133.7 Å²	133.7	68%	0.678	69%	0.694	S	S	*	*			trans	74.8	142.6	130.5	-61.1	169.7	43	0	0	117.4
1151	Q	29.8	Very low	28.4	Very low	142 Å²	142	131.1 Å²	131.1	66%	0.664	69%	0.688	S	S	*	*			cis	-171.4	138.1	1.6	-120.8	169	36.4	0	0	104.4
1152	Y	30.1	Very low	28.4	Very low	189 Å²	189	131.2 Å²	131.2	74%	0.741	69%	0.693	S	S	*	*			cis	-140.5	149.4	29	-91.9	-117.2	0	0	0	106.7
1153	T	28.2	Very low	28.7	Very low	103 Å²	103	131.8 Å²	131.8	63%	0.632	69%	0.69	S	S	*	*				50.7	142	72.8	61.9	0	0	0	0	114.7
1154	D	29.3	Very low	28.7	Very low	112 Å²	112	132.2 Å²	132.2	60%	0.599	68%	0.683	S	S	*	*			cis	-159.8	161.9	20.5	-124	-21.7	0	0	0	113.6
1155	F	30.5	Very low	28.9	Very low	163 Å²	163	131.9 Å²	131.9	72%	0.715	68%	0.675	S	S	*	*			trans	53.8	151.7	156.9	-53.2	-48.3	0	0	0	121.8
1156	D	30.2	Very low	29.1	Very low	117 Å²	117	132.5 Å²	132.5	63%	0.626	67%	0.673	S	S	*	*			cis	-162.1	151	-29.8	-117	-9.6	0	0	0	110.4
1157	P	31.5	Very low	29.2	Very low	120 Å²	120	132.5 Å²	132.5	78%	0.779	68%	0.677	S	S	*	*			trans	-109.7	92.5	174.5	36.8	-26.8	0	0	0	113.1
1158	I	30.9	Very low	29.3	Very low	128 Å²	128	129.7 Å²	129.7	66%	0.656	68%	0.675	S	S	*	*			trans	-133.4	103.5	177.8	-61.2	-178.5	0	0	0	106.5
1159	N	26.3	Very low	29.4	Very low	135 Å²	135	130.5 Å²	130.5	72%	0.722	68%	0.679	S	S	*	*				57.1	116.4	83.9	-179.8	55	0	0	0	113.3
1160	E	29.2	Very low	29.3	Very low	141 Å²	141	130.1 Å²	130.1	66%	0.659	68%	0.683	S	S	*	*				178.5	159.2	125.6	-106	-175.4	-143.7	0	0	114.6
1161	N	31.3	Very low	29.1	Very low	115 Å²	115	128.8 Å²	128.8	62%	0.615	69%	0.69	S	S	*	*			trans	54.2	106.1	156.2	-56	-31.7	0	0	0	118
1162	S	25.2	Very low	29	Very low	103 Å²	103	130.2 Å²	130.2	72%	0.72	70%	0.696	S	S	*	*			cis	61.2	99.8	42.6	-43.2	0	0	0	0	114.8
1163	Q	30.5	Very low	29	Very low	166 Å²	166	127.1 Å²	127.1	78%	0.776	69%	0.691	S	S	*	*			trans	-172.8	116.5	136.5	-98.4	151.1	65.7	0	0	106.9
1164	S	27.2	Very low	28.9	Very low	78 Å²	78	128.9 Å²	128.9	55%	0.545	70%	0.697	S	S	.	*			cis	90.2	152.2	39.3	78	0	0	0	0	114.1
1165	F	28.9	Very low	28.8	Very low	158 Å²	158	128.8 Å²	128.8	69%	0.693	71%	0.705	S	S	*	*			trans	86.6	141.8	168.2	-50.9	-35	0	0	0	116.9
1166	K	30.1	Very low	28.6	Very low	151 Å²	151	128.6 Å²	128.6	66%	0.657	70%	0.704	S	S	*	*			cis	-164.4	134.5	-14.7	-122.2	161.6	-174.4	155.8	0	112
1167	T	27.6	Very low	28.5	Very low	119 Å²	119	131.4 Å²	131.4	73%	0.73	71%	0.707	S	S	*	*			trans	49.1	173	135.8	56.2	0	0	0	0	122.2
1168	S	30.6	Very low	28.4	Very low	97 Å²	97	131.5 Å²	131.5	68%	0.678	71%	0.706	S	S	*	*			trans	66.8	132.3	166.1	50.3	0	0	0	0	118.5
1169	D	29.1	Very low	28.1	Very low	148 Å²	148	132.5 Å²	132.5	79%	0.791	71%	0.711	S	S	*	*			cis	-156.6	161.1	-19.9	-106.2	-39.6	0	0	0	109.9
1170	P	29.5	Very low	28.1	Very low	103 Å²	103	130.4 Å²	130.4	67%	0.669	71%	0.706	S	S	*	*			trans	-84.3	164.8	175.8	35.7	-33.7	0	0	0	112.2
1171	S	25.1	Very low	28.2	Very low	117 Å²	117	131.9 Å²	131.9	82%	0.818	71%	0.713	S	S	*	*			trans	63.4	116.8	-178.9	65.5	0	0	0	0	116.1
1172	E	28.2	Very low	28.1	Very low	171 Å²	171	131.5 Å²	131.5	80%	0.799	71%	0.71	S	S	*	*				-159.9	133.4	107	-100.1	-169.5	167.1	0	0	112.5
1173	I	28.9	Very low	28.2	Very low	124 Å²	124	131.5 Å²	131.5	64%	0.636	71%	0.706	S	S	*	*			trans	68.7	88.7	136.2	-58.8	169.9	0	0	0	119.8
1174	N	26.4	Very low	28.2	Very low	141 Å²	141	129.6 Å²	129.6	75%	0.754	70%	0.701	S	S	*	*				72.6	133.8	121.1	-63.6	-23.4	0	0	0	124.9
1175	S	27.2	Very low	28.6	Very low	110 Å²	110	130.5 Å²	130.5	77%	0.769	71%	0.708	S	S	*	*			trans	75.5	142	153.1	76.3	0	0	0	0	117.8
1176	K	27.8	Very low	28.8	Very low	158 Å²	158	125.9 Å²	125.9	69%	0.687	70%	0.704	S	S	*	*			cis	-167.8	147.6	-5.8	-116.4	174.1	173.6	-161.3	0	106
1177	Y	28.3	Very low	29	Very low	177 Å²	177	126.7 Å²	126.7	69%	0.694	71%	0.71	S	S	*	*			cis	-127.3	157.5	-3.8	-79.8	-91.2	0	0	0	107.1
1178	T	27.5	Very low	29.5	Very low	122 Å²	122	126.9 Å²	126.9	75%	0.748	71%	0.707	S	S	*	*				79.5	132.6	53	-38.2	0	0	0	0	114.8
1179	I	24.9	Very low	29.7	Very low	149 Å²	149	127.6 Å²	127.6	76%	0.764	70%	0.702	S	S	*	*			trans	-141.2	142.5	-178.6	-61.9	166.5	0	0	0	108.1
1180	S	27.4	Very low	29.9	Very low	90 Å²	90	125.5 Å²	125.5	63%	0.629	69%	0.691	S	S	*	*			trans	-158.5	160.3	171.1	47.4	0	0	0	0	113.5
1181	E	31.4	Very low	30.3	Very low	173 Å²	173	126.1 Å²	126.1	81%	0.808	69%	0.685	S	S	*	*			trans	65.1	113.5	175.5	-65	155	-134.3	0	0	115.3
1182	I	27.8	Very low	30.9	Very low	106 Å²	106	124.9 Å²	124.9	54%	0.544	67%	0.668	S	S	.	*			cis	65.8	128.1	19	-19.8	172.8	0	0	0	112
1183	T	27.8	Very low	31.1	Very low	104 Å²	104	120.9 Å²	120.9	64%	0.638	65%	0.652	S	S	*	*			cis	-153.6	152.4	35.1	50.3	0	0	0	0	114.6
1184	N	31.3	Very low	31.5	Very low	126 Å²	126	121.3 Å²	121.3	67%	0.674	65%	0.649	S	S	*	*			trans	146.2	154.7	136.7	-75.8	-27	0	0	0	116.3
1185	S	35.9	Very low	31.7	Very low	97 Å²	97	118.8 Å²	118.8	68%	0.678	64%	0.643	S	S	*	*			trans	46.3	94.4	166.7	55.5	0	0	0	0	118
1186	G	31.7	Very low	32.1	Very low	60 Å²	60	121.2 Å²	121.2	62%	0.619	64%	0.639	S	S	*	*			trans	-96.7	0.5	-179	0	0	0	0	0	117.2
1187	E	34.2	Very low	32	Very low	168 Å²	168	118.1 Å²	118.1	79%	0.785	63%	0.63	S	S	*	*	S	Bend	trans	-91.7	-42.9	-169.4	-63	-173.4	126	0	0	113.3	L1189 L1190 E1191	E1187-L1189 PolarHBondContact O-N 2.96Å; E1187-L1189 VanDerWaalsContact O-N 3.16Å; E1187-L1190 WeakPolarHBondContact O-CB 3.33Å; E1187-L1190 PolarHBondContact O-N 3.14Å; E1187-E1191 PolarHBondContact O-N 2.85Å
1188	D	38	Very low	32	Very low	124 Å²	124	117.6 Å²	117.6	66%	0.663	64%	0.637	S	S	*	*	H	α-helix	trans	-57.8	-33.7	-179.5	-64	-55	0	0	0	113.4	L1190 E1191 L1192	D1188-L1190 VanDerWaalsContact C-N 3.29Å; D1188-L1190 PolarHBondContact O-N 3.05Å; D1188-E1191 PolarHBondContact O-N 2.88Å; D1188-L1192 WeakPolarHBondContact O-CB 3.46Å; D1188-L1192 PolarHBondContact O-N 3.47Å
1189	L	35.2	Very low	32	Very low	111 Å²	111	121.8 Å²	121.8	58%	0.581	64%	0.64	S	S	*	*	H	α-helix	trans	-69.4	-26	178.4	-106.7	166.6	0	0	0	112.8	E1187 L1192 L1193	E1187-L1189 PolarHBondContact O-N 2.96Å; E1187-L1189 VanDerWaalsContact O-N 3.16Å; L1189-L1192 HydrophobicContact CD2-CD2 4.4Å; L1189-L1193 WeakPolarHBondContact O-CB 3.49Å; L1189-L1193 WeakPolarHBondContact O-CD1 3.26Å; L1189-L1193 VanDerWaalsContact O-CG 3.3Å; L1189-L1193 WeakPolarHBondContact O-CG 3.4Å; L1189-L1193 PolarHBondContact O-N 2.88Å
1190	L	34.3	Very low	31.9	Very low	105 Å²	105	124 Å²	124	55%	0.55	64%	0.644	S	S	.	*	H	α-helix	trans	-77	-35.4	174.2	-167	66.4	0	0	0	111	E1187 D1188 L1193 K1194	E1187-L1190 WeakPolarHBondContact O-CB 3.33Å; E1187-L1190 PolarHBondContact O-N 3.14Å; D1188-L1190 VanDerWaalsContact C-N 3.29Å; D1188-L1190 PolarHBondContact O-N 3.05Å; L1190-L1193 PolarHBondContact O-N 3.25Å; L1190-K1194 WeakPolarHBondContact O-CB 3.29Å; L1190-K1194 VanDerWaalsContact O-CG 3.25Å; L1190-K1194 WeakPolarHBondContact O-CG 3.33Å; L1190-K1194 PolarHBondContact O-N 3.09Å
1191	E	36.7	Very low	31.9	Very low	115 Å²	115	124 Å²	124	54%	0.537	64%	0.644	S	S	.	*	H	α-helix	trans	-64.5	-41.9	170.4	-135.7	73.9	-89.7	0	0	111.4	E1187 D1188 L1193 K1194 S1195	E1187-E1191 PolarHBondContact O-N 2.85Å; D1188-E1191 PolarHBondContact O-N 2.88Å; E1191-L1193 VanDerWaalsContact C-N 3.29Å; E1191-L1193 PolarHBondContact O-N 2.87Å; E1191-K1194 PolarHBondContact O-N 3.5Å; E1191-K1194 VanDerWaalsContact OE1-CD 3.24Å; E1191-K1194 WeakPolarHBondContact OE1-CD 3.4Å; E1191-K1194 IonicContact OE1-NZ 2.73Å; E1191-K1194 PolarHBondContact OE1-NZ 2.79Å; E1191-S1195 WeakPolarHBondContact O-CB 3.26Å; E1191-S1195 PolarHBondContact O-N 3.45Å; E1191-S1195 PolarHBondContact O-OG 3.14Å
1192	L	38.5	Very low	31.6	Very low	91 Å²	91	124 Å²	124	48%	0.476	64%	0.637	S	S	.	*	H	α-helix	trans	-68.5	-25	177.1	-167.8	63.7	0	0	0	113.5	D1188 L1189 S1195	D1188-L1192 WeakPolarHBondContact O-CB 3.46Å; D1188-L1192 PolarHBondContact O-N 3.47Å; L1189-L1192 HydrophobicContact CD2-CD2 4.4Å; L1192-S1195 WeakPolarHBondContact CA-OG 3.22Å; L1192-S1195 PolarHBondContact O-OG 3.15Å
1193	L	32.5	Very low	31.6	Very low	87 Å²	87	125.7 Å²	125.7	46%	0.455	65%	0.647	S	S	.	*	H	α-helix	trans	-86.4	-40.6	173.6	-76.9	167.9	0	0	0	112.4	L1189 L1190 E1191 S1195 K1196 L1197	L1189-L1193 WeakPolarHBondContact O-CB 3.49Å; L1189-L1193 WeakPolarHBondContact O-CD1 3.26Å; L1189-L1193 VanDerWaalsContact O-CG 3.3Å; L1189-L1193 WeakPolarHBondContact O-CG 3.4Å; L1189-L1193 PolarHBondContact O-N 2.88Å; L1190-L1193 PolarHBondContact O-N 3.25Å; E1191-L1193 VanDerWaalsContact C-N 3.29Å; E1191-L1193 PolarHBondContact O-N 2.87Å; L1193-S1195 PolarHBondContact O-N 2.8Å; L1193-K1196 CarbonylContact O-C 3.59Å; L1193-K1196 PolarHBondContact O-N 3.36Å; L1193-L1197 HydrophobicContact CB-CD1 3.93Å; L1193-L1197 HydrophobicContact CD2-CD1 3.86Å; L1193-L1197 HydrophobicContact CG-CD1 4.46Å; L1193-L1197 PolarHBondContact O-N 3.44Å
1194	K	35.9	Very low	31.6	Very low	133 Å²	133	128.7 Å²	128.7	58%	0.578	65%	0.654	S	S	*	*	H	α-helix	trans	-55.2	-37.8	170.3	-74.7	167.6	-170.2	169.2	0	111.9	L1190 E1191 K1196	L1190-K1194 WeakPolarHBondContact O-CB 3.29Å; L1190-K1194 VanDerWaalsContact O-CG 3.25Å; L1190-K1194 WeakPolarHBondContact O-CG 3.33Å; L1190-K1194 PolarHBondContact O-N 3.09Å; E1191-K1194 PolarHBondContact O-N 3.5Å; E1191-K1194 VanDerWaalsContact OE1-CD 3.24Å; E1191-K1194 WeakPolarHBondContact OE1-CD 3.4Å; E1191-K1194 IonicContact OE1-NZ 2.73Å; E1191-K1194 PolarHBondContact OE1-NZ 2.79Å; K1194-K1196 VanDerWaalsContact C-N 3.26Å; K1194-K1196 PolarHBondContact O-N 3.21Å
1195	S	32.5	Very low	31.5	Very low	88 Å²	88	132.3 Å²	132.3	62%	0.615	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	0.7	177.3	51.9	0	0	0	0	114.9	E1191 L1192 L1193	E1191-S1195 WeakPolarHBondContact O-CB 3.26Å; E1191-S1195 PolarHBondContact O-N 3.45Å; E1191-S1195 PolarHBondContact O-OG 3.14Å; L1192-S1195 WeakPolarHBondContact CA-OG 3.22Å; L1192-S1195 PolarHBondContact O-OG 3.15Å; L1193-S1195 PolarHBondContact O-N 2.8Å
1196	K	34	Very low	31	Very low	161 Å²	161	133.3 Å²	133.3	70%	0.7	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.2	-9.9	179.8	-69.9	-174.1	176.9	-179.6	0	115.8	L1193 K1194	L1193-K1196 CarbonylContact O-C 3.59Å; L1193-K1196 PolarHBondContact O-N 3.36Å; K1194-K1196 VanDerWaalsContact C-N 3.26Å; K1194-K1196 PolarHBondContact O-N 3.21Å
1197	L	27.1	Very low	30.8	Very low	94 Å²	94	139 Å²	139	49%	0.492	67%	0.674	S	S	.	*			trans	-97.5	100.7	176.1	-89	130.2	0	0	0	112.1	L1193 W1199	L1193-L1197 HydrophobicContact CB-CD1 3.93Å; L1193-L1197 HydrophobicContact CD2-CD1 3.86Å; L1193-L1197 HydrophobicContact CG-CD1 4.46Å; L1193-L1197 PolarHBondContact O-N 3.44Å; L1197-W1199 PolarHBondContact O-N 2.89Å; L1197-W1199 VanDerWaalsContact O-N 3.14Å
1198	I	28.4	Very low	30.4	Very low	165 Å²	165	135.5 Å²	135.5	85%	0.846	67%	0.668	S	S	*	*			trans	-72.6	101.7	165.9	-60.2	176.3	0	0	0	108
1199	W	26.6	Very low	29.8	Very low	210 Å²	210	139.5 Å²	139.5	80%	0.795	68%	0.675	S	S	*	*			trans	-99.3	104.6	-166.8	-126.7	55.2	0	0	0	114.1	L1197	L1197-W1199 PolarHBondContact O-N 2.89Å; L1197-W1199 VanDerWaalsContact O-N 3.14Å
1200	F	23.4	Very low	29.5	Very low	196 Å²	196	142.7 Å²	142.7	86%	0.86	69%	0.687	S	S	*	*			trans	-86.7	101.6	159.4	-93.5	-91.9	0	0	0	109.9
1201	S	25.8	Very low	29	Very low	91 Å²	91	142.9 Å²	142.9	64%	0.636	70%	0.697	S	S	*	*			trans	178.1	120.1	140	-89	0	0	0	0	116.7
1202	R	26.7	Very low	28.7	Very low	171 Å²	171	142.5 Å²	142.5	65%	0.645	71%	0.707	S	S	*	*				43.5	91.8	114.5	-157.5	-174.6	-149.7	169.6	10.6	119
1203	N	26.1	Very low	28	Very low	142 Å²	142	147.5 Å²	147.5	76%	0.759	73%	0.725	S	S	*	*			trans	29.6	90.7	140.6	-68.1	-40.1	0	0	0	118.1
1204	Q	27.9	Very low	28	Very low	167 Å²	167	148.3 Å²	148.3	78%	0.78	73%	0.73	S	S	*	*			trans	-136.5	114.1	143.9	-70.7	-163.5	19	0	0	110.8
1205	Q	29.8	Very low	27.6	Very low	202 Å²	202	147.2 Å²	147.2	94%	0.944	74%	0.736	S	S	*	*			trans	-128.2	122	142.7	-97.5	-172.3	-21.5	0	0	106.6
1206	I	26.3	Very low	27.6	Very low	118 Å²	118	152 Å²	152	61%	0.605	74%	0.741	S	S	*	*			trans	-105.8	146.5	-178.7	-79	170.3	0	0	0	107.5
1207	Q	26.2	Very low	27.6	Very low	181 Å²	181	150.7 Å²	150.7	85%	0.846	75%	0.751	S	S	*	*			trans	67.5	130.7	-178.8	-63.5	152.4	28.5	0	0	113.3
1208	S	26.6	Very low	27.5	Very low	94 Å²	94	154.5 Å²	154.5	66%	0.657	77%	0.771	S	S	*	*			cis	-152.1	165.2	48.3	49.9	0	0	0	0	114.9
1209	Y	25.5	Very low	27.5	Very low	208 Å²	208	155.1 Å²	155.1	82%	0.816	77%	0.77	S	S	*	*			trans	75.9	113.9	169.1	-59.8	-72.7	0	0	0	121.1
1210	Q	27.7	Very low	27.7	Very low	178 Å²	178	156.9 Å²	156.9	83%	0.832	80%	0.795	S	S	*	*			trans	68	101	148	-73.3	171.1	-52.4	0	0	121.4
1211	S	25.2	Very low	27.9	Very low	108 Å²	108	154.9 Å²	154.9	76%	0.755	79%	0.791	S	S	*	*				39.3	128.4	121.9	-153.2	0	0	0	0	118.8
1212	S	29.7	Very low	28	Very low	108 Å²	108	158.3 Å²	158.3	76%	0.755	80%	0.8	S	S	*	*			cis	-156.5	163.5	47.6	-53.4	0	0	0	0	114.1
1213	F	25.1	Very low	28.1	Very low	196 Å²	196	157.6 Å²	157.6	86%	0.86	81%	0.808	S	S	*	*			trans	-63.4	145.2	178.6	-87.2	-122.2	0	0	0	114.5	P1215	F1213-P1215 HydrophobicContact CD1-CG 4.28Å
1214	D	32.2	Very low	28.2	Very low	104 Å²	104	158.5 Å²	158.5	56%	0.556	81%	0.811	S	S	*	*			trans	-156.8	104.1	131.2	-164.2	-16.6	0	0	0	110.7	R1216	D1214-R1216 PolarHBondContact O-N 2.77Å; D1214-R1216 IonicContact OD1-CZ 2.76Å; D1214-R1216 IonicContact OD1-NE 2.72Å; D1214-R1216 PolarHBondContact OD1-NE 3.14Å; D1214-R1216 IonicContact OD1-NH2 3.17Å; D1214-R1216 IonicContact OD2-CZ 3.54Å; D1214-R1216 IonicContact OD2-NE 4Å; D1214-R1216 PolarHBondContact OD2-NE 2.74Å; D1214-R1216 IonicContact OD2-NH2 2.82Å; D1214-R1216 PolarHBondContact OD2-NH2 3.14Å
1215	P	27.5	Very low	28.2	Very low	109 Å²	109	157.9 Å²	157.9	71%	0.708	81%	0.813	S	S	*	*			trans	-94.6	80.2	-178.5	35.7	-31.4	0	0	0	111.4	F1213	F1213-P1215 HydrophobicContact CD1-CG 4.28Å
1216	R	31.3	Very low	28.1	Very low	190 Å²	190	155 Å²	155	72%	0.717	80%	0.804	S	S	*	*			trans	-135.3	161.3	175.7	-70.8	-175.1	-75.4	173.3	-0.8	111.8	D1214	D1214-R1216 PolarHBondContact O-N 2.77Å; D1214-R1216 IonicContact OD1-CZ 2.76Å; D1214-R1216 IonicContact OD1-NE 2.72Å; D1214-R1216 PolarHBondContact OD1-NE 3.14Å; D1214-R1216 IonicContact OD1-NH2 3.17Å; D1214-R1216 IonicContact OD2-CZ 3.54Å; D1214-R1216 IonicContact OD2-NE 4Å; D1214-R1216 PolarHBondContact OD2-NE 2.74Å; D1214-R1216 IonicContact OD2-NH2 2.82Å; D1214-R1216 PolarHBondContact OD2-NH2 3.14Å
1217	C	33.8	Very low	28.3	Very low	133 Å²	133	157.6 Å²	157.6	90%	0.899	82%	0.818	S	S	*	*			trans	74.1	45.2	-176.6	-52.6	0	0	0	0	116.3
1218	L	24.8	Very low	28.4	Very low	174 Å²	174	155.8 Å²	155.8	91%	0.911	82%	0.816	S	S	*	*			trans	-85.5	93.5	139.1	-115.5	170.7	0	0	0	106.8
1219	E	29	Very low	28.6	Very low	178 Å²	178	161 Å²	161	83%	0.832	83%	0.83	S	S	*	*			trans	170.1	101.2	161	-102.6	175.6	175.8	0	0	110.4
1220	N	31.3	Very low	28.9	Very low	246 Å²	246	156.7 Å²	156.7	100%	1.316	83%	0.831	S	S	*	*			trans	173.5	0	148.8	-97	-74.7	0	0	0	109.1

Retrieved 1,220 of 1,220 residues in 255.4 ms (Link to these results)

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