A0AA82MKP5_SCHMA Loading...

Rho-GAP domain-containing protein

AlphaFold DB (A0A3Q0KJC5), UniProt , Accession A0AA82MKP5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,094 aa.

						>A0AA82MKP5_SCHMA|A0AA82MKP5
MDRFVRKINSSPKSKRKTLVQTEDNFGVPLKVLLDRDSTKPVPRIVKNICDYLLHYGLNSQGIFRINGSAKLIDGFKTTFQISAADDLCSLENVDIYALAGVLKLFLRELPDGLVPEKLGLKCIKVAKEYSSDLSVYILKLQTVLFTLAHENYELLKYLCKFLSKIAENEPVNKMSRNSLGIIFGPCVFRCSLDFQVLKNQGLTNYIMTSLIQYHDAIFVHHPKTDFFVLDHLFKLPEIVSNSALPILEDRIQPSSEISTSSSQNNSPGITSSLQENTFSHFVEALPLASKNTLKPGPDNYVWMSHDHSSSEPKIPRTNPGHSIPDSMCGVTVDSNLSSVSSPFQNNVSSRQYKEFLISPSASPTPIPITFEVSSTPTFVSRSNSVSYNEEENAEEVSDSGPEALYTKTSEQLALDITNIISSIATSRSLEALSFETQLDDCFTISTHMSNCNKKPNLVEENPREKLRVSSMLSRSSNKASTGDSLFNKVIRFAHVTDDPNKIKRTFSHRKHTIKESSVYPISTWNSMPSVENKTVQTPPQFTDSCVSVYGQDLCSQSQQHNNVVSNTLEYNGYRFPNTKNTYRLINLQKDDFNEARVQDTANSTHTSTPMPVSTSHSYMKMPAANNEFADLVGNKQPSPVVKNILTQAINQCSDTHVLSFSVKQELDYPSHSSSFPYSINEMDCTVSAKRNPVSSFVKPISTVFRQLEIPLCVFGHSHPNQDHADGPNTEIENKQNKSFEFGTLQYDTTHQPNKYTHSTPTSPILSNHTASITLRSKSNSVCSVTVKPIHSFIHKPKDRGSCPPNLLSLSSKANNEHLNESALNSGKLSSPERNQVITKQRIKQQDSVSDRSPISNQNEEDTRSHRVQLNKLDYFVKSAKYSSYISDSTQQFKRTLNTMGLGCLLNLSTKTYSEPNLLCFKNQLPQRTKLKYSSLQHLAIDELSSIKALPTFKLINKEKLNNVPVKISKNLLFSNKEESNTSVISVIRRVNSFSSNGHTSSIKYHSFLRKYSSLLLKDLRDFNENSKNHSVGDKDDKAGDVVLEQSNSSLISIETFYELLCAALSKQRQYCNRPERLSEMNWDQALFSTIEKP
					

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(Predicted Aligned Error values between residue pairs)

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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	50.8	Low	58.5	Low	171 Å²	171	131.4 Å²	131.4	84%	0.842	64%	0.638	S	S	*	*				0	-16.4	0	-104.1	-63.7	-152.7	0	0	112.6	R3 F4 V5	M1-R3 PolarHBondContact O-N 2.99Å; M1-F4 WeakPolarHBondContact O-CA 3.27Å; M1-F4 VanDerWaalsContact O-CB 3.29Å; M1-F4 WeakPolarHBondContact O-CB 3.48Å; M1-F4 PolarHBondContact O-N 3.3Å; M1-F4 HydrophobicContact SD-CB 4.5Å; M1-V5 HydrophobicContact CB-CG2 4.26Å; M1-V5 PolarHBondContact O-N 3.15Å; M1-V5 VanDerWaalsContact O-N 3.16Å
2	D	63	Low	57	Low	80 Å²	80	129.9 Å²	129.9	43%	0.428	65%	0.647	S	S	.	*	H	α-helix	trans	-76.5	-29.4	-146.8	-51.6	-88.7	0	0	0	113.4	F4 R6	D2-F4 PolarHBondContact O-N 3.47Å; D2-R6 WeakPolarHBondContact O-CB 3.46Å; D2-R6 WeakPolarHBondContact O-CG 3.21Å; D2-R6 PolarHBondContact O-N 2.89Å
3	R	64.9	Low	55.2	Low	227 Å²	227	134.6 Å²	134.6	86%	0.857	66%	0.661	S	S	*	*	H	α-helix	trans	-63.7	-30.2	169.4	-68	-172.9	-175.3	174.2	2.4	112.4	M1 K7	M1-R3 PolarHBondContact O-N 2.99Å; R3-K7 VanDerWaalsContact O-CB 3.24Å; R3-K7 WeakPolarHBondContact O-CB 3.27Å; R3-K7 PolarHBondContact O-N 3.09Å
4	F	66.7	Low	53.9	Low	140 Å²	140	132.7 Å²	132.7	61%	0.614	67%	0.668	S	S	*	*	H	α-helix	trans	-80.6	-45.7	178.7	-150.5	-99.4	0	0	0	110.8	M1 D2 R6 K7 I8	M1-F4 WeakPolarHBondContact O-CA 3.27Å; M1-F4 VanDerWaalsContact O-CB 3.29Å; M1-F4 WeakPolarHBondContact O-CB 3.48Å; M1-F4 PolarHBondContact O-N 3.3Å; M1-F4 HydrophobicContact SD-CB 4.5Å; D2-F4 PolarHBondContact O-N 3.47Å; F4-R6 PolarHBondContact O-N 3.25Å; F4-K7 CarbonylContact O-C 3.56Å; F4-K7 PolarHBondContact O-N 2.83Å; F4-I8 HydrophobicContact CD1-CD1 3.73Å; F4-I8 HydrophobicContact CD1-CG1 4.47Å; F4-I8 HydrophobicContact CE1-CD1 3.81Å; F4-I8 PolarHBondContact O-N 3.22Å
5	V	70	Confident	52.5	Low	67 Å²	67	136.7 Å²	136.7	41%	0.406	68%	0.679	S	S	.	*	H	α-helix	trans	-59.5	-46.4	173.7	179	0	0	0	0	111.2	M1 K7 I8 N9	M1-V5 HydrophobicContact CB-CG2 4.26Å; M1-V5 PolarHBondContact O-N 3.15Å; M1-V5 VanDerWaalsContact O-N 3.16Å; V5-K7 VanDerWaalsContact C-N 3.26Å; V5-K7 PolarHBondContact O-N 2.92Å; V5-I8 PolarHBondContact O-N 3.22Å; V5-N9 WeakPolarHBondContact O-CB 3.41Å; V5-N9 PolarHBondContact O-N 3.27Å
6	R	67.8	Low	51.3	Low	176 Å²	176	141.9 Å²	141.9	66%	0.664	69%	0.688	S	S	*	*	H	α-helix	trans	-61.8	-30.9	173.4	-70.8	176.5	-142.1	-179.9	3.9	112.7	D2 F4 S10	D2-R6 WeakPolarHBondContact O-CB 3.46Å; D2-R6 WeakPolarHBondContact O-CG 3.21Å; D2-R6 PolarHBondContact O-N 2.89Å; F4-R6 PolarHBondContact O-N 3.25Å; R6-S10 WeakPolarHBondContact O-CB 3.42Å; R6-S10 PolarHBondContact O-N 3.43Å; R6-S10 PolarHBondContact O-OG 3.15Å
7	K	65	Low	50.3	Low	169 Å²	169	145.4 Å²	145.4	74%	0.735	70%	0.699	S	S	*	*	H	α-helix	trans	-82	-22.2	179.3	-164.7	163.8	-175.1	175.4	0	113.8	R3 F4 V5 S10	R3-K7 VanDerWaalsContact O-CB 3.24Å; R3-K7 WeakPolarHBondContact O-CB 3.27Å; R3-K7 PolarHBondContact O-N 3.09Å; F4-K7 CarbonylContact O-C 3.56Å; F4-K7 PolarHBondContact O-N 2.83Å; V5-K7 VanDerWaalsContact C-N 3.26Å; V5-K7 PolarHBondContact O-N 2.92Å; K7-S10 WeakPolarHBondContact CA-OG 3.36Å
8	I	56.9	Low	49.2	Very low	114 Å²	114	143.6 Å²	143.6	59%	0.585	70%	0.699	S	S	*	*	H	α-helix	trans	-79.4	-43	168	-68.1	170	0	0	0	110.2	F4 V5 S10	F4-I8 HydrophobicContact CD1-CD1 3.73Å; F4-I8 HydrophobicContact CD1-CG1 4.47Å; F4-I8 HydrophobicContact CE1-CD1 3.81Å; F4-I8 PolarHBondContact O-N 3.22Å; V5-I8 PolarHBondContact O-N 3.22Å; I8-S10 VanDerWaalsContact C-N 3.29Å; I8-S10 PolarHBondContact O-N 3.2Å
9	N	52.8	Low	48.4	Very low	130 Å²	130	145.2 Å²	145.2	70%	0.695	71%	0.71	S	S	*	*	H	α-helix	trans	-79.2	-8.4	-179.8	-64.9	-0.6	0	0	0	113.5	V5 S11	V5-N9 WeakPolarHBondContact O-CB 3.41Å; V5-N9 PolarHBondContact O-N 3.27Å; N9-S11 PolarHBondContact O-N 3.27Å
10	S	46.8	Very low	47.8	Very low	75 Å²	75	142.9 Å²	142.9	52%	0.524	71%	0.705	S	S	.	*			trans	-95.8	59.3	168.3	53.6	0	0	0	0	111.7	R6 K7 I8	R6-S10 WeakPolarHBondContact O-CB 3.42Å; R6-S10 PolarHBondContact O-N 3.43Å; R6-S10 PolarHBondContact O-OG 3.15Å; K7-S10 WeakPolarHBondContact CA-OG 3.36Å; I8-S10 VanDerWaalsContact C-N 3.29Å; I8-S10 PolarHBondContact O-N 3.2Å
11	S	38.5	Very low	47.1	Very low	96 Å²	96	145.2 Å²	145.2	67%	0.671	71%	0.714	S	S	*	*			trans	-53.9	131.2	162.4	-174.9	0	0	0	0	109.1	N9 K13	N9-S11 PolarHBondContact O-N 3.27Å; S11-K13 PolarHBondContact O-N 3.07Å; S11-K13 VanDerWaalsContact O-N 3.1Å
12	P	40.5	Very low	46.9	Very low	114 Å²	114	140.9 Å²	140.9	74%	0.74	70%	0.697	S	S	*	*			trans	-64.3	116.7	-172.8	24.9	-33.6	0	0	0	110.3	S14	P12-S14 PolarHBondContact O-N 2.69Å
13	K	34	Very low	46.9	Very low	191 Å²	191	142.3 Å²	142.3	83%	0.83	70%	0.701	S	S	*	*			trans	-66.6	82.3	171.6	-70.2	-176.6	179.1	178.6	0	109.4	S11 K15	S11-K13 PolarHBondContact O-N 3.07Å; S11-K13 VanDerWaalsContact O-N 3.1Å; K13-K15 PolarHBondContact O-N 2.96Å
14	S	37.3	Very low	47.7	Very low	108 Å²	108	135.2 Å²	135.2	76%	0.755	68%	0.68	S	S	*	*			trans	-69.3	72.6	174	-166.8	0	0	0	0	110.3	P12 R16	P12-S14 PolarHBondContact O-N 2.69Å; S14-R16 PolarHBondContact O-N 3.01Å
15	K	33	Very low	48.5	Very low	192 Å²	192	129.2 Å²	129.2	84%	0.835	65%	0.654	S	S	*	*			trans	-72.1	75.2	170.5	-79.2	-169.3	172	-171.5	0	109.4	K13	K13-K15 PolarHBondContact O-N 2.96Å
16	R	33.4	Very low	49.6	Very low	220 Å²	220	126.5 Å²	126.5	83%	0.83	64%	0.637	S	S	*	*			trans	-118.4	73.8	155.2	-77.6	-172.2	173.3	167.6	-1.7	109	S14 T18	S14-R16 PolarHBondContact O-N 3.01Å; R16-T18 PolarHBondContact O-N 3.09Å
17	K	33.1	Very low	50.7	Low	201 Å²	201	120.3 Å²	120.3	87%	0.874	63%	0.628	S	S	*	*			trans	-69.4	85.3	154	-77.8	-163.9	172.7	-164.1	0	107.2	L19	K17-L19 PolarHBondContact O-N 3.1Å
18	T	31.6	Very low	52	Low	114 Å²	114	113.4 Å²	113.4	70%	0.699	60%	0.6	S	S	*	*			trans	-62.9	122.3	158.9	-37.5	0	0	0	0	106	R16 V20	R16-T18 PolarHBondContact O-N 3.09Å; T18-V20 HydrophobicContact CG2-CG2 4.45Å; T18-V20 PolarHBondContact O-N 3.29Å
19	L	33.6	Very low	53.7	Low	174 Å²	174	111 Å²	111	91%	0.911	59%	0.591	S	S	*	*			trans	-76.8	70	178.7	-88.3	159.1	0	0	0	110.3	K17	K17-L19 PolarHBondContact O-N 3.1Å
20	V	35.5	Very low	55.6	Low	99 Å²	99	105.1 Å²	105.1	60%	0.6	56%	0.56	S	S	*	*			trans	-90.2	132.5	154	-178.5	0	0	0	0	106.1	T18 T22	T18-V20 HydrophobicContact CG2-CG2 4.45Å; T18-V20 PolarHBondContact O-N 3.29Å; V20-T22 HydrophobicContact CB-CG2 4.4Å; V20-T22 HydrophobicContact CG1-CG2 4.21Å; V20-T22 PolarHBondContact O-N 2.94Å
21	Q	34.2	Very low	57.6	Low	191 Å²	191	106.8 Å²	106.8	89%	0.893	56%	0.558	S	S	*	*			trans	-74.8	79.2	171.4	-71.1	170.6	-46.5	0	0	108.5	E23	Q21-E23 PolarHBondContact O-N 3.13Å
22	T	46.2	Very low	60.1	Low	80 Å²	80	105.1 Å²	105.1	49%	0.491	54%	0.544	S	S	.	.			trans	-70.5	115.1	175.1	50.1	0	0	0	0	109.3	V20 D24	V20-T22 HydrophobicContact CB-CG2 4.4Å; V20-T22 HydrophobicContact CG1-CG2 4.21Å; V20-T22 PolarHBondContact O-N 2.94Å; T22-D24 PolarHBondContact O-N 3.49Å
23	E	64	Low	62.3	Low	111 Å²	111	100.1 Å²	100.1	52%	0.519	51%	0.511	S	S	.	.			trans	-69	101.3	173.8	-66.5	-166.1	153.5	0	0	109.8	Q21 N25	Q21-E23 PolarHBondContact O-N 3.13Å; E23-N25 VanDerWaalsContact O-CG 3.25Å; E23-N25 PolarHBondContact O-N 3.15Å; E23-N25 VanDerWaalsContact O-N 3.1Å; E23-N25 PolarHBondContact O-ND2 2.71Å; E23-N25 PolarHBondContact O-OD1 3.49Å
24	D	79.8	Confident	64.9	Low	78 Å²	78	91.9 Å²	91.9	42%	0.417	48%	0.476	S	S	.	.			trans	-59.4	120.4	173.1	-87.4	-48.1	0	0	0	109.5	T22 V28 R36 Q81	T22-D24 PolarHBondContact O-N 3.49Å; D24-V28 HydrophobicContact CB-CG2 4Å; D24-V28 VanDerWaalsContact O-CG2 3.3Å; D24-V28 WeakPolarHBondContact O-CG2 3.44Å; D24-R36 PolarHBondContact O-NH1 3.25Å; D24-R36 PolarHBondContact O-NH2 3.12Å; D24-Q81 PolarHBondContact OD1-NE2 2.84Å
25	N	85.5	Confident	67.1	Low	13 Å²	13	91.5 Å²	91.5	7%	0.07	47%	0.465	C	S	.	.			trans	-109.2	0	-177.4	-67.4	-39.5	0	0	0	112.9	E23 R36 I45 F80 F106	E23-N25 VanDerWaalsContact O-CG 3.25Å; E23-N25 PolarHBondContact O-N 3.15Å; E23-N25 VanDerWaalsContact O-N 3.1Å; E23-N25 PolarHBondContact O-ND2 2.71Å; E23-N25 PolarHBondContact O-OD1 3.49Å; N25-R36 PolarHBondContact OD1-NH1 3.1Å; N25-I45 HydrophobicContact CB-CD1 3.45Å; N25-I45 VanDerWaalsContact CB-CD1 3.45Å; N25-F80 PolarHBondContact ND2-O 3.28Å; N25-F106 WeakPolarHBondContact O-CE2 3.36Å
26	F	92.1	Very high	69.4	Low	11 Å²	11	87 Å²	87	5%	0.048	44%	0.443	C	S	.	.	S	Bend	trans	-127.2	142.7	178.4	-78.6	-102.7	0	0	0	108.4	V28 K77 F80 Q81 V102 F106 E109	F26-V28 PolarHBondContact O-N 3.41Å; F26-K77 HydrophobicContact CD1-CD 4.01Å; F26-K77 HydrophobicContact CD1-CG 4.07Å; F26-K77 HydrophobicContact CD2-CG 4.04Å; F26-K77 HydrophobicContact CE1-CD 4.37Å; F26-K77 HydrophobicContact CE1-CG 4.16Å; F26-K77 HydrophobicContact CE2-CG 4.15Å; F26-K77 HydrophobicContact CG-CD 4.2Å; F26-K77 HydrophobicContact CG-CG 4.01Å; F26-K77 HydrophobicContact CZ-CB 4.46Å; F26-K77 HydrophobicContact CZ-CG 4.21Å; F26-F80 HydrophobicContact CE2-CB 3.85Å; F26-F80 HydrophobicContact CZ-CD2 4.47Å; F26-Q81 HydrophobicContact CD2-CG 4.09Å; F26-V102 HydrophobicContact CE1-CG1 4.11Å; F26-V102 HydrophobicContact CZ-CG1 3.7Å; F26-F106 HydrophobicContact CD1-CB 4.34Å; F26-F106 HydrophobicContact CD1-CD2 4.29Å; F26-F106 HydrophobicContact CE1-CB 3.79Å; F26-F106 HydrophobicContact CE1-CD2 4.15Å; F26-F106 HydrophobicContact CE1-CG 4.5Å; F26-F106 HydrophobicContact CZ-CB 4.39Å; F26-F106 HydrophobicContact CZ-CD2 4.33Å; F26-E109 WeakPolarHBondContact CB-OE2 3.04Å; F26-E109 WeakPolarHBondContact CD1-OE2 3.2Å
27	G	91.4	Very high	71.2	Confident	45 Å²	45	78.1 Å²	78.1	46%	0.464	41%	0.412	S	S	.	.	S	Bend	trans	76.5	3.5	-175	0	0	0	0	0	115.3	E109	G27-E109 WeakPolarHBondContact CA-O 3.3Å
28	V	91.7	Very high	72.8	Confident	25 Å²	25	73.3 Å²	73.3	15%	0.152	40%	0.403	C	S	.	.	S	Bend	trans	-102.7	142.5	-174.2	170.7	0	0	0	0	110.6	D24 F26 L30 V32 L33	D24-V28 HydrophobicContact CB-CG2 4Å; D24-V28 VanDerWaalsContact O-CG2 3.3Å; D24-V28 WeakPolarHBondContact O-CG2 3.44Å; F26-V28 PolarHBondContact O-N 3.41Å; V28-L30 PolarHBondContact O-N 2.9Å; V28-V32 HydrophobicContact CG1-CB 3.83Å; V28-V32 HydrophobicContact CG1-CG1 3.84Å; V28-L33 HydrophobicContact CB-CD2 4Å; V28-L33 HydrophobicContact CB-CG 4.33Å; V28-L33 HydrophobicContact CG1-CD2 3.78Å; V28-L33 HydrophobicContact CG1-CG 4.03Å
29	P	92.2	Very high	74.4	Confident	62 Å²	62	73.6 Å²	73.6	40%	0.403	41%	0.405	S	S	.	.			trans	-55.7	136.2	176.5	-25.5	34.1	0	0	0	112.3	K31 V32 L33 P111	P29-K31 PolarHBondContact O-N 3.17Å; P29-K31 VanDerWaalsContact O-N 3.13Å; P29-V32 HydrophobicContact CB-CG2 4.37Å; P29-V32 PolarHBondContact O-N 3.36Å; P29-L33 PolarHBondContact O-N 3.19Å; P29-P111 HydrophobicContact CB-CG 4.34Å; P29-P111 HydrophobicContact CG-CG 4.02Å
30	L	92.2	Very high	76.3	Confident	7 Å²	7	68.8 Å²	68.8	4%	0.037	38%	0.377	C	S	.	.	H	α-helix	trans	-54.8	-38.4	-173	-179.6	60.5	0	0	0	113.3	V28 V32 L33 L34 P43 L114 E151 N152 L155	V28-L30 PolarHBondContact O-N 2.9Å; L30-V32 PolarHBondContact O-N 2.73Å; L30-L33 WeakPolarHBondContact O-CB 3.12Å; L30-L33 PolarHBondContact O-N 3.21Å; L30-L34 PolarHBondContact O-N 3.34Å; L30-L34 VanDerWaalsContact O-N 3.08Å; L30-P43 HydrophobicContact CD1-CG 3.53Å; L30-L114 HydrophobicContact CD2-CD1 4.31Å; L30-E151 HydrophobicContact CD2-CB 4.15Å; L30-E151 VanDerWaalsContact CD2-O 3.32Å; L30-E151 WeakPolarHBondContact CD2-O 3.44Å; L30-E151 HydrophobicContact CG-CB 4.21Å; L30-N152 HydrophobicContact CD2-CB 4.46Å; L30-L155 HydrophobicContact CD1-CD2 3.63Å; L30-L155 HydrophobicContact CD2-CB 4.01Å; L30-L155 HydrophobicContact CD2-CD2 3.64Å; L30-L155 HydrophobicContact CD2-CG 4.45Å; L30-L155 HydrophobicContact CG-CD2 4.29Å
31	K	90.6	Very high	78.6	Confident	110 Å²	110	67.6 Å²	67.6	48%	0.478	37%	0.372	S	S	.	.	H	α-helix	trans	-54.5	-50.5	174.7	-176.1	178.9	-172	86.6	0	112.5	P29 L33 L34 D35 E151	P29-K31 PolarHBondContact O-N 3.17Å; P29-K31 VanDerWaalsContact O-N 3.13Å; K31-L33 PolarHBondContact O-N 3.28Å; K31-L34 CarbonylContact O-C 3.58Å; K31-L34 PolarHBondContact O-N 3.05Å; K31-D35 WeakPolarHBondContact CG-OD2 3.49Å; K31-D35 VanDerWaalsContact O-CG 3.24Å; K31-D35 PolarHBondContact O-N 2.97Å; K31-E151 HydrophobicContact CB-CG 4.33Å; K31-E151 WeakPolarHBondContact CD-OE1 3.44Å; K31-E151 HydrophobicContact CG-CG 4.48Å; K31-E151 WeakPolarHBondContact CG-OE1 3.45Å; K31-E151 IonicContact NZ-OE1 3.69Å; K31-E151 PolarHBondContact NZ-OE1 3.18Å
32	V	89.4	Confident	81.3	Confident	62 Å²	62	58.9 Å²	58.9	38%	0.376	33%	0.331	S	S	.	.	H	α-helix	trans	-63.7	-27.9	-179.3	178.5	0	0	0	0	111.9	V28 P29 L30 R36	V28-V32 HydrophobicContact CG1-CB 3.83Å; V28-V32 HydrophobicContact CG1-CG1 3.84Å; P29-V32 HydrophobicContact CB-CG2 4.37Å; P29-V32 PolarHBondContact O-N 3.36Å; L30-V32 PolarHBondContact O-N 2.73Å; V32-R36 WeakPolarHBondContact O-CG 3.47Å
33	L	87.7	Confident	83.5	Confident	9 Å²	9	55.4 Å²	55.4	5%	0.047	31%	0.31	C	S	.	.	H	α-helix	trans	-73.3	-38.4	172.8	-59.8	178.1	0	0	0	112.1	V28 P29 L30 K31 D37 P43 F106	V28-L33 HydrophobicContact CB-CD2 4Å; V28-L33 HydrophobicContact CB-CG 4.33Å; V28-L33 HydrophobicContact CG1-CD2 3.78Å; V28-L33 HydrophobicContact CG1-CG 4.03Å; P29-L33 PolarHBondContact O-N 3.19Å; L30-L33 WeakPolarHBondContact O-CB 3.12Å; L30-L33 PolarHBondContact O-N 3.21Å; K31-L33 PolarHBondContact O-N 3.28Å; L33-D37 WeakPolarHBondContact O-CB 3.46Å; L33-D37 PolarHBondContact O-N 3.18Å; L33-P43 HydrophobicContact CB-CB 4.46Å; L33-P43 HydrophobicContact CB-CG 4.26Å; L33-F106 HydrophobicContact CD1-CE2 3.77Å; L33-F106 HydrophobicContact CD1-CZ 3.71Å
34	L	87.4	Confident	84.6	Confident	17 Å²	17	53 Å²	53	9%	0.089	30%	0.296	C	S	.	.	H	α-helix	trans	-76.5	-32.2	177.2	-67.4	-177.6	0	0	0	113.1	L30 K31 R36 D37 S38 P43 E151	L30-L34 PolarHBondContact O-N 3.34Å; L30-L34 VanDerWaalsContact O-N 3.08Å; K31-L34 CarbonylContact O-C 3.58Å; K31-L34 PolarHBondContact O-N 3.05Å; L34-R36 PolarHBondContact O-N 3.03Å; L34-D37 CarbonylContact O-C 3.56Å; L34-D37 VanDerWaalsContact O-C 3.24Å; L34-D37 PolarHBondContact O-N 3.23Å; L34-S38 VanDerWaalsContact O-CA 3.23Å; L34-S38 WeakPolarHBondContact O-CA 3.47Å; L34-S38 PolarHBondContact O-N 3.37Å; L34-P43 HydrophobicContact CD2-CG 3.83Å; L34-P43 HydrophobicContact CG-CG 4.38Å; L34-E151 HydrophobicContact CD1-CB 3.75Å; L34-E151 HydrophobicContact CD1-CG 3.86Å
35	D	85.2	Confident	85.1	Confident	100 Å²	100	49.6 Å²	49.6	54%	0.535	28%	0.278	S	S	.	.	H	α-helix	trans	-62.1	-31.4	175.4	-67.7	-28.4	0	0	0	111.5	K31	K31-D35 WeakPolarHBondContact CG-OD2 3.49Å; K31-D35 VanDerWaalsContact O-CG 3.24Å; K31-D35 PolarHBondContact O-N 2.97Å
36	R	80.8	Confident	85.4	Confident	98 Å²	98	49 Å²	49	37%	0.37	28%	0.275	S	S	.	.	H	α-helix	trans	-73.2	-37.7	170.1	-64.6	174.8	-168	158.4	4.5	112.8	D24 N25 V32 L34	D24-R36 PolarHBondContact O-NH1 3.25Å; D24-R36 PolarHBondContact O-NH2 3.12Å; N25-R36 PolarHBondContact OD1-NH1 3.1Å; V32-R36 WeakPolarHBondContact O-CG 3.47Å; L34-R36 PolarHBondContact O-N 3.03Å
37	D	71.6	Confident	85.4	Confident	33 Å²	33	53.1 Å²	53.1	18%	0.176	29%	0.293	C	S	.	.	S	Bend	trans	-103.5	32.6	-170.9	-135.5	-14.8	0	0	0	111.3	L33 L34 T39 K40 R44	L33-D37 WeakPolarHBondContact O-CB 3.46Å; L33-D37 PolarHBondContact O-N 3.18Å; L34-D37 CarbonylContact O-C 3.56Å; L34-D37 VanDerWaalsContact O-C 3.24Å; L34-D37 PolarHBondContact O-N 3.23Å; D37-T39 PolarHBondContact O-N 2.86Å; D37-K40 PolarHBondContact O-N 3.29Å; D37-K40 VanDerWaalsContact O-N 3.08Å; D37-K40 IonicContact OD1-NZ 2.68Å; D37-K40 PolarHBondContact OD1-NZ 3.38Å; D37-R44 WeakPolarHBondContact OD2-CB 3.28Å; D37-R44 PolarHBondContact OD2-N 2.9Å
38	S	65.2	Low	85.4	Confident	100 Å²	100	51.9 Å²	51.9	70%	0.699	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	0.1	-157.6	62.9	0	0	0	0	118.5	L34	L34-S38 VanDerWaalsContact O-CA 3.23Å; L34-S38 WeakPolarHBondContact O-CA 3.47Å; L34-S38 PolarHBondContact O-N 3.37Å
39	T	66.9	Low	85.5	Confident	120 Å²	120	50.7 Å²	50.7	74%	0.736	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-3	174	53.3	0	0	0	0	113.6	D37	D37-T39 PolarHBondContact O-N 2.86Å
40	K	72.9	Confident	85.7	Confident	73 Å²	73	47.8 Å²	47.8	32%	0.317	25%	0.249	S	C	.	.			trans	-135	144.3	-169.6	-61.2	164.6	-155.6	144.9	0	112.3	D37 V42	D37-K40 PolarHBondContact O-N 3.29Å; D37-K40 VanDerWaalsContact O-N 3.08Å; D37-K40 IonicContact OD1-NZ 2.68Å; D37-K40 PolarHBondContact OD1-NZ 3.38Å; K40-V42 PolarHBondContact O-N 3.22Å
41	P	83.9	Confident	85.8	Confident	75 Å²	75	50.3 Å²	50.3	49%	0.487	26%	0.263	S	S	.	.	S	Bend	trans	-79.6	-1.6	175.5	33.7	-36.7	0	0	0	114	E154	P41-E154 HydrophobicContact CB-CB 4.09Å; P41-E154 HydrophobicContact CB-CG 4.32Å
42	V	91	Very high	85.9	Confident	8 Å²	8	45.4 Å²	45.4	5%	0.048	24%	0.241	C	C	.	.	S	Bend	trans	-143.9	134.4	-173.1	173.3	0	0	0	0	108.7	K40 V46 L155 Y158	K40-V42 PolarHBondContact O-N 3.22Å; V42-V46 HydrophobicContact CG1-CB 3.92Å; V42-V46 HydrophobicContact CG1-CG1 3.87Å; V42-L155 HydrophobicContact CG1-CD1 4.17Å; V42-Y158 HydrophobicContact CG1-CD1 3.98Å; V42-Y158 HydrophobicContact CG1-CE1 4.18Å; V42-Y158 HydrophobicContact CG1-CG 4.36Å; V42-Y158 HydrophobicContact CG2-CD1 4.22Å; V42-Y158 HydrophobicContact CG2-CD2 4.17Å; V42-Y158 HydrophobicContact CG2-CG 3.79Å
43	P	91.2	Very high	86.2	Confident	6 Å²	6	42.4 Å²	42.4	4%	0.039	22%	0.223	C	C	.	.			trans	-61.2	141	-177.8	-22.6	33.7	0	0	0	112.3	L30 L33 L34 I45 V46 K47 F106	L30-P43 HydrophobicContact CD1-CG 3.53Å; L33-P43 HydrophobicContact CB-CB 4.46Å; L33-P43 HydrophobicContact CB-CG 4.26Å; L34-P43 HydrophobicContact CD2-CG 3.83Å; L34-P43 HydrophobicContact CG-CG 4.38Å; P43-I45 VanDerWaalsContact C-N 3.26Å; P43-I45 PolarHBondContact O-N 3.06Å; P43-I45 VanDerWaalsContact O-N 3.13Å; P43-V46 PolarHBondContact O-N 3.49Å; P43-K47 PolarHBondContact O-N 3.17Å; P43-K47 VanDerWaalsContact O-N 3.17Å; P43-F106 HydrophobicContact CG-CZ 4.27Å
44	R	87.7	Confident	86.6	Confident	61 Å²	61	43.6 Å²	43.6	23%	0.23	23%	0.23	C	C	.	.	H	α-helix	trans	-54.1	-38.1	-174.5	-177.1	173.6	-175.4	-173.8	-3.9	113.5	D37 V46 K47 N48 A84 A85 D87	D37-R44 WeakPolarHBondContact OD2-CB 3.28Å; D37-R44 PolarHBondContact OD2-N 2.9Å; R44-V46 PolarHBondContact O-N 2.84Å; R44-K47 PolarHBondContact O-N 2.93Å; R44-N48 WeakPolarHBondContact O-CB 3.37Å; R44-N48 PolarHBondContact O-N 3.29Å; R44-N48 PolarHBondContact O-OD1 2.87Å; R44-A84 VanDerWaalsContact CD-O 3.31Å; R44-A84 WeakPolarHBondContact CD-O 3.11Å; R44-A85 PolarHBondContact NH2-O 2.82Å; R44-D87 IonicContact CZ-OD1 2.64Å; R44-D87 IonicContact NE-OD1 2.72Å; R44-D87 IonicContact NH2-OD1 2.73Å; R44-D87 PolarHBondContact NH2-OD1 3.07Å; R44-D87 IonicContact NH2-OD2 2.65Å; R44-D87 PolarHBondContact NH2-OD2 3.5Å; R44-D87 VanDerWaalsContact NH2-OD2 3.11Å
45	I	89.5	Confident	86.9	Confident	7 Å²	7	49.3 Å²	49.3	4%	0.036	26%	0.255	C	S	.	.	H	α-helix	trans	-60.5	-44.7	178.4	-66.3	159.1	0	0	0	111.4	N25 P43 I49 F80 A84	N25-I45 HydrophobicContact CB-CD1 3.45Å; N25-I45 VanDerWaalsContact CB-CD1 3.45Å; P43-I45 VanDerWaalsContact C-N 3.26Å; P43-I45 PolarHBondContact O-N 3.06Å; P43-I45 VanDerWaalsContact O-N 3.13Å; I45-I49 HydrophobicContact CG2-CD1 3.76Å; I45-I49 WeakPolarHBondContact O-CB 3.49Å; I45-I49 VanDerWaalsContact O-CG1 3.24Å; I45-I49 WeakPolarHBondContact O-CG1 3.38Å; I45-I49 PolarHBondContact O-N 3.4Å; I45-F80 HydrophobicContact CD1-CB 4Å; I45-F80 HydrophobicContact CG1-CB 4.19Å; I45-F80 HydrophobicContact CG1-CD1 4.29Å; I45-F80 HydrophobicContact CG1-CG 4.38Å; I45-F80 HydrophobicContact CG2-CB 4.37Å; I45-F80 HydrophobicContact CG2-CD1 4.34Å; I45-F80 HydrophobicContact CG2-CD2 4.21Å; I45-F80 HydrophobicContact CG2-CG 4.07Å; I45-A84 HydrophobicContact CD1-CB 3.96Å; I45-A84 HydrophobicContact CG1-CB 3.94Å
46	V	93.6	Very high	87.3	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	25%	0.249	C	C	.	.	H	α-helix	trans	-63.4	-46	177	175.5	0	0	0	0	110.1	V42 P43 R44 C50 L103 F106 L155 Y158	V42-V46 HydrophobicContact CG1-CB 3.92Å; V42-V46 HydrophobicContact CG1-CG1 3.87Å; P43-V46 PolarHBondContact O-N 3.49Å; R44-V46 PolarHBondContact O-N 2.84Å; V46-C50 WeakPolarHBondContact O-CB 3.2Å; V46-C50 PolarHBondContact O-N 3.12Å; V46-C50 PolarHBondContact O-SG 3.02Å; V46-L103 HydrophobicContact CG1-CD1 4.07Å; V46-L103 HydrophobicContact CG2-CD1 4.44Å; V46-F106 HydrophobicContact CG2-CD1 3.58Å; V46-F106 HydrophobicContact CG2-CE1 3.31Å; V46-F106 HydrophobicContact CG2-CG 4.32Å; V46-F106 HydrophobicContact CG2-CZ 3.85Å; V46-L155 HydrophobicContact CB-CD1 4.48Å; V46-L155 HydrophobicContact CG1-CD1 3.84Å; V46-L155 HydrophobicContact CG2-CD1 4.34Å; V46-Y158 HydrophobicContact CG1-CD1 4.32Å; V46-Y158 HydrophobicContact CG1-CE1 4.17Å
47	K	92.3	Very high	87.9	Confident	96 Å²	96	44.6 Å²	44.6	42%	0.417	23%	0.231	S	C	.	.	H	α-helix	trans	-61.3	-53.4	178.7	-178	171.3	179.2	-178.9	0	111.7	P43 R44 I49 C50 D51	P43-K47 PolarHBondContact O-N 3.17Å; P43-K47 VanDerWaalsContact O-N 3.17Å; R44-K47 PolarHBondContact O-N 2.93Å; K47-I49 VanDerWaalsContact C-N 3.31Å; K47-I49 PolarHBondContact O-N 2.73Å; K47-C50 PolarHBondContact O-N 2.87Å; K47-C50 VanDerWaalsContact O-N 3.15Å; K47-D51 WeakPolarHBondContact CE-OD2 3.31Å; K47-D51 VanDerWaalsContact CG-OD2 3.27Å; K47-D51 WeakPolarHBondContact CG-OD2 3.33Å; K47-D51 WeakPolarHBondContact O-CB 3.35Å; K47-D51 PolarHBondContact O-N 3.26Å
48	N	90.5	Very high	89.1	Confident	19 Å²	19	45.4 Å²	45.4	10%	0.102	24%	0.235	C	C	.	.	H	α-helix	trans	-56.8	-42.1	-179.2	-79.8	28.6	0	0	0	111.9	R44 Y52 D86 D87 L88	R44-N48 WeakPolarHBondContact O-CB 3.37Å; R44-N48 PolarHBondContact O-N 3.29Å; R44-N48 PolarHBondContact O-OD1 2.87Å; N48-Y52 WeakPolarHBondContact O-CB 3.37Å; N48-Y52 PolarHBondContact O-N 3.18Å; N48-Y52 VanDerWaalsContact O-N 3.13Å; N48-D86 PolarHBondContact ND2-O 3.1Å; N48-D87 PolarHBondContact ND2-OD1 3.44Å; N48-L88 HydrophobicContact CB-CD1 4.36Å
49	I	94.4	Very high	90.6	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-68.1	-46.8	176.3	-64.1	167.7	0	0	0	111.1	I45 K47 D51 Y52 L53 F80 L88 L99 V102 L103	I45-I49 HydrophobicContact CG2-CD1 3.76Å; I45-I49 WeakPolarHBondContact O-CB 3.49Å; I45-I49 VanDerWaalsContact O-CG1 3.24Å; I45-I49 WeakPolarHBondContact O-CG1 3.38Å; I45-I49 PolarHBondContact O-N 3.4Å; K47-I49 VanDerWaalsContact C-N 3.31Å; K47-I49 PolarHBondContact O-N 2.73Å; I49-D51 PolarHBondContact O-N 3.38Å; I49-Y52 PolarHBondContact O-N 2.95Å; I49-L53 HydrophobicContact CG2-CD1 3.72Å; I49-L53 HydrophobicContact CG2-CG 4.16Å; I49-L53 WeakPolarHBondContact O-CB 3.37Å; I49-L53 VanDerWaalsContact O-CG 3.25Å; I49-L53 WeakPolarHBondContact O-CG 3.29Å; I49-L53 PolarHBondContact O-N 3.46Å; I49-F80 HydrophobicContact CD1-CD2 4.46Å; I49-F80 HydrophobicContact CD1-CE2 3.8Å; I49-F80 HydrophobicContact CD1-CZ 4.06Å; I49-F80 HydrophobicContact CG1-CE2 4.19Å; I49-F80 HydrophobicContact CG1-CZ 3.95Å; I49-L88 HydrophobicContact CB-CD1 4.49Å; I49-L88 HydrophobicContact CG1-CD1 3.85Å; I49-L99 HydrophobicContact CG1-CD2 4.48Å; I49-L99 HydrophobicContact CG2-CB 4.34Å; I49-V102 HydrophobicContact CD1-CB 4.32Å; I49-V102 HydrophobicContact CD1-CG1 3.83Å; I49-L103 HydrophobicContact CG2-CB 4.07Å
50	C	95.6	Very high	92	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.8	-43.6	178.8	-78.9	0	0	0	0	112.5	V46 K47 L53 L54 Y158 F162	V46-C50 WeakPolarHBondContact O-CB 3.2Å; V46-C50 PolarHBondContact O-N 3.12Å; V46-C50 PolarHBondContact O-SG 3.02Å; K47-C50 PolarHBondContact O-N 2.87Å; K47-C50 VanDerWaalsContact O-N 3.15Å; C50-L53 PolarHBondContact O-N 2.79Å; C50-L54 WeakPolarHBondContact O-CG 3.48Å; C50-L54 PolarHBondContact O-N 3.01Å; C50-Y158 HydrophobicContact CB-CE1 3.91Å; C50-F162 HydrophobicContact CB-CD2 3.69Å; C50-F162 HydrophobicContact CB-CE2 3.82Å; C50-F162 HydrophobicContact CB-CG 4.18Å; C50-F162 HydrophobicContact CB-CZ 4.42Å; C50-F162 WeakPolarHBondContact O-CE2 3.28Å
51	D	93.5	Very high	93.1	Very high	61 Å²	61	43.2 Å²	43.2	33%	0.326	21%	0.212	S	C	.	.	H	α-helix	trans	-65.6	-41.2	179.4	-70.6	-16.6	0	0	0	111.1	K47 I49 L54 H55	K47-D51 WeakPolarHBondContact CE-OD2 3.31Å; K47-D51 VanDerWaalsContact CG-OD2 3.27Å; K47-D51 WeakPolarHBondContact CG-OD2 3.33Å; K47-D51 WeakPolarHBondContact O-CB 3.35Å; K47-D51 PolarHBondContact O-N 3.26Å; I49-D51 PolarHBondContact O-N 3.38Å; D51-L54 PolarHBondContact O-N 3.2Å; D51-H55 WeakPolarHBondContact O-CB 3.22Å; D51-H55 PolarHBondContact O-N 3.17Å
52	Y	94.1	Very high	93.8	Very high	6 Å²	6	40.1 Å²	40.1	2%	0.024	19%	0.193	C	C	.	.	H	α-helix	trans	-63.6	-43.2	172.4	-173.9	-80.1	0	0	0	112.2	N48 I49 L54 H55 Y56 L88 V94 L99	N48-Y52 WeakPolarHBondContact O-CB 3.37Å; N48-Y52 PolarHBondContact O-N 3.18Å; N48-Y52 VanDerWaalsContact O-N 3.13Å; I49-Y52 PolarHBondContact O-N 2.95Å; Y52-L54 VanDerWaalsContact C-N 3.33Å; Y52-L54 PolarHBondContact O-N 3.03Å; Y52-H55 PolarHBondContact O-N 2.89Å; Y52-Y56 HydrophobicContact CD1-CD2 4.03Å; Y52-Y56 AromaticContact CD2-CD2 3.53Å; Y52-Y56 HydrophobicContact CD2-CD2 3.53Å; Y52-Y56 AromaticContact CD2-CE2 3.72Å; Y52-Y56 HydrophobicContact CD2-CE2 3.72Å; Y52-Y56 AromaticContact CE1-CD2 3.9Å; Y52-Y56 HydrophobicContact CE1-CD2 3.9Å; Y52-Y56 HydrophobicContact CE1-CG 4.29Å; Y52-Y56 AromaticContact CE2-CD2 3.39Å; Y52-Y56 HydrophobicContact CE2-CD2 3.39Å; Y52-Y56 AromaticContact CE2-CE2 3.58Å; Y52-Y56 HydrophobicContact CE2-CE2 3.58Å; Y52-Y56 HydrophobicContact CE2-CG 4.3Å; Y52-Y56 AromaticContact CG-CD2 3.85Å; Y52-Y56 HydrophobicContact CG-CD2 3.85Å; Y52-Y56 HydrophobicContact CG-CE2 4.44Å; Y52-Y56 AromaticContact CZ-CD2 3.57Å; Y52-Y56 PolarHBondContact O-N 3.15Å; Y52-L88 HydrophobicContact CD2-CB 3.77Å; Y52-L88 WeakPolarHBondContact CD2-O 3.45Å; Y52-L88 WeakPolarHBondContact CE2-O 3.35Å; Y52-L88 HydrophobicContact CG-CB 4.18Å; Y52-V94 HydrophobicContact CE1-CB 4.12Å; Y52-V94 HydrophobicContact CE2-CB 4.33Å; Y52-V94 HydrophobicContact CE2-CG2 3.93Å; Y52-V94 WeakPolarHBondContact OH-CB 3.45Å; Y52-V94 WeakPolarHBondContact OH-CG2 3.43Å; Y52-V94 PolarHBondContact OH-N 2.96Å; Y52-L99 HydrophobicContact CD1-CD1 3.35Å; Y52-L99 HydrophobicContact CE1-CD1 3.59Å; Y52-L99 HydrophobicContact CG-CD1 4Å
53	L	95.8	Very high	94.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.191	C	C	.	.	I	π-helix	trans	-69.6	-28.4	178.9	-69.1	178.8	0	0	0	112.7	I49 C50 G57 L58 I63 F64 I96 L99 A100 F162	I49-L53 HydrophobicContact CG2-CD1 3.72Å; I49-L53 HydrophobicContact CG2-CG 4.16Å; I49-L53 WeakPolarHBondContact O-CB 3.37Å; I49-L53 VanDerWaalsContact O-CG 3.25Å; I49-L53 WeakPolarHBondContact O-CG 3.29Å; I49-L53 PolarHBondContact O-N 3.46Å; C50-L53 PolarHBondContact O-N 2.79Å; L53-G57 CarbonylContact O-C 3.58Å; L53-G57 VanDerWaalsContact O-C 3.3Å; L53-G57 WeakPolarHBondContact O-CA 3.5Å; L53-G57 PolarHBondContact O-N 3.08Å; L53-L58 PolarHBondContact O-N 3.45Å; L53-L58 VanDerWaalsContact O-N 3.11Å; L53-I63 HydrophobicContact CD2-CD1 4.23Å; L53-F64 HydrophobicContact CD1-CE1 4.09Å; L53-F64 HydrophobicContact CD1-CZ 3.66Å; L53-I96 HydrophobicContact CD2-CG2 3.77Å; L53-L99 HydrophobicContact CD2-CB 4.1Å; L53-A100 HydrophobicContact CD1-CB 4.29Å; L53-F162 HydrophobicContact CB-CE2 4.21Å; L53-F162 HydrophobicContact CB-CZ 4.07Å; L53-F162 HydrophobicContact CD1-CZ 4.3Å
54	L	95.4	Very high	94.4	Very high	34 Å²	34	39.4 Å²	39.4	18%	0.178	19%	0.189	C	C	.	.	I	π-helix	trans	-69.2	-44	167.9	-72.3	179.7	0	0	0	111.4	C50 D51 Y52 L58 F162 K165 I166	C50-L54 WeakPolarHBondContact O-CG 3.48Å; C50-L54 PolarHBondContact O-N 3.01Å; D51-L54 PolarHBondContact O-N 3.2Å; Y52-L54 VanDerWaalsContact C-N 3.33Å; Y52-L54 PolarHBondContact O-N 3.03Å; L54-L58 HydrophobicContact CD2-CD2 4.47Å; L54-L58 HydrophobicContact CD2-CG 4.46Å; L54-L58 VanDerWaalsContact O-CD1 3.23Å; L54-L58 WeakPolarHBondContact O-CD1 3.3Å; L54-L58 WeakPolarHBondContact O-CG 3.4Å; L54-F162 HydrophobicContact CD1-CD2 4.2Å; L54-F162 HydrophobicContact CD2-CD2 3.91Å; L54-F162 HydrophobicContact CD2-CE2 3.97Å; L54-F162 HydrophobicContact CG-CD2 3.83Å; L54-F162 HydrophobicContact CG-CE2 3.85Å; L54-K165 HydrophobicContact CD1-CD 3.99Å; L54-K165 HydrophobicContact CD2-CB 3.82Å; L54-K165 HydrophobicContact CD2-CD 3.97Å; L54-I166 HydrophobicContact CD2-CD1 4.22Å
55	H	93.2	Very high	94.9	Very high	136 Å²	136	44.9 Å²	44.9	63%	0.63	21%	0.21	S	C	*	.	I	π-helix	trans	-73.2	-40.5	-175.1	-164.5	-83.3	0	0	0	113.7	D51 Y52	D51-H55 WeakPolarHBondContact O-CB 3.22Å; D51-H55 PolarHBondContact O-N 3.17Å; Y52-H55 PolarHBondContact O-N 2.89Å
56	Y	93.8	Very high	95.2	Very high	100 Å²	100	48.2 Å²	48.2	39%	0.392	23%	0.227	S	C	.	.	I	π-helix	trans	-117.3	-25.9	-173.7	-56.9	-74.9	0	0	0	113.9	Y52	Y52-Y56 HydrophobicContact CD1-CD2 4.03Å; Y52-Y56 AromaticContact CD2-CD2 3.53Å; Y52-Y56 HydrophobicContact CD2-CD2 3.53Å; Y52-Y56 AromaticContact CD2-CE2 3.72Å; Y52-Y56 HydrophobicContact CD2-CE2 3.72Å; Y52-Y56 AromaticContact CE1-CD2 3.9Å; Y52-Y56 HydrophobicContact CE1-CD2 3.9Å; Y52-Y56 HydrophobicContact CE1-CG 4.29Å; Y52-Y56 AromaticContact CE2-CD2 3.39Å; Y52-Y56 HydrophobicContact CE2-CD2 3.39Å; Y52-Y56 AromaticContact CE2-CE2 3.58Å; Y52-Y56 HydrophobicContact CE2-CE2 3.58Å; Y52-Y56 HydrophobicContact CE2-CG 4.3Å; Y52-Y56 AromaticContact CG-CD2 3.85Å; Y52-Y56 HydrophobicContact CG-CD2 3.85Å; Y52-Y56 HydrophobicContact CG-CE2 4.44Å; Y52-Y56 AromaticContact CZ-CD2 3.57Å; Y52-Y56 PolarHBondContact O-N 3.15Å
57	G	93.9	Very high	95.3	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.256	C	S	.	.	I	π-helix	trans	-89.4	-16	-173.9	0	0	0	0	0	116	L53 N59 S60 I63	L53-G57 CarbonylContact O-C 3.58Å; L53-G57 VanDerWaalsContact O-C 3.3Å; L53-G57 WeakPolarHBondContact O-CA 3.5Å; L53-G57 PolarHBondContact O-N 3.08Å; G57-N59 PolarHBondContact O-N 2.89Å; G57-S60 WeakPolarHBondContact O-CB 3.39Å; G57-S60 PolarHBondContact O-N 3.2Å; G57-S60 PolarHBondContact O-OG 2.96Å; G57-I63 WeakPolarHBondContact O-CD1 3.33Å
58	L	95.9	Very high	95.4	Very high	49 Å²	49	49.8 Å²	49.8	26%	0.257	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-34.5	-170.5	-99.6	176.8	0	0	0	114.5	L53 L54 K165 I166 N169 N173	L53-L58 PolarHBondContact O-N 3.45Å; L53-L58 VanDerWaalsContact O-N 3.11Å; L54-L58 HydrophobicContact CD2-CD2 4.47Å; L54-L58 HydrophobicContact CD2-CG 4.46Å; L54-L58 VanDerWaalsContact O-CD1 3.23Å; L54-L58 WeakPolarHBondContact O-CD1 3.3Å; L54-L58 WeakPolarHBondContact O-CG 3.4Å; L58-K165 WeakPolarHBondContact CD2-O 3.2Å; L58-I166 HydrophobicContact CD2-CD1 3.98Å; L58-N169 HydrophobicContact CD2-CB 4.09Å; L58-N169 PolarHBondContact O-ND2 2.77Å; L58-N173 WeakPolarHBondContact O-CB 3.33Å; L58-N173 PolarHBondContact O-ND2 2.87Å
59	N	96.6	Very high	95.6	Very high	106 Å²	106	51.6 Å²	51.6	57%	0.567	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-4.3	-176.2	-67.8	-36.3	0	0	0	114.1	G57 Q61 N169 V172	G57-N59 PolarHBondContact O-N 2.89Å; N59-Q61 PolarHBondContact O-N 3.21Å; N59-N169 PolarHBondContact OD1-ND2 3.37Å; N59-V172 HydrophobicContact CB-CG1 3.94Å
60	S	96.6	Very high	95.7	Very high	19 Å²	19	54.7 Å²	54.7	13%	0.133	28%	0.283	C	S	.	.			trans	-71.8	113.6	-176.5	-62.7	0	0	0	0	111.3	G57 G62 I63 I96 N173	G57-S60 WeakPolarHBondContact O-CB 3.39Å; G57-S60 PolarHBondContact O-N 3.2Å; G57-S60 PolarHBondContact O-OG 2.96Å; S60-G62 PolarHBondContact O-N 3.49Å; S60-I63 WeakPolarHBondContact O-CB 3.35Å; S60-I63 PolarHBondContact O-N 3.48Å; S60-I63 VanDerWaalsContact O-N 3.11Å; S60-I96 WeakPolarHBondContact OG-CD1 3.14Å; S60-N173 WeakPolarHBondContact O-CB 3.16Å
61	Q	97.3	Very high	95.6	Very high	122 Å²	122	63 Å²	63	57%	0.57	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	131.3	178.3	-67.8	-172.6	12.1	0	0	110.9	N59 I63 I66 Y97 N173	N59-Q61 PolarHBondContact O-N 3.21Å; Q61-I63 VanDerWaalsContact C-N 3.31Å; Q61-I63 PolarHBondContact O-N 2.92Å; Q61-I66 WeakPolarHBondContact O-CD1 3.28Å; Q61-Y97 WeakPolarHBondContact O-CE1 3.32Å; Q61-Y97 PolarHBondContact O-OH 2.87Å; Q61-N173 CarbonylContact C-O 3.24Å; Q61-N173 WeakPolarHBondContact CA-O 3.5Å
62	G	96.9	Very high	95.7	Very high	10 Å²	10	63.7 Å²	63.7	10%	0.103	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	24.4	-178.8	0	0	0	0	0	114.5	S60 F64 R65 I66 N173	S60-G62 PolarHBondContact O-N 3.49Å; G62-F64 PolarHBondContact O-N 3.12Å; G62-R65 CarbonylContact O-C 3.42Å; G62-R65 WeakPolarHBondContact O-CA 3.29Å; G62-R65 WeakPolarHBondContact O-CB 3.37Å; G62-R65 PolarHBondContact O-N 2.98Å; G62-I66 PolarHBondContact O-N 3.08Å; G62-N173 PolarHBondContact N-O 3.37Å
63	I	98	Very high	95.7	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	139.3	172.7	-172.7	166.4	0	0	0	111	L53 G57 S60 Q61 R65 I96 A100 I166 N173 M175	L53-I63 HydrophobicContact CD2-CD1 4.23Å; G57-I63 WeakPolarHBondContact O-CD1 3.33Å; S60-I63 WeakPolarHBondContact O-CB 3.35Å; S60-I63 PolarHBondContact O-N 3.48Å; S60-I63 VanDerWaalsContact O-N 3.11Å; Q61-I63 VanDerWaalsContact C-N 3.31Å; Q61-I63 PolarHBondContact O-N 2.92Å; I63-R65 PolarHBondContact O-N 3.47Å; I63-I96 HydrophobicContact CD1-CG2 4.05Å; I63-A100 HydrophobicContact CG1-CB 4.31Å; I63-I166 HydrophobicContact CG2-CG2 3.73Å; I63-N173 HydrophobicContact CG2-CB 4.3Å; I63-M175 HydrophobicContact CG2-CB 4.49Å; I63-M175 HydrophobicContact CG2-CG 3.84Å; I63-M175 WeakPolarHBondContact O-CE 3.5Å; I63-M175 WeakPolarHBondContact O-CG 3.44Å
64	F	98.2	Very high	95.6	Very high	0 Å²	0	69 Å²	69	0%	0	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	-27.6	-166.7	-57.7	-71.2	0	0	0	117.2	L53 G62 A100 L103 K104 F162 L163 I166 L180 I183 F184	L53-F64 HydrophobicContact CD1-CE1 4.09Å; L53-F64 HydrophobicContact CD1-CZ 3.66Å; G62-F64 PolarHBondContact O-N 3.12Å; F64-A100 HydrophobicContact CD1-CB 3.62Å; F64-A100 HydrophobicContact CE1-CB 3.61Å; F64-A100 HydrophobicContact CG-CB 4.29Å; F64-A100 HydrophobicContact CZ-CB 4.29Å; F64-L103 HydrophobicContact CE1-CB 4.41Å; F64-L103 HydrophobicContact CE1-CD2 3.94Å; F64-L103 HydrophobicContact CZ-CD2 4.02Å; F64-K104 HydrophobicContact CD1-CD 4.34Å; F64-K104 HydrophobicContact CD1-CG 4.19Å; F64-K104 PolarHBondContact O-NZ 3.17Å; F64-F162 AromaticContact CE2-CE1 3.81Å; F64-F162 HydrophobicContact CE2-CE1 3.81Å; F64-F162 AromaticContact CE2-CZ 3.96Å; F64-F162 HydrophobicContact CE2-CZ 3.96Å; F64-F162 AromaticContact CZ-CE1 3.57Å; F64-F162 HydrophobicContact CZ-CE1 3.57Å; F64-F162 AromaticContact CZ-CZ 3.72Å; F64-F162 HydrophobicContact CZ-CZ 3.72Å; F64-L163 HydrophobicContact CD2-CD2 4.45Å; F64-L163 HydrophobicContact CE2-CD2 4.24Å; F64-I166 HydrophobicContact CE2-CG1 4.27Å; F64-L180 HydrophobicContact CB-CD2 4.38Å; F64-L180 HydrophobicContact CD2-CD2 4.12Å; F64-I183 HydrophobicContact CB-CG2 4.24Å; F64-F184 HydrophobicContact CB-CE2 3.95Å; F64-F184 HydrophobicContact CB-CZ 4.47Å; F64-F184 AromaticContact CD1-CE2 3.87Å; F64-F184 HydrophobicContact CD1-CE2 3.87Å; F64-F184 AromaticContact CD1-CZ 3.54Å; F64-F184 HydrophobicContact CD1-CZ 3.54Å; F64-F184 HydrophobicContact CD2-CE2 4.05Å; F64-F184 HydrophobicContact CD2-CZ 4.29Å; F64-F184 HydrophobicContact CE1-CE2 4.43Å; F64-F184 AromaticContact CE1-CZ 3.77Å; F64-F184 HydrophobicContact CE1-CZ 3.77Å; F64-F184 HydrophobicContact CE2-CZ 4.48Å; F64-F184 AromaticContact CG-CE2 3.67Å; F64-F184 HydrophobicContact CG-CE2 3.67Å; F64-F184 AromaticContact CG-CZ 3.84Å; F64-F184 HydrophobicContact CG-CZ 3.84Å; F64-F184 HydrophobicContact CZ-CZ 4.24Å
65	R	97.5	Very high	95.4	Very high	176 Å²	176	68.8 Å²	68.8	66%	0.664	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-44.8	175.5	-178.3	179.1	173.9	-176.7	-1.8	112.4	G62 I63 M175 I183	G62-R65 CarbonylContact O-C 3.42Å; G62-R65 WeakPolarHBondContact O-CA 3.29Å; G62-R65 WeakPolarHBondContact O-CB 3.37Å; G62-R65 PolarHBondContact O-N 2.98Å; I63-R65 PolarHBondContact O-N 3.47Å; R65-M175 HydrophobicContact CB-CE 3.8Å; R65-M175 HydrophobicContact CB-SD 3.73Å; R65-I183 HydrophobicContact CB-CD1 3.79Å; R65-I183 HydrophobicContact CG-CD1 4.46Å
66	I	97.2	Very high	95.3	Very high	77 Å²	77	64.1 Å²	64.1	40%	0.395	34%	0.335	S	S	.	.	S	Bend	trans	-77	138.6	172.7	-61.5	178.9	0	0	0	108.1	Q61 G62 Y97	Q61-I66 WeakPolarHBondContact O-CD1 3.28Å; G62-I66 PolarHBondContact O-N 3.08Å; I66-Y97 HydrophobicContact CB-CD1 3.67Å; I66-Y97 HydrophobicContact CB-CE1 3.76Å; I66-Y97 HydrophobicContact CB-CG 4.38Å; I66-Y97 HydrophobicContact CD1-CE1 3.97Å; I66-Y97 HydrophobicContact CG1-CE1 4.34Å; I66-Y97 HydrophobicContact CG2-CD1 3.77Å; I66-Y97 HydrophobicContact CG2-CD2 4.41Å; I66-Y97 HydrophobicContact CG2-CE1 4.01Å; I66-Y97 HydrophobicContact CG2-CG 3.97Å
67	N	94.7	Very high	95.2	Very high	115 Å²	115	61.3 Å²	61.3	62%	0.615	33%	0.325	S	S	*	.			trans	-96.9	130.6	176	-65.5	-42.2	0	0	0	109.7	K104	N67-K104 PolarHBondContact OD1-NZ 3.45Å
68	G	94.4	Very high	95	Very high	15 Å²	15	64.8 Å²	64.8	16%	0.155	35%	0.347	C	S	.	.			trans	-70.3	176.8	169.3	0	0	0	0	0	112.6	A70 Y97	G68-A70 PolarHBondContact O-N 3.21Å; G68-Y97 PolarHBondContact N-O 3.48Å; G68-Y97 VanDerWaalsContact N-O 3.16Å
69	S	95.5	Very high	94.5	Very high	57 Å²	57	65.1 Å²	65.1	40%	0.399	35%	0.351	S	S	.	.			trans	-61	123.3	177.6	177.5	0	0	0	0	111	K71 L72 I73	S69-K71 PolarHBondContact O-N 3.41Å; S69-L72 WeakPolarHBondContact O-CA 3.38Å; S69-L72 WeakPolarHBondContact O-CB 3.4Å; S69-L72 PolarHBondContact O-N 3.48Å; S69-I73 PolarHBondContact O-N 2.96Å
70	A	95.2	Very high	94.1	Very high	65 Å²	65	60.3 Å²	60.3	54%	0.537	33%	0.325	S	S	.	.	H	α-helix	trans	-53.3	-40.3	178	0	0	0	0	0	112.1	G68 L72 I73 D74	G68-A70 PolarHBondContact O-N 3.21Å; A70-L72 VanDerWaalsContact C-N 3.26Å; A70-L72 PolarHBondContact O-N 3.34Å; A70-I73 WeakPolarHBondContact O-CB 3.41Å; A70-I73 PolarHBondContact O-N 3.46Å; A70-I73 VanDerWaalsContact O-N 3.13Å; A70-D74 VanDerWaalsContact O-CG 3.26Å; A70-D74 PolarHBondContact O-N 3.25Å
71	K	94.9	Very high	93.5	Very high	175 Å²	175	61.7 Å²	61.7	76%	0.761	33%	0.329	S	S	*	.	H	α-helix	trans	-61.2	-31.6	175.7	-64	-177.2	179.4	-179.5	0	113.6	S69 G75	S69-K71 PolarHBondContact O-N 3.41Å; K71-G75 PolarHBondContact O-N 3.29Å; K71-G75 VanDerWaalsContact O-N 3.08Å
72	L	94	Very high	92.5	Very high	76 Å²	76	62.2 Å²	62.2	40%	0.398	33%	0.334	S	S	.	.	H	α-helix	trans	-79.3	-38.2	175.1	-65.4	-179.8	0	0	0	110.8	S69 A70 G75 F76 D95 A98	S69-L72 WeakPolarHBondContact O-CA 3.38Å; S69-L72 WeakPolarHBondContact O-CB 3.4Å; S69-L72 PolarHBondContact O-N 3.48Å; A70-L72 VanDerWaalsContact C-N 3.26Å; A70-L72 PolarHBondContact O-N 3.34Å; L72-G75 PolarHBondContact O-N 2.84Å; L72-F76 HydrophobicContact CB-CD2 4.33Å; L72-F76 HydrophobicContact CB-CE2 3.99Å; L72-F76 WeakPolarHBondContact O-CB 3.27Å; L72-F76 WeakPolarHBondContact O-CD2 3.34Å; L72-F76 WeakPolarHBondContact O-CG 3.38Å; L72-F76 PolarHBondContact O-N 3.24Å; L72-D95 HydrophobicContact CD1-CB 3.9Å; L72-D95 WeakPolarHBondContact CD1-OD2 3.32Å; L72-A98 HydrophobicContact CB-CB 3.79Å
73	I	94.6	Very high	91.3	Very high	24 Å²	24	63 Å²	63	12%	0.123	34%	0.339	C	S	.	.	H	α-helix	trans	-59	-47.7	173.3	-63.3	168.9	0	0	0	110.4	S69 A70 F76 K77 A98 V102 L105	S69-I73 PolarHBondContact O-N 2.96Å; A70-I73 WeakPolarHBondContact O-CB 3.41Å; A70-I73 PolarHBondContact O-N 3.46Å; A70-I73 VanDerWaalsContact O-N 3.13Å; I73-F76 PolarHBondContact O-N 2.91Å; I73-K77 WeakPolarHBondContact O-CB 3.25Å; I73-K77 PolarHBondContact O-N 3.36Å; I73-A98 HydrophobicContact CG1-CB 4.07Å; I73-V102 HydrophobicContact CB-CG2 4.4Å; I73-V102 HydrophobicContact CG2-CG2 3.99Å; I73-L105 HydrophobicContact CG2-CD2 3.86Å
74	D	93	Very high	89.7	Confident	93 Å²	93	64.4 Å²	64.4	50%	0.497	35%	0.35	S	S	.	.	H	α-helix	trans	-64.2	-39.3	176	-63	-31	0	0	0	111.8	A70 T78	A70-D74 VanDerWaalsContact O-CG 3.26Å; A70-D74 PolarHBondContact O-N 3.25Å; D74-T78 WeakPolarHBondContact O-CB 3.48Å; D74-T78 PolarHBondContact O-N 3Å; D74-T78 PolarHBondContact O-OG1 3.39Å
75	G	91.8	Very high	87.7	Confident	30 Å²	30	66.8 Å²	66.8	31%	0.309	37%	0.37	S	S	.	.	H	α-helix	trans	-63.8	-47.6	175.8	0	0	0	0	0	113.1	K71 L72 T78 T79	K71-G75 PolarHBondContact O-N 3.29Å; K71-G75 VanDerWaalsContact O-N 3.08Å; L72-G75 PolarHBondContact O-N 2.84Å; G75-T78 PolarHBondContact O-N 3.27Å; G75-T79 PolarHBondContact O-N 3.11Å; G75-T79 PolarHBondContact O-OG1 2.94Å
76	F	91.9	Very high	86.1	Confident	37 Å²	37	61.8 Å²	61.8	16%	0.162	36%	0.356	C	S	.	.	H	α-helix	trans	-65.4	-41.8	175.4	-69.7	-51.7	0	0	0	111.7	L72 I73 T78 T79 F80 V94 A98 L99 V102	L72-F76 HydrophobicContact CB-CD2 4.33Å; L72-F76 HydrophobicContact CB-CE2 3.99Å; L72-F76 WeakPolarHBondContact O-CB 3.27Å; L72-F76 WeakPolarHBondContact O-CD2 3.34Å; L72-F76 WeakPolarHBondContact O-CG 3.38Å; L72-F76 PolarHBondContact O-N 3.24Å; I73-F76 PolarHBondContact O-N 2.91Å; F76-T78 VanDerWaalsContact C-N 3.31Å; F76-T78 PolarHBondContact O-N 3.31Å; F76-T79 WeakPolarHBondContact O-CB 3.34Å; F76-T79 PolarHBondContact O-N 2.92Å; F76-T79 VanDerWaalsContact O-N 3.12Å; F76-F80 HydrophobicContact CB-CD2 4.37Å; F76-F80 HydrophobicContact CB-CE2 3.97Å; F76-F80 WeakPolarHBondContact O-CD2 3.49Å; F76-F80 WeakPolarHBondContact O-CG 3.36Å; F76-F80 PolarHBondContact O-N 3.48Å; F76-V94 HydrophobicContact CE1-CG1 3.63Å; F76-V94 HydrophobicContact CE2-CG1 4.04Å; F76-V94 HydrophobicContact CZ-CG1 3.3Å; F76-A98 HydrophobicContact CD2-CB 3.96Å; F76-A98 HydrophobicContact CE2-CB 3.75Å; F76-L99 HydrophobicContact CD2-CD2 4.35Å; F76-L99 HydrophobicContact CG-CD2 4.33Å; F76-V102 HydrophobicContact CB-CG2 3.72Å; F76-V102 HydrophobicContact CD2-CG2 4.47Å
77	K	91.5	Very high	84.4	Confident	41 Å²	41	62 Å²	62	18%	0.178	36%	0.358	C	S	.	.	H	α-helix	trans	-55.2	-47.5	172	176.5	173.2	174.1	175.6	0	111.3	F26 I73 T79 F80 Q81 L105 E109	F26-K77 HydrophobicContact CD1-CD 4.01Å; F26-K77 HydrophobicContact CD1-CG 4.07Å; F26-K77 HydrophobicContact CD2-CG 4.04Å; F26-K77 HydrophobicContact CE1-CD 4.37Å; F26-K77 HydrophobicContact CE1-CG 4.16Å; F26-K77 HydrophobicContact CE2-CG 4.15Å; F26-K77 HydrophobicContact CG-CD 4.2Å; F26-K77 HydrophobicContact CG-CG 4.01Å; F26-K77 HydrophobicContact CZ-CB 4.46Å; F26-K77 HydrophobicContact CZ-CG 4.21Å; I73-K77 WeakPolarHBondContact O-CB 3.25Å; I73-K77 PolarHBondContact O-N 3.36Å; K77-T79 VanDerWaalsContact C-N 3.32Å; K77-T79 PolarHBondContact O-N 3.42Å; K77-F80 PolarHBondContact O-N 3.07Å; K77-Q81 WeakPolarHBondContact O-CG 3.38Å; K77-Q81 PolarHBondContact O-N 2.97Å; K77-L105 HydrophobicContact CD-CD2 3.81Å; K77-E109 WeakPolarHBondContact CE-OE2 3.48Å; K77-E109 IonicContact NZ-OE1 2.64Å; K77-E109 PolarHBondContact NZ-OE1 3.46Å; K77-E109 IonicContact NZ-OE2 3.9Å; K77-E109 PolarHBondContact NZ-OE2 3.08Å
78	T	88.7	Confident	83.4	Confident	74 Å²	74	56.8 Å²	56.8	45%	0.454	33%	0.33	S	S	.	.	H	α-helix	trans	-61.6	-40.3	176.9	-52.1	0	0	0	0	111.6	D74 G75 F76 Q81 I82	D74-T78 WeakPolarHBondContact O-CB 3.48Å; D74-T78 PolarHBondContact O-N 3Å; D74-T78 PolarHBondContact O-OG1 3.39Å; G75-T78 PolarHBondContact O-N 3.27Å; F76-T78 VanDerWaalsContact C-N 3.31Å; F76-T78 PolarHBondContact O-N 3.31Å; T78-Q81 PolarHBondContact O-N 3.17Å; T78-I82 HydrophobicContact CG2-CD1 4.15Å; T78-I82 WeakPolarHBondContact O-CG1 3.45Å; T78-I82 PolarHBondContact O-N 2.93Å
79	T	87.1	Confident	81.9	Confident	56 Å²	56	59.5 Å²	59.5	34%	0.344	35%	0.346	S	S	.	.	H	α-helix	trans	-61.2	-50	175.9	-53.3	0	0	0	0	110.8	G75 F76 K77 Q81 I82 S83	G75-T79 PolarHBondContact O-N 3.11Å; G75-T79 PolarHBondContact O-OG1 2.94Å; F76-T79 WeakPolarHBondContact O-CB 3.34Å; F76-T79 PolarHBondContact O-N 2.92Å; F76-T79 VanDerWaalsContact O-N 3.12Å; K77-T79 VanDerWaalsContact C-N 3.32Å; K77-T79 PolarHBondContact O-N 3.42Å; T79-Q81 VanDerWaalsContact C-N 3.28Å; T79-Q81 PolarHBondContact O-N 3.46Å; T79-I82 PolarHBondContact O-N 2.85Å; T79-S83 PolarHBondContact O-N 3.18Å
80	F	87.7	Confident	80.4	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.018	36%	0.358	C	S	.	.	H	α-helix	trans	-68.4	-19.2	178.7	-63.2	-51.6	0	0	0	114.6	N25 F26 I45 I49 F76 K77 S83 L88 L99 V102	N25-F80 PolarHBondContact ND2-O 3.28Å; F26-F80 HydrophobicContact CE2-CB 3.85Å; F26-F80 HydrophobicContact CZ-CD2 4.47Å; I45-F80 HydrophobicContact CD1-CB 4Å; I45-F80 HydrophobicContact CG1-CB 4.19Å; I45-F80 HydrophobicContact CG1-CD1 4.29Å; I45-F80 HydrophobicContact CG1-CG 4.38Å; I45-F80 HydrophobicContact CG2-CB 4.37Å; I45-F80 HydrophobicContact CG2-CD1 4.34Å; I45-F80 HydrophobicContact CG2-CD2 4.21Å; I45-F80 HydrophobicContact CG2-CG 4.07Å; I49-F80 HydrophobicContact CD1-CD2 4.46Å; I49-F80 HydrophobicContact CD1-CE2 3.8Å; I49-F80 HydrophobicContact CD1-CZ 4.06Å; I49-F80 HydrophobicContact CG1-CE2 4.19Å; I49-F80 HydrophobicContact CG1-CZ 3.95Å; F76-F80 HydrophobicContact CB-CD2 4.37Å; F76-F80 HydrophobicContact CB-CE2 3.97Å; F76-F80 WeakPolarHBondContact O-CD2 3.49Å; F76-F80 WeakPolarHBondContact O-CG 3.36Å; F76-F80 PolarHBondContact O-N 3.48Å; K77-F80 PolarHBondContact O-N 3.07Å; F80-S83 WeakPolarHBondContact CA-O 3.16Å; F80-L88 HydrophobicContact CE1-CD1 4.19Å; F80-L88 HydrophobicContact CE1-CD2 3.94Å; F80-L88 HydrophobicContact CE1-CG 4.22Å; F80-L88 HydrophobicContact CZ-CD1 3.81Å; F80-L88 HydrophobicContact CZ-CD2 3.8Å; F80-L88 HydrophobicContact CZ-CG 4.2Å; F80-L99 HydrophobicContact CE2-CD2 4.41Å; F80-L99 HydrophobicContact CZ-CD2 4.25Å; F80-V102 HydrophobicContact CD2-CG1 3.98Å; F80-V102 HydrophobicContact CE2-CG1 3.93Å
81	Q	84.2	Confident	79.3	Confident	48 Å²	48	62 Å²	62	22%	0.224	35%	0.352	C	S	.	.	H	α-helix	trans	-79.4	-22.3	168.9	-75.1	178.3	-83.8	0	0	113.2	D24 F26 K77 T78 T79	D24-Q81 PolarHBondContact OD1-NE2 2.84Å; F26-Q81 HydrophobicContact CD2-CG 4.09Å; K77-Q81 WeakPolarHBondContact O-CG 3.38Å; K77-Q81 PolarHBondContact O-N 2.97Å; T78-Q81 PolarHBondContact O-N 3.17Å; T79-Q81 VanDerWaalsContact C-N 3.28Å; T79-Q81 PolarHBondContact O-N 3.46Å
82	I	76.6	Confident	78.2	Confident	133 Å²	133	61.5 Å²	61.5	68%	0.682	35%	0.353	S	S	*	.	H	α-helix	trans	-92.7	-39.9	176.5	-64.7	166.9	0	0	0	110.6	T78 T79	T78-I82 HydrophobicContact CG2-CD1 4.15Å; T78-I82 WeakPolarHBondContact O-CG1 3.45Å; T78-I82 PolarHBondContact O-N 2.93Å; T79-I82 PolarHBondContact O-N 2.85Å
83	S	70.8	Confident	77.5	Confident	28 Å²	28	65.1 Å²	65.1	20%	0.196	37%	0.373	C	S	.	.			trans	-141.6	106.7	177	-179	0	0	0	0	110.4	T79 F80 A85 D86	T79-S83 PolarHBondContact O-N 3.18Å; F80-S83 WeakPolarHBondContact CA-O 3.16Å; S83-A85 PolarHBondContact O-N 3.04Å; S83-A85 PolarHBondContact OG-N 2.93Å; S83-A85 VanDerWaalsContact OG-N 3.11Å; S83-D86 WeakPolarHBondContact CB-OD1 3.44Å; S83-D86 PolarHBondContact OG-N 3.48Å; S83-D86 PolarHBondContact OG-OD1 3.33Å
84	A	64.5	Low	77.2	Confident	29 Å²	29	64.6 Å²	64.6	24%	0.24	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-3.5	161.3	0	0	0	0	0	112.4	R44 I45	R44-A84 VanDerWaalsContact CD-O 3.31Å; R44-A84 WeakPolarHBondContact CD-O 3.11Å; I45-A84 HydrophobicContact CD1-CB 3.96Å; I45-A84 HydrophobicContact CG1-CB 3.94Å
85	A	56.6	Low	77.3	Confident	50 Å²	50	62.3 Å²	62.3	41%	0.413	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-4.5	-168.7	0	0	0	0	0	114.8	R44 S83 D87	R44-A85 PolarHBondContact NH2-O 2.82Å; S83-A85 PolarHBondContact O-N 3.04Å; S83-A85 PolarHBondContact OG-N 2.93Å; S83-A85 VanDerWaalsContact OG-N 3.11Å; A85-D87 PolarHBondContact O-N 3.4Å
86	D	62.3	Low	77.4	Confident	71 Å²	71	62.4 Å²	62.4	38%	0.38	35%	0.352	S	S	.	.			trans	-73	107.7	179.1	-68.5	10	0	0	0	109.7	N48 S83 L88	N48-D86 PolarHBondContact ND2-O 3.1Å; S83-D86 WeakPolarHBondContact CB-OD1 3.44Å; S83-D86 PolarHBondContact OG-N 3.48Å; S83-D86 PolarHBondContact OG-OD1 3.33Å; D86-L88 PolarHBondContact O-N 3.47Å
87	D	62.9	Low	77.7	Confident	80 Å²	80	63.7 Å²	63.7	43%	0.428	36%	0.356	S	S	.	.			trans	-75.7	98.3	178.2	-71.5	-32.4	0	0	0	110.1	R44 N48 A85 C89 S90	R44-D87 IonicContact CZ-OD1 2.64Å; R44-D87 IonicContact NE-OD1 2.72Å; R44-D87 IonicContact NH2-OD1 2.73Å; R44-D87 PolarHBondContact NH2-OD1 3.07Å; R44-D87 IonicContact NH2-OD2 2.65Å; R44-D87 PolarHBondContact NH2-OD2 3.5Å; R44-D87 VanDerWaalsContact NH2-OD2 3.11Å; N48-D87 PolarHBondContact ND2-OD1 3.44Å; A85-D87 PolarHBondContact O-N 3.4Å; D87-C89 PolarHBondContact O-N 3.48Å; D87-S90 WeakPolarHBondContact O-CB 3.44Å; D87-S90 PolarHBondContact O-N 2.97Å; D87-S90 PolarHBondContact O-OG 3.02Å
88	L	73.2	Confident	77.9	Confident	6 Å²	6	61.7 Å²	61.7	3%	0.031	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-48.6	-29.3	-178.6	-63.5	173.2	0	0	0	114	N48 I49 Y52 F80 D86 S90 L91 L99	N48-L88 HydrophobicContact CB-CD1 4.36Å; I49-L88 HydrophobicContact CB-CD1 4.49Å; I49-L88 HydrophobicContact CG1-CD1 3.85Å; Y52-L88 HydrophobicContact CD2-CB 3.77Å; Y52-L88 WeakPolarHBondContact CD2-O 3.45Å; Y52-L88 WeakPolarHBondContact CE2-O 3.35Å; Y52-L88 HydrophobicContact CG-CB 4.18Å; F80-L88 HydrophobicContact CE1-CD1 4.19Å; F80-L88 HydrophobicContact CE1-CD2 3.94Å; F80-L88 HydrophobicContact CE1-CG 4.22Å; F80-L88 HydrophobicContact CZ-CD1 3.81Å; F80-L88 HydrophobicContact CZ-CD2 3.8Å; F80-L88 HydrophobicContact CZ-CG 4.2Å; D86-L88 PolarHBondContact O-N 3.47Å; L88-S90 PolarHBondContact O-N 3.35Å; L88-S90 VanDerWaalsContact O-N 3.1Å; L88-L91 PolarHBondContact O-N 3.37Å; L88-L99 HydrophobicContact CD1-CD1 4.34Å; L88-L99 HydrophobicContact CD1-CD2 4.07Å; L88-L99 HydrophobicContact CD2-CD2 4.47Å
89	C	63.6	Low	78.2	Confident	72 Å²	72	58.2 Å²	58.2	49%	0.486	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-60.7	-14.8	175.8	-56.6	0	0	0	0	114.1	D87	D87-C89 PolarHBondContact O-N 3.48Å
90	S	64.3	Low	78.7	Confident	95 Å²	95	55.5 Å²	55.5	66%	0.664	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-87.4	-13.9	172.3	66	0	0	0	0	114.2	D87 L88	D87-S90 WeakPolarHBondContact O-CB 3.44Å; D87-S90 PolarHBondContact O-N 2.97Å; D87-S90 PolarHBondContact O-OG 3.02Å; L88-S90 PolarHBondContact O-N 3.35Å; L88-S90 VanDerWaalsContact O-N 3.1Å
91	L	71.6	Confident	79.2	Confident	79 Å²	79	55.6 Å²	55.6	41%	0.414	31%	0.311	S	S	.	.			trans	-95.8	112.9	175.6	-67.8	95.1	0	0	0	109.7	L88 V94	L88-L91 PolarHBondContact O-N 3.37Å; L91-V94 HydrophobicContact CB-CG2 3.51Å; L91-V94 WeakPolarHBondContact O-CG2 3.19Å
92	E	71.2	Confident	79.7	Confident	165 Å²	165	53.3 Å²	53.3	77%	0.771	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	150.3	166.5	-60.5	-174.5	166	0	0	110.7	V94	E92-V94 PolarHBondContact O-N 3.47Å
93	N	79.6	Confident	80.7	Confident	152 Å²	152	47 Å²	47	81%	0.813	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	27.1	171.2	-47.8	-75.5	0	0	0	116.6
94	V	88.6	Confident	81.9	Confident	14 Å²	14	46.8 Å²	46.8	9%	0.085	26%	0.264	C	S	.	.			trans	-67.8	136.3	172.6	-161.2	0	0	0	0	111.2	Y52 F76 L91 E92 I96 L99	Y52-V94 HydrophobicContact CE1-CB 4.12Å; Y52-V94 HydrophobicContact CE2-CB 4.33Å; Y52-V94 HydrophobicContact CE2-CG2 3.93Å; Y52-V94 WeakPolarHBondContact OH-CB 3.45Å; Y52-V94 WeakPolarHBondContact OH-CG2 3.43Å; Y52-V94 PolarHBondContact OH-N 2.96Å; F76-V94 HydrophobicContact CE1-CG1 3.63Å; F76-V94 HydrophobicContact CE2-CG1 4.04Å; F76-V94 HydrophobicContact CZ-CG1 3.3Å; L91-V94 HydrophobicContact CB-CG2 3.51Å; L91-V94 WeakPolarHBondContact O-CG2 3.19Å; E92-V94 PolarHBondContact O-N 3.47Å; V94-I96 PolarHBondContact O-N 3.31Å; V94-L99 HydrophobicContact CB-CD1 4.09Å; V94-L99 HydrophobicContact CG1-CD1 3.69Å; V94-L99 HydrophobicContact CG1-CD2 4.22Å; V94-L99 HydrophobicContact CG1-CG 3.84Å
95	D	93.7	Very high	83.4	Confident	45 Å²	45	46.2 Å²	46.2	24%	0.241	26%	0.257	C	S	.	.			trans	-62.2	107.4	177	176.6	-3.3	0	0	0	111.2	L72 Y97 A98 L99	L72-D95 HydrophobicContact CD1-CB 3.9Å; L72-D95 WeakPolarHBondContact CD1-OD2 3.32Å; D95-Y97 VanDerWaalsContact C-N 3.31Å; D95-Y97 PolarHBondContact O-N 3Å; D95-Y97 WeakPolarHBondContact OD1-CA 3.46Å; D95-Y97 WeakPolarHBondContact OD1-CB 3.48Å; D95-Y97 PolarHBondContact OD1-N 3Å; D95-A98 HydrophobicContact CB-CB 3.79Å; D95-A98 VanDerWaalsContact CG-CB 3.49Å; D95-A98 PolarHBondContact O-N 3.13Å; D95-A98 PolarHBondContact OD1-N 3.21Å; D95-A98 WeakPolarHBondContact OD2-CB 3.35Å; D95-L99 PolarHBondContact O-N 3.19Å
96	I	95.9	Very high	85.2	Confident	32 Å²	32	44 Å²	44	16%	0.164	24%	0.238	C	C	.	.	H	α-helix	trans	-61	-37.6	-179	-62.9	164.1	0	0	0	111.5	L53 S60 I63 V94 A100	L53-I96 HydrophobicContact CD2-CG2 3.77Å; S60-I96 WeakPolarHBondContact OG-CD1 3.14Å; I63-I96 HydrophobicContact CD1-CG2 4.05Å; V94-I96 PolarHBondContact O-N 3.31Å; I96-A100 WeakPolarHBondContact O-CB 3.49Å; I96-A100 PolarHBondContact O-N 3.48Å
97	Y	97.3	Very high	86.8	Confident	63 Å²	63	40.6 Å²	40.6	25%	0.247	22%	0.219	C	C	.	.	H	α-helix	trans	-76	-28.5	179.1	-56.7	-68.3	0	0	0	111.8	Q61 I66 G68 D95 G101	Q61-Y97 WeakPolarHBondContact O-CE1 3.32Å; Q61-Y97 PolarHBondContact O-OH 2.87Å; I66-Y97 HydrophobicContact CB-CD1 3.67Å; I66-Y97 HydrophobicContact CB-CE1 3.76Å; I66-Y97 HydrophobicContact CB-CG 4.38Å; I66-Y97 HydrophobicContact CD1-CE1 3.97Å; I66-Y97 HydrophobicContact CG1-CE1 4.34Å; I66-Y97 HydrophobicContact CG2-CD1 3.77Å; I66-Y97 HydrophobicContact CG2-CD2 4.41Å; I66-Y97 HydrophobicContact CG2-CE1 4.01Å; I66-Y97 HydrophobicContact CG2-CG 3.97Å; G68-Y97 PolarHBondContact N-O 3.48Å; G68-Y97 VanDerWaalsContact N-O 3.16Å; D95-Y97 VanDerWaalsContact C-N 3.31Å; D95-Y97 PolarHBondContact O-N 3Å; D95-Y97 WeakPolarHBondContact OD1-CA 3.46Å; D95-Y97 WeakPolarHBondContact OD1-CB 3.48Å; D95-Y97 PolarHBondContact OD1-N 3Å; Y97-G101 PolarHBondContact O-N 3.49Å
98	A	96.3	Very high	88.3	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-71.9	-47.7	171	0	0	0	0	0	111.2	L72 I73 F76 D95 A100 G101 V102	L72-A98 HydrophobicContact CB-CB 3.79Å; I73-A98 HydrophobicContact CG1-CB 4.07Å; F76-A98 HydrophobicContact CD2-CB 3.96Å; F76-A98 HydrophobicContact CE2-CB 3.75Å; D95-A98 HydrophobicContact CB-CB 3.79Å; D95-A98 VanDerWaalsContact CG-CB 3.49Å; D95-A98 PolarHBondContact O-N 3.13Å; D95-A98 PolarHBondContact OD1-N 3.21Å; D95-A98 WeakPolarHBondContact OD2-CB 3.35Å; A98-A100 VanDerWaalsContact C-N 3.34Å; A98-A100 PolarHBondContact O-N 2.88Å; A98-G101 CarbonylContact O-C 3.58Å; A98-G101 VanDerWaalsContact O-CA 3.25Å; A98-G101 WeakPolarHBondContact O-CA 3.2Å; A98-G101 PolarHBondContact O-N 3.35Å; A98-V102 WeakPolarHBondContact O-CG2 3.45Å; A98-V102 PolarHBondContact O-N 3.32Å
99	L	95.1	Very high	89.3	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.1	-42.9	174.3	-74.3	-179.2	0	0	0	112.3	I49 Y52 L53 F76 F80 L88 V94 D95 G101 V102 L103	I49-L99 HydrophobicContact CG1-CD2 4.48Å; I49-L99 HydrophobicContact CG2-CB 4.34Å; Y52-L99 HydrophobicContact CD1-CD1 3.35Å; Y52-L99 HydrophobicContact CE1-CD1 3.59Å; Y52-L99 HydrophobicContact CG-CD1 4Å; L53-L99 HydrophobicContact CD2-CB 4.1Å; F76-L99 HydrophobicContact CD2-CD2 4.35Å; F76-L99 HydrophobicContact CG-CD2 4.33Å; F80-L99 HydrophobicContact CE2-CD2 4.41Å; F80-L99 HydrophobicContact CZ-CD2 4.25Å; L88-L99 HydrophobicContact CD1-CD1 4.34Å; L88-L99 HydrophobicContact CD1-CD2 4.07Å; L88-L99 HydrophobicContact CD2-CD2 4.47Å; V94-L99 HydrophobicContact CB-CD1 4.09Å; V94-L99 HydrophobicContact CG1-CD1 3.69Å; V94-L99 HydrophobicContact CG1-CD2 4.22Å; V94-L99 HydrophobicContact CG1-CG 3.84Å; D95-L99 PolarHBondContact O-N 3.19Å; L99-G101 PolarHBondContact O-N 2.89Å; L99-V102 PolarHBondContact O-N 3.22Å; L99-V102 VanDerWaalsContact O-N 3.13Å; L99-L103 PolarHBondContact O-N 3.24Å
100	A	97.3	Very high	90.7	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.8	-30.5	171.8	0	0	0	0	0	112.6	L53 I63 F64 I96 A98 K104	L53-A100 HydrophobicContact CD1-CB 4.29Å; I63-A100 HydrophobicContact CG1-CB 4.31Å; F64-A100 HydrophobicContact CD1-CB 3.62Å; F64-A100 HydrophobicContact CE1-CB 3.61Å; F64-A100 HydrophobicContact CG-CB 4.29Å; F64-A100 HydrophobicContact CZ-CB 4.29Å; I96-A100 WeakPolarHBondContact O-CB 3.49Å; I96-A100 PolarHBondContact O-N 3.48Å; A98-A100 VanDerWaalsContact C-N 3.34Å; A98-A100 PolarHBondContact O-N 2.88Å; A100-K104 WeakPolarHBondContact O-CE 3.15Å; A100-K104 WeakPolarHBondContact O-CG 3.25Å; A100-K104 PolarHBondContact O-N 3.08Å
101	G	97.1	Very high	92	Very high	6 Å²	6	40.8 Å²	40.8	6%	0.062	20%	0.198	C	C	.	.	H	α-helix	trans	-67.7	-43.6	169.8	0	0	0	0	0	113.3	Y97 A98 L99 K104 L105	Y97-G101 PolarHBondContact O-N 3.49Å; A98-G101 CarbonylContact O-C 3.58Å; A98-G101 VanDerWaalsContact O-CA 3.25Å; A98-G101 WeakPolarHBondContact O-CA 3.2Å; A98-G101 PolarHBondContact O-N 3.35Å; L99-G101 PolarHBondContact O-N 2.89Å; G101-K104 PolarHBondContact O-N 3.4Å; G101-L105 WeakPolarHBondContact O-CB 3.28Å; G101-L105 PolarHBondContact O-N 3.18Å
102	V	95.8	Very high	92.7	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64	-41.2	178.3	179.1	0	0	0	0	111.5	F26 I49 I73 F76 F80 A98 L99 K104 L105 F106	F26-V102 HydrophobicContact CE1-CG1 4.11Å; F26-V102 HydrophobicContact CZ-CG1 3.7Å; I49-V102 HydrophobicContact CD1-CB 4.32Å; I49-V102 HydrophobicContact CD1-CG1 3.83Å; I73-V102 HydrophobicContact CB-CG2 4.4Å; I73-V102 HydrophobicContact CG2-CG2 3.99Å; F76-V102 HydrophobicContact CB-CG2 3.72Å; F76-V102 HydrophobicContact CD2-CG2 4.47Å; F80-V102 HydrophobicContact CD2-CG1 3.98Å; F80-V102 HydrophobicContact CE2-CG1 3.93Å; A98-V102 WeakPolarHBondContact O-CG2 3.45Å; A98-V102 PolarHBondContact O-N 3.32Å; L99-V102 PolarHBondContact O-N 3.22Å; L99-V102 VanDerWaalsContact O-N 3.13Å; V102-K104 PolarHBondContact O-N 2.96Å; V102-L105 WeakPolarHBondContact O-CB 3.31Å; V102-L105 PolarHBondContact O-N 3.26Å; V102-L105 VanDerWaalsContact O-N 3.13Å; V102-F106 PolarHBondContact O-N 2.98Å
103	L	96.9	Very high	93.7	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-62.3	-43.1	176.1	-177.4	60	0	0	0	112	V46 I49 F64 L99 L105 L107 F162	V46-L103 HydrophobicContact CG1-CD1 4.07Å; V46-L103 HydrophobicContact CG2-CD1 4.44Å; I49-L103 HydrophobicContact CG2-CB 4.07Å; F64-L103 HydrophobicContact CE1-CB 4.41Å; F64-L103 HydrophobicContact CE1-CD2 3.94Å; F64-L103 HydrophobicContact CZ-CD2 4.02Å; L99-L103 PolarHBondContact O-N 3.24Å; L103-L105 VanDerWaalsContact C-N 3.29Å; L103-L105 PolarHBondContact O-N 3.43Å; L103-L107 WeakPolarHBondContact O-CG 3.17Å; L103-L107 PolarHBondContact O-N 3.25Å; L103-F162 HydrophobicContact CD2-CE1 3.98Å; L103-F162 HydrophobicContact CD2-CZ 4.49Å
104	K	96.9	Very high	94.4	Very high	23 Å²	23	27.2 Å²	27.2	10%	0.1	13%	0.132	C	C	.	.	H	α-helix	trans	-62.8	-35.9	172.9	-69.1	-177.8	-60.4	177.5	0	112	F64 N67 A100 G101 V102 R108 I183 F184	F64-K104 HydrophobicContact CD1-CD 4.34Å; F64-K104 HydrophobicContact CD1-CG 4.19Å; F64-K104 PolarHBondContact O-NZ 3.17Å; N67-K104 PolarHBondContact OD1-NZ 3.45Å; A100-K104 WeakPolarHBondContact O-CE 3.15Å; A100-K104 WeakPolarHBondContact O-CG 3.25Å; A100-K104 PolarHBondContact O-N 3.08Å; G101-K104 PolarHBondContact O-N 3.4Å; V102-K104 PolarHBondContact O-N 2.96Å; K104-R108 WeakPolarHBondContact O-CB 3.22Å; K104-R108 PolarHBondContact O-N 2.86Å; K104-I183 HydrophobicContact CD-CG2 3.83Å; K104-F184 HydrophobicContact CG-CE1 4.4Å; K104-F184 HydrophobicContact CG-CZ 4.28Å
105	L	95.2	Very high	94.7	Very high	16 Å²	16	26.5 Å²	26.5	8%	0.084	13%	0.128	C	C	.	.	H	α-helix	trans	-68.5	-47	178.6	-174.6	62.3	0	0	0	111.8	I73 K77 G101 V102 L103 L107 R108 E109	I73-L105 HydrophobicContact CG2-CD2 3.86Å; K77-L105 HydrophobicContact CD-CD2 3.81Å; G101-L105 WeakPolarHBondContact O-CB 3.28Å; G101-L105 PolarHBondContact O-N 3.18Å; V102-L105 WeakPolarHBondContact O-CB 3.31Å; V102-L105 PolarHBondContact O-N 3.26Å; V102-L105 VanDerWaalsContact O-N 3.13Å; L103-L105 VanDerWaalsContact C-N 3.29Å; L103-L105 PolarHBondContact O-N 3.43Å; L105-L107 PolarHBondContact O-N 2.91Å; L105-R108 PolarHBondContact O-N 3.3Å; L105-E109 HydrophobicContact CD1-CG 4.16Å; L105-E109 WeakPolarHBondContact CD1-OE1 3.23Å; L105-E109 HydrophobicContact CG-CG 4.45Å; L105-E109 WeakPolarHBondContact O-CG 3.33Å; L105-E109 PolarHBondContact O-N 3.43Å
106	F	95.3	Very high	94.7	Very high	3 Å²	3	26 Å²	26	1%	0.013	13%	0.128	C	C	.	.	H	α-helix	trans	-54.1	-52.7	177.5	176.2	-91.1	0	0	0	111.7	N25 F26 L33 P43 V46 V102 R108 E109 L110 L155	N25-F106 WeakPolarHBondContact O-CE2 3.36Å; F26-F106 HydrophobicContact CD1-CB 4.34Å; F26-F106 HydrophobicContact CD1-CD2 4.29Å; F26-F106 HydrophobicContact CE1-CB 3.79Å; F26-F106 HydrophobicContact CE1-CD2 4.15Å; F26-F106 HydrophobicContact CE1-CG 4.5Å; F26-F106 HydrophobicContact CZ-CB 4.39Å; F26-F106 HydrophobicContact CZ-CD2 4.33Å; L33-F106 HydrophobicContact CD1-CE2 3.77Å; L33-F106 HydrophobicContact CD1-CZ 3.71Å; P43-F106 HydrophobicContact CG-CZ 4.27Å; V46-F106 HydrophobicContact CG2-CD1 3.58Å; V46-F106 HydrophobicContact CG2-CE1 3.31Å; V46-F106 HydrophobicContact CG2-CG 4.32Å; V46-F106 HydrophobicContact CG2-CZ 3.85Å; V102-F106 PolarHBondContact O-N 2.98Å; F106-R108 VanDerWaalsContact C-N 3.29Å; F106-R108 PolarHBondContact O-N 3.45Å; F106-E109 PolarHBondContact O-N 3.4Å; F106-E109 VanDerWaalsContact O-N 3.15Å; F106-L110 HydrophobicContact CE1-CD2 3.97Å; F106-L110 HydrophobicContact CZ-CD2 3.99Å; F106-L110 PolarHBondContact O-N 3.33Å; F106-L110 VanDerWaalsContact O-N 3.15Å; F106-L155 HydrophobicContact CE1-CD2 4.39Å
107	L	95.8	Very high	94.4	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59.7	-38.5	-179.7	-67	172.4	0	0	0	112.7	L103 L105 L114 L155 L159 F184	L103-L107 WeakPolarHBondContact O-CG 3.17Å; L103-L107 PolarHBondContact O-N 3.25Å; L105-L107 PolarHBondContact O-N 2.91Å; L107-L114 HydrophobicContact CD2-CD2 4.01Å; L107-L155 HydrophobicContact CD2-CD2 4.42Å; L107-L159 HydrophobicContact CD1-CD1 4.19Å; L107-L159 HydrophobicContact CD1-CD2 3.68Å; L107-L159 HydrophobicContact CD2-CD2 4.28Å; L107-F184 HydrophobicContact CD1-CD1 4.01Å; L107-F184 HydrophobicContact CD1-CE1 3.85Å
108	R	94.2	Very high	94.1	Very high	150 Å²	150	33.2 Å²	33.2	57%	0.566	16%	0.16	S	C	*	.	H	α-helix	trans	-74.9	-25.2	179.2	-171.4	177.8	66.1	-158.8	1	113.4	K104 L105 F106	K104-R108 WeakPolarHBondContact O-CB 3.22Å; K104-R108 PolarHBondContact O-N 2.86Å; L105-R108 PolarHBondContact O-N 3.3Å; F106-R108 VanDerWaalsContact C-N 3.29Å; F106-R108 PolarHBondContact O-N 3.45Å
109	E	93.8	Very high	93.9	Very high	55 Å²	55	34.5 Å²	34.5	26%	0.257	17%	0.167	S	C	.	.	H	α-helix	trans	-88.6	-16.9	178.7	-71.1	-176.5	174.3	0	0	113.8	F26 G27 K77 L105 F106 P111	F26-E109 WeakPolarHBondContact CB-OE2 3.04Å; F26-E109 WeakPolarHBondContact CD1-OE2 3.2Å; G27-E109 WeakPolarHBondContact CA-O 3.3Å; K77-E109 WeakPolarHBondContact CE-OE2 3.48Å; K77-E109 IonicContact NZ-OE1 2.64Å; K77-E109 PolarHBondContact NZ-OE1 3.46Å; K77-E109 IonicContact NZ-OE2 3.9Å; K77-E109 PolarHBondContact NZ-OE2 3.08Å; L105-E109 HydrophobicContact CD1-CG 4.16Å; L105-E109 WeakPolarHBondContact CD1-OE1 3.23Å; L105-E109 HydrophobicContact CG-CG 4.45Å; L105-E109 WeakPolarHBondContact O-CG 3.33Å; L105-E109 PolarHBondContact O-N 3.43Å; F106-E109 PolarHBondContact O-N 3.4Å; F106-E109 VanDerWaalsContact O-N 3.15Å; E109-P111 WeakPolarHBondContact O-CD 3.2Å; E109-P111 VanDerWaalsContact O-N 3.11Å
110	L	93.6	Very high	93.8	Very high	5 Å²	5	34.7 Å²	34.7	3%	0.026	17%	0.169	C	C	.	.				6.2	88.5	126	27.7	138.4	0	0	0	117.7	F106 D112 G113 L114 L155 R190	F106-L110 HydrophobicContact CE1-CD2 3.97Å; F106-L110 HydrophobicContact CZ-CD2 3.99Å; F106-L110 PolarHBondContact O-N 3.33Å; F106-L110 VanDerWaalsContact O-N 3.15Å; L110-D112 PolarHBondContact O-N 3.4Å; L110-G113 PolarHBondContact O-N 3.15Å; L110-L114 HydrophobicContact CD1-CB 4.31Å; L110-L155 HydrophobicContact CD1-CD2 4.41Å; L110-R190 PolarHBondContact O-NH1 3.38Å
111	P	91.1	Very high	93.5	Very high	47 Å²	47	39 Å²	39	31%	0.305	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-49.4	-176.6	15.4	-30.1	0	0	0	113	P29 E109 R190	P29-P111 HydrophobicContact CB-CG 4.34Å; P29-P111 HydrophobicContact CG-CG 4.02Å; E109-P111 WeakPolarHBondContact O-CD 3.2Å; E109-P111 VanDerWaalsContact O-N 3.11Å; P111-R190 PolarHBondContact O-NH1 3.2Å; P111-R190 PolarHBondContact O-NH2 3.06Å
112	D	86.4	Confident	93.3	Very high	105 Å²	105	44.2 Å²	44.2	56%	0.561	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.3	1	175.7	-54.4	-71.6	0	0	0	113.6	L110 P116 R190	L110-D112 PolarHBondContact O-N 3.4Å; D112-P116 HydrophobicContact CB-CG 4.34Å; D112-P116 WeakPolarHBondContact O-CA 3.48Å; D112-R190 VanDerWaalsContact O-CB 3.24Å; D112-R190 WeakPolarHBondContact O-CB 3.44Å; D112-R190 WeakPolarHBondContact O-CG 3.44Å
113	G	91.7	Very high	93.2	Very high	6 Å²	6	44.2 Å²	44.2	6%	0.062	21%	0.212	C	C	.	.			trans	71.5	179.7	-162.3	0	0	0	0	0	113.3	L110	L110-G113 PolarHBondContact O-N 3.15Å
114	L	95.3	Very high	93.1	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.215	C	C	.	.	S	Bend	trans	-80.4	-39.7	176.7	-179.3	55.4	0	0	0	111.7	L30 L107 L110 N152 L155 L156 L159 V188	L30-L114 HydrophobicContact CD2-CD1 4.31Å; L107-L114 HydrophobicContact CD2-CD2 4.01Å; L110-L114 HydrophobicContact CD1-CB 4.31Å; L114-N152 HydrophobicContact CD1-CB 4.18Å; L114-N152 PolarHBondContact O-ND2 2.94Å; L114-L155 HydrophobicContact CD1-CB 4.02Å; L114-L155 HydrophobicContact CD1-CD2 3.78Å; L114-L155 HydrophobicContact CD1-CG 3.84Å; L114-L155 HydrophobicContact CD2-CG 4.14Å; L114-L156 HydrophobicContact CD2-CB 4.14Å; L114-L156 HydrophobicContact CD2-CD1 3.95Å; L114-L156 HydrophobicContact CG-CB 4.32Å; L114-L156 HydrophobicContact CG-CD1 4.42Å; L114-L159 HydrophobicContact CD2-CD2 3.98Å; L114-V188 HydrophobicContact CB-CG1 4.29Å; L114-V188 HydrophobicContact CD2-CG1 4.27Å; L114-V188 HydrophobicContact CD2-CG2 4.41Å; L114-V188 HydrophobicContact CG-CG1 4.43Å; L114-V188 PolarHBondContact N-O 3.16Å
115	V	95	Very high	92.9	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-109.6	106.1	166.6	178.9	0	0	0	0	107.9	L119 L148 L156 V188 F189 R190	V115-L119 HydrophobicContact CG1-CB 4.09Å; V115-L148 HydrophobicContact CG1-CD2 4.48Å; V115-L148 HydrophobicContact CG2-CD1 4.45Å; V115-L156 HydrophobicContact CG2-CD1 4.49Å; V115-L156 HydrophobicContact CG2-CD2 3.88Å; V115-V188 HydrophobicContact CG2-CG1 3.86Å; V115-V188 PolarHBondContact N-O 3.15Å; V115-F189 HydrophobicContact CB-CD1 3.86Å; V115-F189 HydrophobicContact CB-CE1 4.09Å; V115-F189 HydrophobicContact CB-CG 4.39Å; V115-F189 HydrophobicContact CG1-CD1 3.72Å; V115-F189 HydrophobicContact CG1-CE1 3.79Å; V115-F189 HydrophobicContact CG2-CD1 4.4Å; V115-F189 HydrophobicContact CG2-CE1 4.19Å; V115-F189 HydrophobicContact CG2-CZ 4.48Å; V115-R190 PolarHBondContact O-N 2.91Å
116	P	92.5	Very high	92.9	Very high	35 Å²	35	49.5 Å²	49.5	23%	0.227	24%	0.236	C	C	.	.			trans	-59.1	148.7	178.4	-26.2	35.5	0	0	0	112.7	D112 K118 L119 G120	D112-P116 HydrophobicContact CB-CG 4.34Å; D112-P116 WeakPolarHBondContact O-CA 3.48Å; P116-K118 VanDerWaalsContact C-N 3.3Å; P116-K118 PolarHBondContact O-N 3.26Å; P116-K118 VanDerWaalsContact O-N 3.16Å; P116-L119 HydrophobicContact CB-CD1 4.17Å; P116-L119 HydrophobicContact CG-CD1 4.38Å; P116-L119 WeakPolarHBondContact O-CA 3.4Å; P116-L119 PolarHBondContact O-N 2.85Å; P116-G120 PolarHBondContact O-N 3.07Å
117	E	90.2	Very high	92.8	Very high	71 Å²	71	49.3 Å²	49.3	33%	0.332	24%	0.235	S	C	.	.	H	α-helix	trans	-51.9	-44.2	-170.8	-177.4	175.8	173.9	0	0	113.4	L119 G120 L121 R190 S192	E117-L119 PolarHBondContact O-N 3.41Å; E117-G120 PolarHBondContact O-N 3.39Å; E117-G120 VanDerWaalsContact O-N 3.08Å; E117-L121 HydrophobicContact CG-CD1 4.38Å; E117-L121 WeakPolarHBondContact O-CG 3.33Å; E117-L121 PolarHBondContact O-N 3.29Å; E117-R190 HydrophobicContact CB-CB 4.37Å; E117-S192 WeakPolarHBondContact OE1-CB 3.48Å; E117-S192 PolarHBondContact OE1-OG 3.42Å
118	K	90.5	Very high	92.6	Very high	175 Å²	175	55.1 Å²	55.1	76%	0.761	26%	0.26	S	S	*	.	H	α-helix	trans	-58.7	-30.5	177.6	-65.5	-175.2	179.4	-178.2	0	113.4	P116 K122	P116-K118 VanDerWaalsContact C-N 3.3Å; P116-K118 PolarHBondContact O-N 3.26Å; P116-K118 VanDerWaalsContact O-N 3.16Å; K118-K122 WeakPolarHBondContact O-CG 3.42Å
119	L	92.6	Very high	92.6	Very high	26 Å²	26	52.5 Å²	52.5	14%	0.136	26%	0.255	C	S	.	.	H	α-helix	trans	-87.2	-35.7	173.4	-69.3	100	0	0	0	111.7	V115 P116 E117 L121 K122 C123 T147 L148	V115-L119 HydrophobicContact CG1-CB 4.09Å; P116-L119 HydrophobicContact CB-CD1 4.17Å; P116-L119 HydrophobicContact CG-CD1 4.38Å; P116-L119 WeakPolarHBondContact O-CA 3.4Å; P116-L119 PolarHBondContact O-N 2.85Å; E117-L119 PolarHBondContact O-N 3.41Å; L119-L121 VanDerWaalsContact C-N 3.29Å; L119-L121 PolarHBondContact O-N 3.27Å; L119-K122 WeakPolarHBondContact O-CA 3.28Å; L119-K122 WeakPolarHBondContact O-CB 3.31Å; L119-K122 PolarHBondContact O-N 3.07Å; L119-C123 PolarHBondContact O-N 3.3Å; L119-C123 PolarHBondContact O-SG 2.99Å; L119-C123 VanDerWaalsContact O-SG 3.38Å; L119-T147 VanDerWaalsContact CD2-OG1 3.29Å; L119-T147 WeakPolarHBondContact CD2-OG1 3.4Å; L119-L148 HydrophobicContact CD1-CD2 4.43Å; L119-L148 HydrophobicContact CD2-CD2 3.88Å; L119-L148 HydrophobicContact CD2-CG 4.02Å
120	G	92.2	Very high	92.6	Very high	5 Å²	5	53.4 Å²	53.4	5%	0.052	26%	0.256	C	S	.	.	H	α-helix	trans	-54.1	-45.2	171.9	0	0	0	0	0	112.2	P116 E117 K122 C123 I124	P116-G120 PolarHBondContact O-N 3.07Å; E117-G120 PolarHBondContact O-N 3.39Å; E117-G120 VanDerWaalsContact O-N 3.08Å; G120-K122 PolarHBondContact O-N 2.82Å; G120-C123 PolarHBondContact O-N 2.89Å; G120-I124 WeakPolarHBondContact O-CD1 3.24Å; G120-I124 VanDerWaalsContact O-CG1 3.27Å; G120-I124 WeakPolarHBondContact O-CG1 3.14Å; G120-I124 PolarHBondContact O-N 2.86Å
121	L	91.7	Very high	92.3	Very high	89 Å²	89	56 Å²	56	47%	0.466	27%	0.274	S	S	.	.	H	α-helix	trans	-62.3	-38	174.7	-67.5	173.6	0	0	0	112.9	E117 L119 I124 K125	E117-L121 HydrophobicContact CG-CD1 4.38Å; E117-L121 WeakPolarHBondContact O-CG 3.33Å; E117-L121 PolarHBondContact O-N 3.29Å; L119-L121 VanDerWaalsContact C-N 3.29Å; L119-L121 PolarHBondContact O-N 3.27Å; L121-I124 HydrophobicContact CD2-CD1 4.44Å; L121-I124 PolarHBondContact O-N 3.41Å; L121-K125 PolarHBondContact O-N 2.73Å
122	K	93	Very high	92.3	Very high	116 Å²	116	59.4 Å²	59.4	50%	0.504	30%	0.299	S	S	.	.	H	α-helix	trans	-65.6	-42.7	173	-70.6	178.6	179.9	-175.4	0	111.9	K118 L119 G120 I124 K125 V126 V144	K118-K122 WeakPolarHBondContact O-CG 3.42Å; L119-K122 WeakPolarHBondContact O-CA 3.28Å; L119-K122 WeakPolarHBondContact O-CB 3.31Å; L119-K122 PolarHBondContact O-N 3.07Å; G120-K122 PolarHBondContact O-N 2.82Å; K122-I124 VanDerWaalsContact C-N 3.32Å; K122-I124 PolarHBondContact O-N 3.42Å; K122-K125 PolarHBondContact O-N 3.25Å; K122-V126 WeakPolarHBondContact O-CG2 3.31Å; K122-V126 PolarHBondContact O-N 3.22Å; K122-V144 HydrophobicContact CB-CG1 3.61Å; K122-V144 HydrophobicContact CB-CG2 4.12Å; K122-V144 HydrophobicContact CD-CG1 4.4Å
123	C	94.2	Very high	92.6	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.5	-38.3	173.9	-64	0	0	0	0	112	L119 G120 V126 A127 L141 V144 F189 I207	L119-C123 PolarHBondContact O-N 3.3Å; L119-C123 PolarHBondContact O-SG 2.99Å; L119-C123 VanDerWaalsContact O-SG 3.38Å; G120-C123 PolarHBondContact O-N 2.89Å; C123-V126 PolarHBondContact O-N 3.25Å; C123-A127 WeakPolarHBondContact O-CB 3.48Å; C123-A127 PolarHBondContact O-N 3.27Å; C123-L141 HydrophobicContact CB-CD1 4.01Å; C123-V144 VanDerWaalsContact SG-CG1 3.59Å; C123-F189 HydrophobicContact CB-CE1 4.34Å; C123-I207 HydrophobicContact CB-CD1 4.04Å; C123-I207 HydrophobicContact CB-CG2 4.35Å; C123-I207 WeakPolarHBondContact O-CD1 3.34Å
124	I	93.3	Very high	92.6	Very high	14 Å²	14	60.9 Å²	60.9	7%	0.072	31%	0.306	C	S	.	.	H	α-helix	trans	-64.5	-40.5	174	-70.7	158.5	0	0	0	111.2	G120 L121 K122 A127 K128 N200 L203 I207	G120-I124 WeakPolarHBondContact O-CD1 3.24Å; G120-I124 VanDerWaalsContact O-CG1 3.27Å; G120-I124 WeakPolarHBondContact O-CG1 3.14Å; G120-I124 PolarHBondContact O-N 2.86Å; L121-I124 HydrophobicContact CD2-CD1 4.44Å; L121-I124 PolarHBondContact O-N 3.41Å; K122-I124 VanDerWaalsContact C-N 3.32Å; K122-I124 PolarHBondContact O-N 3.42Å; I124-A127 PolarHBondContact O-N 3.49Å; I124-K128 HydrophobicContact CG2-CD 4.3Å; I124-K128 WeakPolarHBondContact O-CG 3.39Å; I124-K128 PolarHBondContact O-N 3.03Å; I124-N200 HydrophobicContact CD1-CB 3.95Å; I124-N200 HydrophobicContact CG2-CB 4.39Å; I124-L203 HydrophobicContact CG2-CD1 4.11Å; I124-I207 HydrophobicContact CG1-CD1 3.96Å
125	K	93.1	Very high	92.5	Very high	126 Å²	126	64.7 Å²	64.7	55%	0.548	33%	0.332	S	S	.	.	H	α-helix	trans	-60.7	-51	173.3	-176.3	171.7	179.9	175.4	0	111	L121 K122 A127 K128 E129	L121-K125 PolarHBondContact O-N 2.73Å; K122-K125 PolarHBondContact O-N 3.25Å; K125-A127 VanDerWaalsContact C-N 3.29Å; K125-A127 PolarHBondContact O-N 2.93Å; K125-K128 PolarHBondContact O-N 3.25Å; K125-E129 VanDerWaalsContact CE-CD 3.41Å; K125-E129 WeakPolarHBondContact CE-OE1 3.35Å; K125-E129 WeakPolarHBondContact CE-OE2 3.46Å; K125-E129 HydrophobicContact CG-CG 4.4Å; K125-E129 WeakPolarHBondContact CG-OE2 3.46Å; K125-E129 IonicContact NZ-OE1 3.76Å; K125-E129 WeakPolarHBondContact O-CG 3.08Å; K125-E129 PolarHBondContact O-N 3Å
126	V	94.3	Very high	92.4	Very high	11 Å²	11	67 Å²	67	7%	0.067	35%	0.347	C	S	.	.	H	α-helix	trans	-56.6	-39.2	175.9	167.6	0	0	0	0	112.6	K122 C123 Y130 Y137 K140 L141 V144	K122-V126 WeakPolarHBondContact O-CG2 3.31Å; K122-V126 PolarHBondContact O-N 3.22Å; C123-V126 PolarHBondContact O-N 3.25Å; V126-Y130 HydrophobicContact CB-CD2 4.49Å; V126-Y130 HydrophobicContact CG1-CD2 4.2Å; V126-Y130 PolarHBondContact O-N 2.9Å; V126-Y137 HydrophobicContact CG1-CD2 3.86Å; V126-Y137 HydrophobicContact CG1-CE2 4.16Å; V126-K140 HydrophobicContact CG1-CB 3.74Å; V126-K140 HydrophobicContact CG2-CB 4.04Å; V126-L141 HydrophobicContact CG1-CB 4.25Å; V126-V144 HydrophobicContact CG2-CG2 3.94Å
127	A	93.6	Very high	92.5	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-70.9	-28.6	176.5	0	0	0	0	0	113.9	C123 I124 K125 S131 Y137 Y206 I207	C123-A127 WeakPolarHBondContact O-CB 3.48Å; C123-A127 PolarHBondContact O-N 3.27Å; I124-A127 PolarHBondContact O-N 3.49Å; K125-A127 VanDerWaalsContact C-N 3.29Å; K125-A127 PolarHBondContact O-N 2.93Å; A127-S131 WeakPolarHBondContact O-CB 3.29Å; A127-S131 PolarHBondContact O-OG 2.95Å; A127-Y137 HydrophobicContact CB-CE2 3.97Å; A127-Y206 HydrophobicContact CB-CD1 4.4Å; A127-Y206 HydrophobicContact CB-CE1 4.49Å; A127-I207 HydrophobicContact CB-CD1 3.85Å; A127-I207 HydrophobicContact CB-CG1 3.73Å
128	K	92.8	Very high	92.8	Very high	121 Å²	121	63 Å²	63	53%	0.526	33%	0.325	S	S	.	.	H	α-helix	trans	-75	-40.4	173.6	-72	173.2	-176.1	176.1	0	111.8	I124 K125 N200 L203	I124-K128 HydrophobicContact CG2-CD 4.3Å; I124-K128 WeakPolarHBondContact O-CG 3.39Å; I124-K128 PolarHBondContact O-N 3.03Å; K125-K128 PolarHBondContact O-N 3.25Å; K128-N200 PolarHBondContact NZ-OD1 3.43Å; K128-L203 HydrophobicContact CD-CD1 4.09Å; K128-L203 HydrophobicContact CG-CD1 3.7Å
129	E	93.6	Very high	92.9	Very high	95 Å²	95	58.1 Å²	58.1	44%	0.444	31%	0.307	S	S	.	.	H	α-helix	trans	-83.1	-35.4	-172	-69	173.9	159	0	0	113.8	K125	K125-E129 VanDerWaalsContact CE-CD 3.41Å; K125-E129 WeakPolarHBondContact CE-OE1 3.35Å; K125-E129 WeakPolarHBondContact CE-OE2 3.46Å; K125-E129 HydrophobicContact CG-CG 4.4Å; K125-E129 WeakPolarHBondContact CG-OE2 3.46Å; K125-E129 IonicContact NZ-OE1 3.76Å; K125-E129 WeakPolarHBondContact O-CG 3.08Å; K125-E129 PolarHBondContact O-N 3Å
130	Y	93.3	Very high	93	Very high	75 Å²	75	59.8 Å²	59.8	29%	0.294	31%	0.313	S	S	.	.	H	α-helix	trans	-121.4	1.4	-166	-56.6	-67	0	0	0	115.6	V126 S132 D133 V136 K140	V126-Y130 HydrophobicContact CB-CD2 4.49Å; V126-Y130 HydrophobicContact CG1-CD2 4.2Å; V126-Y130 PolarHBondContact O-N 2.9Å; Y130-S132 PolarHBondContact O-N 3.48Å; Y130-D133 CarbonylContact O-C 3.48Å; Y130-D133 PolarHBondContact O-N 3.33Å; Y130-D133 VanDerWaalsContact O-O 3.04Å; Y130-V136 HydrophobicContact CD1-CB 4.48Å; Y130-V136 HydrophobicContact CD1-CG1 3.46Å; Y130-V136 VanDerWaalsContact CD1-CG1 3.46Å; Y130-V136 HydrophobicContact CE1-CG1 3.91Å; Y130-V136 HydrophobicContact CG-CG1 3.91Å; Y130-K140 HydrophobicContact CD2-CB 4.13Å; Y130-K140 HydrophobicContact CD2-CG 3.99Å; Y130-K140 HydrophobicContact CE2-CB 4.31Å; Y130-K140 HydrophobicContact CE2-CD 4.4Å; Y130-K140 HydrophobicContact CE2-CG 3.85Å
131	S	88.7	Confident	93.1	Very high	58 Å²	58	59.6 Å²	59.6	41%	0.406	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-9.9	-174.6	46.2	0	0	0	0	115.9	A127	A127-S131 WeakPolarHBondContact O-CB 3.29Å; A127-S131 PolarHBondContact O-OG 2.95Å
132	S	90.5	Very high	93.2	Very high	119 Å²	119	56.4 Å²	56.4	83%	0.832	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-30.4	169.6	49.2	0	0	0	0	114	Y130	Y130-S132 PolarHBondContact O-N 3.48Å
133	D	92.6	Very high	93.2	Very high	71 Å²	71	52.9 Å²	52.9	38%	0.38	28%	0.282	S	S	.	.			trans	-113.3	101.6	175.6	-175.8	-31	0	0	0	109.6	Y130 S135 V136 Y137	Y130-D133 CarbonylContact O-C 3.48Å; Y130-D133 PolarHBondContact O-N 3.33Å; Y130-D133 VanDerWaalsContact O-O 3.04Å; D133-S135 PolarHBondContact O-N 3.24Å; D133-S135 WeakPolarHBondContact OD1-CA 3.46Å; D133-S135 VanDerWaalsContact OD1-CB 3.28Å; D133-S135 WeakPolarHBondContact OD1-CB 3.39Å; D133-S135 PolarHBondContact OD1-N 3.44Å; D133-V136 HydrophobicContact CB-CB 4.13Å; D133-V136 HydrophobicContact CB-CG2 4.25Å; D133-V136 PolarHBondContact O-N 2.9Å; D133-V136 PolarHBondContact OD1-N 3.03Å; D133-V136 WeakPolarHBondContact OD2-CG2 3.44Å; D133-Y137 WeakPolarHBondContact O-CB 3.49Å; D133-Y137 PolarHBondContact O-N 2.86Å
134	L	92.4	Very high	93.2	Very high	71 Å²	71	53.8 Å²	53.8	37%	0.372	29%	0.287	S	S	.	.	H	α-helix	trans	-56.6	-32.1	179.8	-179.7	60.4	0	0	0	113.2	Y137 I138 Y214	L134-Y137 HydrophobicContact CD1-CD1 4.31Å; L134-I138 HydrophobicContact CD1-CD1 3.81Å; L134-I138 HydrophobicContact CD1-CG1 4.15Å; L134-I138 HydrophobicContact CG-CD1 3.97Å; L134-I138 WeakPolarHBondContact O-CB 3.33Å; L134-I138 VanDerWaalsContact O-CG1 3.24Å; L134-I138 WeakPolarHBondContact O-CG1 3.49Å; L134-I138 PolarHBondContact O-N 2.92Å; L134-Y214 HydrophobicContact CD1-CD2 4.15Å; L134-Y214 HydrophobicContact CD1-CE1 4.31Å; L134-Y214 HydrophobicContact CD1-CE2 3.61Å; L134-Y214 HydrophobicContact CD2-CE1 4Å
135	S	92.1	Very high	93.3	Very high	80 Å²	80	53.2 Å²	53.2	56%	0.559	28%	0.284	S	S	*	.	H	α-helix	trans	-74.2	-48.6	-178.3	-49.5	0	0	0	0	110.6	D133 I138 L139	D133-S135 PolarHBondContact O-N 3.24Å; D133-S135 WeakPolarHBondContact OD1-CA 3.46Å; D133-S135 VanDerWaalsContact OD1-CB 3.28Å; D133-S135 WeakPolarHBondContact OD1-CB 3.39Å; D133-S135 PolarHBondContact OD1-N 3.44Å; S135-I138 PolarHBondContact O-N 2.64Å; S135-L139 VanDerWaalsContact O-CG 3.3Å; S135-L139 WeakPolarHBondContact O-CG 3.41Å; S135-L139 PolarHBondContact O-N 2.76Å
136	V	93.5	Very high	93.3	Very high	50 Å²	50	50.7 Å²	50.7	30%	0.303	27%	0.273	S	S	.	.	H	α-helix	trans	-66.1	-40.2	176.7	178.6	0	0	0	0	110.6	Y130 D133 L139 K140	Y130-V136 HydrophobicContact CD1-CB 4.48Å; Y130-V136 HydrophobicContact CD1-CG1 3.46Å; Y130-V136 VanDerWaalsContact CD1-CG1 3.46Å; Y130-V136 HydrophobicContact CE1-CG1 3.91Å; Y130-V136 HydrophobicContact CG-CG1 3.91Å; D133-V136 HydrophobicContact CB-CB 4.13Å; D133-V136 HydrophobicContact CB-CG2 4.25Å; D133-V136 PolarHBondContact O-N 2.9Å; D133-V136 PolarHBondContact OD1-N 3.03Å; D133-V136 WeakPolarHBondContact OD2-CG2 3.44Å; V136-L139 PolarHBondContact O-N 3.26Å; V136-K140 HydrophobicContact CG1-CG 4.17Å; V136-K140 WeakPolarHBondContact O-CB 3.31Å; V136-K140 WeakPolarHBondContact O-CG 3.45Å; V136-K140 PolarHBondContact O-N 3.4Å
137	Y	95.3	Very high	93.2	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58	-48.8	173.9	172.9	-111.2	0	0	0	112.3	V126 A127 D133 L134 K140 L141 Y206 S210	V126-Y137 HydrophobicContact CG1-CD2 3.86Å; V126-Y137 HydrophobicContact CG1-CE2 4.16Å; A127-Y137 HydrophobicContact CB-CE2 3.97Å; D133-Y137 WeakPolarHBondContact O-CB 3.49Å; D133-Y137 PolarHBondContact O-N 2.86Å; L134-Y137 HydrophobicContact CD1-CD1 4.31Å; Y137-K140 PolarHBondContact O-N 2.76Å; Y137-L141 HydrophobicContact CE1-CD2 4.13Å; Y137-L141 HydrophobicContact CE2-CD2 4.3Å; Y137-L141 WeakPolarHBondContact O-CB 3.15Å; Y137-L141 PolarHBondContact O-N 3.24Å; Y137-Y206 HydrophobicContact CE1-CE1 4.25Å; Y137-Y206 HydrophobicContact CE2-CE1 4.24Å; Y137-Y206 AromaticContact CZ-CE1 3.77Å; Y137-S210 WeakPolarHBondContact OH-CB 3.2Å; Y137-S210 PolarHBondContact OH-OG 2.9Å
138	I	94.6	Very high	93.2	Very high	21 Å²	21	54.9 Å²	54.9	11%	0.108	30%	0.299	C	S	.	.	H	α-helix	trans	-61.2	-47.3	176.8	-75.1	169.4	0	0	0	110.9	L134 S135 K140 L141 Q142 Y214 A217 I218	L134-I138 HydrophobicContact CD1-CD1 3.81Å; L134-I138 HydrophobicContact CD1-CG1 4.15Å; L134-I138 HydrophobicContact CG-CD1 3.97Å; L134-I138 WeakPolarHBondContact O-CB 3.33Å; L134-I138 VanDerWaalsContact O-CG1 3.24Å; L134-I138 WeakPolarHBondContact O-CG1 3.49Å; L134-I138 PolarHBondContact O-N 2.92Å; S135-I138 PolarHBondContact O-N 2.64Å; I138-K140 PolarHBondContact O-N 2.82Å; I138-L141 PolarHBondContact O-N 3Å; I138-Q142 HydrophobicContact CG2-CG 4.42Å; I138-Q142 WeakPolarHBondContact O-CB 3.48Å; I138-Q142 VanDerWaalsContact O-CG 3.28Å; I138-Q142 WeakPolarHBondContact O-CG 3.49Å; I138-Q142 PolarHBondContact O-N 3.36Å; I138-Y214 HydrophobicContact CD1-CD1 4.24Å; I138-Y214 HydrophobicContact CD1-CD2 4.37Å; I138-Y214 HydrophobicContact CD1-CG 3.96Å; I138-A217 HydrophobicContact CG2-CB 4.27Å; I138-I218 HydrophobicContact CG1-CG1 4.33Å; I138-I218 HydrophobicContact CG2-CG1 4.06Å
139	L	93.8	Very high	93.2	Very high	73 Å²	73	51.6 Å²	51.6	38%	0.382	29%	0.294	S	S	.	.	H	α-helix	trans	-62.9	-42	179.9	-69.7	169.6	0	0	0	112.7	S135 V136 Q142 T143	S135-L139 VanDerWaalsContact O-CG 3.3Å; S135-L139 WeakPolarHBondContact O-CG 3.41Å; S135-L139 PolarHBondContact O-N 2.76Å; V136-L139 PolarHBondContact O-N 3.26Å; L139-Q142 WeakPolarHBondContact O-CB 3.32Å; L139-T143 PolarHBondContact O-N 2.84Å; L139-T143 VanDerWaalsContact O-N 3.09Å; L139-T143 PolarHBondContact O-OG1 2.72Å
140	K	94.1	Very high	93.1	Very high	61 Å²	61	53 Å²	53	27%	0.265	30%	0.301	S	S	.	.	H	α-helix	trans	-71.8	-34.6	176.9	-70.2	-66.3	-175.2	-176.1	0	111.9	V126 Y130 V136 Y137 I138 T143 V144 H232	V126-K140 HydrophobicContact CG1-CB 3.74Å; V126-K140 HydrophobicContact CG2-CB 4.04Å; Y130-K140 HydrophobicContact CD2-CB 4.13Å; Y130-K140 HydrophobicContact CD2-CG 3.99Å; Y130-K140 HydrophobicContact CE2-CB 4.31Å; Y130-K140 HydrophobicContact CE2-CD 4.4Å; Y130-K140 HydrophobicContact CE2-CG 3.85Å; V136-K140 HydrophobicContact CG1-CG 4.17Å; V136-K140 WeakPolarHBondContact O-CB 3.31Å; V136-K140 WeakPolarHBondContact O-CG 3.45Å; V136-K140 PolarHBondContact O-N 3.4Å; Y137-K140 PolarHBondContact O-N 2.76Å; I138-K140 PolarHBondContact O-N 2.82Å; K140-T143 PolarHBondContact O-N 3.44Å; K140-V144 WeakPolarHBondContact O-CG2 3.27Å; K140-V144 PolarHBondContact O-N 2.76Å; K140-V144 VanDerWaalsContact O-N 3.09Å; K140-H232 PolarHBondContact NZ-NE2 2.88Å
141	L	94.8	Very high	93.1	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-70.1	-41.8	176	-173.3	58.1	0	0	0	111.9	C123 V126 Y137 I138 T143 V144 L145 I207 L211 I218	C123-L141 HydrophobicContact CB-CD1 4.01Å; V126-L141 HydrophobicContact CG1-CB 4.25Å; Y137-L141 HydrophobicContact CE1-CD2 4.13Å; Y137-L141 HydrophobicContact CE2-CD2 4.3Å; Y137-L141 WeakPolarHBondContact O-CB 3.15Å; Y137-L141 PolarHBondContact O-N 3.24Å; I138-L141 PolarHBondContact O-N 3Å; L141-T143 VanDerWaalsContact C-N 3.33Å; L141-T143 PolarHBondContact O-N 2.89Å; L141-V144 PolarHBondContact O-N 2.89Å; L141-L145 HydrophobicContact CD1-CD1 4.18Å; L141-L145 HydrophobicContact CD1-CG 4.29Å; L141-L145 HydrophobicContact CG-CD1 3.94Å; L141-L145 HydrophobicContact CG-CG 4.48Å; L141-L145 WeakPolarHBondContact O-CB 3.36Å; L141-L145 VanDerWaalsContact O-CG 3.26Å; L141-L145 WeakPolarHBondContact O-CG 3.45Å; L141-L145 PolarHBondContact O-N 3.32Å; L141-I207 HydrophobicContact CD1-CG2 4.27Å; L141-I207 HydrophobicContact CD2-CG2 4.4Å; L141-L211 HydrophobicContact CD2-CD2 3.82Å; L141-L211 HydrophobicContact CG-CD2 4.3Å; L141-I218 HydrophobicContact CD2-CD1 4.04Å
142	Q	94.5	Very high	93.3	Very high	23 Å²	23	49.3 Å²	49.3	11%	0.107	28%	0.28	C	S	.	.	H	α-helix	trans	-50.9	-52.6	167	-77.1	170.2	-4.8	0	0	110.8	I138 L139 V144 L145 F146 A217 I218	I138-Q142 HydrophobicContact CG2-CG 4.42Å; I138-Q142 WeakPolarHBondContact O-CB 3.48Å; I138-Q142 VanDerWaalsContact O-CG 3.28Å; I138-Q142 WeakPolarHBondContact O-CG 3.49Å; I138-Q142 PolarHBondContact O-N 3.36Å; L139-Q142 WeakPolarHBondContact O-CB 3.32Å; Q142-V144 VanDerWaalsContact C-N 3.31Å; Q142-V144 PolarHBondContact O-N 2.88Å; Q142-L145 PolarHBondContact O-N 3.48Å; Q142-F146 WeakPolarHBondContact O-CB 3.3Å; Q142-F146 PolarHBondContact O-N 2.73Å; Q142-A217 PolarHBondContact NE2-O 3.03Å; Q142-I218 WeakPolarHBondContact CG-O 3.43Å
143	T	93.1	Very high	93.6	Very high	41 Å²	41	44.5 Å²	44.5	25%	0.252	24%	0.244	S	C	.	.	H	α-helix	trans	-58.5	-41	-177	-53.5	0	0	0	0	112	L139 K140 L141	L139-T143 PolarHBondContact O-N 2.84Å; L139-T143 VanDerWaalsContact O-N 3.09Å; L139-T143 PolarHBondContact O-OG1 2.72Å; K140-T143 PolarHBondContact O-N 3.44Å; L141-T143 VanDerWaalsContact C-N 3.33Å; L141-T143 PolarHBondContact O-N 2.89Å
144	V	94	Very high	93.6	Very high	19 Å²	19	42.7 Å²	42.7	12%	0.115	23%	0.233	C	C	.	.	H	α-helix	trans	-69.6	-46.3	175.7	175.1	0	0	0	0	111.5	K122 C123 V126 K140 L141 Q142 F146 T147	K122-V144 HydrophobicContact CB-CG1 3.61Å; K122-V144 HydrophobicContact CB-CG2 4.12Å; K122-V144 HydrophobicContact CD-CG1 4.4Å; C123-V144 VanDerWaalsContact SG-CG1 3.59Å; V126-V144 HydrophobicContact CG2-CG2 3.94Å; K140-V144 WeakPolarHBondContact O-CG2 3.27Å; K140-V144 PolarHBondContact O-N 2.76Å; K140-V144 VanDerWaalsContact O-N 3.09Å; L141-V144 PolarHBondContact O-N 2.89Å; Q142-V144 VanDerWaalsContact C-N 3.31Å; Q142-V144 PolarHBondContact O-N 2.88Å; V144-F146 VanDerWaalsContact C-N 3.31Å; V144-F146 PolarHBondContact O-N 2.81Å; V144-T147 PolarHBondContact O-N 3.04Å; V144-T147 PolarHBondContact O-OG1 3.22Å
145	L	94.5	Very high	93.8	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-67.3	-30	-177	-68.3	170.3	0	0	0	113.1	L141 Q142 T147 L148 Y153 L156 L211 I218	L141-L145 HydrophobicContact CD1-CD1 4.18Å; L141-L145 HydrophobicContact CD1-CG 4.29Å; L141-L145 HydrophobicContact CG-CD1 3.94Å; L141-L145 HydrophobicContact CG-CG 4.48Å; L141-L145 WeakPolarHBondContact O-CB 3.36Å; L141-L145 VanDerWaalsContact O-CG 3.26Å; L141-L145 WeakPolarHBondContact O-CG 3.45Å; L141-L145 PolarHBondContact O-N 3.32Å; Q142-L145 PolarHBondContact O-N 3.48Å; L145-T147 PolarHBondContact O-N 3.01Å; L145-T147 VanDerWaalsContact O-N 3.15Å; L145-L148 HydrophobicContact CB-CD1 4.47Å; L145-L148 HydrophobicContact CD2-CD1 3.87Å; L145-L148 VanDerWaalsContact O-CB 3.27Å; L145-L148 WeakPolarHBondContact O-CB 3.35Å; L145-L148 WeakPolarHBondContact O-CG 3.29Å; L145-L148 PolarHBondContact O-N 2.79Å; L145-Y153 HydrophobicContact CB-CE2 4.48Å; L145-Y153 WeakPolarHBondContact O-CD2 3.45Å; L145-L156 HydrophobicContact CD2-CD2 3.89Å; L145-L211 HydrophobicContact CD1-CD2 3.62Å; L145-I218 HydrophobicContact CD1-CG2 3.6Å
146	F	92.6	Very high	94	Very high	73 Å²	73	35.5 Å²	35.5	32%	0.32	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-10.8	173.4	-163	-104.4	0	0	0	113.1	Q142 V144 V229	Q142-F146 WeakPolarHBondContact O-CB 3.3Å; Q142-F146 PolarHBondContact O-N 2.73Å; V144-F146 VanDerWaalsContact C-N 3.31Å; V144-F146 PolarHBondContact O-N 2.81Å; F146-V229 HydrophobicContact CD1-CG2 4.37Å
147	T	93.3	Very high	94.1	Very high	84 Å²	84	35.9 Å²	35.9	52%	0.515	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	6.7	170.9	69	0	0	0	0	114.2	L119 V144 L145	L119-T147 VanDerWaalsContact CD2-OG1 3.29Å; L119-T147 WeakPolarHBondContact CD2-OG1 3.4Å; V144-T147 PolarHBondContact O-N 3.04Å; V144-T147 PolarHBondContact O-OG1 3.22Å; L145-T147 PolarHBondContact O-N 3.01Å; L145-T147 VanDerWaalsContact O-N 3.15Å
148	L	93.4	Very high	94.2	Very high	16 Å²	16	38.8 Å²	38.8	8%	0.084	20%	0.198	C	C	.	.	S	Bend	trans	-69.1	157.3	165	-72	168	0	0	0	110.8	V115 L119 L145 N152 L156	V115-L148 HydrophobicContact CG1-CD2 4.48Å; V115-L148 HydrophobicContact CG2-CD1 4.45Å; L119-L148 HydrophobicContact CD1-CD2 4.43Å; L119-L148 HydrophobicContact CD2-CD2 3.88Å; L119-L148 HydrophobicContact CD2-CG 4.02Å; L145-L148 HydrophobicContact CB-CD1 4.47Å; L145-L148 HydrophobicContact CD2-CD1 3.87Å; L145-L148 VanDerWaalsContact O-CB 3.27Å; L145-L148 WeakPolarHBondContact O-CB 3.35Å; L145-L148 WeakPolarHBondContact O-CG 3.29Å; L145-L148 PolarHBondContact O-N 2.79Å; L148-N152 HydrophobicContact CB-CB 4.4Å; L148-N152 HydrophobicContact CD2-CB 4.47Å; L148-L156 HydrophobicContact CD1-CD2 3.9Å
149	A	92.8	Very high	94.3	Very high	52 Å²	52	37.8 Å²	37.8	43%	0.43	19%	0.193	S	C	.	.			trans	-57.9	145	162.7	0	0	0	0	0	110.1	E151 N152 Y153	A149-E151 PolarHBondContact O-N 3.42Å; A149-N152 HydrophobicContact CB-CB 4.44Å; A149-N152 WeakPolarHBondContact O-CB 3.41Å; A149-N152 PolarHBondContact O-N 3.23Å; A149-Y153 PolarHBondContact O-N 3.29Å
150	H	91.7	Very high	94.5	Very high	125 Å²	125	34.3 Å²	34.3	58%	0.579	18%	0.175	S	C	*	.	H	α-helix	trans	-58	-41	-174.5	177.4	57	0	0	0	111.9	N152 Y153 E154	H150-N152 VanDerWaalsContact C-N 3.34Å; H150-N152 PolarHBondContact O-N 3.47Å; H150-Y153 PolarHBondContact O-N 2.98Å; H150-E154 PolarHBondContact O-N 2.79Å
151	E	92.2	Very high	94.7	Very high	32 Å²	32	36.6 Å²	36.6	15%	0.15	18%	0.184	C	C	.	.	H	α-helix	trans	-55	-47.4	174.6	-57.2	93.8	147.5	0	0	111.4	L30 K31 L34 A149 L155	L30-E151 HydrophobicContact CD2-CB 4.15Å; L30-E151 VanDerWaalsContact CD2-O 3.32Å; L30-E151 WeakPolarHBondContact CD2-O 3.44Å; L30-E151 HydrophobicContact CG-CB 4.21Å; K31-E151 HydrophobicContact CB-CG 4.33Å; K31-E151 WeakPolarHBondContact CD-OE1 3.44Å; K31-E151 HydrophobicContact CG-CG 4.48Å; K31-E151 WeakPolarHBondContact CG-OE1 3.45Å; K31-E151 IonicContact NZ-OE1 3.69Å; K31-E151 PolarHBondContact NZ-OE1 3.18Å; L34-E151 HydrophobicContact CD1-CB 3.75Å; L34-E151 HydrophobicContact CD1-CG 3.86Å; A149-E151 PolarHBondContact O-N 3.42Å; E151-L155 WeakPolarHBondContact O-CB 3.43Å; E151-L155 PolarHBondContact O-N 2.97Å
152	N	94.5	Very high	94.8	Very high	22 Å²	22	36.9 Å²	36.9	12%	0.118	19%	0.186	C	C	.	.	H	α-helix	trans	-71.6	-37.3	178.7	-70.5	56.7	0	0	0	112	L30 L114 L148 A149 H150 L156	L30-N152 HydrophobicContact CD2-CB 4.46Å; L114-N152 HydrophobicContact CD1-CB 4.18Å; L114-N152 PolarHBondContact O-ND2 2.94Å; L148-N152 HydrophobicContact CB-CB 4.4Å; L148-N152 HydrophobicContact CD2-CB 4.47Å; A149-N152 HydrophobicContact CB-CB 4.44Å; A149-N152 WeakPolarHBondContact O-CB 3.41Å; A149-N152 PolarHBondContact O-N 3.23Å; H150-N152 VanDerWaalsContact C-N 3.34Å; H150-N152 PolarHBondContact O-N 3.47Å; N152-L156 VanDerWaalsContact O-CB 3.24Å; N152-L156 WeakPolarHBondContact O-CB 3.46Å; N152-L156 PolarHBondContact O-N 3.43Å
153	Y	95.2	Very high	95	Very high	19 Å²	19	35.8 Å²	35.8	8%	0.075	18%	0.18	C	C	.	.	H	α-helix	trans	-64.6	-48.8	178.8	-177.7	-92.5	0	0	0	111.7	L145 A149 H150 L156 K157 F219	L145-Y153 HydrophobicContact CB-CE2 4.48Å; L145-Y153 WeakPolarHBondContact O-CD2 3.45Å; A149-Y153 PolarHBondContact O-N 3.29Å; H150-Y153 PolarHBondContact O-N 2.98Å; Y153-L156 PolarHBondContact O-N 3.33Å; Y153-K157 HydrophobicContact CD1-CD 4.42Å; Y153-K157 HydrophobicContact CE1-CD 4.01Å; Y153-K157 WeakPolarHBondContact O-CB 3.3Å; Y153-K157 PolarHBondContact O-N 3.02Å; Y153-F219 HydrophobicContact CD2-CD1 4.49Å; Y153-F219 HydrophobicContact CD2-CE1 4.44Å; Y153-F219 HydrophobicContact CE1-CD1 4.21Å; Y153-F219 AromaticContact CE2-CD1 3.83Å; Y153-F219 HydrophobicContact CE2-CD1 3.83Å; Y153-F219 HydrophobicContact CE2-CE1 4.09Å; Y153-F219 AromaticContact CZ-CD1 3.68Å
154	E	94	Very high	95.2	Very high	32 Å²	32	34 Å²	34	15%	0.15	17%	0.17	C	C	.	.	H	α-helix	trans	-68.8	-37.8	179.5	-70.8	-59.3	131.2	0	0	112.6	P41 H150 K157 Y158	P41-E154 HydrophobicContact CB-CB 4.09Å; P41-E154 HydrophobicContact CB-CG 4.32Å; H150-E154 PolarHBondContact O-N 2.79Å; E154-K157 PolarHBondContact O-N 3.32Å; E154-K157 WeakPolarHBondContact OE1-CD 2.94Å; E154-K157 IonicContact OE1-NZ 3.11Å; E154-K157 PolarHBondContact OE1-NZ 3.03Å; E154-K157 WeakPolarHBondContact OE2-CD 3.47Å; E154-K157 IonicContact OE2-NZ 2.81Å; E154-K157 PolarHBondContact OE2-NZ 2.9Å; E154-Y158 VanDerWaalsContact O-CB 3.3Å; E154-Y158 WeakPolarHBondContact O-CB 3.28Å; E154-Y158 PolarHBondContact O-N 3.16Å
155	L	95.4	Very high	95.4	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-63.6	-41.6	172.1	175.5	56.2	0	0	0	112	L30 V42 V46 F106 L107 L110 L114 E151 Y158 L159	L30-L155 HydrophobicContact CD1-CD2 3.63Å; L30-L155 HydrophobicContact CD2-CB 4.01Å; L30-L155 HydrophobicContact CD2-CD2 3.64Å; L30-L155 HydrophobicContact CD2-CG 4.45Å; L30-L155 HydrophobicContact CG-CD2 4.29Å; V42-L155 HydrophobicContact CG1-CD1 4.17Å; V46-L155 HydrophobicContact CB-CD1 4.48Å; V46-L155 HydrophobicContact CG1-CD1 3.84Å; V46-L155 HydrophobicContact CG2-CD1 4.34Å; F106-L155 HydrophobicContact CE1-CD2 4.39Å; L107-L155 HydrophobicContact CD2-CD2 4.42Å; L110-L155 HydrophobicContact CD1-CD2 4.41Å; L114-L155 HydrophobicContact CD1-CB 4.02Å; L114-L155 HydrophobicContact CD1-CD2 3.78Å; L114-L155 HydrophobicContact CD1-CG 3.84Å; L114-L155 HydrophobicContact CD2-CG 4.14Å; E151-L155 WeakPolarHBondContact O-CB 3.43Å; E151-L155 PolarHBondContact O-N 2.97Å; L155-Y158 PolarHBondContact O-N 3.44Å; L155-L159 VanDerWaalsContact O-CB 3.26Å; L155-L159 WeakPolarHBondContact O-CB 3.09Å; L155-L159 PolarHBondContact O-N 2.68Å
156	L	97	Very high	95.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64.8	-45.9	177.2	-177.7	63.9	0	0	0	111.9	L114 V115 L145 L148 N152 Y153 L159 C160 V188 L211 F219	L114-L156 HydrophobicContact CD2-CB 4.14Å; L114-L156 HydrophobicContact CD2-CD1 3.95Å; L114-L156 HydrophobicContact CG-CB 4.32Å; L114-L156 HydrophobicContact CG-CD1 4.42Å; V115-L156 HydrophobicContact CG2-CD1 4.49Å; V115-L156 HydrophobicContact CG2-CD2 3.88Å; L145-L156 HydrophobicContact CD2-CD2 3.89Å; L148-L156 HydrophobicContact CD1-CD2 3.9Å; N152-L156 VanDerWaalsContact O-CB 3.24Å; N152-L156 WeakPolarHBondContact O-CB 3.46Å; N152-L156 PolarHBondContact O-N 3.43Å; Y153-L156 PolarHBondContact O-N 3.33Å; L156-L159 PolarHBondContact O-N 3.42Å; L156-C160 WeakPolarHBondContact O-CB 3.48Å; L156-C160 PolarHBondContact O-N 2.87Å; L156-C160 PolarHBondContact O-SG 3.42Å; L156-C160 VanDerWaalsContact O-SG 3.33Å; L156-V188 HydrophobicContact CD1-CG1 3.63Å; L156-L211 HydrophobicContact CD1-CD1 4.15Å; L156-L211 HydrophobicContact CD2-CD1 4.23Å; L156-F219 HydrophobicContact CD2-CE1 4.38Å; L156-F219 HydrophobicContact CD2-CZ 4.16Å; L156-F219 HydrophobicContact CG-CE1 4.4Å; L156-F219 HydrophobicContact CG-CZ 3.98Å
157	K	96.3	Very high	95.8	Very high	58 Å²	58	34.5 Å²	34.5	25%	0.252	17%	0.171	S	C	.	.	H	α-helix	trans	-57.5	-47	174.8	174.7	177.6	172.6	-152.8	0	112.1	Y153 E154 K161 F219	Y153-K157 HydrophobicContact CD1-CD 4.42Å; Y153-K157 HydrophobicContact CE1-CD 4.01Å; Y153-K157 WeakPolarHBondContact O-CB 3.3Å; Y153-K157 PolarHBondContact O-N 3.02Å; E154-K157 PolarHBondContact O-N 3.32Å; E154-K157 WeakPolarHBondContact OE1-CD 2.94Å; E154-K157 IonicContact OE1-NZ 3.11Å; E154-K157 PolarHBondContact OE1-NZ 3.03Å; E154-K157 WeakPolarHBondContact OE2-CD 3.47Å; E154-K157 IonicContact OE2-NZ 2.81Å; E154-K157 PolarHBondContact OE2-NZ 2.9Å; K157-K161 WeakPolarHBondContact O-CB 3.47Å; K157-K161 PolarHBondContact O-N 3.08Å; K157-K161 VanDerWaalsContact O-N 3.11Å; K157-F219 HydrophobicContact CB-CB 4.32Å; K157-F219 HydrophobicContact CB-CD1 3.66Å; K157-F219 HydrophobicContact CB-CD2 4.32Å; K157-F219 HydrophobicContact CB-CE1 4.01Å; K157-F219 HydrophobicContact CB-CG 3.85Å; K157-F219 HydrophobicContact CB-CZ 4.5Å; K157-F219 HydrophobicContact CD-CB 3.94Å; K157-F219 HydrophobicContact CD-CD1 4.29Å; K157-F219 HydrophobicContact CD-CG 4.31Å; K157-F219 HydrophobicContact CG-CB 3.71Å; K157-F219 HydrophobicContact CG-CD1 4.02Å; K157-F219 HydrophobicContact CG-CD2 4.37Å; K157-F219 HydrophobicContact CG-CG 3.79Å
158	Y	96.5	Very high	96	Very high	60 Å²	60	36.1 Å²	36.1	24%	0.235	17%	0.173	C	C	.	.	H	α-helix	trans	-61.6	-47.5	174.7	-178.8	-95.9	0	0	0	111.8	V42 V46 C50 E154 L155 K161 F162	V42-Y158 HydrophobicContact CG1-CD1 3.98Å; V42-Y158 HydrophobicContact CG1-CE1 4.18Å; V42-Y158 HydrophobicContact CG1-CG 4.36Å; V42-Y158 HydrophobicContact CG2-CD1 4.22Å; V42-Y158 HydrophobicContact CG2-CD2 4.17Å; V42-Y158 HydrophobicContact CG2-CG 3.79Å; V46-Y158 HydrophobicContact CG1-CD1 4.32Å; V46-Y158 HydrophobicContact CG1-CE1 4.17Å; C50-Y158 HydrophobicContact CB-CE1 3.91Å; E154-Y158 VanDerWaalsContact O-CB 3.3Å; E154-Y158 WeakPolarHBondContact O-CB 3.28Å; E154-Y158 PolarHBondContact O-N 3.16Å; L155-Y158 PolarHBondContact O-N 3.44Å; Y158-K161 PolarHBondContact O-N 3.46Å; Y158-F162 WeakPolarHBondContact O-CB 3.31Å; Y158-F162 PolarHBondContact O-N 2.93Å
159	L	97.6	Very high	96.2	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-60.7	-46.5	178.9	179.4	64.9	0	0	0	111.8	L107 L114 L155 L156 K161 F162 L163 F184 V188	L107-L159 HydrophobicContact CD1-CD1 4.19Å; L107-L159 HydrophobicContact CD1-CD2 3.68Å; L107-L159 HydrophobicContact CD2-CD2 4.28Å; L114-L159 HydrophobicContact CD2-CD2 3.98Å; L155-L159 VanDerWaalsContact O-CB 3.26Å; L155-L159 WeakPolarHBondContact O-CB 3.09Å; L155-L159 PolarHBondContact O-N 2.68Å; L156-L159 PolarHBondContact O-N 3.42Å; L159-K161 PolarHBondContact O-N 3.12Å; L159-F162 HydrophobicContact CD1-CD1 4.38Å; L159-F162 PolarHBondContact O-N 3.48Å; L159-L163 HydrophobicContact CD1-CD1 4.07Å; L159-L163 HydrophobicContact CD1-CG 4.19Å; L159-L163 HydrophobicContact CG-CD1 4.01Å; L159-L163 HydrophobicContact CG-CG 4.46Å; L159-L163 WeakPolarHBondContact O-CB 3.3Å; L159-L163 VanDerWaalsContact O-CG 3.29Å; L159-L163 WeakPolarHBondContact O-CG 3.2Å; L159-L163 PolarHBondContact O-N 3.39Å; L159-F184 HydrophobicContact CD1-CD1 4.45Å; L159-F184 HydrophobicContact CD1-CE1 4.09Å; L159-F184 HydrophobicContact CD2-CD1 4.35Å; L159-V188 HydrophobicContact CD2-CG2 3.65Å
160	C	98	Very high	96.4	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.2	-40.2	179.3	-71	0	0	0	0	112.4	L156 L163 S164 H215 F219	L156-C160 WeakPolarHBondContact O-CB 3.48Å; L156-C160 PolarHBondContact O-N 2.87Å; L156-C160 PolarHBondContact O-SG 3.42Å; L156-C160 VanDerWaalsContact O-SG 3.33Å; C160-L163 PolarHBondContact O-N 3.38Å; C160-S164 PolarHBondContact O-N 3.13Å; C160-H215 HydrophobicContact CB-CB 4.06Å; C160-F219 HydrophobicContact CB-CE2 3.97Å
161	K	96.9	Very high	96.7	Very high	108 Å²	108	37.5 Å²	37.5	47%	0.47	18%	0.18	S	C	.	.	H	α-helix	trans	-67	-38.5	174.4	-172.8	161.2	-174.1	150.6	0	112.7	K157 Y158 L159 K165	K157-K161 WeakPolarHBondContact O-CB 3.47Å; K157-K161 PolarHBondContact O-N 3.08Å; K157-K161 VanDerWaalsContact O-N 3.11Å; Y158-K161 PolarHBondContact O-N 3.46Å; L159-K161 PolarHBondContact O-N 3.12Å; K161-K165 PolarHBondContact O-N 3.4Å
162	F	97.9	Very high	96.9	Very high	6 Å²	6	38.9 Å²	38.9	3%	0.026	19%	0.191	C	C	.	.	H	α-helix	trans	-62.1	-47	171.4	163.8	-99.3	0	0	0	111.6	C50 L53 L54 F64 L103 Y158 L159 S164 K165 I166	C50-F162 HydrophobicContact CB-CD2 3.69Å; C50-F162 HydrophobicContact CB-CE2 3.82Å; C50-F162 HydrophobicContact CB-CG 4.18Å; C50-F162 HydrophobicContact CB-CZ 4.42Å; C50-F162 WeakPolarHBondContact O-CE2 3.28Å; L53-F162 HydrophobicContact CB-CE2 4.21Å; L53-F162 HydrophobicContact CB-CZ 4.07Å; L53-F162 HydrophobicContact CD1-CZ 4.3Å; L54-F162 HydrophobicContact CD1-CD2 4.2Å; L54-F162 HydrophobicContact CD2-CD2 3.91Å; L54-F162 HydrophobicContact CD2-CE2 3.97Å; L54-F162 HydrophobicContact CG-CD2 3.83Å; L54-F162 HydrophobicContact CG-CE2 3.85Å; F64-F162 AromaticContact CE2-CE1 3.81Å; F64-F162 HydrophobicContact CE2-CE1 3.81Å; F64-F162 AromaticContact CE2-CZ 3.96Å; F64-F162 HydrophobicContact CE2-CZ 3.96Å; F64-F162 AromaticContact CZ-CE1 3.57Å; F64-F162 HydrophobicContact CZ-CE1 3.57Å; F64-F162 AromaticContact CZ-CZ 3.72Å; F64-F162 HydrophobicContact CZ-CZ 3.72Å; L103-F162 HydrophobicContact CD2-CE1 3.98Å; L103-F162 HydrophobicContact CD2-CZ 4.49Å; Y158-F162 WeakPolarHBondContact O-CB 3.31Å; Y158-F162 PolarHBondContact O-N 2.93Å; L159-F162 HydrophobicContact CD1-CD1 4.38Å; L159-F162 PolarHBondContact O-N 3.48Å; F162-S164 VanDerWaalsContact C-N 3.34Å; F162-S164 PolarHBondContact O-N 3.25Å; F162-K165 WeakPolarHBondContact O-CB 3.5Å; F162-K165 PolarHBondContact O-N 3.03Å; F162-I166 HydrophobicContact CE1-CG1 4.19Å; F162-I166 HydrophobicContact CE2-CD1 4.07Å; F162-I166 HydrophobicContact CE2-CG1 4.27Å; F162-I166 HydrophobicContact CZ-CD1 3.97Å; F162-I166 HydrophobicContact CZ-CG1 3.97Å; F162-I166 PolarHBondContact O-N 3.39Å
163	L	98.4	Very high	97.1	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-67.5	-29.5	-179.3	-68.5	176	0	0	0	113.3	F64 L159 C160 I166 A167 L180 F184 M208 I212	F64-L163 HydrophobicContact CD2-CD2 4.45Å; F64-L163 HydrophobicContact CE2-CD2 4.24Å; L159-L163 HydrophobicContact CD1-CD1 4.07Å; L159-L163 HydrophobicContact CD1-CG 4.19Å; L159-L163 HydrophobicContact CG-CD1 4.01Å; L159-L163 HydrophobicContact CG-CG 4.46Å; L159-L163 WeakPolarHBondContact O-CB 3.3Å; L159-L163 VanDerWaalsContact O-CG 3.29Å; L159-L163 WeakPolarHBondContact O-CG 3.2Å; L159-L163 PolarHBondContact O-N 3.39Å; C160-L163 PolarHBondContact O-N 3.38Å; L163-I166 PolarHBondContact O-N 3.26Å; L163-A167 PolarHBondContact O-N 2.87Å; L163-L180 HydrophobicContact CB-CD1 4.27Å; L163-L180 HydrophobicContact CD2-CD1 4.32Å; L163-L180 HydrophobicContact CD2-CD2 4.42Å; L163-L180 WeakPolarHBondContact O-CD1 3.47Å; L163-F184 HydrophobicContact CD1-CB 4.24Å; L163-F184 HydrophobicContact CD1-CD1 4Å; L163-F184 HydrophobicContact CD1-CD2 3.75Å; L163-F184 HydrophobicContact CD1-CE1 4.28Å; L163-F184 HydrophobicContact CD1-CE2 4.05Å; L163-F184 HydrophobicContact CD1-CG 3.71Å; L163-F184 HydrophobicContact CD1-CZ 4.31Å; L163-F184 HydrophobicContact CD2-CD2 3.97Å; L163-F184 HydrophobicContact CD2-CE1 4.38Å; L163-F184 HydrophobicContact CD2-CE2 3.46Å; L163-F184 VanDerWaalsContact CD2-CE2 3.46Å; L163-F184 HydrophobicContact CD2-CZ 3.7Å; L163-F184 HydrophobicContact CG-CE2 4.42Å; L163-M208 HydrophobicContact CD1-CE 3.91Å; L163-I212 HydrophobicContact CB-CD1 4.09Å; L163-I212 HydrophobicContact CB-CG1 4.05Å; L163-I212 HydrophobicContact CB-CG2 4.01Å; L163-I212 HydrophobicContact CD1-CD1 3.86Å; L163-I212 HydrophobicContact CD1-CG1 4.21Å
164	S	97.8	Very high	97.2	Very high	4 Å²	4	42.5 Å²	42.5	3%	0.028	21%	0.206	C	C	.	.	H	α-helix	trans	-66.1	-41.5	171.9	-171	0	0	0	0	111.9	C160 F162 I166 A167 E168 R177 H215	C160-S164 PolarHBondContact O-N 3.13Å; F162-S164 VanDerWaalsContact C-N 3.34Å; F162-S164 PolarHBondContact O-N 3.25Å; S164-I166 VanDerWaalsContact C-N 3.26Å; S164-I166 PolarHBondContact O-N 2.9Å; S164-A167 CarbonylContact O-C 3.6Å; S164-A167 WeakPolarHBondContact O-CA 3.44Å; S164-A167 PolarHBondContact O-N 3.09Å; S164-E168 WeakPolarHBondContact O-CG 3.26Å; S164-E168 PolarHBondContact O-N 2.94Å; S164-E168 PolarHBondContact OG-OE1 2.85Å; S164-R177 PolarHBondContact OG-NE 3.29Å; S164-R177 PolarHBondContact OG-NH2 2.7Å; S164-H215 VanDerWaalsContact CB-CD2 3.42Å; S164-H215 WeakPolarHBondContact CB-CD2 3.02Å; S164-H215 WeakPolarHBondContact CB-NE2 3.41Å; S164-H215 PolarHBondContact OG-NE2 3.35Å
165	K	97.6	Very high	97.4	Very high	99 Å²	99	41 Å²	41	43%	0.43	20%	0.199	S	C	.	.	H	α-helix	trans	-58.7	-36.7	173.7	-69	-176.7	175.1	-172.2	0	112.8	L54 L58 K161 F162	L54-K165 HydrophobicContact CD1-CD 3.99Å; L54-K165 HydrophobicContact CD2-CB 3.82Å; L54-K165 HydrophobicContact CD2-CD 3.97Å; L58-K165 WeakPolarHBondContact CD2-O 3.2Å; K161-K165 PolarHBondContact O-N 3.4Å; F162-K165 WeakPolarHBondContact O-CB 3.5Å; F162-K165 PolarHBondContact O-N 3.03Å
166	I	98.2	Very high	97.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64.4	-44.8	172.9	-58	-61.6	0	0	0	110.4	L54 L58 I63 F64 F162 L163 S164 N169 N173 M175 L180	L54-I166 HydrophobicContact CD2-CD1 4.22Å; L58-I166 HydrophobicContact CD2-CD1 3.98Å; I63-I166 HydrophobicContact CG2-CG2 3.73Å; F64-I166 HydrophobicContact CE2-CG1 4.27Å; F162-I166 HydrophobicContact CE1-CG1 4.19Å; F162-I166 HydrophobicContact CE2-CD1 4.07Å; F162-I166 HydrophobicContact CE2-CG1 4.27Å; F162-I166 HydrophobicContact CZ-CD1 3.97Å; F162-I166 HydrophobicContact CZ-CG1 3.97Å; F162-I166 PolarHBondContact O-N 3.39Å; L163-I166 PolarHBondContact O-N 3.26Å; S164-I166 VanDerWaalsContact C-N 3.26Å; S164-I166 PolarHBondContact O-N 2.9Å; I166-N169 PolarHBondContact O-N 3.44Å; I166-N173 PolarHBondContact O-ND2 3.08Å; I166-M175 HydrophobicContact CG2-CB 4.42Å; I166-L180 HydrophobicContact CB-CD1 4.13Å; I166-L180 HydrophobicContact CG2-CD1 4.07Å; I166-L180 HydrophobicContact CG2-CD2 4.49Å
167	A	97.9	Very high	97.6	Very high	6 Å²	6	44.9 Å²	44.9	5%	0.05	22%	0.218	C	C	.	.	H	α-helix	trans	-72.1	-26.1	179.9	0	0	0	0	0	114.5	L163 S164 N169 E170 M175 R177 L180	L163-A167 PolarHBondContact O-N 2.87Å; S164-A167 CarbonylContact O-C 3.6Å; S164-A167 WeakPolarHBondContact O-CA 3.44Å; S164-A167 PolarHBondContact O-N 3.09Å; A167-N169 PolarHBondContact O-N 2.65Å; A167-E170 WeakPolarHBondContact O-CB 3.24Å; A167-E170 PolarHBondContact O-N 2.98Å; A167-M175 WeakPolarHBondContact CA-O 3.5Å; A167-R177 HydrophobicContact CB-CB 4.4Å; A167-R177 HydrophobicContact CB-CG 3.4Å; A167-L180 HydrophobicContact CB-CD1 4.06Å
168	E	97.2	Very high	97.6	Very high	118 Å²	118	46.8 Å²	46.8	55%	0.551	23%	0.23	S	C	*	.	H	α-helix	trans	-61.1	-26.1	171.6	-77.7	149.6	-147.8	0	0	111.9	S164 R177	S164-E168 WeakPolarHBondContact O-CG 3.26Å; S164-E168 PolarHBondContact O-N 2.94Å; S164-E168 PolarHBondContact OG-OE1 2.85Å; E168-R177 IonicContact OE1-NH2 2.76Å
169	N	97.1	Very high	97.7	Very high	36 Å²	36	45.1 Å²	45.1	19%	0.193	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	19.5	173.2	-158	35.2	0	0	0	114.1	L58 N59 I166 A167 P171 V172 N173	L58-N169 HydrophobicContact CD2-CB 4.09Å; L58-N169 PolarHBondContact O-ND2 2.77Å; N59-N169 PolarHBondContact OD1-ND2 3.37Å; I166-N169 PolarHBondContact O-N 3.44Å; A167-N169 PolarHBondContact O-N 2.65Å; N169-P171 VanDerWaalsContact C-N 3.27Å; N169-P171 VanDerWaalsContact O-N 3.17Å; N169-V172 PolarHBondContact O-N 3.44Å; N169-V172 WeakPolarHBondContact OD1-CG2 3.45Å; N169-N173 VanDerWaalsContact O-CG 3.28Å; N169-N173 PolarHBondContact O-N 2.71Å; N169-N173 PolarHBondContact O-ND2 2.81Å; N169-N173 PolarHBondContact O-OD1 3.08Å
170	E	97.6	Very high	97.7	Very high	86 Å²	86	45.1 Å²	45.1	40%	0.402	23%	0.228	S	C	.	.	H	α-helix	trans	-45.6	-40.5	173	175.1	178.6	175.7	0	0	114	A167 V172 N173 K174 S176	A167-E170 WeakPolarHBondContact O-CB 3.24Å; A167-E170 PolarHBondContact O-N 2.98Å; E170-V172 PolarHBondContact O-N 2.75Å; E170-V172 VanDerWaalsContact O-N 3.09Å; E170-N173 WeakPolarHBondContact CA-OD1 3.49Å; E170-K174 VanDerWaalsContact O-CA 3.26Å; E170-K174 WeakPolarHBondContact O-CA 3.47Å; E170-K174 PolarHBondContact O-N 3.27Å; E170-S176 VanDerWaalsContact CD-CA 3.49Å; E170-S176 WeakPolarHBondContact OE1-CB 2.74Å; E170-S176 WeakPolarHBondContact OE2-CA 3.45Å; E170-S176 WeakPolarHBondContact OE2-CB 3.44Å
171	P	97.4	Very high	97.7	Very high	100 Å²	100	45.1 Å²	45.1	65%	0.649	23%	0.228	S	C	*	.	H	α-helix	trans	-56.4	-29.4	178.6	-28.3	37.2	0	0	0	114.1	N169 K174	N169-P171 VanDerWaalsContact C-N 3.27Å; N169-P171 VanDerWaalsContact O-N 3.17Å; P171-K174 PolarHBondContact O-NZ 3.24Å
172	V	97.6	Very high	97.7	Very high	60 Å²	60	44.7 Å²	44.7	36%	0.364	23%	0.23	S	C	.	.	H	α-helix	trans	-94.2	-57.8	176.3	-174.8	0	0	0	0	110.7	N59 N169 E170	N59-V172 HydrophobicContact CB-CG1 3.94Å; N169-V172 PolarHBondContact O-N 3.44Å; N169-V172 WeakPolarHBondContact OD1-CG2 3.45Å; E170-V172 PolarHBondContact O-N 2.75Å; E170-V172 VanDerWaalsContact O-N 3.09Å
173	N	97.6	Very high	97.6	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-85	-9.6	-168.8	68.8	29	0	0	0	115.1	L58 S60 Q61 G62 I63 I166 N169 E170 M175	L58-N173 WeakPolarHBondContact O-CB 3.33Å; L58-N173 PolarHBondContact O-ND2 2.87Å; S60-N173 WeakPolarHBondContact O-CB 3.16Å; Q61-N173 CarbonylContact C-O 3.24Å; Q61-N173 WeakPolarHBondContact CA-O 3.5Å; G62-N173 PolarHBondContact N-O 3.37Å; I63-N173 HydrophobicContact CG2-CB 4.3Å; I166-N173 PolarHBondContact O-ND2 3.08Å; N169-N173 VanDerWaalsContact O-CG 3.28Å; N169-N173 PolarHBondContact O-N 2.71Å; N169-N173 PolarHBondContact O-ND2 2.81Å; N169-N173 PolarHBondContact O-OD1 3.08Å; E170-N173 WeakPolarHBondContact CA-OD1 3.49Å; N173-M175 VanDerWaalsContact C-N 3.29Å; N173-M175 PolarHBondContact O-N 2.9Å; N173-M175 WeakPolarHBondContact OD1-CB 3.41Å; N173-M175 PolarHBondContact OD1-N 3.02Å
174	K	97.9	Very high	97.5	Very high	117 Å²	117	46 Å²	46	51%	0.509	24%	0.237	S	C	.	.			trans	64.3	23.7	178.5	-42.6	-54	-179.9	-174.9	0	115.1	E170 P171	E170-K174 VanDerWaalsContact O-CA 3.26Å; E170-K174 WeakPolarHBondContact O-CA 3.47Å; E170-K174 PolarHBondContact O-N 3.27Å; P171-K174 PolarHBondContact O-NZ 3.24Å
175	M	98.1	Very high	97.4	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	24%	0.235	C	C	.	.			trans	-111.1	83	-177.2	-64.7	-52.4	-58.1	0	0	112.6	I63 R65 I166 A167 N173 S179 L180 I183	I63-M175 HydrophobicContact CG2-CB 4.49Å; I63-M175 HydrophobicContact CG2-CG 3.84Å; I63-M175 WeakPolarHBondContact O-CE 3.5Å; I63-M175 WeakPolarHBondContact O-CG 3.44Å; R65-M175 HydrophobicContact CB-CE 3.8Å; R65-M175 HydrophobicContact CB-SD 3.73Å; I166-M175 HydrophobicContact CG2-CB 4.42Å; A167-M175 WeakPolarHBondContact CA-O 3.5Å; N173-M175 VanDerWaalsContact C-N 3.29Å; N173-M175 PolarHBondContact O-N 2.9Å; N173-M175 WeakPolarHBondContact OD1-CB 3.41Å; N173-M175 PolarHBondContact OD1-N 3.02Å; M175-S179 WeakPolarHBondContact CA-OG 3.4Å; M175-S179 VanDerWaalsContact CE-OG 3.28Å; M175-S179 WeakPolarHBondContact CE-OG 3.44Å; M175-L180 HydrophobicContact CB-CD2 4.18Å; M175-L180 HydrophobicContact CB-CG 4.32Å; M175-L180 HydrophobicContact CE-CD2 3.72Å; M175-L180 HydrophobicContact CE-CG 4.35Å; M175-I183 HydrophobicContact CE-CD1 3.4Å
176	S	98	Very high	97.2	Very high	28 Å²	28	44.2 Å²	44.2	20%	0.196	24%	0.235	C	C	.	.			trans	-62.2	158.4	173.1	75.7	0	0	0	0	113.2	E170 N178 S179 L180	E170-S176 VanDerWaalsContact CD-CA 3.49Å; E170-S176 WeakPolarHBondContact OE1-CB 2.74Å; E170-S176 WeakPolarHBondContact OE2-CA 3.45Å; E170-S176 WeakPolarHBondContact OE2-CB 3.44Å; S176-N178 PolarHBondContact O-N 3.15Å; S176-S179 PolarHBondContact N-OG 3.01Å; S176-S179 PolarHBondContact O-N 3.07Å; S176-S179 PolarHBondContact O-OG 2.83Å; S176-S179 PolarHBondContact OG-N 2.99Å; S176-S179 VanDerWaalsContact OG-N 3.13Å; S176-L180 PolarHBondContact O-N 3.44Å
177	R	97.8	Very high	96.9	Very high	54 Å²	54	45 Å²	45	20%	0.204	24%	0.24	C	C	.	.	H	α-helix	trans	-54.6	-38.4	174.6	-63.9	-167.2	-178.9	83	12.7	112.5	S164 A167 E168 L180 G181 T209 I212 Q213	S164-R177 PolarHBondContact OG-NE 3.29Å; S164-R177 PolarHBondContact OG-NH2 2.7Å; A167-R177 HydrophobicContact CB-CB 4.4Å; A167-R177 HydrophobicContact CB-CG 3.4Å; E168-R177 IonicContact OE1-NH2 2.76Å; R177-L180 PolarHBondContact O-N 3.39Å; R177-G181 PolarHBondContact O-N 3.46Å; R177-T209 HydrophobicContact CB-CG2 4.5Å; R177-I212 HydrophobicContact CB-CG2 4.21Å; R177-I212 HydrophobicContact CG-CG2 3.85Å; R177-Q213 VanDerWaalsContact CD-CA 3.46Å
178	N	97.5	Very high	96.8	Very high	98 Å²	98	44.7 Å²	44.7	52%	0.524	24%	0.238	S	C	.	.	H	α-helix	trans	-64.4	-41.8	175.6	-59.2	37.3	0	0	0	111.5	S176 G181 I182 T209	S176-N178 PolarHBondContact O-N 3.15Å; N178-G181 PolarHBondContact O-N 2.92Å; N178-I182 WeakPolarHBondContact O-CG1 3.41Å; N178-I182 PolarHBondContact O-N 3.32Å; N178-T209 HydrophobicContact CB-CG2 4.23Å; N178-T209 WeakPolarHBondContact OD1-CG2 3.38Å
179	S	97.5	Very high	96.6	Very high	26 Å²	26	39.4 Å²	39.4	18%	0.182	21%	0.213	C	C	.	.	H	α-helix	trans	-67.6	-37.9	178.3	75.7	0	0	0	0	112.4	M175 S176 I182 I183	M175-S179 WeakPolarHBondContact CA-OG 3.4Å; M175-S179 VanDerWaalsContact CE-OG 3.28Å; M175-S179 WeakPolarHBondContact CE-OG 3.44Å; S176-S179 PolarHBondContact N-OG 3.01Å; S176-S179 PolarHBondContact O-N 3.07Å; S176-S179 PolarHBondContact O-OG 2.83Å; S176-S179 PolarHBondContact OG-N 2.99Å; S176-S179 VanDerWaalsContact OG-N 3.13Å; S179-I182 PolarHBondContact O-N 2.85Å; S179-I183 WeakPolarHBondContact O-CD1 3.18Å; S179-I183 WeakPolarHBondContact O-CG1 3.43Å; S179-I183 PolarHBondContact O-N 3.3Å
180	L	98.3	Very high	95.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68.2	-38.9	172.1	-65	175.4	0	0	0	111.3	F64 L163 I166 A167 M175 S176 R177 I182 I183 F184 I212	F64-L180 HydrophobicContact CB-CD2 4.38Å; F64-L180 HydrophobicContact CD2-CD2 4.12Å; L163-L180 HydrophobicContact CB-CD1 4.27Å; L163-L180 HydrophobicContact CD2-CD1 4.32Å; L163-L180 HydrophobicContact CD2-CD2 4.42Å; L163-L180 WeakPolarHBondContact O-CD1 3.47Å; I166-L180 HydrophobicContact CB-CD1 4.13Å; I166-L180 HydrophobicContact CG2-CD1 4.07Å; I166-L180 HydrophobicContact CG2-CD2 4.49Å; A167-L180 HydrophobicContact CB-CD1 4.06Å; M175-L180 HydrophobicContact CB-CD2 4.18Å; M175-L180 HydrophobicContact CB-CG 4.32Å; M175-L180 HydrophobicContact CE-CD2 3.72Å; M175-L180 HydrophobicContact CE-CG 4.35Å; S176-L180 PolarHBondContact O-N 3.44Å; R177-L180 PolarHBondContact O-N 3.39Å; L180-I182 VanDerWaalsContact C-N 3.32Å; L180-I182 PolarHBondContact O-N 3.18Å; L180-I183 PolarHBondContact O-N 3.37Å; L180-I183 VanDerWaalsContact O-N 3.11Å; L180-F184 HydrophobicContact CD2-CE2 4.38Å; L180-F184 WeakPolarHBondContact O-CB 3.24Å; L180-F184 WeakPolarHBondContact O-CD2 3.43Å; L180-F184 PolarHBondContact O-N 3.13Å; L180-I212 HydrophobicContact CB-CD1 3.92Å
181	G	97.4	Very high	94	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-59.2	-39.2	174.3	0	0	0	0	0	113.3	R177 N178 G185	R177-G181 PolarHBondContact O-N 3.46Å; N178-G181 PolarHBondContact O-N 2.92Å; G181-G185 WeakPolarHBondContact O-CA 3.41Å; G181-G185 PolarHBondContact O-N 3.02Å
182	I	96.2	Very high	92.1	Very high	100 Å²	100	37.6 Å²	37.6	51%	0.513	20%	0.198	S	C	.	.	H	α-helix	trans	-66	-36.8	173.7	-68	163.2	0	0	0	112.2	N178 S179 L180 P186 N205	N178-I182 WeakPolarHBondContact O-CG1 3.41Å; N178-I182 PolarHBondContact O-N 3.32Å; S179-I182 PolarHBondContact O-N 2.85Å; L180-I182 VanDerWaalsContact C-N 3.32Å; L180-I182 PolarHBondContact O-N 3.18Å; I182-P186 VanDerWaalsContact O-CD 3.31Å; I182-P186 WeakPolarHBondContact O-CD 3.5Å; I182-N205 HydrophobicContact CG1-CB 4.2Å
183	I	96.8	Very high	90	Very high	34 Å²	34	43.5 Å²	43.5	17%	0.174	23%	0.227	C	C	.	.	H	α-helix	trans	-79.2	-41.6	-178	-67.2	161	0	0	0	111.8	F64 R65 K104 M175 S179 L180 C187	F64-I183 HydrophobicContact CB-CG2 4.24Å; R65-I183 HydrophobicContact CB-CD1 3.79Å; R65-I183 HydrophobicContact CG-CD1 4.46Å; K104-I183 HydrophobicContact CD-CG2 3.83Å; M175-I183 HydrophobicContact CE-CD1 3.4Å; S179-I183 WeakPolarHBondContact O-CD1 3.18Å; S179-I183 WeakPolarHBondContact O-CG1 3.43Å; S179-I183 PolarHBondContact O-N 3.3Å; L180-I183 PolarHBondContact O-N 3.37Å; L180-I183 VanDerWaalsContact O-N 3.11Å; I183-C187 PolarHBondContact O-SG 3.05Å; I183-C187 VanDerWaalsContact O-SG 3.34Å
184	F	97.2	Very high	88	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-89.9	-20.9	-175.4	-79.4	-90.6	0	0	0	113.8	F64 K104 L107 L159 L163 L180 C187 V188 M208	F64-F184 HydrophobicContact CB-CE2 3.95Å; F64-F184 HydrophobicContact CB-CZ 4.47Å; F64-F184 AromaticContact CD1-CE2 3.87Å; F64-F184 HydrophobicContact CD1-CE2 3.87Å; F64-F184 AromaticContact CD1-CZ 3.54Å; F64-F184 HydrophobicContact CD1-CZ 3.54Å; F64-F184 HydrophobicContact CD2-CE2 4.05Å; F64-F184 HydrophobicContact CD2-CZ 4.29Å; F64-F184 HydrophobicContact CE1-CE2 4.43Å; F64-F184 AromaticContact CE1-CZ 3.77Å; F64-F184 HydrophobicContact CE1-CZ 3.77Å; F64-F184 HydrophobicContact CE2-CZ 4.48Å; F64-F184 AromaticContact CG-CE2 3.67Å; F64-F184 HydrophobicContact CG-CE2 3.67Å; F64-F184 AromaticContact CG-CZ 3.84Å; F64-F184 HydrophobicContact CG-CZ 3.84Å; F64-F184 HydrophobicContact CZ-CZ 4.24Å; K104-F184 HydrophobicContact CG-CE1 4.4Å; K104-F184 HydrophobicContact CG-CZ 4.28Å; L107-F184 HydrophobicContact CD1-CD1 4.01Å; L107-F184 HydrophobicContact CD1-CE1 3.85Å; L159-F184 HydrophobicContact CD1-CD1 4.45Å; L159-F184 HydrophobicContact CD1-CE1 4.09Å; L159-F184 HydrophobicContact CD2-CD1 4.35Å; L163-F184 HydrophobicContact CD1-CB 4.24Å; L163-F184 HydrophobicContact CD1-CD1 4Å; L163-F184 HydrophobicContact CD1-CD2 3.75Å; L163-F184 HydrophobicContact CD1-CE1 4.28Å; L163-F184 HydrophobicContact CD1-CE2 4.05Å; L163-F184 HydrophobicContact CD1-CG 3.71Å; L163-F184 HydrophobicContact CD1-CZ 4.31Å; L163-F184 HydrophobicContact CD2-CD2 3.97Å; L163-F184 HydrophobicContact CD2-CE1 4.38Å; L163-F184 HydrophobicContact CD2-CE2 3.46Å; L163-F184 VanDerWaalsContact CD2-CE2 3.46Å; L163-F184 HydrophobicContact CD2-CZ 3.7Å; L163-F184 HydrophobicContact CG-CE2 4.42Å; L180-F184 HydrophobicContact CD2-CE2 4.38Å; L180-F184 WeakPolarHBondContact O-CB 3.24Å; L180-F184 WeakPolarHBondContact O-CD2 3.43Å; L180-F184 PolarHBondContact O-N 3.13Å; F184-C187 CarbonylContact O-C 3.53Å; F184-C187 WeakPolarHBondContact O-CA 3.43Å; F184-C187 PolarHBondContact O-N 3.36Å; F184-V188 HydrophobicContact CB-CG2 4.33Å; F184-V188 HydrophobicContact CD1-CG2 4.48Å; F184-V188 WeakPolarHBondContact O-CB 3.41Å; F184-V188 WeakPolarHBondContact O-CG2 3.15Å; F184-V188 PolarHBondContact O-N 3.36Å; F184-M208 HydrophobicContact CB-CE 3.95Å; F184-M208 HydrophobicContact CB-CG 4.01Å; F184-M208 HydrophobicContact CB-SD 4.31Å
185	G	94.8	Very high	86	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-48.9	-55.9	174.5	0	0	0	0	0	112.7	G181 C187 V188 F189	G181-G185 WeakPolarHBondContact O-CA 3.41Å; G181-G185 PolarHBondContact O-N 3.02Å; G185-C187 PolarHBondContact O-N 2.99Å; G185-V188 PolarHBondContact O-N 3.15Å; G185-F189 PolarHBondContact O-N 3.21Å; G185-F189 VanDerWaalsContact O-N 3.12Å
186	P	92.3	Very high	84.2	Confident	64 Å²	64	55.3 Å²	55.3	42%	0.416	29%	0.285	S	S	.	.	H	α-helix	trans	-68.1	-10.9	174.8	-18.6	30.7	0	0	0	116	I182	I182-P186 VanDerWaalsContact O-CD 3.31Å; I182-P186 WeakPolarHBondContact O-CD 3.5Å
187	C	93.2	Very high	82.3	Confident	17 Å²	17	55.4 Å²	55.4	12%	0.115	28%	0.284	C	S	.	.	H	α-helix	trans	-99.5	-24.2	179.9	-58.8	0	0	0	0	112.8	I183 F184 G185	I183-C187 PolarHBondContact O-SG 3.05Å; I183-C187 VanDerWaalsContact O-SG 3.34Å; F184-C187 CarbonylContact O-C 3.53Å; F184-C187 WeakPolarHBondContact O-CA 3.43Å; F184-C187 PolarHBondContact O-N 3.36Å; G185-C187 PolarHBondContact O-N 2.99Å
188	V	95.2	Very high	80.8	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-98.5	-46.7	-176.7	169.2	0	0	0	0	111.1	L114 V115 L156 L159 F184 G185 M208	L114-V188 HydrophobicContact CB-CG1 4.29Å; L114-V188 HydrophobicContact CD2-CG1 4.27Å; L114-V188 HydrophobicContact CD2-CG2 4.41Å; L114-V188 HydrophobicContact CG-CG1 4.43Å; L114-V188 PolarHBondContact N-O 3.16Å; V115-V188 HydrophobicContact CG2-CG1 3.86Å; V115-V188 PolarHBondContact N-O 3.15Å; L156-V188 HydrophobicContact CD1-CG1 3.63Å; L159-V188 HydrophobicContact CD2-CG2 3.65Å; F184-V188 HydrophobicContact CB-CG2 4.33Å; F184-V188 HydrophobicContact CD1-CG2 4.48Å; F184-V188 WeakPolarHBondContact O-CB 3.41Å; F184-V188 WeakPolarHBondContact O-CG2 3.15Å; F184-V188 PolarHBondContact O-N 3.36Å; G185-V188 PolarHBondContact O-N 3.15Å; V188-M208 HydrophobicContact CB-SD 3.97Å; V188-M208 HydrophobicContact CG1-SD 4.05Å; V188-M208 HydrophobicContact CG2-CE 4.03Å; V188-M208 HydrophobicContact CG2-SD 3.9Å
189	F	92.1	Very high	79.6	Confident	7 Å²	7	60.8 Å²	60.8	3%	0.031	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	-87.8	127.8	-178.4	-67	-93.8	0	0	0	110.3	V115 C123 G185 C191 T204 I207 M208 L211	V115-F189 HydrophobicContact CB-CD1 3.86Å; V115-F189 HydrophobicContact CB-CE1 4.09Å; V115-F189 HydrophobicContact CB-CG 4.39Å; V115-F189 HydrophobicContact CG1-CD1 3.72Å; V115-F189 HydrophobicContact CG1-CE1 3.79Å; V115-F189 HydrophobicContact CG2-CD1 4.4Å; V115-F189 HydrophobicContact CG2-CE1 4.19Å; V115-F189 HydrophobicContact CG2-CZ 4.48Å; C123-F189 HydrophobicContact CB-CE1 4.34Å; G185-F189 PolarHBondContact O-N 3.21Å; G185-F189 VanDerWaalsContact O-N 3.12Å; F189-C191 PolarHBondContact O-N 3.46Å; F189-T204 HydrophobicContact CB-CG2 3.63Å; F189-T204 HydrophobicContact CD1-CG2 4.42Å; F189-T204 HydrophobicContact CD2-CG2 3.62Å; F189-T204 HydrophobicContact CE2-CG2 4.43Å; F189-T204 HydrophobicContact CG-CG2 3.63Å; F189-I207 HydrophobicContact CE1-CG2 4.22Å; F189-I207 HydrophobicContact CE2-CG2 4.42Å; F189-I207 HydrophobicContact CZ-CB 4.34Å; F189-I207 HydrophobicContact CZ-CG2 3.61Å; F189-M208 HydrophobicContact CE2-CB 4.16Å; F189-M208 HydrophobicContact CE2-SD 4.02Å; F189-L211 HydrophobicContact CE2-CD1 4.35Å; F189-L211 HydrophobicContact CZ-CD1 4.01Å
190	R	80.3	Confident	78.9	Confident	105 Å²	105	60.4 Å²	60.4	40%	0.396	31%	0.306	S	S	.	.			trans	-74.5	114.1	174.3	-168.3	63.5	171.7	-148.2	-7.6	109.8	L110 P111 D112 V115 E117	L110-R190 PolarHBondContact O-NH1 3.38Å; P111-R190 PolarHBondContact O-NH1 3.2Å; P111-R190 PolarHBondContact O-NH2 3.06Å; D112-R190 VanDerWaalsContact O-CB 3.24Å; D112-R190 WeakPolarHBondContact O-CB 3.44Å; D112-R190 WeakPolarHBondContact O-CG 3.44Å; V115-R190 PolarHBondContact O-N 2.91Å; E117-R190 HydrophobicContact CB-CB 4.37Å
191	C	61.3	Low	78.4	Confident	45 Å²	45	62.6 Å²	62.6	30%	0.304	32%	0.316	S	S	.	.			trans	-102.1	125.6	171.8	-67.2	0	0	0	0	109.8	F189 V197	F189-C191 PolarHBondContact O-N 3.46Å; C191-V197 HydrophobicContact CB-CB 4.38Å; C191-V197 HydrophobicContact CB-CG1 3.65Å; C191-V197 HydrophobicContact CB-CG2 3.81Å
192	S	56.7	Low	78	Confident	33 Å²	33	65 Å²	65	23%	0.231	34%	0.341	C	S	.	.			trans	-62.8	169.6	160.5	42.8	0	0	0	0	110.9	E117 D194 V197	E117-S192 WeakPolarHBondContact OE1-CB 3.48Å; E117-S192 PolarHBondContact OE1-OG 3.42Å; S192-D194 PolarHBondContact O-N 3.2Å; S192-V197 WeakPolarHBondContact O-CG2 3.23Å
193	L	54.3	Low	77.9	Confident	184 Å²	184	62.4 Å²	62.4	96%	0.963	33%	0.328	S	S	*	.	S	Bend	trans	-83	10	-176.8	-71.9	167.2	0	0	0	113.7
194	D	54.7	Low	77.7	Confident	104 Å²	104	61 Å²	61	56%	0.556	32%	0.321	S	S	*	.	S	Bend	trans	-78.4	149.3	-171.2	-68.9	-13.7	0	0	0	113.5	S192 Q196 V197	S192-D194 PolarHBondContact O-N 3.2Å; D194-Q196 PolarHBondContact O-N 3.49Å; D194-V197 WeakPolarHBondContact O-CB 3.48Å; D194-V197 PolarHBondContact O-N 3.16Å
195	F	55.9	Low	77.6	Confident	152 Å²	152	62.1 Å²	62.1	67%	0.667	33%	0.327	S	S	*	.	H	α-helix	trans	-57.4	-22	-179.7	-167.2	-101.1	0	0	0	114	V197 L198	F195-V197 VanDerWaalsContact C-N 3.25Å; F195-V197 PolarHBondContact O-N 3.07Å; F195-L198 HydrophobicContact CD2-CD1 4.19Å; F195-L198 HydrophobicContact CE2-CD1 4.27Å; F195-L198 PolarHBondContact O-N 3.26Å
196	Q	59.9	Low	77.6	Confident	111 Å²	111	66.2 Å²	66.2	52%	0.519	34%	0.343	S	S	.	.	H	α-helix	trans	-65.2	-26.1	174	-59.2	-69.9	22.3	0	0	112.8	D194 K199 N200	D194-Q196 PolarHBondContact O-N 3.49Å; Q196-K199 PolarHBondContact O-N 3.47Å; Q196-N200 WeakPolarHBondContact O-CB 2.98Å; Q196-N200 PolarHBondContact O-N 2.98Å; Q196-N200 PolarHBondContact O-ND2 3.49Å; Q196-N200 VanDerWaalsContact O-ND2 3.15Å
197	V	59.8	Low	77.8	Confident	29 Å²	29	63.2 Å²	63.2	18%	0.176	32%	0.324	C	S	.	.	H	α-helix	trans	-65.4	-40.6	176.9	165.3	0	0	0	0	111.3	C191 S192 D194 F195 K199 N200 Q201	C191-V197 HydrophobicContact CB-CB 4.38Å; C191-V197 HydrophobicContact CB-CG1 3.65Å; C191-V197 HydrophobicContact CB-CG2 3.81Å; S192-V197 WeakPolarHBondContact O-CG2 3.23Å; D194-V197 WeakPolarHBondContact O-CB 3.48Å; D194-V197 PolarHBondContact O-N 3.16Å; F195-V197 VanDerWaalsContact C-N 3.25Å; F195-V197 PolarHBondContact O-N 3.07Å; V197-K199 PolarHBondContact O-N 3.28Å; V197-N200 CarbonylContact O-C 3.58Å; V197-N200 PolarHBondContact O-N 3.34Å; V197-N200 VanDerWaalsContact O-N 3.1Å; V197-Q201 WeakPolarHBondContact O-CB 3.27Å; V197-Q201 PolarHBondContact O-N 3.03Å
198	L	65.9	Low	78	Confident	133 Å²	133	62.4 Å²	62.4	70%	0.696	32%	0.318	S	S	*	.	H	α-helix	trans	-59.9	-36.4	176.3	-65.4	177.1	0	0	0	112	F195	F195-L198 HydrophobicContact CD2-CD1 4.19Å; F195-L198 HydrophobicContact CE2-CD1 4.27Å; F195-L198 PolarHBondContact O-N 3.26Å
199	K	71.7	Confident	78.1	Confident	132 Å²	132	63.3 Å²	63.3	57%	0.574	32%	0.324	S	S	*	.	H	α-helix	trans	-71.1	-40.7	173.9	-60	-177.5	-174.3	171.2	0	112.4	Q196 V197	Q196-K199 PolarHBondContact O-N 3.47Å; V197-K199 PolarHBondContact O-N 3.28Å
200	N	82.5	Confident	78.3	Confident	19 Å²	19	63.2 Å²	63.2	10%	0.102	32%	0.324	C	S	.	.	H	α-helix	trans	-85.3	-10.7	-176.4	-68	-41.7	0	0	0	114.1	I124 K128 Q196 V197 G202 L203 T204	I124-N200 HydrophobicContact CD1-CB 3.95Å; I124-N200 HydrophobicContact CG2-CB 4.39Å; K128-N200 PolarHBondContact NZ-OD1 3.43Å; Q196-N200 WeakPolarHBondContact O-CB 2.98Å; Q196-N200 PolarHBondContact O-N 2.98Å; Q196-N200 PolarHBondContact O-ND2 3.49Å; Q196-N200 VanDerWaalsContact O-ND2 3.15Å; V197-N200 CarbonylContact O-C 3.58Å; V197-N200 PolarHBondContact O-N 3.34Å; V197-N200 VanDerWaalsContact O-N 3.1Å; N200-G202 VanDerWaalsContact C-N 3.3Å; N200-G202 PolarHBondContact O-N 3.45Å; N200-L203 WeakPolarHBondContact O-CB 3.47Å; N200-L203 PolarHBondContact O-N 3.34Å; N200-T204 PolarHBondContact O-N 3.06Å; N200-T204 PolarHBondContact O-OG1 3.49Å
201	Q	87.5	Confident	79.1	Confident	45 Å²	45	58.2 Å²	58.2	21%	0.21	31%	0.305	C	S	.	.	H	α-helix	trans	-60.3	-37.1	-176.1	-171.7	64.4	69.5	0	0	112.7	V197 L203 T204 N205	V197-Q201 WeakPolarHBondContact O-CB 3.27Å; V197-Q201 PolarHBondContact O-N 3.03Å; Q201-L203 VanDerWaalsContact C-N 3.33Å; Q201-L203 PolarHBondContact O-N 2.71Å; Q201-T204 PolarHBondContact O-N 3.3Å; Q201-N205 PolarHBondContact NE2-OD1 3.1Å; Q201-N205 WeakPolarHBondContact O-CB 3.3Å; Q201-N205 PolarHBondContact O-N 2.9Å; Q201-N205 PolarHBondContact O-OD1 3.23Å
202	G	90.5	Very high	80.9	Confident	51 Å²	51	56 Å²	56	53%	0.526	29%	0.291	S	S	.	.	H	α-helix	trans	-60.8	-41.4	174.4	0	0	0	0	0	112.5	N200 N205 Y206	N200-G202 VanDerWaalsContact C-N 3.3Å; N200-G202 PolarHBondContact O-N 3.45Å; G202-N205 PolarHBondContact O-N 3.41Å; G202-Y206 WeakPolarHBondContact O-CB 3.42Å; G202-Y206 PolarHBondContact O-N 3.02Å
203	L	92.4	Very high	82.8	Confident	46 Å²	46	58.1 Å²	58.1	24%	0.241	30%	0.296	C	S	.	.	H	α-helix	trans	-70.3	-38.2	175.3	-65.4	169.2	0	0	0	111.7	I124 K128 N200 Q201 N205 Y206 I207	I124-L203 HydrophobicContact CG2-CD1 4.11Å; K128-L203 HydrophobicContact CD-CD1 4.09Å; K128-L203 HydrophobicContact CG-CD1 3.7Å; N200-L203 WeakPolarHBondContact O-CB 3.47Å; N200-L203 PolarHBondContact O-N 3.34Å; Q201-L203 VanDerWaalsContact C-N 3.33Å; Q201-L203 PolarHBondContact O-N 2.71Å; L203-N205 VanDerWaalsContact C-N 3.33Å; L203-N205 PolarHBondContact O-N 2.83Å; L203-Y206 PolarHBondContact O-N 3.48Å; L203-I207 WeakPolarHBondContact O-CD1 3.32Å; L203-I207 WeakPolarHBondContact O-CG1 3.28Å; L203-I207 PolarHBondContact O-N 3.11Å
204	T	93	Very high	84.8	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.018	27%	0.265	C	S	.	.	H	α-helix	trans	-60.9	-43.1	175	-53.3	0	0	0	0	111.1	F189 N200 Q201 I207 M208	F189-T204 HydrophobicContact CB-CG2 3.63Å; F189-T204 HydrophobicContact CD1-CG2 4.42Å; F189-T204 HydrophobicContact CD2-CG2 3.62Å; F189-T204 HydrophobicContact CE2-CG2 4.43Å; F189-T204 HydrophobicContact CG-CG2 3.63Å; N200-T204 PolarHBondContact O-N 3.06Å; N200-T204 PolarHBondContact O-OG1 3.49Å; Q201-T204 PolarHBondContact O-N 3.3Å; T204-I207 PolarHBondContact O-N 3.44Å; T204-M208 WeakPolarHBondContact O-CB 3.41Å; T204-M208 PolarHBondContact O-N 3.44Å
205	N	95.2	Very high	86.7	Confident	25 Å²	25	48.9 Å²	48.9	13%	0.134	24%	0.242	C	C	.	.	H	α-helix	trans	-68	-38.4	175.8	-65.1	-3.1	0	0	0	111.9	I182 Q201 G202 L203 T209	I182-N205 HydrophobicContact CG1-CB 4.2Å; Q201-N205 PolarHBondContact NE2-OD1 3.1Å; Q201-N205 WeakPolarHBondContact O-CB 3.3Å; Q201-N205 PolarHBondContact O-N 2.9Å; Q201-N205 PolarHBondContact O-OD1 3.23Å; G202-N205 PolarHBondContact O-N 3.41Å; L203-N205 VanDerWaalsContact C-N 3.33Å; L203-N205 PolarHBondContact O-N 2.83Å; N205-T209 WeakPolarHBondContact O-CB 3.24Å; N205-T209 PolarHBondContact O-N 2.85Å; N205-T209 PolarHBondContact O-OG1 3.06Å
206	Y	94.9	Very high	88.4	Confident	86 Å²	86	46.7 Å²	46.7	34%	0.337	24%	0.238	S	C	.	.	H	α-helix	trans	-63.5	-46.6	173	169.8	-97	0	0	0	111.7	A127 Y137 G202 L203 M208 T209 S210	A127-Y206 HydrophobicContact CB-CD1 4.4Å; A127-Y206 HydrophobicContact CB-CE1 4.49Å; Y137-Y206 HydrophobicContact CE1-CE1 4.25Å; Y137-Y206 HydrophobicContact CE2-CE1 4.24Å; Y137-Y206 AromaticContact CZ-CE1 3.77Å; G202-Y206 WeakPolarHBondContact O-CB 3.42Å; G202-Y206 PolarHBondContact O-N 3.02Å; L203-Y206 PolarHBondContact O-N 3.48Å; Y206-M208 PolarHBondContact O-N 3.37Å; Y206-T209 WeakPolarHBondContact O-CB 3.4Å; Y206-T209 PolarHBondContact O-N 3.03Å; Y206-T209 VanDerWaalsContact O-N 3.16Å; Y206-S210 PolarHBondContact O-N 3.11Å; Y206-S210 PolarHBondContact O-OG 3.5Å
207	I	96.2	Very high	90	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-59.5	-49.9	176	-64.7	155	0	0	0	109.6	C123 I124 A127 L141 F189 L203 T204 T209 S210 L211	C123-I207 HydrophobicContact CB-CD1 4.04Å; C123-I207 HydrophobicContact CB-CG2 4.35Å; C123-I207 WeakPolarHBondContact O-CD1 3.34Å; I124-I207 HydrophobicContact CG1-CD1 3.96Å; A127-I207 HydrophobicContact CB-CD1 3.85Å; A127-I207 HydrophobicContact CB-CG1 3.73Å; L141-I207 HydrophobicContact CD1-CG2 4.27Å; L141-I207 HydrophobicContact CD2-CG2 4.4Å; F189-I207 HydrophobicContact CE1-CG2 4.22Å; F189-I207 HydrophobicContact CE2-CG2 4.42Å; F189-I207 HydrophobicContact CZ-CB 4.34Å; F189-I207 HydrophobicContact CZ-CG2 3.61Å; L203-I207 WeakPolarHBondContact O-CD1 3.32Å; L203-I207 WeakPolarHBondContact O-CG1 3.28Å; L203-I207 PolarHBondContact O-N 3.11Å; T204-I207 PolarHBondContact O-N 3.44Å; I207-T209 VanDerWaalsContact C-N 3.26Å; I207-T209 PolarHBondContact O-N 3.16Å; I207-S210 CarbonylContact O-C 3.3Å; I207-S210 WeakPolarHBondContact O-CA 3.14Å; I207-S210 WeakPolarHBondContact O-CB 3.38Å; I207-S210 PolarHBondContact O-N 2.79Å; I207-L211 HydrophobicContact CG2-CG 4.32Å; I207-L211 WeakPolarHBondContact O-CG 3.38Å; I207-L211 PolarHBondContact O-N 2.75Å
208	M	97.4	Very high	91.6	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58.7	-38.1	177.2	-168.4	68.2	-151.6	0	0	112.1	L163 F184 V188 F189 T204 Y206 L211 I212	L163-M208 HydrophobicContact CD1-CE 3.91Å; F184-M208 HydrophobicContact CB-CE 3.95Å; F184-M208 HydrophobicContact CB-CG 4.01Å; F184-M208 HydrophobicContact CB-SD 4.31Å; V188-M208 HydrophobicContact CB-SD 3.97Å; V188-M208 HydrophobicContact CG1-SD 4.05Å; V188-M208 HydrophobicContact CG2-CE 4.03Å; V188-M208 HydrophobicContact CG2-SD 3.9Å; F189-M208 HydrophobicContact CE2-CB 4.16Å; F189-M208 HydrophobicContact CE2-SD 4.02Å; T204-M208 WeakPolarHBondContact O-CB 3.41Å; T204-M208 PolarHBondContact O-N 3.44Å; Y206-M208 PolarHBondContact O-N 3.37Å; M208-L211 PolarHBondContact O-N 3.01Å; M208-L211 HydrophobicContact SD-CD1 4.25Å; M208-I212 HydrophobicContact CE-CD1 3.99Å; M208-I212 HydrophobicContact CE-CG1 4Å; M208-I212 HydrophobicContact CG-CD1 4.28Å; M208-I212 WeakPolarHBondContact O-CD1 3.44Å; M208-I212 VanDerWaalsContact O-CG1 3.28Å; M208-I212 WeakPolarHBondContact O-CG1 3.4Å; M208-I212 PolarHBondContact O-N 2.73Å; M208-I212 VanDerWaalsContact O-N 3.15Å
209	T	97.5	Very high	92.8	Very high	19 Å²	19	36.5 Å²	36.5	12%	0.117	19%	0.191	C	C	.	.	H	α-helix	trans	-61	-46.2	173	-57.2	0	0	0	0	111.2	R177 N178 N205 Y206 I207 I212 Q213	R177-T209 HydrophobicContact CB-CG2 4.5Å; N178-T209 HydrophobicContact CB-CG2 4.23Å; N178-T209 WeakPolarHBondContact OD1-CG2 3.38Å; N205-T209 WeakPolarHBondContact O-CB 3.24Å; N205-T209 PolarHBondContact O-N 2.85Å; N205-T209 PolarHBondContact O-OG1 3.06Å; Y206-T209 WeakPolarHBondContact O-CB 3.4Å; Y206-T209 PolarHBondContact O-N 3.03Å; Y206-T209 VanDerWaalsContact O-N 3.16Å; I207-T209 VanDerWaalsContact C-N 3.26Å; I207-T209 PolarHBondContact O-N 3.16Å; T209-I212 PolarHBondContact O-N 2.82Å; T209-Q213 WeakPolarHBondContact O-CB 3.47Å; T209-Q213 PolarHBondContact O-N 2.9Å
210	S	97	Very high	93.1	Very high	5 Å²	5	33 Å²	33	4%	0.035	18%	0.18	C	C	.	.	H	α-helix	trans	-63.4	-38.7	176.1	-65.4	0	0	0	0	112.9	Y137 Y206 I207 I212 Q213 Y214	Y137-S210 WeakPolarHBondContact OH-CB 3.2Å; Y137-S210 PolarHBondContact OH-OG 2.9Å; Y206-S210 PolarHBondContact O-N 3.11Å; Y206-S210 PolarHBondContact O-OG 3.5Å; I207-S210 CarbonylContact O-C 3.3Å; I207-S210 WeakPolarHBondContact O-CA 3.14Å; I207-S210 WeakPolarHBondContact O-CB 3.38Å; I207-S210 PolarHBondContact O-N 2.79Å; S210-I212 VanDerWaalsContact C-N 3.28Å; S210-I212 PolarHBondContact O-N 3.23Å; S210-Q213 PolarHBondContact O-N 3.49Å; S210-Y214 WeakPolarHBondContact O-CD2 3.39Å; S210-Y214 PolarHBondContact O-N 2.91Å
211	L	97.5	Very high	91.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.3	-36.9	174.1	-61.4	-173	0	0	0	111.9	L141 L145 L156 F189 I207 M208 H215 I218	L141-L211 HydrophobicContact CD2-CD2 3.82Å; L141-L211 HydrophobicContact CG-CD2 4.3Å; L145-L211 HydrophobicContact CD1-CD2 3.62Å; L156-L211 HydrophobicContact CD1-CD1 4.15Å; L156-L211 HydrophobicContact CD2-CD1 4.23Å; F189-L211 HydrophobicContact CE2-CD1 4.35Å; F189-L211 HydrophobicContact CZ-CD1 4.01Å; I207-L211 HydrophobicContact CG2-CG 4.32Å; I207-L211 WeakPolarHBondContact O-CG 3.38Å; I207-L211 PolarHBondContact O-N 2.75Å; M208-L211 PolarHBondContact O-N 3.01Å; M208-L211 HydrophobicContact SD-CD1 4.25Å; L211-H215 WeakPolarHBondContact O-CA 3.48Å; L211-H215 WeakPolarHBondContact O-CB 3.26Å; L211-H215 PolarHBondContact O-N 3.33Å; L211-I218 HydrophobicContact CD2-CD1 4.11Å; L211-I218 HydrophobicContact CD2-CG2 4.18Å
212	I	97.9	Very high	89.7	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-79.3	-34.6	177.4	-57.5	162.6	0	0	0	111.3	L163 R177 L180 M208 T209 S210 H215	L163-I212 HydrophobicContact CB-CD1 4.09Å; L163-I212 HydrophobicContact CB-CG1 4.05Å; L163-I212 HydrophobicContact CB-CG2 4.01Å; L163-I212 HydrophobicContact CD1-CD1 3.86Å; L163-I212 HydrophobicContact CD1-CG1 4.21Å; R177-I212 HydrophobicContact CB-CG2 4.21Å; R177-I212 HydrophobicContact CG-CG2 3.85Å; L180-I212 HydrophobicContact CB-CD1 3.92Å; M208-I212 HydrophobicContact CE-CD1 3.99Å; M208-I212 HydrophobicContact CE-CG1 4Å; M208-I212 HydrophobicContact CG-CD1 4.28Å; M208-I212 WeakPolarHBondContact O-CD1 3.44Å; M208-I212 VanDerWaalsContact O-CG1 3.28Å; M208-I212 WeakPolarHBondContact O-CG1 3.4Å; M208-I212 PolarHBondContact O-N 2.73Å; M208-I212 VanDerWaalsContact O-N 3.15Å; T209-I212 PolarHBondContact O-N 2.82Å; S210-I212 VanDerWaalsContact C-N 3.28Å; S210-I212 PolarHBondContact O-N 3.23Å; I212-H215 PolarHBondContact O-CD2 3.45Å
213	Q	96.8	Very high	87.3	Confident	76 Å²	76	38.9 Å²	38.9	36%	0.355	20%	0.2	S	C	.	.	H	α-helix	trans	-80.2	-26.5	-177.8	-177.6	55.9	84.3	0	0	113.5	R177 T209 S210	R177-Q213 VanDerWaalsContact CD-CA 3.46Å; T209-Q213 WeakPolarHBondContact O-CB 3.47Å; T209-Q213 PolarHBondContact O-N 2.9Å; S210-Q213 PolarHBondContact O-N 3.49Å
214	Y	96	Very high	84.7	Confident	79 Å²	79	38 Å²	38	31%	0.31	20%	0.195	S	C	.	.	S	Bend	trans	-125.8	26.7	-176	-51.3	-68.4	0	0	0	112.6	L134 I138 S210 D216 A217 I218	L134-Y214 HydrophobicContact CD1-CD2 4.15Å; L134-Y214 HydrophobicContact CD1-CE1 4.31Å; L134-Y214 HydrophobicContact CD1-CE2 3.61Å; L134-Y214 HydrophobicContact CD2-CE1 4Å; I138-Y214 HydrophobicContact CD1-CD1 4.24Å; I138-Y214 HydrophobicContact CD1-CD2 4.37Å; I138-Y214 HydrophobicContact CD1-CG 3.96Å; S210-Y214 WeakPolarHBondContact O-CD2 3.39Å; S210-Y214 PolarHBondContact O-N 2.91Å; Y214-D216 VanDerWaalsContact C-N 3.3Å; Y214-D216 PolarHBondContact O-N 3.09Å; Y214-A217 PolarHBondContact O-N 3.17Å; Y214-I218 WeakPolarHBondContact O-CG1 3.24Å; Y214-I218 PolarHBondContact O-N 2.89Å
215	H	94.7	Very high	82.3	Confident	15 Å²	15	38.5 Å²	38.5	7%	0.069	20%	0.198	C	C	.	.	H	α-helix	trans	-54.1	-43.6	-176.4	62.6	73.2	0	0	0	113	C160 S164 L211 I212 A217 I218 F219	C160-H215 HydrophobicContact CB-CB 4.06Å; S164-H215 VanDerWaalsContact CB-CD2 3.42Å; S164-H215 WeakPolarHBondContact CB-CD2 3.02Å; S164-H215 WeakPolarHBondContact CB-NE2 3.41Å; S164-H215 PolarHBondContact OG-NE2 3.35Å; L211-H215 WeakPolarHBondContact O-CA 3.48Å; L211-H215 WeakPolarHBondContact O-CB 3.26Å; L211-H215 PolarHBondContact O-N 3.33Å; I212-H215 PolarHBondContact O-CD2 3.45Å; H215-A217 PolarHBondContact O-N 3.32Å; H215-I218 PolarHBondContact O-N 2.84Å; H215-F219 HydrophobicContact CB-CD2 3.93Å; H215-F219 HydrophobicContact CB-CE2 4.24Å; H215-F219 WeakPolarHBondContact O-CB 3.44Å; H215-F219 VanDerWaalsContact O-CD2 3.3Å; H215-F219 WeakPolarHBondContact O-CD2 3.36Å; H215-F219 PolarHBondContact O-N 3.47Å
216	D	92.1	Very high	79.5	Confident	107 Å²	107	41 Å²	41	57%	0.572	21%	0.211	S	C	*	.	H	α-helix	trans	-67.6	-24.5	-178	-69.2	-34	0	0	0	112.4	Y214 V220	Y214-D216 VanDerWaalsContact C-N 3.3Å; Y214-D216 PolarHBondContact O-N 3.09Å; D216-V220 WeakPolarHBondContact O-CG2 3.43Å
217	A	92.6	Very high	76.8	Confident	40 Å²	40	42.6 Å²	42.6	33%	0.331	22%	0.22	S	C	.	.	H	α-helix	trans	-84.1	-41.4	170.9	0	0	0	0	0	112.1	I138 Q142 Y214 H215 F219	I138-A217 HydrophobicContact CG2-CB 4.27Å; Q142-A217 PolarHBondContact NE2-O 3.03Å; Y214-A217 PolarHBondContact O-N 3.17Å; H215-A217 PolarHBondContact O-N 3.32Å; A217-F219 PolarHBondContact O-N 2.87Å
218	I	93.4	Very high	74	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-74.3	-25.7	-174.4	-68	169.3	0	0	0	112.4	I138 L141 Q142 L145 L211 Y214 H215	I138-I218 HydrophobicContact CG1-CG1 4.33Å; I138-I218 HydrophobicContact CG2-CG1 4.06Å; L141-I218 HydrophobicContact CD2-CD1 4.04Å; Q142-I218 WeakPolarHBondContact CG-O 3.43Å; L145-I218 HydrophobicContact CD1-CG2 3.6Å; L211-I218 HydrophobicContact CD2-CD1 4.11Å; L211-I218 HydrophobicContact CD2-CG2 4.18Å; Y214-I218 WeakPolarHBondContact O-CG1 3.24Å; Y214-I218 PolarHBondContact O-N 2.89Å; H215-I218 PolarHBondContact O-N 2.84Å
219	F	91.3	Very high	71.3	Confident	17 Å²	17	49.6 Å²	49.6	8%	0.075	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	23.4	-177.4	-58.8	-73.9	0	0	0	114.2	Y153 L156 K157 C160 H215 A217	Y153-F219 HydrophobicContact CD2-CD1 4.49Å; Y153-F219 HydrophobicContact CD2-CE1 4.44Å; Y153-F219 HydrophobicContact CE1-CD1 4.21Å; Y153-F219 AromaticContact CE2-CD1 3.83Å; Y153-F219 HydrophobicContact CE2-CD1 3.83Å; Y153-F219 HydrophobicContact CE2-CE1 4.09Å; Y153-F219 AromaticContact CZ-CD1 3.68Å; L156-F219 HydrophobicContact CD2-CE1 4.38Å; L156-F219 HydrophobicContact CD2-CZ 4.16Å; L156-F219 HydrophobicContact CG-CE1 4.4Å; L156-F219 HydrophobicContact CG-CZ 3.98Å; K157-F219 HydrophobicContact CB-CB 4.32Å; K157-F219 HydrophobicContact CB-CD1 3.66Å; K157-F219 HydrophobicContact CB-CD2 4.32Å; K157-F219 HydrophobicContact CB-CE1 4.01Å; K157-F219 HydrophobicContact CB-CG 3.85Å; K157-F219 HydrophobicContact CB-CZ 4.5Å; K157-F219 HydrophobicContact CD-CB 3.94Å; K157-F219 HydrophobicContact CD-CD1 4.29Å; K157-F219 HydrophobicContact CD-CG 4.31Å; K157-F219 HydrophobicContact CG-CB 3.71Å; K157-F219 HydrophobicContact CG-CD1 4.02Å; K157-F219 HydrophobicContact CG-CD2 4.37Å; K157-F219 HydrophobicContact CG-CG 3.79Å; C160-F219 HydrophobicContact CB-CE2 3.97Å; H215-F219 HydrophobicContact CB-CD2 3.93Å; H215-F219 HydrophobicContact CB-CE2 4.24Å; H215-F219 WeakPolarHBondContact O-CB 3.44Å; H215-F219 VanDerWaalsContact O-CD2 3.3Å; H215-F219 WeakPolarHBondContact O-CD2 3.36Å; H215-F219 PolarHBondContact O-N 3.47Å; A217-F219 PolarHBondContact O-N 2.87Å
220	V	79.4	Confident	68.2	Low	58 Å²	58	52.9 Å²	52.9	35%	0.352	27%	0.271	S	S	.	.			trans	-69.4	132.7	166.9	-169.8	0	0	0	0	109.7	D216 H222	D216-V220 WeakPolarHBondContact O-CG2 3.43Å; V220-H222 HydrophobicContact CB-CB 4.49Å; V220-H222 HydrophobicContact CG1-CB 4.31Å; V220-H222 PolarHBondContact O-N 3.48Å
221	H	56.2	Low	65.3	Low	128 Å²	128	54.9 Å²	54.9	59%	0.593	28%	0.281	S	S	*	.			trans	-71.1	76.3	159.5	-114.9	-66.5	0	0	0	109.4	P223	H221-P223 WeakPolarHBondContact O-CD 3.42Å
222	H	42.7	Very low	62.6	Low	33 Å²	33	58.9 Å²	58.9	15%	0.153	30%	0.3	C	S	.	.			trans	-80.6	116.7	-179.5	-176.3	-126.8	0	0	0	108.2	V220 K224 T225	V220-H222 HydrophobicContact CB-CB 4.49Å; V220-H222 HydrophobicContact CG1-CB 4.31Å; V220-H222 PolarHBondContact O-N 3.48Å; H222-K224 VanDerWaalsContact CE1-CD 3.45Å; H222-K224 WeakPolarHBondContact CE1-CD 3.34Å; H222-K224 WeakPolarHBondContact NE2-CD 3.44Å; H222-K224 VanDerWaalsContact NE2-CE 3.31Å; H222-K224 WeakPolarHBondContact NE2-CE 3.48Å; H222-K224 PolarHBondContact NE2-NZ 3.3Å; H222-K224 PolarHBondContact O-N 3.11Å; H222-T225 HydrophobicContact CB-CG2 4.28Å; H222-T225 PolarHBondContact O-N 2.6Å; H222-T225 PolarHBondContact O-OG1 2.97Å
223	P	39.2	Very low	59.6	Low	79 Å²	79	64 Å²	64	51%	0.513	33%	0.327	S	S	.	.	H	α-helix	trans	-67.5	2.3	-176.4	28	-36.2	0	0	0	113.9	H221	H221-P223 WeakPolarHBondContact O-CD 3.42Å
224	K	38.1	Very low	56.6	Low	28 Å²	28	67.9 Å²	67.9	12%	0.122	34%	0.342	C	S	.	.	H	α-helix	trans	-100.3	-5.9	171	-31.4	174.6	-157.6	161.1	0	111.9	H222 D226 F227 F228 S423 S427	H222-K224 VanDerWaalsContact CE1-CD 3.45Å; H222-K224 WeakPolarHBondContact CE1-CD 3.34Å; H222-K224 WeakPolarHBondContact NE2-CD 3.44Å; H222-K224 VanDerWaalsContact NE2-CE 3.31Å; H222-K224 WeakPolarHBondContact NE2-CE 3.48Å; H222-K224 PolarHBondContact NE2-NZ 3.3Å; H222-K224 PolarHBondContact O-N 3.11Å; K224-D226 VanDerWaalsContact C-N 3.32Å; K224-F227 HydrophobicContact CB-CB 4.31Å; K224-F227 CarbonylContact O-C 3.56Å; K224-F227 PolarHBondContact O-N 3.09Å; K224-F228 HydrophobicContact CB-CD2 4.43Å; K224-F228 WeakPolarHBondContact O-CB 3.43Å; K224-F228 WeakPolarHBondContact O-CD2 3.47Å; K224-F228 PolarHBondContact O-N 3.01Å; K224-S423 VanDerWaalsContact CD-OG 3.24Å; K224-S423 WeakPolarHBondContact CD-OG 3.39Å; K224-S423 WeakPolarHBondContact CE-O 3.48Å; K224-S423 WeakPolarHBondContact CE-OG 3.46Å; K224-S423 PolarHBondContact NZ-O 3.04Å; K224-S427 PolarHBondContact NZ-OG 2.86Å; K224-S427 VanDerWaalsContact NZ-OG 3.11Å
225	T	41.5	Very low	53.9	Low	13 Å²	13	70.3 Å²	70.3	8%	0.08	36%	0.355	C	S	.	.	H	α-helix	trans	-66.3	-40.5	161.9	51.4	0	0	0	0	109.6	H222 F227 F228 V229	H222-T225 HydrophobicContact CB-CG2 4.28Å; H222-T225 PolarHBondContact O-N 2.6Å; H222-T225 PolarHBondContact O-OG1 2.97Å; T225-F227 VanDerWaalsContact C-N 3.3Å; T225-F227 PolarHBondContact O-N 3.32Å; T225-F228 PolarHBondContact O-N 3.13Å; T225-V229 VanDerWaalsContact O-CB 3.25Å; T225-V229 WeakPolarHBondContact O-CB 3.38Å; T225-V229 VanDerWaalsContact O-CG2 3.22Å; T225-V229 WeakPolarHBondContact O-CG2 3.4Å; T225-V229 PolarHBondContact O-N 3.01Å
226	D	37.9	Very low	50.7	Low	78 Å²	78	75.3 Å²	75.3	42%	0.417	38%	0.381	S	S	.	.	H	α-helix	trans	-56.1	-46.4	168.3	-53.4	-46	0	0	0	110.9	K224 V229 L230	K224-D226 VanDerWaalsContact C-N 3.32Å; D226-V229 PolarHBondContact O-N 2.95Å; D226-L230 WeakPolarHBondContact O-CB 3.27Å; D226-L230 WeakPolarHBondContact O-CG 3.49Å; D226-L230 PolarHBondContact O-N 3.33Å
227	F	36.8	Very low	47.5	Very low	119 Å²	119	74.6 Å²	74.6	52%	0.522	38%	0.382	S	S	.	.	H	α-helix	trans	-66.4	-38.2	177.7	-153.5	-82.4	0	0	0	113.5	K224 T225 D231	K224-F227 HydrophobicContact CB-CB 4.31Å; K224-F227 CarbonylContact O-C 3.56Å; K224-F227 PolarHBondContact O-N 3.09Å; T225-F227 VanDerWaalsContact C-N 3.3Å; T225-F227 PolarHBondContact O-N 3.32Å; F227-D231 WeakPolarHBondContact O-CB 3.45Å; F227-D231 PolarHBondContact O-N 2.81Å
228	F	38.7	Very low	44.5	Very low	98 Å²	98	81 Å²	81	43%	0.43	41%	0.405	S	S	.	.	H	α-helix	trans	-77	-29.6	177.2	-85	-62.8	0	0	0	113.1	K224 T225 H232	K224-F228 HydrophobicContact CB-CD2 4.43Å; K224-F228 WeakPolarHBondContact O-CB 3.43Å; K224-F228 WeakPolarHBondContact O-CD2 3.47Å; K224-F228 PolarHBondContact O-N 3.01Å; T225-F228 PolarHBondContact O-N 3.13Å; F228-H232 WeakPolarHBondContact O-CB 3.42Å; F228-H232 PolarHBondContact O-N 3.22Å
229	V	39.2	Very low	41.4	Very low	49 Å²	49	88 Å²	88	30%	0.297	44%	0.441	S	S	.	.	H	α-helix	trans	-71.7	-42.7	171.6	168	0	0	0	0	109.4	F146 T225 D226 H232 L233	F146-V229 HydrophobicContact CD1-CG2 4.37Å; T225-V229 VanDerWaalsContact O-CB 3.25Å; T225-V229 WeakPolarHBondContact O-CB 3.38Å; T225-V229 VanDerWaalsContact O-CG2 3.22Å; T225-V229 WeakPolarHBondContact O-CG2 3.4Å; T225-V229 PolarHBondContact O-N 3.01Å; D226-V229 PolarHBondContact O-N 2.95Å; V229-H232 PolarHBondContact O-N 2.95Å; V229-L233 HydrophobicContact CG1-CD1 3.8Å; V229-L233 HydrophobicContact CG1-CG 4.43Å; V229-L233 VanDerWaalsContact O-CB 3.3Å; V229-L233 WeakPolarHBondContact O-CB 3.43Å; V229-L233 WeakPolarHBondContact O-CD1 3.23Å; V229-L233 WeakPolarHBondContact O-CG 3.41Å; V229-L233 PolarHBondContact O-N 3.43Å
230	L	33.9	Very low	38.4	Very low	87 Å²	87	94.1 Å²	94.1	46%	0.455	48%	0.48	S	S	.	.	H	α-helix	trans	-62.6	-47.3	170.7	-70.7	168.4	0	0	0	111.4	D226 H232 L233 F234	D226-L230 WeakPolarHBondContact O-CB 3.27Å; D226-L230 WeakPolarHBondContact O-CG 3.49Å; D226-L230 PolarHBondContact O-N 3.33Å; L230-H232 VanDerWaalsContact C-N 3.34Å; L230-H232 PolarHBondContact O-N 3.2Å; L230-L233 CarbonylContact O-C 3.6Å; L230-L233 PolarHBondContact O-N 3.1Å; L230-L233 VanDerWaalsContact O-N 3.07Å; L230-F234 HydrophobicContact CB-CD2 4.31Å; L230-F234 HydrophobicContact CB-CE2 4.32Å; L230-F234 HydrophobicContact CD2-CE2 4.1Å; L230-F234 WeakPolarHBondContact O-CD2 3.37Å; L230-F234 PolarHBondContact O-N 2.84Å
231	D	36	Very low	35.9	Very low	47 Å²	47	96.1 Å²	96.1	25%	0.251	50%	0.497	S	S	.	.	H	α-helix	trans	-58.6	-41.3	176.1	-178	65.3	0	0	0	112	F227 K235	F227-D231 WeakPolarHBondContact O-CB 3.45Å; F227-D231 PolarHBondContact O-N 2.81Å; D231-K235 WeakPolarHBondContact O-CB 3.39Å; D231-K235 WeakPolarHBondContact O-CD 3.45Å; D231-K235 WeakPolarHBondContact O-CG 3.22Å; D231-K235 PolarHBondContact O-N 2.85Å; D231-K235 WeakPolarHBondContact OD1-CE 3.24Å; D231-K235 IonicContact OD1-NZ 3.65Å; D231-K235 PolarHBondContact OD1-NZ 3.22Å; D231-K235 IonicContact OD2-NZ 3.6Å; D231-K235 PolarHBondContact OD2-NZ 3.38Å
232	H	39.2	Very low	34.5	Very low	84 Å²	84	97 Å²	97	39%	0.389	51%	0.505	S	S	.	.	H	α-helix	trans	-73	-27.2	173	-91.1	-57.5	0	0	0	114.1	K140 F228 V229 L230 L236	K140-H232 PolarHBondContact NZ-NE2 2.88Å; F228-H232 WeakPolarHBondContact O-CB 3.42Å; F228-H232 PolarHBondContact O-N 3.22Å; V229-H232 PolarHBondContact O-N 2.95Å; L230-H232 VanDerWaalsContact C-N 3.34Å; L230-H232 PolarHBondContact O-N 3.2Å; H232-L236 WeakPolarHBondContact O-CG 3.2Å
233	L	34.9	Very low	33.8	Very low	109 Å²	109	101.2 Å²	101.2	57%	0.571	54%	0.539	S	S	*	.	H	α-helix	trans	-77.3	-29.9	174	-75.7	167.6	0	0	0	112.7	V229 L230	V229-L233 HydrophobicContact CG1-CD1 3.8Å; V229-L233 HydrophobicContact CG1-CG 4.43Å; V229-L233 VanDerWaalsContact O-CB 3.3Å; V229-L233 WeakPolarHBondContact O-CB 3.43Å; V229-L233 WeakPolarHBondContact O-CD1 3.23Å; V229-L233 WeakPolarHBondContact O-CG 3.41Å; V229-L233 PolarHBondContact O-N 3.43Å; L230-L233 CarbonylContact O-C 3.6Å; L230-L233 PolarHBondContact O-N 3.1Å; L230-L233 VanDerWaalsContact O-N 3.07Å
234	F	34.8	Very low	33.4	Very low	156 Å²	156	102 Å²	102	68%	0.684	55%	0.552	S	S	*	*	H	α-helix	trans	-86.5	-21.7	173.7	-71.2	-62.1	0	0	0	112.9	L230 L236	L230-F234 HydrophobicContact CB-CD2 4.31Å; L230-F234 HydrophobicContact CB-CE2 4.32Å; L230-F234 HydrophobicContact CD2-CE2 4.1Å; L230-F234 WeakPolarHBondContact O-CD2 3.37Å; L230-F234 PolarHBondContact O-N 2.84Å; F234-L236 PolarHBondContact O-N 3.24Å
235	K	39.5	Very low	32.9	Very low	131 Å²	131	108.8 Å²	108.8	57%	0.57	59%	0.589	S	S	*	*	S	Bend	trans	-85.6	37.7	167	-69.7	169.5	177.2	162.2	0	113	D231	D231-K235 WeakPolarHBondContact O-CB 3.39Å; D231-K235 WeakPolarHBondContact O-CD 3.45Å; D231-K235 WeakPolarHBondContact O-CG 3.22Å; D231-K235 PolarHBondContact O-N 2.85Å; D231-K235 WeakPolarHBondContact OD1-CE 3.24Å; D231-K235 IonicContact OD1-NZ 3.65Å; D231-K235 PolarHBondContact OD1-NZ 3.22Å; D231-K235 IonicContact OD2-NZ 3.6Å; D231-K235 PolarHBondContact OD2-NZ 3.38Å
236	L	27.1	Very low	32.4	Very low	120 Å²	120	113.7 Å²	113.7	63%	0.628	62%	0.621	S	S	*	*			trans	-118.8	60.5	168.6	-78.2	169.5	0	0	0	113	H232 F234	H232-L236 WeakPolarHBondContact O-CG 3.2Å; F234-L236 PolarHBondContact O-N 3.24Å
237	P	25.2	Very low	31.8	Very low	91 Å²	91	116.6 Å²	116.6	59%	0.591	64%	0.635	S	S	*	*			trans	-77.8	167.4	147.9	37.1	-32.4	0	0	0	110.7
238	E	29.7	Very low	31.5	Very low	175 Å²	175	119.2 Å²	119.2	82%	0.818	65%	0.653	S	S	*	*	S	Bend	trans	66	47	159.2	-63	179	157.5	0	0	120
239	I	27.9	Very low	31	Very low	148 Å²	148	122.6 Å²	122.6	76%	0.759	67%	0.671	S	S	*	*	S	Bend	trans	-127.1	-10	151.8	-58.7	-177.6	0	0	0	112.9
240	V	28.1	Very low	30.6	Very low	145 Å²	145	126 Å²	126	88%	0.879	69%	0.687	S	S	*	*	S	Bend	trans	-99.3	0.2	-172.9	-172.1	0	0	0	0	113.4
241	S	27.6	Very low	30.3	Very low	101 Å²	101	131.7 Å²	131.7	71%	0.706	70%	0.702	S	S	*	*	S	Bend	trans	-110.4	3.3	-170.7	-49.3	0	0	0	0	115.5
242	N	26.3	Very low	29.9	Very low	145 Å²	145	137.5 Å²	137.5	78%	0.775	73%	0.732	S	S	*	*	S	Bend	trans	-136.2	143.3	-177.7	-79.2	-47.4	0	0	0	111.8
243	S	29.4	Very low	29.4	Very low	122 Å²	122	141.8 Å²	141.8	85%	0.853	75%	0.752	S	S	*	*	S	Bend	trans	76.6	124.2	178.3	74.7	0	0	0	0	118.9
244	A	29.8	Very low	29	Very low	97 Å²	97	142.7 Å²	142.7	80%	0.802	76%	0.764	S	S	*	*			trans	59.6	84	153.4	0	0	0	0	0	120.7
245	L	28	Very low	28.7	Very low	169 Å²	169	141.2 Å²	141.2	89%	0.885	77%	0.773	S	S	*	*	P	Polyproline II helix		-95.1	149.4	127.6	-81.1	175.6	0	0	0	109
246	P	31.1	Very low	28.2	Very low	117 Å²	117	139.8 Å²	139.8	76%	0.76	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-75.2	146	-169.5	-15.8	31.6	0	0	0	113.7	L248	P246-L248 PolarHBondContact O-N 3.05Å
247	I	25.8	Very low	28.4	Very low	138 Å²	138	142.7 Å²	142.7	71%	0.708	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-70.4	123.5	168.8	-62.1	169.1	0	0	0	109.2	E249	I247-E249 HydrophobicContact CG2-CB 4.36Å; I247-E249 HydrophobicContact CG2-CG 3.94Å
248	L	29.7	Very low	28.6	Very low	174 Å²	174	144.6 Å²	144.6	91%	0.911	79%	0.794	S	S	*	*			trans	-131.2	76.5	157.8	-81	177	0	0	0	108.3	P246	P246-L248 PolarHBondContact O-N 3.05Å
249	E	27.8	Very low	28.3	Very low	169 Å²	169	142 Å²	142	79%	0.79	80%	0.796	S	S	*	*			trans	-74.2	122.3	162	-71.7	173	111.9	0	0	109.2	I247	I247-E249 HydrophobicContact CG2-CB 4.36Å; I247-E249 HydrophobicContact CG2-CG 3.94Å
250	D	30.5	Very low	28.4	Very low	120 Å²	120	140.8 Å²	140.8	64%	0.642	80%	0.795	S	S	*	*				-155.6	127.8	129.8	-134	0.5	0	0	0	111.6
251	R	27	Very low	28.3	Very low	207 Å²	207	139.3 Å²	139.3	78%	0.781	79%	0.791	S	S	*	*			trans	33.7	126.4	153.5	-56.6	157.4	-147.5	-143.5	2.9	119.9
252	I	29	Very low	28.4	Very low	170 Å²	170	140 Å²	140	87%	0.872	80%	0.796	S	S	*	*				-164.8	157.7	92.3	-95.5	162.8	0	0	0	109.6
253	Q	27.5	Very low	28.7	Very low	173 Å²	173	137.4 Å²	137.4	81%	0.808	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-83.7	153.1	-168.6	-62.5	164.1	-50.5	0	0	113.7
254	P	26.6	Very low	29	Very low	128 Å²	128	139.2 Å²	139.2	83%	0.831	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-75.9	130.7	164.3	31.8	-32.6	0	0	0	110.9
255	S	30.1	Very low	29.1	Very low	125 Å²	125	139.9 Å²	139.9	87%	0.874	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-78.2	143.5	175.2	-53.6	0	0	0	0	112.2
256	S	27.9	Very low	29.5	Very low	102 Å²	102	138.4 Å²	138.4	71%	0.713	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-78.5	138.3	178.8	54.2	0	0	0	0	114
257	E	30.8	Very low	29.5	Very low	180 Å²	180	138 Å²	138	84%	0.841	77%	0.768	S	S	*	*			trans	-132.5	99.9	138.6	-69.2	-159	151.7	0	0	108
258	I	29.6	Very low	30	Very low	131 Å²	131	137.6 Å²	137.6	67%	0.672	77%	0.774	S	S	*	*				78.3	110.4	97.4	-68.4	159.9	0	0	0	113	T260	I258-T260 HydrophobicContact CG2-CG2 4.3Å
259	S	24.1	Very low	29.9	Very low	122 Å²	122	132.3 Å²	132.3	85%	0.853	76%	0.762	S	S	*	*			trans	-110.1	132	165.5	-53.5	0	0	0	0	109.7
260	T	29.1	Very low	29.9	Very low	122 Å²	122	131.5 Å²	131.5	75%	0.748	76%	0.761	S	S	*	*			trans	-132	90.2	174.8	42	0	0	0	0	112.9	I258	I258-T260 HydrophobicContact CG2-CG2 4.3Å
261	S	26.8	Very low	29.6	Very low	113 Å²	113	131.3 Å²	131.3	79%	0.79	76%	0.764	S	S	*	*			trans	13.9	115.1	144.3	58.6	0	0	0	0	120.3
262	S	29.9	Very low	29.5	Very low	116 Å²	116	126.5 Å²	126.5	81%	0.811	76%	0.763	S	S	*	*				-171.1	154.6	124.8	52.1	0	0	0	0	108.7
263	S	32.2	Very low	29.2	Very low	91 Å²	91	122.8 Å²	122.8	64%	0.636	75%	0.752	S	S	*	*			cis	-157.6	153.2	7.4	-131.8	0	0	0	0	110.6
264	Q	34.8	Very low	29	Very low	160 Å²	160	122.1 Å²	122.1	75%	0.748	75%	0.753	S	S	*	*			trans	62.4	140	148.3	-65.9	-178.3	22.8	0	0	118.5
265	N	33.6	Very low	28.9	Very low	110 Å²	110	123.4 Å²	123.4	59%	0.588	75%	0.748	S	S	*	*			cis	-163.5	152.3	8.2	-103.3	-22	0	0	0	110.2
266	N	35.8	Very low	28.6	Very low	138 Å²	138	124.3 Å²	124.3	74%	0.738	74%	0.738	S	S	*	*			trans	47.3	136.8	144.7	-49.1	-21.3	0	0	0	121.2
267	S	30.3	Very low	28.5	Very low	109 Å²	109	125.9 Å²	125.9	76%	0.762	74%	0.738	S	S	*	*			cis	-162.2	160.1	-11	-104	0	0	0	0	110
268	P	36	Very low	28.2	Very low	130 Å²	130	121.4 Å²	121.4	84%	0.844	72%	0.724	S	S	*	*			trans	-97	169.9	-164.8	38.5	-37.4	0	0	0	114.9
269	G	28	Very low	28.2	Very low	63 Å²	63	124.6 Å²	124.6	65%	0.649	73%	0.733	S	S	*	*			trans	-168.7	121	166.4	0	0	0	0	0	116
270	I	29	Very low	28.3	Very low	151 Å²	151	122.4 Å²	122.4	77%	0.774	72%	0.718	S	S	*	*			trans	57	85.1	135.8	-55.2	174.3	0	0	0	115.3
271	T	23.9	Very low	28.3	Very low	116 Å²	116	123.4 Å²	123.4	71%	0.712	71%	0.713	S	S	*	*				66.2	142.6	80.7	66.8	0	0	0	0	116.2
272	S	24	Very low	28.4	Very low	107 Å²	107	126.9 Å²	126.9	75%	0.748	72%	0.715	S	S	*	*			trans	63.6	153.3	156.2	52	0	0	0	0	118.4
273	S	23.4	Very low	28.3	Very low	92 Å²	92	126.3 Å²	126.3	64%	0.643	71%	0.706	S	S	*	*			cis	-178.7	156.7	-22	55.1	0	0	0	0	109.2
274	L	23.1	Very low	28.1	Very low	158 Å²	158	130.6 Å²	130.6	83%	0.827	72%	0.716	S	S	*	*			trans	64	172.9	156.7	-67.1	160.1	0	0	0	117
275	Q	24.7	Very low	27.8	Very low	156 Å²	156	127.3 Å²	127.3	73%	0.729	72%	0.716	S	S	*	*			trans	65.2	104.9	168.2	-59.1	-163.4	-86.8	0	0	115.7
276	E	23.6	Very low	27.6	Very low	144 Å²	144	128.8 Å²	128.8	67%	0.673	72%	0.723	S	S	*	*				82.4	151.3	68.2	-79.3	179.4	150.8	0	0	112.2
277	N	25.5	Very low	27.2	Very low	134 Å²	134	127.8 Å²	127.8	72%	0.717	72%	0.724	S	S	*	*			trans	71.6	153.4	164.7	-62.1	-56.6	0	0	0	117
278	T	25.4	Very low	27	Very low	87 Å²	87	129.7 Å²	129.7	53%	0.534	73%	0.725	S	S	.	*			cis	177.4	129.3	-26.2	-93.3	0	0	0	0	103.6	S280	T278-S280 WeakPolarHBondContact CG2-OG 3.28Å
279	F	28.2	Very low	26.6	Very low	198 Å²	198	127.9 Å²	127.9	87%	0.868	72%	0.721	S	S	*	*			trans	168	93.1	159	-93.5	-59.7	0	0	0	106.6
280	S	27.2	Very low	26.5	Very low	76 Å²	76	130.1 Å²	130.1	53%	0.531	73%	0.727	S	S	.	*			cis	79.1	138.3	35.2	-46.4	0	0	0	0	114.6	T278	T278-S280 WeakPolarHBondContact CG2-OG 3.28Å
281	H	28.6	Very low	26.3	Very low	142 Å²	142	131.7 Å²	131.7	66%	0.657	73%	0.728	S	S	*	*			trans	72.6	134.6	-179.5	-49.4	-82.9	0	0	0	115
282	F	28.3	Very low	26.4	Very low	186 Å²	186	132.4 Å²	132.4	82%	0.816	73%	0.727	S	S	*	*			cis	-116.7	139.6	-0.9	-79.8	-98.9	0	0	0	108.8
283	V	27.9	Very low	26.4	Very low	104 Å²	104	133.2 Å²	133.2	63%	0.63	73%	0.728	S	S	*	*				62.8	117.5	53.4	-175	0	0	0	0	108.9
284	E	29.8	Very low	26.5	Very low	182 Å²	182	136.5 Å²	136.5	85%	0.85	74%	0.738	S	S	*	*				-172.3	160.3	58.2	-150.6	159.9	-136.1	0	0	108.3
285	A	27.1	Very low	26.8	Very low	90 Å²	90	138.4 Å²	138.4	74%	0.744	74%	0.739	S	S	*	*			cis	-159.3	158.8	-38.9	0	0	0	0	0	109.4
286	L	29.3	Very low	26.9	Very low	142 Å²	142	136.6 Å²	136.6	74%	0.743	74%	0.741	S	S	*	*			trans	-68.6	155.1	169.9	-82.4	162	0	0	0	111.3	L288	L286-L288 HydrophobicContact CD1-CD1 4.23Å; L286-L288 HydrophobicContact CD2-CD1 4.23Å; L286-L288 HydrophobicContact CD2-CG 4.21Å
287	P	28.4	Very low	26.9	Very low	117 Å²	117	132.7 Å²	132.7	76%	0.76	74%	0.739	S	S	*	*				-141.1	161.7	69.3	35.9	-16.6	0	0	0	115.6
288	L	25.8	Very low	27.1	Very low	149 Å²	149	132.4 Å²	132.4	78%	0.78	75%	0.745	S	S	*	*			cis	71	64.9	37.6	-79.9	172.3	0	0	0	116.6	L286	L286-L288 HydrophobicContact CD1-CD1 4.23Å; L286-L288 HydrophobicContact CD2-CD1 4.23Å; L286-L288 HydrophobicContact CD2-CG 4.21Å
289	A	26.8	Very low	27.2	Very low	91 Å²	91	135.4 Å²	135.4	75%	0.752	76%	0.757	S	S	*	*			trans	-150.3	126.2	148.7	0	0	0	0	0	107.2
290	S	26.1	Very low	27.2	Very low	110 Å²	110	133.2 Å²	133.2	77%	0.769	76%	0.755	S	S	*	*			cis	59.7	83.5	39.1	-163	0	0	0	0	113.8
291	K	26.2	Very low	27.3	Very low	184 Å²	184	139.9 Å²	139.9	80%	0.8	77%	0.77	S	S	*	*			trans	-172.2	128.1	134.5	-101.7	151.9	-172.7	173.5	0	114.1
292	N	25.7	Very low	27.3	Very low	131 Å²	131	138.8 Å²	138.8	70%	0.701	77%	0.773	S	S	*	*			trans	59.3	104.2	130.3	-60	10.8	0	0	0	120.6
293	T	23.6	Very low	27.2	Very low	125 Å²	125	139.9 Å²	139.9	77%	0.767	77%	0.772	S	S	*	*				43.5	114.2	123.1	61.2	0	0	0	0	119.7
294	L	25.8	Very low	27.3	Very low	161 Å²	161	144.1 Å²	144.1	84%	0.843	79%	0.787	S	S	*	*				-153.7	140.5	121	-138.2	69.6	0	0	0	111.5
295	K	28.2	Very low	27.1	Very low	198 Å²	198	138 Å²	138	86%	0.861	77%	0.765	S	S	*	*			trans	-90.4	131.6	153	-71.8	-179.4	177.4	178.3	0	106.4
296	P	26.7	Very low	27.4	Very low	118 Å²	118	142.9 Å²	142.9	77%	0.766	77%	0.771	S	S	*	*				-108.2	171.3	101.2	-7.9	25.3	0	0	0	110.3
297	G	24.9	Very low	27.3	Very low	61 Å²	61	141.7 Å²	141.7	63%	0.629	77%	0.766	S	S	*	*			cis	127	121.1	16.7	0	0	0	0	0	107.2
298	P	30	Very low	27.5	Very low	129 Å²	129	144.6 Å²	144.6	84%	0.838	77%	0.769	S	S	*	*			trans	-87.3	133.6	-172.2	33.3	-32.2	0	0	0	111.3
299	D	26.7	Very low	27.5	Very low	149 Å²	149	142 Å²	142	80%	0.797	76%	0.763	S	S	*	*			trans	-143.1	145.5	169.5	-94.5	-53	0	0	0	112.9
300	N	28.7	Very low	27.5	Very low	153 Å²	153	142.3 Å²	142.3	82%	0.818	76%	0.76	S	S	*	*			trans	-102.6	152	175.6	-68.1	-69.9	0	0	0	110.5
301	Y	29	Very low	27.7	Very low	215 Å²	215	143.1 Å²	143.1	84%	0.843	77%	0.766	S	S	*	*			trans	-137.6	128.7	171.4	-85.2	-98.1	0	0	0	107
302	V	28.3	Very low	27.9	Very low	120 Å²	120	140.6 Å²	140.6	73%	0.727	76%	0.757	S	S	*	*			cis	-146.8	121.6	-4.7	178.5	0	0	0	0	105.4
303	W	26.1	Very low	28.2	Very low	208 Å²	208	140.3 Å²	140.3	79%	0.788	76%	0.762	S	S	*	*				62.5	96.5	81.8	-101.5	73.2	0	0	0	117.2
304	M	30	Very low	28.4	Very low	194 Å²	194	140.6 Å²	140.6	96%	0.956	75%	0.752	S	S	*	*			trans	-137.4	115.9	133.3	-79.2	-160.3	77.3	0	0	108
305	S	25	Very low	28.7	Very low	54 Å²	54	139.8 Å²	139.8	38%	0.378	75%	0.748	S	S	.	*			trans	-104.6	152.3	-179.3	-51.3	0	0	0	0	110
306	H	34.4	Very low	28.8	Very low	191 Å²	191	136.1 Å²	136.1	88%	0.884	74%	0.744	S	S	*	*			trans	-149.3	140.1	141.6	-100.4	-63.3	0	0	0	110.1
307	D	26.3	Very low	28.9	Very low	118 Å²	118	141.8 Å²	141.8	63%	0.631	75%	0.75	S	S	*	*			trans	-99.8	-175.5	-164.1	-67.9	-89.2	0	0	0	113.9
308	H	32.1	Very low	29.2	Very low	177 Å²	177	145.6 Å²	145.6	82%	0.819	76%	0.761	S	S	*	*			trans	81.6	149	161.9	-40.4	-63	0	0	0	117.3
309	S	26.8	Very low	29.2	Very low	94 Å²	94	146.8 Å²	146.8	66%	0.657	76%	0.76	S	S	*	*			cis	-166.6	163.5	-30.7	56.6	0	0	0	0	109.4
310	S	26.8	Very low	29.7	Very low	99 Å²	99	145.6 Å²	145.6	69%	0.692	76%	0.761	S	S	*	*			trans	46.1	114.8	148.8	60.1	0	0	0	0	120.2
311	S	31	Very low	29.6	Very low	126 Å²	126	141.4 Å²	141.4	88%	0.881	75%	0.754	S	S	*	*				173.3	151.6	102.5	44.6	0	0	0	0	114.5
312	E	30.6	Very low	29.6	Very low	131 Å²	131	140.5 Å²	140.5	61%	0.612	76%	0.757	S	S	*	*			trans	-85.1	157.3	167.6	-95.9	-176.7	149.2	0	0	110.5	K314	E312-K314 HydrophobicContact CG-CG 4.31Å; E312-K314 WeakPolarHBondContact OE1-CD 3.4Å; E312-K314 WeakPolarHBondContact OE1-CE 3.41Å; E312-K314 WeakPolarHBondContact OE1-CG 3.44Å; E312-K314 IonicContact OE1-NZ 2.77Å; E312-K314 PolarHBondContact OE1-NZ 3.36Å; E312-K314 WeakPolarHBondContact OE2-CD 3.48Å; E312-K314 IonicContact OE2-NZ 2.65Å; E312-K314 PolarHBondContact OE2-NZ 2.98Å
313	P	31.7	Very low	29.7	Very low	125 Å²	125	139.2 Å²	139.2	81%	0.812	75%	0.753	S	S	*	*				-134.5	157	64.4	32.6	-13.7	0	0	0	115.2
314	K	27.9	Very low	29.7	Very low	131 Å²	131	136.6 Å²	136.6	57%	0.57	75%	0.753	S	S	*	*			cis	83.1	105.7	35.6	-86.9	-171.4	162.7	115.8	0	116.9	E312	E312-K314 HydrophobicContact CG-CG 4.31Å; E312-K314 WeakPolarHBondContact OE1-CD 3.4Å; E312-K314 WeakPolarHBondContact OE1-CE 3.41Å; E312-K314 WeakPolarHBondContact OE1-CG 3.44Å; E312-K314 IonicContact OE1-NZ 2.77Å; E312-K314 PolarHBondContact OE1-NZ 3.36Å; E312-K314 WeakPolarHBondContact OE2-CD 3.48Å; E312-K314 IonicContact OE2-NZ 2.65Å; E312-K314 PolarHBondContact OE2-NZ 2.98Å
315	I	31.5	Very low	29.9	Very low	145 Å²	145	131.8 Å²	131.8	74%	0.744	74%	0.736	S	S	*	*			trans	74.4	151.8	132.9	-64.9	169.8	0	0	0	116.1
316	P	30.9	Very low	30	Very low	120 Å²	120	136.3 Å²	136.3	78%	0.779	76%	0.756	S	S	*	*			cis	-119.8	179.8	2.8	21.2	2.8	0	0	0	116.4
317	R	28.7	Very low	29.7	Very low	238 Å²	238	132 Å²	132	90%	0.898	75%	0.748	S	S	*	*			trans	-96.7	153.7	165.4	-54.4	162.5	172.3	155.2	-6.8	110.6
318	T	31.4	Very low	29.8	Very low	140 Å²	140	134.4 Å²	134.4	86%	0.859	76%	0.757	S	S	*	*			trans	-151.6	124.5	146.9	24.8	0	0	0	0	112.1
319	N	30.3	Very low	29.5	Very low	154 Å²	154	131.4 Å²	131.4	82%	0.824	76%	0.755	S	S	*	*			trans	-88	-172.3	153.4	-59.2	-27	0	0	0	107.6
320	P	36.1	Very low	29.6	Very low	125 Å²	125	130.5 Å²	130.5	81%	0.812	76%	0.76	S	S	*	*			cis	-135.5	176.2	-9.1	40.1	-23.2	0	0	0	115.6
321	G	26.7	Very low	29.6	Very low	64 Å²	64	131.1 Å²	131.1	66%	0.66	76%	0.76	S	S	*	*				102.8	155.9	128.2	0	0	0	0	0	120.2
322	H	29.3	Very low	29.4	Very low	196 Å²	196	131 Å²	131	91%	0.907	75%	0.754	S	S	*	*			trans	62.4	151.1	171.1	-58.8	-27.3	0	0	0	117.7
323	S	29.2	Very low	29.3	Very low	93 Å²	93	130.6 Å²	130.6	65%	0.65	76%	0.76	S	S	*	*			cis	-167.4	139.7	-29.6	50.6	0	0	0	0	111
324	I	27.7	Very low	29.3	Very low	153 Å²	153	130.9 Å²	130.9	79%	0.785	76%	0.755	S	S	*	*				19.1	134.3	121.3	-48.5	169.5	0	0	0	116.3
325	P	34.4	Very low	29.4	Very low	94 Å²	94	128.6 Å²	128.6	61%	0.61	76%	0.755	S	S	*	*			cis	-142.6	-156.9	-26.5	42.1	-21.2	0	0	0	112.6
326	D	25.8	Very low	29.2	Very low	149 Å²	149	128.3 Å²	128.3	80%	0.797	76%	0.755	S	S	*	*			trans	55.8	152.6	143.3	-62.3	-21.5	0	0	0	124.5
327	S	27.7	Very low	29	Very low	100 Å²	100	130.7 Å²	130.7	70%	0.699	76%	0.76	S	S	*	*			trans	101.2	133.2	135.9	-152.5	0	0	0	0	119.7
328	M	28.3	Very low	28.9	Very low	168 Å²	168	123.9 Å²	123.9	83%	0.828	75%	0.749	S	S	*	*			trans	67.3	149.3	159.5	-72.2	161.7	75.4	0	0	118.5
329	C	26.9	Very low	28.7	Very low	115 Å²	115	121.9 Å²	121.9	78%	0.777	74%	0.741	S	S	*	*			cis	169.7	139.8	-28.4	-105.9	0	0	0	0	104.9
330	G	27.9	Very low	28.5	Very low	74 Å²	74	121.9 Å²	121.9	76%	0.763	75%	0.746	S	S	*	*			trans	157.5	52.9	-178.9	0	0	0	0	0	113.2
331	V	27.5	Very low	28.1	Very low	113 Å²	113	121 Å²	121	69%	0.685	74%	0.743	S	S	*	*				74.8	98.6	79.9	174.7	0	0	0	0	112.5
332	T	27.1	Very low	28.3	Very low	124 Å²	124	122.5 Å²	122.5	76%	0.761	74%	0.743	S	S	*	*			trans	63.6	165.2	158.5	63.7	0	0	0	0	117
333	V	29	Very low	28.5	Very low	121 Å²	121	119.2 Å²	119.2	73%	0.733	74%	0.74	S	S	*	*			cis	-144.8	154.6	4.7	-118.8	0	0	0	0	107
334	D	30.1	Very low	28.4	Very low	132 Å²	132	122.5 Å²	122.5	71%	0.706	74%	0.742	S	S	*	*			cis	-157.8	177.7	-7.8	-150.6	-21.7	0	0	0	110.3
335	S	31.6	Very low	28.4	Very low	83 Å²	83	122.3 Å²	122.3	58%	0.58	74%	0.738	S	S	*	*			trans	7.6	148.9	138.7	-69.4	0	0	0	0	121.3
336	N	25.8	Very low	28	Very low	138 Å²	138	124.1 Å²	124.1	74%	0.738	74%	0.743	S	S	*	*			cis	162.3	169.4	-12.1	-107	-52.3	0	0	0	104.8
337	L	27.5	Very low	28	Very low	170 Å²	170	123.3 Å²	123.3	89%	0.89	74%	0.738	S	S	*	*			trans	70.5	140.4	170.7	-57.3	153.9	0	0	0	115.6
338	S	26.6	Very low	28	Very low	95 Å²	95	124.9 Å²	124.9	66%	0.664	74%	0.743	S	S	*	*			cis	-164.1	-177.8	-15.3	61.8	0	0	0	0	111.4
339	S	27.8	Very low	28	Very low	99 Å²	99	121.6 Å²	121.6	69%	0.692	74%	0.737	S	S	*	*			trans	72.8	77.8	161.7	71.3	0	0	0	0	119.1
340	V	26.6	Very low	28	Very low	153 Å²	153	121.7 Å²	121.7	93%	0.927	74%	0.739	S	S	*	*			trans	-119.2	89	141.9	-178.7	0	0	0	0	107.8
341	S	26.4	Very low	28.2	Very low	107 Å²	107	128.5 Å²	128.5	75%	0.748	74%	0.741	S	S	*	*			trans	-148.6	94.8	-177.2	-62.8	0	0	0	0	111.3
342	S	31	Very low	28.1	Very low	95 Å²	95	131.1 Å²	131.1	66%	0.664	75%	0.746	S	S	*	*			trans	44.1	123.5	157.5	62	0	0	0	0	121
343	P	33.7	Very low	28.3	Very low	128 Å²	128	136 Å²	136	83%	0.831	75%	0.752	S	S	*	*			trans	-85.3	111.5	139.4	-21.1	35.7	0	0	0	112.8
344	F	27.6	Very low	28.1	Very low	161 Å²	161	138.2 Å²	138.2	71%	0.706	75%	0.752	S	S	*	*				31.8	113.7	117.4	-71.2	-90.4	0	0	0	118.3
345	Q	26.1	Very low	27.9	Very low	150 Å²	150	138.2 Å²	138.2	70%	0.701	75%	0.748	S	S	*	*				71.7	123.1	67.4	-72.7	-172.5	-7.7	0	0	115.8
346	N	27	Very low	27.7	Very low	132 Å²	132	143.3 Å²	143.3	71%	0.706	76%	0.76	S	S	*	*				-179.1	124.2	120.9	-94.2	-60.4	0	0	0	107.7
347	N	25.8	Very low	27.7	Very low	131 Å²	131	144.3 Å²	144.3	70%	0.701	76%	0.764	S	S	*	*				62.4	133.9	87.3	-66.6	-41.8	0	0	0	112.7
348	V	28.6	Very low	27.8	Very low	133 Å²	133	144 Å²	144	81%	0.806	76%	0.762	S	S	*	*			cis	-142.7	155.2	36.2	170.6	0	0	0	0	113.9
349	S	27.4	Very low	27.7	Very low	100 Å²	100	145 Å²	145	70%	0.699	77%	0.769	S	S	*	*			trans	-30.9	144.9	173	-44.6	0	0	0	0	121.3
350	S	27.4	Very low	27.9	Very low	116 Å²	116	145.7 Å²	145.7	81%	0.811	77%	0.771	S	S	*	*				-166	141.4	124.4	-84.7	0	0	0	0	110.9
351	R	31.4	Very low	27.9	Very low	217 Å²	217	143.7 Å²	143.7	82%	0.819	76%	0.764	S	S	*	*			cis	-155.1	164.9	-15.5	-146.8	-177.1	-177.5	-177.9	0.8	110.7
352	Q	26.5	Very low	28.2	Very low	169 Å²	169	142.8 Å²	142.8	79%	0.79	76%	0.763	S	S	*	*			trans	-68.2	145.7	169.4	-64.6	155.6	-64.4	0	0	113.4
353	Y	30.4	Very low	28.1	Very low	226 Å²	226	143.5 Å²	143.5	89%	0.886	77%	0.768	S	S	*	*				-152.8	138.5	120.8	-101.9	-72.2	0	0	0	110
354	K	24.5	Very low	28.2	Very low	168 Å²	168	142.6 Å²	142.6	73%	0.73	76%	0.762	S	S	*	*			trans	-156	149.4	178.1	-172.4	-172.7	169.2	-111.2	0	106.4
355	E	25.1	Very low	28.3	Very low	131 Å²	131	141 Å²	141	61%	0.612	77%	0.766	S	S	*	*			trans	67.6	152.4	-172.2	-58.5	141.4	-148.5	0	0	111.7
356	F	28.5	Very low	28.5	Very low	191 Å²	191	138.9 Å²	138.9	84%	0.838	77%	0.765	S	S	*	*			cis	-121.9	168.3	14.9	-103.1	-96.7	0	0	0	114.7
357	L	25.3	Very low	28.7	Very low	158 Å²	158	139.5 Å²	139.5	83%	0.827	77%	0.767	S	S	*	*			trans	-72.7	146.5	167.5	-63.5	159.6	0	0	0	111.1
358	I	30.3	Very low	28.6	Very low	164 Å²	164	139 Å²	139	84%	0.841	77%	0.77	S	S	*	*			trans	-167.5	148.3	147.5	-98.3	144.9	0	0	0	108.7
359	S	24.4	Very low	28.6	Very low	116 Å²	116	139.3 Å²	139.3	81%	0.811	77%	0.766	S	S	*	*			trans	-134.1	145.2	171.9	-55.3	0	0	0	0	109.4
360	P	32.5	Very low	28.4	Very low	113 Å²	113	140.6 Å²	140.6	73%	0.734	77%	0.77	S	S	*	*				-133.3	160.3	108.8	11.5	10.9	0	0	0	111.4
361	S	25.7	Very low	28.4	Very low	112 Å²	112	144 Å²	144	78%	0.783	77%	0.77	S	S	*	*			cis	103	143.4	25.4	93.5	0	0	0	0	114.4
362	A	33.1	Very low	28	Very low	88 Å²	88	142.8 Å²	142.8	73%	0.727	77%	0.774	S	S	*	*			trans	62.5	127.8	-167.7	0	0	0	0	0	115.5
363	S	29.4	Very low	28.1	Very low	109 Å²	109	140.8 Å²	140.8	76%	0.762	77%	0.773	S	S	*	*			cis	80	151.2	27.5	93	0	0	0	0	114.5
364	P	34.9	Very low	27.7	Very low	109 Å²	109	135.6 Å²	135.6	71%	0.708	77%	0.77	S	S	*	*			cis	-135.1	-144.6	15.7	43.2	-24.2	0	0	0	114.4
365	T	30.3	Very low	27.8	Very low	128 Å²	128	132.7 Å²	132.7	79%	0.785	77%	0.771	S	S	*	*			trans	92.9	147	175.1	77.9	0	0	0	0	116
366	P	29.9	Very low	27.7	Very low	106 Å²	106	132.1 Å²	132.1	69%	0.688	78%	0.777	S	S	*	*				-137.8	164.1	-88.9	28.5	-5.4	0	0	0	117.8
367	I	31	Very low	27.7	Very low	144 Å²	144	129 Å²	129	74%	0.738	78%	0.775	S	S	*	*			trans	46.1	116.8	147.1	-58.5	163.8	0	0	0	118.8
368	P	24.6	Very low	27.5	Very low	120 Å²	120	126.7 Å²	126.7	78%	0.779	77%	0.768	S	S	*	*			trans	-82.1	140.8	166	34.4	-32.2	0	0	0	112
369	I	27.8	Very low	27.4	Very low	141 Å²	141	128.7 Å²	128.7	72%	0.723	77%	0.771	S	S	*	*			trans	-108.7	122.7	164.3	-61.7	178.4	0	0	0	108.1	F371	I369-F371 HydrophobicContact CG2-CD2 4.01Å; I369-F371 HydrophobicContact CG2-CE2 3.8Å
370	T	23.3	Very low	27.4	Very low	127 Å²	127	128.2 Å²	128.2	78%	0.779	76%	0.763	S	S	*	*			trans	-82.4	129.2	175.7	44.7	0	0	0	0	111.3
371	F	26.5	Very low	27.2	Very low	186 Å²	186	128.6 Å²	128.6	82%	0.816	77%	0.768	S	S	*	*			trans	-129.8	122	154.9	-84.2	-82	0	0	0	109.1	I369	I369-F371 HydrophobicContact CG2-CD2 4.01Å; I369-F371 HydrophobicContact CG2-CE2 3.8Å
372	E	23.5	Very low	27	Very low	193 Å²	193	133.9 Å²	133.9	90%	0.902	77%	0.771	S	S	*	*			trans	-78.3	130.5	160.8	-65.8	-167.8	138.4	0	0	108.4
373	V	28.2	Very low	26.7	Very low	127 Å²	127	134.4 Å²	134.4	77%	0.77	77%	0.769	S	S	*	*			trans	-135.5	105.1	159.6	-178.1	0	0	0	0	107.9
374	S	22.5	Very low	26.6	Very low	116 Å²	116	136 Å²	136	81%	0.811	77%	0.77	S	S	*	*			trans	-85.7	125.3	160.2	52.7	0	0	0	0	108.9
375	S	27.9	Very low	26.1	Very low	107 Å²	107	136.8 Å²	136.8	75%	0.748	78%	0.778	S	S	*	*			trans	179.8	146.6	145.6	33.4	0	0	0	0	111.9
376	T	22.4	Very low	25.9	Very low	120 Å²	120	136.5 Å²	136.5	74%	0.736	78%	0.775	S	S	*	*			trans	-90.8	136.5	170.1	45.8	0	0	0	0	110.7	T378	T376-T378 PolarHBondContact O-N 3.23Å
377	P	27.8	Very low	25.6	Very low	125 Å²	125	136.3 Å²	136.3	81%	0.812	78%	0.776	S	S	*	*			trans	-88.1	97.6	158.5	32.7	-27.8	0	0	0	109.6
378	T	22.4	Very low	25.3	Very low	109 Å²	109	138.9 Å²	138.9	67%	0.669	78%	0.778	S	S	*	*			trans	-77.1	126.9	161.4	-54	0	0	0	0	107.8	T376 V380	T376-T378 PolarHBondContact O-N 3.23Å; T378-V380 HydrophobicContact CG2-CG2 4.28Å
379	F	27.7	Very low	25.3	Very low	206 Å²	206	140.4 Å²	140.4	90%	0.904	78%	0.78	S	S	*	*			trans	-127.4	137.3	163.9	-119.8	-91.6	0	0	0	110.6
380	V	24.1	Very low	25.4	Very low	107 Å²	107	142.3 Å²	142.3	65%	0.648	79%	0.785	S	S	*	*			trans	-108.6	142.8	-165.6	173.8	0	0	0	0	110.2	T378	T378-V380 HydrophobicContact CG2-CG2 4.28Å
381	S	27.5	Very low	25.5	Very low	120 Å²	120	144.7 Å²	144.7	84%	0.839	79%	0.788	S	S	*	*			trans	-144.7	127.8	151.9	-74	0	0	0	0	109
382	R	23.3	Very low	25.8	Very low	223 Å²	223	145.4 Å²	145.4	84%	0.842	79%	0.794	S	S	*	*			trans	-68.3	163.2	172.3	-77	174.1	161.7	161.7	-8.9	108.9
383	S	26.6	Very low	26.1	Very low	100 Å²	100	143.3 Å²	143.3	70%	0.699	79%	0.789	S	S	*	*			cis	-155.7	150.3	39.5	-57.2	0	0	0	0	115.5
384	N	26.9	Very low	26.1	Very low	143 Å²	143	142 Å²	142	77%	0.765	79%	0.791	S	S	*	*			trans	47.2	93.7	141.9	-56.1	6.2	0	0	0	119
385	S	23.7	Very low	26.5	Very low	125 Å²	125	145.9 Å²	145.9	87%	0.874	80%	0.796	S	S	*	*			trans	-89.9	119.2	146.1	55.7	0	0	0	0	109.6
386	V	25.9	Very low	26.5	Very low	121 Å²	121	149.8 Å²	149.8	73%	0.733	80%	0.803	S	S	*	*			trans	-100.8	130.7	165.8	176.5	0	0	0	0	108	Y388	V386-Y388 HydrophobicContact CG1-CD2 3.8Å; V386-Y388 HydrophobicContact CG1-CE2 3.66Å
387	S	23.1	Very low	26.9	Very low	102 Å²	102	151 Å²	151	71%	0.713	81%	0.81	S	S	*	*			trans	-109.8	124.1	177.3	55.6	0	0	0	0	110.3
388	Y	26.4	Very low	27	Very low	199 Å²	199	150 Å²	150	78%	0.78	81%	0.806	S	S	*	*			trans	-121.5	128.7	158.1	-81.3	-86.9	0	0	0	108.8	V386	V386-Y388 HydrophobicContact CG1-CD2 3.8Å; V386-Y388 HydrophobicContact CG1-CE2 3.66Å
389	N	24.1	Very low	27.5	Very low	151 Å²	151	151.7 Å²	151.7	81%	0.807	81%	0.811	S	S	*	*			trans	-95	140.6	160.3	-34.7	-81.1	0	0	0	105.6
390	E	28.8	Very low	27.6	Very low	181 Å²	181	147.2 Å²	147.2	85%	0.846	81%	0.805	S	S	*	*			trans	-148.4	147.9	160.6	-119.7	144.1	-127.3	0	0	110
391	E	27	Very low	27.9	Very low	178 Å²	178	145.5 Å²	145.5	83%	0.832	81%	0.808	S	S	*	*			trans	-101.5	108.9	-168.4	-62.3	-178.1	127.8	0	0	109.9	N393	E391-N393 PolarHBondContact O-N 3.46Å
392	E	32.4	Very low	28.1	Very low	200 Å²	200	145.5 Å²	145.5	94%	0.935	81%	0.806	S	S	*	*			trans	-79.7	83.7	-179.6	-164	172	-134.2	0	0	111
393	N	30.1	Very low	28.3	Very low	150 Å²	150	144 Å²	144	80%	0.802	81%	0.808	S	S	*	*			trans	-83.1	129.1	159.6	-78.7	-66.4	0	0	0	109	E391	E391-N393 PolarHBondContact O-N 3.46Å
394	A	27.8	Very low	28.4	Very low	98 Å²	98	143.7 Å²	143.7	81%	0.81	81%	0.812	S	S	*	*			trans	-87.8	139.7	-177	0	0	0	0	0	112.4
395	E	30.8	Very low	28.4	Very low	199 Å²	199	144.2 Å²	144.2	93%	0.93	81%	0.814	S	S	*	*			trans	-146.1	138.6	150.5	-121.6	166.3	-156.8	0	0	109.4
396	E	27.4	Very low	28.5	Very low	189 Å²	189	149.6 Å²	149.6	88%	0.883	82%	0.817	S	S	*	*			trans	-90.1	154.5	-177.8	-58.4	174.7	120.7	0	0	110.9
397	V	31.3	Very low	28.5	Very low	146 Å²	146	149 Å²	149	89%	0.885	81%	0.814	S	S	*	*			trans	-171.8	147.4	133.1	137.5	0	0	0	0	111.6
398	S	30.5	Very low	29.2	Very low	103 Å²	103	150.4 Å²	150.4	72%	0.72	81%	0.807	S	S	*	*			trans	-90.6	-178.7	-179.6	58.1	0	0	0	0	112.2
399	D	32.2	Very low	29.9	Very low	145 Å²	145	144.8 Å²	144.8	78%	0.775	79%	0.793	S	S	*	*			cis	-163.7	173.5	20.6	-166	17.1	0	0	0	112.7
400	S	29.2	Very low	30.5	Very low	112 Å²	112	142.6 Å²	142.6	78%	0.783	79%	0.79	S	S	*	*			trans	86.3	115.1	149.5	74.7	0	0	0	0	120.7
401	G	31	Very low	31.1	Very low	70 Å²	70	141.3 Å²	141.3	72%	0.722	78%	0.784	S	S	*	*			trans	172.7	122.2	170.2	0	0	0	0	0	109.5
402	P	31.6	Very low	32	Very low	121 Å²	121	136.9 Å²	136.9	79%	0.786	76%	0.763	S	S	*	*			trans	-93.2	-171.3	-169.8	37.4	-36.8	0	0	0	114.3
403	E	27.2	Very low	32.5	Very low	190 Å²	190	131.5 Å²	131.5	89%	0.888	74%	0.74	S	S	*	*			trans	85.8	135.2	174.2	-55.9	177.6	-171.1	0	0	115.5
404	A	28.5	Very low	33	Very low	94 Å²	94	125.8 Å²	125.8	78%	0.777	71%	0.714	S	S	*	*			cis	-142.9	152.1	-5.3	0	0	0	0	0	112.1	Y406	A404-Y406 PolarHBondContact O-N 2.82Å
405	L	26.5	Very low	34.2	Very low	155 Å²	155	125.6 Å²	125.6	81%	0.812	70%	0.699	S	S	*	*			trans	-83.8	109	-175.5	-131.9	80.9	0	0	0	112.3	T407	L405-T407 HydrophobicContact CD2-CG2 4.03Å; L405-T407 PolarHBondContact O-N 3.4Å
406	Y	27.1	Very low	34.9	Very low	237 Å²	237	118 Å²	118	93%	0.929	67%	0.665	S	S	*	*			trans	-82.1	80	174.8	-128.5	-78.5	0	0	0	111.7	A404 K408	A404-Y406 PolarHBondContact O-N 2.82Å; Y406-K408 PolarHBondContact O-N 3.04Å
407	T	26.4	Very low	35.8	Very low	109 Å²	109	111.7 Å²	111.7	67%	0.669	64%	0.636	S	S	*	*			trans	-75.6	107.8	177.8	45	0	0	0	0	111.5	L405 T409	L405-T407 HydrophobicContact CD2-CG2 4.03Å; L405-T407 PolarHBondContact O-N 3.4Å; T407-T409 PolarHBondContact O-N 3.34Å
408	K	36.4	Very low	36.6	Very low	131 Å²	131	108.3 Å²	108.3	57%	0.57	62%	0.616	S	S	*	*			trans	-59.4	133.5	164.9	-80.5	-168.8	170.6	-172.5	0	109.6	Y406 Q412 D416	Y406-K408 PolarHBondContact O-N 3.04Å; K408-Q412 HydrophobicContact CD-CG 4.4Å; K408-D416 IonicContact NZ-OD2 2.73Å; K408-D416 PolarHBondContact NZ-OD2 2.6Å
409	T	41.7	Very low	37.6	Very low	82 Å²	82	108 Å²	108	50%	0.503	61%	0.606	S	S	.	*			trans	-62.2	151.5	171.9	61	0	0	0	0	110.4	T407 E411 Q412 L413	T407-T409 PolarHBondContact O-N 3.34Å; T409-E411 PolarHBondContact O-N 3.05Å; T409-Q412 PolarHBondContact O-N 3.21Å; T409-Q412 VanDerWaalsContact O-N 3.16Å; T409-Q412 WeakPolarHBondContact OG1-CB 3.09Å; T409-Q412 PolarHBondContact OG1-N 2.87Å; T409-Q412 VanDerWaalsContact OG1-N 3.15Å; T409-L413 PolarHBondContact O-N 3.16Å
410	S	37.3	Very low	38.2	Very low	104 Å²	104	106 Å²	106	73%	0.727	59%	0.594	S	S	*	*	H	α-helix	trans	-57.2	-33.6	173.6	48.7	0	0	0	0	112.1	A414	S410-A414 VanDerWaalsContact O-CB 3.28Å; S410-A414 WeakPolarHBondContact O-CB 3.42Å; S410-A414 PolarHBondContact O-N 2.89Å
411	E	41.3	Very low	38.9	Very low	155 Å²	155	104.4 Å²	104.4	72%	0.724	58%	0.576	S	S	*	*	H	α-helix	trans	-62.7	-50.8	173.6	-61	-174.9	145.3	0	0	111.9	T409 L413 A414 L415	T409-E411 PolarHBondContact O-N 3.05Å; E411-L413 VanDerWaalsContact C-N 3.32Å; E411-L413 PolarHBondContact O-N 2.97Å; E411-A414 PolarHBondContact O-N 3.08Å; E411-L415 WeakPolarHBondContact O-CB 3.34Å; E411-L415 PolarHBondContact O-N 2.94Å
412	Q	44.8	Very low	39.4	Very low	84 Å²	84	104.2 Å²	104.2	39%	0.393	56%	0.564	S	S	.	*	H	α-helix	trans	-62.8	-40.7	178.3	-173.4	61.5	49.4	0	0	111.4	K408 T409 L415 D416	K408-Q412 HydrophobicContact CD-CG 4.4Å; T409-Q412 PolarHBondContact O-N 3.21Å; T409-Q412 VanDerWaalsContact O-N 3.16Å; T409-Q412 WeakPolarHBondContact OG1-CB 3.09Å; T409-Q412 PolarHBondContact OG1-N 2.87Å; T409-Q412 VanDerWaalsContact OG1-N 3.15Å; Q412-L415 PolarHBondContact O-N 3.46Å; Q412-D416 PolarHBondContact NE2-OD1 3.19Å; Q412-D416 WeakPolarHBondContact O-CB 3.42Å; Q412-D416 PolarHBondContact O-N 3.04Å
413	L	43.4	Very low	39.8	Very low	88 Å²	88	100.4 Å²	100.4	46%	0.461	54%	0.54	S	S	.	.	H	α-helix	trans	-66.5	-39	179.3	-149.4	163.8	0	0	0	111.2	T409 E411 I417	T409-L413 PolarHBondContact O-N 3.16Å; E411-L413 VanDerWaalsContact C-N 3.32Å; E411-L413 PolarHBondContact O-N 2.97Å; L413-I417 HydrophobicContact CD2-CD1 3.54Å; L413-I417 HydrophobicContact CD2-CG1 4.2Å; L413-I417 WeakPolarHBondContact O-CB 3.42Å; L413-I417 VanDerWaalsContact O-CG1 3.29Å; L413-I417 WeakPolarHBondContact O-CG1 3.25Å; L413-I417 PolarHBondContact O-N 2.88Å
414	A	41.3	Very low	40.3	Very low	30 Å²	30	94.9 Å²	94.9	25%	0.248	52%	0.516	C	S	.	.	H	α-helix	trans	-67.2	-35.2	172.6	0	0	0	0	0	112.9	S410 E411 T418	S410-A414 VanDerWaalsContact O-CB 3.28Å; S410-A414 WeakPolarHBondContact O-CB 3.42Å; S410-A414 PolarHBondContact O-N 2.89Å; E411-A414 PolarHBondContact O-N 3.08Å; A414-T418 WeakPolarHBondContact O-CB 3.39Å; A414-T418 PolarHBondContact O-N 2.76Å; A414-T418 PolarHBondContact O-OG1 3.25Å
415	L	51.7	Low	40.4	Very low	93 Å²	93	92.9 Å²	92.9	49%	0.487	50%	0.5	S	S	.	.	H	α-helix	trans	-71.4	-43.1	178.3	-155.4	156.1	0	0	0	110.9	E411 Q412 T418 N419	E411-L415 WeakPolarHBondContact O-CB 3.34Å; E411-L415 PolarHBondContact O-N 2.94Å; Q412-L415 PolarHBondContact O-N 3.46Å; L415-T418 PolarHBondContact O-N 3.1Å; L415-N419 WeakPolarHBondContact CD2-ND2 3.29Å; L415-N419 PolarHBondContact O-N 3.36Å
416	D	45.3	Very low	40.9	Very low	41 Å²	41	87.5 Å²	87.5	22%	0.219	47%	0.474	C	S	.	.	H	α-helix	trans	-56.8	-49.3	170.6	-68.3	-7.8	0	0	0	111.1	K408 Q412 T418 N419 I420	K408-D416 IonicContact NZ-OD2 2.73Å; K408-D416 PolarHBondContact NZ-OD2 2.6Å; Q412-D416 PolarHBondContact NE2-OD1 3.19Å; Q412-D416 WeakPolarHBondContact O-CB 3.42Å; Q412-D416 PolarHBondContact O-N 3.04Å; D416-T418 VanDerWaalsContact C-N 3.34Å; D416-T418 PolarHBondContact O-N 2.83Å; D416-N419 PolarHBondContact O-N 3.42Å; D416-I420 VanDerWaalsContact O-CG1 3.31Å; D416-I420 WeakPolarHBondContact O-CG1 3.43Å; D416-I420 PolarHBondContact O-N 3.18Å
417	I	47.5	Very low	41.3	Very low	55 Å²	55	76.8 Å²	76.8	28%	0.282	43%	0.433	S	S	.	.	H	α-helix	trans	-59.9	-43.3	176.2	-74.4	170.6	0	0	0	111.3	L413 N419 I420 I421	L413-I417 HydrophobicContact CD2-CD1 3.54Å; L413-I417 HydrophobicContact CD2-CG1 4.2Å; L413-I417 WeakPolarHBondContact O-CB 3.42Å; L413-I417 VanDerWaalsContact O-CG1 3.29Å; L413-I417 WeakPolarHBondContact O-CG1 3.25Å; L413-I417 PolarHBondContact O-N 2.88Å; I417-N419 PolarHBondContact O-N 3.24Å; I417-I420 PolarHBondContact O-N 3.11Å; I417-I421 HydrophobicContact CG2-CD1 3.65Å; I417-I421 HydrophobicContact CG2-CG1 4.35Å; I417-I421 WeakPolarHBondContact O-CG1 3.28Å; I417-I421 PolarHBondContact O-N 3.38Å
418	T	47.3	Very low	41.5	Very low	75 Å²	75	79.9 Å²	79.9	46%	0.46	43%	0.433	S	S	.	.	H	α-helix	trans	-63.4	-42	-179.9	-60.9	0	0	0	0	111.3	A414 L415 D416 I421 S422	A414-T418 WeakPolarHBondContact O-CB 3.39Å; A414-T418 PolarHBondContact O-N 2.76Å; A414-T418 PolarHBondContact O-OG1 3.25Å; L415-T418 PolarHBondContact O-N 3.1Å; D416-T418 VanDerWaalsContact C-N 3.34Å; D416-T418 PolarHBondContact O-N 2.83Å; T418-I421 PolarHBondContact O-N 3.45Å; T418-S422 VanDerWaalsContact O-CB 3.32Å; T418-S422 WeakPolarHBondContact O-CB 3.39Å; T418-S422 PolarHBondContact O-N 2.98Å
419	N	51.6	Low	41.1	Very low	97 Å²	97	77 Å²	77	52%	0.519	43%	0.429	S	S	.	.	H	α-helix	trans	-63.2	-42.6	174.6	-74.8	-22.1	0	0	0	111.9	L415 D416 I417 S422 S423	L415-N419 WeakPolarHBondContact CD2-ND2 3.29Å; L415-N419 PolarHBondContact O-N 3.36Å; D416-N419 PolarHBondContact O-N 3.42Å; I417-N419 PolarHBondContact O-N 3.24Å; N419-S422 PolarHBondContact O-N 3.09Å; N419-S423 WeakPolarHBondContact O-CB 3.4Å; N419-S423 PolarHBondContact O-N 3.12Å
420	I	46.1	Very low	40.6	Very low	102 Å²	102	77.6 Å²	77.6	52%	0.523	43%	0.428	S	S	.	.	H	α-helix	trans	-62.5	-47	176	-69.2	164.1	0	0	0	111.2	D416 I417 S423 I424	D416-I420 VanDerWaalsContact O-CG1 3.31Å; D416-I420 WeakPolarHBondContact O-CG1 3.43Å; D416-I420 PolarHBondContact O-N 3.18Å; I417-I420 PolarHBondContact O-N 3.11Å; I420-S423 WeakPolarHBondContact O-CB 3.46Å; I420-S423 PolarHBondContact O-N 3.49Å; I420-I424 HydrophobicContact CG2-CD1 3.83Å; I420-I424 VanDerWaalsContact O-CG1 3.31Å; I420-I424 WeakPolarHBondContact O-CG1 3.47Å; I420-I424 PolarHBondContact O-N 3.35Å
421	I	42.2	Very low	40.2	Very low	79 Å²	79	76.8 Å²	76.8	41%	0.405	41%	0.413	S	S	.	.	H	α-helix	trans	-62.7	-46.4	178.7	-69	168.9	0	0	0	110.9	I417 T418 S423 I424 A425 F893	I417-I421 HydrophobicContact CG2-CD1 3.65Å; I417-I421 HydrophobicContact CG2-CG1 4.35Å; I417-I421 WeakPolarHBondContact O-CG1 3.28Å; I417-I421 PolarHBondContact O-N 3.38Å; T418-I421 PolarHBondContact O-N 3.45Å; I421-S423 VanDerWaalsContact C-N 3.29Å; I421-S423 PolarHBondContact O-N 3.11Å; I421-I424 PolarHBondContact O-N 3.44Å; I421-I424 VanDerWaalsContact O-N 3.09Å; I421-A425 PolarHBondContact O-N 3.36Å; I421-F893 HydrophobicContact CD1-CZ 4.01Å
422	S	41.3	Very low	39.5	Very low	67 Å²	67	72 Å²	72	47%	0.469	40%	0.401	S	S	.	.	H	α-helix	trans	-59.1	-42	176	-170.2	0	0	0	0	111.3	T418 N419 I424 A425 T426	T418-S422 VanDerWaalsContact O-CB 3.32Å; T418-S422 WeakPolarHBondContact O-CB 3.39Å; T418-S422 PolarHBondContact O-N 2.98Å; N419-S422 PolarHBondContact O-N 3.09Å; S422-I424 VanDerWaalsContact C-N 3.33Å; S422-I424 PolarHBondContact O-N 3.21Å; S422-A425 PolarHBondContact O-N 2.95Å; S422-T426 VanDerWaalsContact O-CB 3.31Å; S422-T426 WeakPolarHBondContact O-CB 3.33Å; S422-T426 VanDerWaalsContact O-CG2 3.28Å; S422-T426 WeakPolarHBondContact O-CG2 3.15Å; S422-T426 PolarHBondContact O-N 2.85Å; S422-T426 PolarHBondContact O-OG1 3.42Å
423	S	40.5	Very low	38.6	Very low	41 Å²	41	72.6 Å²	72.6	29%	0.287	41%	0.406	S	S	.	.	H	α-helix	trans	-65.1	-30.2	175	-166.6	0	0	0	0	113.4	K224 N419 I420 I421 T426 S427	K224-S423 VanDerWaalsContact CD-OG 3.24Å; K224-S423 WeakPolarHBondContact CD-OG 3.39Å; K224-S423 WeakPolarHBondContact CE-O 3.48Å; K224-S423 WeakPolarHBondContact CE-OG 3.46Å; K224-S423 PolarHBondContact NZ-O 3.04Å; N419-S423 WeakPolarHBondContact O-CB 3.4Å; N419-S423 PolarHBondContact O-N 3.12Å; I420-S423 WeakPolarHBondContact O-CB 3.46Å; I420-S423 PolarHBondContact O-N 3.49Å; I421-S423 VanDerWaalsContact C-N 3.29Å; I421-S423 PolarHBondContact O-N 3.11Å; S423-T426 WeakPolarHBondContact CA-OG1 3.41Å; S423-T426 PolarHBondContact O-OG1 2.83Å; S423-S427 PolarHBondContact O-N 3.11Å; S423-S427 PolarHBondContact O-OG 2.86Å
424	I	37.3	Very low	37.9	Very low	73 Å²	73	70.8 Å²	70.8	37%	0.374	40%	0.4	S	S	.	.	H	α-helix	trans	-76.8	-45.6	174.6	-68.5	163.4	0	0	0	111.9	I420 I421 S422 T426 S427 R428	I420-I424 HydrophobicContact CG2-CD1 3.83Å; I420-I424 VanDerWaalsContact O-CG1 3.31Å; I420-I424 WeakPolarHBondContact O-CG1 3.47Å; I420-I424 PolarHBondContact O-N 3.35Å; I421-I424 PolarHBondContact O-N 3.44Å; I421-I424 VanDerWaalsContact O-N 3.09Å; S422-I424 VanDerWaalsContact C-N 3.33Å; S422-I424 PolarHBondContact O-N 3.21Å; I424-T426 VanDerWaalsContact C-N 3.29Å; I424-T426 PolarHBondContact O-N 2.96Å; I424-S427 PolarHBondContact O-N 3.23Å; I424-S427 PolarHBondContact O-OG 3.27Å; I424-S427 VanDerWaalsContact O-OG 3.06Å; I424-R428 PolarHBondContact O-N 3.01Å; I424-R428 VanDerWaalsContact O-N 3.16Å
425	A	32.1	Very low	37.2	Very low	53 Å²	53	75.9 Å²	75.9	44%	0.438	42%	0.417	S	S	.	.	H	α-helix	trans	-61.4	-41.5	176.7	0	0	0	0	0	111.3	I421 S422 R428 S429	I421-A425 PolarHBondContact O-N 3.36Å; S422-A425 PolarHBondContact O-N 2.95Å; A425-R428 PolarHBondContact O-N 2.8Å; A425-S429 PolarHBondContact O-N 3.18Å; A425-S429 VanDerWaalsContact O-N 3.08Å; A425-S429 PolarHBondContact O-OG 3.05Å
426	T	36.4	Very low	36.1	Very low	42 Å²	42	77.5 Å²	77.5	26%	0.258	42%	0.422	S	S	.	.	H	α-helix	trans	-76	-20.1	-179	55.4	0	0	0	0	115	S422 S423 I424 R1069	S422-T426 VanDerWaalsContact O-CB 3.31Å; S422-T426 WeakPolarHBondContact O-CB 3.33Å; S422-T426 VanDerWaalsContact O-CG2 3.28Å; S422-T426 WeakPolarHBondContact O-CG2 3.15Å; S422-T426 PolarHBondContact O-N 2.85Å; S422-T426 PolarHBondContact O-OG1 3.42Å; S423-T426 WeakPolarHBondContact CA-OG1 3.41Å; S423-T426 PolarHBondContact O-OG1 2.83Å; I424-T426 VanDerWaalsContact C-N 3.29Å; I424-T426 PolarHBondContact O-N 2.96Å; T426-R1069 PolarHBondContact O-NH2 2.99Å
427	S	34.9	Very low	35.4	Very low	12 Å²	12	80 Å²	80	8%	0.084	44%	0.439	C	S	.	.	H	α-helix	trans	-77.1	-44.7	167.3	61.2	0	0	0	0	111.3	K224 S423 I424 S429 L430 E431	K224-S427 PolarHBondContact NZ-OG 2.86Å; K224-S427 VanDerWaalsContact NZ-OG 3.11Å; S423-S427 PolarHBondContact O-N 3.11Å; S423-S427 PolarHBondContact O-OG 2.86Å; I424-S427 PolarHBondContact O-N 3.23Å; I424-S427 PolarHBondContact O-OG 3.27Å; I424-S427 VanDerWaalsContact O-OG 3.06Å; S427-S429 VanDerWaalsContact C-N 3.3Å; S427-S429 PolarHBondContact O-N 3.18Å; S427-L430 WeakPolarHBondContact O-CB 3.38Å; S427-L430 PolarHBondContact O-N 3.35Å; S427-E431 PolarHBondContact O-N 3.32Å
428	R	30.3	Very low	34.7	Very low	174 Å²	174	82.9 Å²	82.9	66%	0.657	45%	0.451	S	S	*	.	H	α-helix	trans	-62	-33.7	178.4	-76.2	-177.3	169.1	-179.4	-2.4	114.1	I424 A425 L430 E431 A432	I424-R428 PolarHBondContact O-N 3.01Å; I424-R428 VanDerWaalsContact O-N 3.16Å; A425-R428 PolarHBondContact O-N 2.8Å; R428-L430 VanDerWaalsContact C-N 3.32Å; R428-E431 PolarHBondContact O-N 3.24Å; R428-A432 PolarHBondContact O-N 3.15Å
429	S	29.4	Very low	33.8	Very low	69 Å²	69	83.8 Å²	83.8	48%	0.483	45%	0.453	S	S	.	.	H	α-helix	trans	-67.7	-32.1	175.4	-54.6	0	0	0	0	112.7	A425 S427 L433	A425-S429 PolarHBondContact O-N 3.18Å; A425-S429 VanDerWaalsContact O-N 3.08Å; A425-S429 PolarHBondContact O-OG 3.05Å; S427-S429 VanDerWaalsContact C-N 3.3Å; S427-S429 PolarHBondContact O-N 3.18Å; S429-L433 WeakPolarHBondContact O-CG 3.43Å; S429-L433 PolarHBondContact O-N 3.25Å
430	L	30.7	Very low	32.7	Very low	95 Å²	95	84.8 Å²	84.8	50%	0.497	46%	0.458	S	S	.	.	H	α-helix	trans	-74.9	-39.9	174.6	-80.2	163.6	0	0	0	111.4	S427 R428 A432 L433 S434	S427-L430 WeakPolarHBondContact O-CB 3.38Å; S427-L430 PolarHBondContact O-N 3.35Å; R428-L430 VanDerWaalsContact C-N 3.32Å; L430-A432 PolarHBondContact O-N 3.31Å; L430-L433 PolarHBondContact O-N 3.17Å; L430-S434 WeakPolarHBondContact O-CB 3.46Å; L430-S434 PolarHBondContact O-N 2.95Å; L430-S434 PolarHBondContact O-OG 2.86Å
431	E	28.5	Very low	32	Very low	87 Å²	87	85.6 Å²	85.6	41%	0.407	46%	0.464	S	S	.	.	H	α-helix	trans	-58.3	-46.4	174.1	-70.7	160.2	-175	0	0	111	S427 R428 S434 F435	S427-E431 PolarHBondContact O-N 3.32Å; R428-E431 PolarHBondContact O-N 3.24Å; E431-S434 PolarHBondContact O-N 2.91Å; E431-S434 PolarHBondContact O-OG 2.8Å; E431-F435 PolarHBondContact O-N 2.83Å; E431-F435 VanDerWaalsContact O-N 3.1Å
432	A	26.4	Very low	31.4	Very low	56 Å²	56	85.8 Å²	85.8	46%	0.463	47%	0.471	S	S	.	.	H	α-helix	trans	-59.1	-50.6	177.1	0	0	0	0	0	113.1	R428 L430 S434 F435 E436	R428-A432 PolarHBondContact O-N 3.15Å; L430-A432 PolarHBondContact O-N 3.31Å; A432-S434 VanDerWaalsContact C-N 3.27Å; A432-S434 PolarHBondContact O-N 3.28Å; A432-F435 WeakPolarHBondContact O-CB 3.43Å; A432-F435 PolarHBondContact O-N 2.9Å; A432-E436 PolarHBondContact O-N 3.38Å; A432-E436 VanDerWaalsContact O-N 3.11Å
433	L	27.5	Very low	30.8	Very low	96 Å²	96	89.6 Å²	89.6	50%	0.503	48%	0.479	S	S	.	.	H	α-helix	trans	-62.8	-33.7	178.2	-70.3	167.2	0	0	0	112.3	S429 L430 F435 T437	S429-L433 WeakPolarHBondContact O-CG 3.43Å; S429-L433 PolarHBondContact O-N 3.25Å; L430-L433 PolarHBondContact O-N 3.17Å; L433-F435 VanDerWaalsContact C-N 3.29Å; L433-F435 PolarHBondContact O-N 3.45Å; L433-T437 PolarHBondContact O-N 3.43Å; L433-T437 PolarHBondContact O-OG1 3.11Å
434	S	27.3	Very low	30.4	Very low	49 Å²	49	92.8 Å²	92.8	34%	0.343	50%	0.497	S	S	.	.	H	α-helix	trans	-69.6	-25.8	174.8	76.9	0	0	0	0	113.5	L430 E431 A432 T437 Q438	L430-S434 WeakPolarHBondContact O-CB 3.46Å; L430-S434 PolarHBondContact O-N 2.95Å; L430-S434 PolarHBondContact O-OG 2.86Å; E431-S434 PolarHBondContact O-N 2.91Å; E431-S434 PolarHBondContact O-OG 2.8Å; A432-S434 VanDerWaalsContact C-N 3.27Å; A432-S434 PolarHBondContact O-N 3.28Å; S434-T437 PolarHBondContact O-OG1 3.3Å; S434-T437 VanDerWaalsContact O-OG1 3.07Å; S434-Q438 WeakPolarHBondContact O-CG 3.41Å; S434-Q438 PolarHBondContact O-N 3.36Å
435	F	27.4	Very low	30	Very low	138 Å²	138	96.1 Å²	96.1	61%	0.605	51%	0.514	S	S	*	.	H	α-helix	trans	-78.2	-40.8	175.3	-105.3	-86.5	0	0	0	112.3	E431 A432 L433 T437 Q438 L439	E431-F435 PolarHBondContact O-N 2.83Å; E431-F435 VanDerWaalsContact O-N 3.1Å; A432-F435 WeakPolarHBondContact O-CB 3.43Å; A432-F435 PolarHBondContact O-N 2.9Å; L433-F435 VanDerWaalsContact C-N 3.29Å; L433-F435 PolarHBondContact O-N 3.45Å; F435-T437 PolarHBondContact O-N 2.87Å; F435-Q438 PolarHBondContact O-N 3.04Å; F435-L439 WeakPolarHBondContact O-CG 3.47Å; F435-L439 PolarHBondContact O-N 2.86Å
436	E	27.8	Very low	30	Very low	126 Å²	126	97.6 Å²	97.6	59%	0.589	52%	0.522	S	S	*	.	H	α-helix	trans	-59.1	-46.7	174.4	-69.1	-178.3	142.3	0	0	110.7	A432 Q438 L439	A432-E436 PolarHBondContact O-N 3.38Å; A432-E436 VanDerWaalsContact O-N 3.11Å; E436-Q438 VanDerWaalsContact C-N 3.27Å; E436-Q438 PolarHBondContact O-N 3.49Å; E436-L439 PolarHBondContact O-N 3.33Å; E436-L439 VanDerWaalsContact O-N 3.09Å
437	T	31.1	Very low	29.6	Very low	95 Å²	95	101 Å²	101	58%	0.583	54%	0.542	S	S	*	.	H	α-helix	trans	-64.7	-24.3	177.3	49.5	0	0	0	0	114.7	L433 S434 F435	L433-T437 PolarHBondContact O-N 3.43Å; L433-T437 PolarHBondContact O-OG1 3.11Å; S434-T437 PolarHBondContact O-OG1 3.3Å; S434-T437 VanDerWaalsContact O-OG1 3.07Å; F435-T437 PolarHBondContact O-N 2.87Å
438	Q	31.9	Very low	29.4	Very low	114 Å²	114	108.5 Å²	108.5	53%	0.533	58%	0.576	S	S	.	*	H	α-helix	trans	-84.4	-17.6	175.1	-74.7	179.4	33.9	0	0	113	S434 F435 E436 C442	S434-Q438 WeakPolarHBondContact O-CG 3.41Å; S434-Q438 PolarHBondContact O-N 3.36Å; F435-Q438 PolarHBondContact O-N 3.04Å; E436-Q438 VanDerWaalsContact C-N 3.27Å; E436-Q438 PolarHBondContact O-N 3.49Å; Q438-C442 PolarHBondContact O-N 3.41Å; Q438-C442 PolarHBondContact O-SG 3Å
439	L	30.3	Very low	29.2	Very low	94 Å²	94	108.7 Å²	108.7	49%	0.492	59%	0.586	S	S	.	*	H	α-helix	trans	-76	-35.1	178.3	-76.4	165.3	0	0	0	112.3	F435 E436 C442 F443	F435-L439 WeakPolarHBondContact O-CG 3.47Å; F435-L439 PolarHBondContact O-N 2.86Å; E436-L439 PolarHBondContact O-N 3.33Å; E436-L439 VanDerWaalsContact O-N 3.09Å; L439-C442 PolarHBondContact O-N 2.85Å; L439-F443 PolarHBondContact O-N 3.02Å
440	D	28.1	Very low	29	Very low	118 Å²	118	110.6 Å²	110.6	63%	0.631	60%	0.6	S	S	*	*	H	α-helix	trans	-66.2	-41.5	177.7	-75.1	-28.8	0	0	0	112.8	C442 F443 T444	D440-C442 VanDerWaalsContact C-N 3.29Å; D440-C442 PolarHBondContact O-N 3.32Å; D440-F443 PolarHBondContact O-N 3.04Å; D440-T444 PolarHBondContact O-N 3.3Å; D440-T444 PolarHBondContact O-OG1 2.88Å
441	D	31.1	Very low	29	Very low	120 Å²	120	113.8 Å²	113.8	64%	0.642	62%	0.617	S	S	*	*	H	α-helix	trans	-59.9	-40.4	171.2	-84.8	-15.6	0	0	0	111.3	T444	D441-T444 PolarHBondContact O-N 2.98Å
442	C	29.7	Very low	28.9	Very low	83 Å²	83	115.7 Å²	115.7	56%	0.561	64%	0.639	S	S	*	*	H	α-helix	trans	-70.6	-36.2	179.8	-69.6	0	0	0	0	112.9	Q438 L439 D440 T444 S446	Q438-C442 PolarHBondContact O-N 3.41Å; Q438-C442 PolarHBondContact O-SG 3Å; L439-C442 PolarHBondContact O-N 2.85Å; D440-C442 VanDerWaalsContact C-N 3.29Å; D440-C442 PolarHBondContact O-N 3.32Å; C442-T444 VanDerWaalsContact C-N 3.31Å; C442-T444 PolarHBondContact O-N 3.34Å; C442-S446 PolarHBondContact O-N 2.9Å
443	F	29.3	Very low	28.9	Very low	146 Å²	146	121.1 Å²	121.1	64%	0.64	66%	0.66	S	S	*	*	H	α-helix	trans	-66.2	-34	176.8	-103.6	-85.3	0	0	0	112.6	L439 D440 I445 S446	L439-F443 PolarHBondContact O-N 3.02Å; D440-F443 PolarHBondContact O-N 3.04Å; F443-I445 VanDerWaalsContact C-N 3.29Å; F443-I445 PolarHBondContact O-N 3.12Å; F443-S446 PolarHBondContact O-N 3.43Å
444	T	30.1	Very low	29.1	Very low	108 Å²	108	126.2 Å²	126.2	66%	0.663	68%	0.678	S	S	*	*	H	α-helix	trans	-67	-27.8	-177.8	-57.6	0	0	0	0	112.9	D440 D441 C442	D440-T444 PolarHBondContact O-N 3.3Å; D440-T444 PolarHBondContact O-OG1 2.88Å; D441-T444 PolarHBondContact O-N 2.98Å; C442-T444 VanDerWaalsContact C-N 3.31Å; C442-T444 PolarHBondContact O-N 3.34Å
445	I	30.4	Very low	28.9	Very low	143 Å²	143	132.5 Å²	132.5	73%	0.733	70%	0.699	S	S	*	*	H	α-helix	trans	-89.5	-26	178.4	-62.1	176.2	0	0	0	112.4	F443 T447	F443-I445 VanDerWaalsContact C-N 3.29Å; F443-I445 PolarHBondContact O-N 3.12Å; I445-T447 VanDerWaalsContact C-N 3.34Å; I445-T447 PolarHBondContact O-N 3.3Å
446	S	30.5	Very low	29.1	Very low	85 Å²	85	132 Å²	132	59%	0.594	71%	0.71	S	S	*	*	H	α-helix	trans	-70.7	-24.3	-173.5	-162.1	0	0	0	0	114.6	C442 F443 H448	C442-S446 PolarHBondContact O-N 2.9Å; F443-S446 PolarHBondContact O-N 3.43Å; S446-H448 PolarHBondContact O-N 3.31Å; S446-H448 VanDerWaalsContact O-N 3.08Å
447	T	29.6	Very low	29	Very low	112 Å²	112	131.8 Å²	131.8	69%	0.687	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-3.8	-169.2	52.6	0	0	0	0	116	I445	I445-T447 VanDerWaalsContact C-N 3.34Å; I445-T447 PolarHBondContact O-N 3.3Å
448	H	30.1	Very low	28.7	Very low	171 Å²	171	135.1 Å²	135.1	79%	0.792	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	-1.9	-177.4	-118.6	-78	0	0	0	115.9	S446	S446-H448 PolarHBondContact O-N 3.31Å; S446-H448 VanDerWaalsContact O-N 3.08Å
449	M	26.4	Very low	28.5	Very low	177 Å²	177	136 Å²	136	87%	0.872	74%	0.739	S	S	*	*			trans	-119.4	55.8	-176.2	-72.9	-93	82.7	0	0	113
450	S	25.5	Very low	28.2	Very low	110 Å²	110	140.5 Å²	140.5	77%	0.769	76%	0.758	S	S	*	*			trans	-145.8	73.6	176	-144.5	0	0	0	0	114.7
451	N	29.1	Very low	28.2	Very low	161 Å²	161	144 Å²	144	86%	0.861	77%	0.77	S	S	*	*			trans	-162.8	174.9	158.8	-110.2	-40.2	0	0	0	111
452	C	27.1	Very low	28.2	Very low	128 Å²	128	145.9 Å²	145.9	87%	0.865	78%	0.78	S	S	*	*			trans	68.9	50.7	172.8	-60.9	0	0	0	0	117.1
453	N	26.1	Very low	28.2	Very low	169 Å²	169	147 Å²	147	90%	0.904	79%	0.786	S	S	*	*			trans	-103.1	92	157.9	-143.7	-13.3	0	0	0	109.6
454	K	31.6	Very low	28	Very low	203 Å²	203	151.6 Å²	151.6	88%	0.883	80%	0.799	S	S	*	*			trans	-163.9	117.3	172.1	-111.4	176.3	-176.4	-174.9	0	111.3
455	K	24.4	Very low	28	Very low	181 Å²	181	153.8 Å²	153.8	79%	0.787	80%	0.802	S	S	*	*			trans	-73	159.2	161.7	-71.6	-171.3	172.9	-170.6	0	110.2
456	P	30.1	Very low	28	Very low	127 Å²	127	154 Å²	154	83%	0.825	80%	0.798	S	S	*	*				-122.9	-176.7	97.8	37.4	-33.9	0	0	0	113.4
457	N	25.8	Very low	28	Very low	122 Å²	122	156.2 Å²	156.2	65%	0.652	80%	0.802	S	S	*	*			trans	-105	179.6	-177.8	-56.6	-38.2	0	0	0	111.9
458	L	25.7	Very low	27.7	Very low	166 Å²	166	161.2 Å²	161.2	87%	0.869	81%	0.809	S	S	*	*			trans	97.2	149.3	151.9	-67.1	162.2	0	0	0	120
459	V	26.9	Very low	27.7	Very low	132 Å²	132	159.7 Å²	159.7	80%	0.8	81%	0.811	S	S	*	*			trans	77.8	113.7	171	-165.7	0	0	0	0	116.9
460	E	24.5	Very low	27.8	Very low	188 Å²	188	156.5 Å²	156.5	88%	0.879	81%	0.806	S	S	*	*			trans	-81.1	144.4	159.7	-59.5	163.4	94.4	0	0	109.6
461	E	29.3	Very low	27.8	Very low	193 Å²	193	156.9 Å²	156.9	90%	0.902	81%	0.809	S	S	*	*			trans	-155	164.3	152.6	-128.1	169.9	-146.8	0	0	112.9
462	N	29.5	Very low	27.7	Very low	158 Å²	158	157.2 Å²	157.2	85%	0.845	81%	0.807	S	S	*	*			trans	-85.1	161.5	-159.8	-101.3	-57.2	0	0	0	115.5
463	P	30.3	Very low	27.7	Very low	107 Å²	107	157.9 Å²	157.9	70%	0.695	80%	0.801	S	S	*	*			trans	-94.7	168	-177.6	38	-35	0	0	0	114.8
464	R	24.6	Very low	27.7	Very low	242 Å²	242	154.1 Å²	154.1	91%	0.913	79%	0.788	S	S	*	*			trans	92.6	108.4	170.8	-64.1	-178.2	163.1	-176.7	-3.4	118
465	E	30.6	Very low	27.4	Very low	155 Å²	155	155.6 Å²	155.6	72%	0.724	79%	0.788	S	S	*	*			trans	-166.9	158.8	153.4	-99.9	-96.9	89.8	0	0	106.8
466	K	30.4	Very low	27.4	Very low	148 Å²	148	152 Å²	152	64%	0.643	79%	0.786	S	S	*	*			cis	-138.2	-85.1	-1	-177.3	159.5	-148.7	71.7	0	112.1
467	L	29.4	Very low	27.3	Very low	130 Å²	130	150.4 Å²	150.4	68%	0.681	78%	0.778	S	S	*	*			trans	-157	150.6	-162.3	-72.2	165.3	0	0	0	108.3
468	R	24.7	Very low	27.3	Very low	218 Å²	218	150.6 Å²	150.6	82%	0.823	78%	0.779	S	S	*	*			cis	106.7	88.3	23.3	-173.9	-163.3	-167.4	172.1	5.6	113.1
469	V	29.7	Very low	27.4	Very low	138 Å²	138	151.3 Å²	151.3	84%	0.836	78%	0.775	S	S	*	*			trans	-143.2	93.7	159.4	179.8	0	0	0	0	107
470	S	29.1	Very low	27.3	Very low	111 Å²	111	149.2 Å²	149.2	78%	0.776	77%	0.772	S	S	*	*				85.7	114.8	93.8	-61.3	0	0	0	0	114
471	S	24	Very low	27.5	Very low	117 Å²	117	145.7 Å²	145.7	82%	0.818	77%	0.768	S	S	*	*			trans	-93.4	131	170.7	45.2	0	0	0	0	110.9
472	M	28.5	Very low	27.3	Very low	168 Å²	168	143.1 Å²	143.1	83%	0.828	77%	0.765	S	S	*	*			trans	-144	117.9	160.2	-83.5	-153.3	165.4	0	0	112.3
473	L	26.5	Very low	27.2	Very low	142 Å²	142	138.6 Å²	138.6	74%	0.743	76%	0.756	S	S	*	*				57.7	120.3	119.5	-61.4	174.1	0	0	0	120.9
474	S	25.1	Very low	27.1	Very low	90 Å²	90	140.7 Å²	140.7	63%	0.629	76%	0.761	S	S	*	*				77.1	115.9	122.6	-64.3	0	0	0	0	121.8
475	R	25.7	Very low	27.2	Very low	234 Å²	234	133.8 Å²	133.8	88%	0.883	75%	0.75	S	S	*	*			trans	75	160.2	130.7	-67.2	175	166.6	179.2	-5.3	119
476	S	25.7	Very low	27.1	Very low	106 Å²	106	133.4 Å²	133.4	74%	0.741	75%	0.752	S	S	*	*			trans	67.9	119.5	170.5	-91.7	0	0	0	0	115.3
477	S	27	Very low	26.8	Very low	93 Å²	93	135.1 Å²	135.1	65%	0.65	76%	0.76	S	S	*	*				74.5	146.6	66	92.5	0	0	0	0	112.1
478	N	26.8	Very low	26.7	Very low	127 Å²	127	133.9 Å²	133.9	68%	0.679	75%	0.754	S	S	*	*			cis	-165.2	155.5	7.7	-137.4	-20.3	0	0	0	109.8
479	K	28.1	Very low	26.8	Very low	181 Å²	181	131.5 Å²	131.5	79%	0.787	75%	0.75	S	S	*	*			trans	65.8	132.1	162.9	-57.6	167.4	-175.8	-178.6	0	115.2
480	A	24.1	Very low	26.6	Very low	88 Å²	88	130.7 Å²	130.7	73%	0.727	75%	0.745	S	S	*	*			cis	85.1	157.6	45	0	0	0	0	0	114
481	S	27.7	Very low	26.6	Very low	114 Å²	114	130.7 Å²	130.7	80%	0.797	74%	0.735	S	S	*	*			trans	76.5	149.2	-176.6	84	0	0	0	0	115.8
482	T	26.3	Very low	26.7	Very low	138 Å²	138	134 Å²	134	85%	0.847	73%	0.73	S	S	*	*			cis	-168	152.3	-41	14	0	0	0	0	108.1
483	G	26.5	Very low	26.6	Very low	63 Å²	63	135 Å²	135	65%	0.649	73%	0.729	S	S	*	*			trans	70.1	176.8	167.7	0	0	0	0	0	115.8
484	D	27.5	Very low	26.7	Very low	152 Å²	152	131.8 Å²	131.8	81%	0.813	72%	0.723	S	S	*	*			cis	-160.2	133.3	-16.4	-110.2	-34.5	0	0	0	112.8
485	S	27.3	Very low	26.9	Very low	97 Å²	97	135.3 Å²	135.3	68%	0.678	73%	0.73	S	S	*	*			trans	63.5	178.2	146.4	79.4	0	0	0	0	120.9
486	L	29.2	Very low	27.1	Very low	147 Å²	147	129.4 Å²	129.4	77%	0.77	72%	0.719	S	S	*	*			trans	57.3	99	166.2	-59.1	170.6	0	0	0	116.2
487	F	23.2	Very low	27.3	Very low	183 Å²	183	129.5 Å²	129.5	80%	0.803	72%	0.716	S	S	*	*			cis	64.1	136.3	45	-156.1	-87.8	0	0	0	114.4
488	N	28.1	Very low	27.5	Very low	105 Å²	105	131.9 Å²	131.9	56%	0.561	72%	0.721	S	S	*	*			trans	93.3	148.3	-174.7	-62.9	-77.4	0	0	0	115.7
489	K	26.9	Very low	27.7	Very low	168 Å²	168	133 Å²	133	73%	0.73	73%	0.727	S	S	*	*			cis	-177.5	-176.2	-19.5	-172	175.3	-105.4	145.8	0	106.7
490	V	25.7	Very low	28	Very low	121 Å²	121	129.3 Å²	129.3	73%	0.733	72%	0.722	S	S	*	*			trans	76	127.4	158.2	174.7	0	0	0	0	115.1
491	I	28.4	Very low	28.3	Very low	110 Å²	110	132 Å²	132	56%	0.564	72%	0.724	S	S	*	*			cis	-148.7	150.2	-6	-119.9	175.5	0	0	0	111.1
492	R	26.4	Very low	28.4	Very low	188 Å²	188	135.3 Å²	135.3	71%	0.709	72%	0.724	S	S	*	*			trans	5	154.8	147.9	-41.5	154.9	-167.5	156.5	0.8	118.7
493	F	27.3	Very low	28.5	Very low	187 Å²	187	136.6 Å²	136.6	82%	0.82	72%	0.724	S	S	*	*			cis	-156.1	168	26.5	-103.5	-47.2	0	0	0	108
494	A	28.4	Very low	28.6	Very low	75 Å²	75	142.5 Å²	142.5	62%	0.62	73%	0.732	S	S	*	*			cis	-156.5	-150.8	-8.9	0	0	0	0	0	106.1
495	H	29.2	Very low	28.6	Very low	165 Å²	165	146.4 Å²	146.4	76%	0.764	74%	0.735	S	S	*	*			cis	-160.4	159.4	-5.2	-143.7	-68.8	0	0	0	108.2
496	V	29.4	Very low	28.7	Very low	109 Å²	109	146.8 Å²	146.8	66%	0.661	73%	0.734	S	S	*	*			trans	59.8	95.2	168.1	-176.1	0	0	0	0	114.9
497	T	29.1	Very low	28.7	Very low	108 Å²	108	148.7 Å²	148.7	66%	0.663	74%	0.736	S	S	*	*				65.9	128.7	67.9	70.9	0	0	0	0	113.4
498	D	31.3	Very low	28.9	Very low	143 Å²	143	143.6 Å²	143.6	77%	0.765	72%	0.723	S	S	*	*			cis	-144.9	135.8	4.2	-78.7	-44	0	0	0	110.2
499	D	31.5	Very low	29	Very low	150 Å²	150	146.3 Å²	146.3	80%	0.802	73%	0.732	S	S	*	*				68.3	110.4	96.5	-159.2	33.5	0	0	0	116.4
500	P	35.2	Very low	29.1	Very low	105 Å²	105	149.4 Å²	149.4	68%	0.682	74%	0.739	S	S	*	*			trans	-98.6	99.5	-170.5	35.9	-32.9	0	0	0	114.5
501	N	29.1	Very low	29	Very low	145 Å²	145	152.5 Å²	152.5	78%	0.775	74%	0.743	S	S	*	*			trans	-172.7	142.9	148.5	-111.7	-72	0	0	0	115.2
502	K	29.8	Very low	29.1	Very low	183 Å²	183	155.1 Å²	155.1	80%	0.796	75%	0.752	S	S	*	*			trans	66.5	117.8	164	-56.8	164	-175.6	164	0	119.6
503	I	29.8	Very low	29	Very low	164 Å²	164	151.5 Å²	151.5	84%	0.841	75%	0.751	S	S	*	*			trans	169.9	112.5	136.3	-87	149.5	0	0	0	104.3
504	K	27.3	Very low	29.1	Very low	188 Å²	188	149.4 Å²	149.4	82%	0.817	75%	0.747	S	S	*	*			cis	91	128.1	17.2	-152.1	177.1	-172.5	179.4	0	115.1
505	R	29.3	Very low	28.9	Very low	233 Å²	233	153.7 Å²	153.7	88%	0.879	75%	0.752	S	S	*	*			trans	86.4	139.7	-168.5	-57.1	173.5	179.9	123	-4.9	112.2
506	T	29	Very low	28.7	Very low	106 Å²	106	152.2 Å²	152.2	65%	0.65	75%	0.745	S	S	*	*			cis	-154.9	161.1	-4.8	4	0	0	0	0	107.2
507	F	29.4	Very low	28.5	Very low	187 Å²	187	152.4 Å²	152.4	82%	0.82	75%	0.752	S	S	*	*			cis	-114.3	175.2	9	-67.8	-85.1	0	0	0	110.4
508	S	26.7	Very low	28.5	Very low	76 Å²	76	152 Å²	152	53%	0.531	75%	0.753	S	S	.	*			cis	92.4	123	20	-146.4	0	0	0	0	117.1
509	H	30.4	Very low	28.4	Very low	162 Å²	162	151.2 Å²	151.2	75%	0.75	75%	0.753	S	S	*	*			trans	70.5	139.7	176.9	-49.3	-57.3	0	0	0	116.3
510	R	27.7	Very low	28.1	Very low	232 Å²	232	153 Å²	153	88%	0.875	75%	0.75	S	S	*	*			cis	-147.7	147	1.5	-127.2	167.8	-162.1	163.5	3.7	110.1
511	K	24.8	Very low	27.8	Very low	186 Å²	186	153.5 Å²	153.5	81%	0.809	75%	0.753	S	S	*	*			trans	-69.3	150.2	156.3	-66.8	-179.2	177.5	-178	0	108.4
512	H	29.8	Very low	27.6	Very low	165 Å²	165	152.4 Å²	152.4	76%	0.764	75%	0.746	S	S	*	*				177.4	163.7	114.3	-104.4	-93.1	0	0	0	111.9
513	T	25.1	Very low	27.5	Very low	113 Å²	113	148.5 Å²	148.5	69%	0.693	74%	0.742	S	S	*	*			trans	-15.2	149.6	158.5	52	0	0	0	0	116.9
514	I	28.3	Very low	27.3	Very low	142 Å²	142	145.7 Å²	145.7	73%	0.728	73%	0.733	S	S	*	*				-155.5	132.7	53.6	-68.7	171.3	0	0	0	106.3
515	K	23.9	Very low	27.3	Very low	166 Å²	166	147.2 Å²	147.2	72%	0.722	73%	0.733	S	S	*	*				70.1	146.6	72.5	-132.4	-175.2	174.6	-139.4	0	114.9
516	E	25.9	Very low	27.2	Very low	133 Å²	133	142 Å²	142	62%	0.621	72%	0.723	S	S	*	*			trans	64.9	129.8	158.4	-80.8	138.1	-155.1	0	0	123
517	S	26.2	Very low	27.3	Very low	114 Å²	114	143 Å²	143	80%	0.797	74%	0.735	S	S	*	*			trans	78.7	150.8	137.3	75.5	0	0	0	0	119.3
518	S	27.3	Very low	27.1	Very low	100 Å²	100	142 Å²	142	70%	0.699	73%	0.734	S	S	*	*			cis	-166.7	149.2	-3.5	27.2	0	0	0	0	114.2
519	V	29.5	Very low	27.3	Very low	126 Å²	126	144.1 Å²	144.1	76%	0.764	75%	0.746	S	S	*	*			trans	66.1	116.2	136.3	175.5	0	0	0	0	120.8
520	Y	24.9	Very low	27.2	Very low	186 Å²	186	141.1 Å²	141.1	73%	0.729	74%	0.743	S	S	*	*				24.8	152.6	122.4	-74.2	-60.3	0	0	0	122.1	I522	Y520-I522 HydrophobicContact CD1-CB 4.32Å; Y520-I522 HydrophobicContact CD1-CD1 3.82Å; Y520-I522 HydrophobicContact CD1-CG1 3.74Å; Y520-I522 HydrophobicContact CE1-CD1 3.34Å; Y520-I522 HydrophobicContact CE1-CG1 3.71Å
521	P	30.4	Very low	27.2	Very low	116 Å²	116	135.6 Å²	135.6	75%	0.753	74%	0.735	S	S	*	*			cis	-130.5	160.3	46.7	31.2	-10.6	0	0	0	114.7
522	I	23.2	Very low	27.4	Very low	123 Å²	123	134 Å²	134	63%	0.631	73%	0.73	S	S	*	*			cis	44.8	84.7	37.3	-51.9	-177.6	0	0	0	116.9	Y520	Y520-I522 HydrophobicContact CD1-CB 4.32Å; Y520-I522 HydrophobicContact CD1-CD1 3.82Å; Y520-I522 HydrophobicContact CD1-CG1 3.74Å; Y520-I522 HydrophobicContact CE1-CD1 3.34Å; Y520-I522 HydrophobicContact CE1-CG1 3.71Å
523	S	29.1	Very low	27.4	Very low	101 Å²	101	131.3 Å²	131.3	71%	0.706	72%	0.722	S	S	*	*			trans	-170.5	113.4	134	53.8	0	0	0	0	107.9
524	T	25	Very low	27.7	Very low	105 Å²	105	133.7 Å²	133.7	64%	0.644	72%	0.723	S	S	*	*				79.5	151.9	61.6	-52.5	0	0	0	0	112.5
525	W	28	Very low	27.8	Very low	219 Å²	219	132.2 Å²	132.2	83%	0.83	72%	0.72	S	S	*	*			trans	80.1	137.7	-178.4	-55.9	80.5	0	0	0	115.3
526	N	26.3	Very low	28	Very low	125 Å²	125	130.4 Å²	130.4	67%	0.668	72%	0.723	S	S	*	*			cis	157	115.1	-22.2	-98.4	-13.8	0	0	0	104.4
527	S	31.2	Very low	28.2	Very low	127 Å²	127	132.8 Å²	132.8	89%	0.888	73%	0.734	S	S	*	*			trans	-166.5	96.9	162.1	-83.3	0	0	0	0	111.3
528	M	26	Very low	28.3	Very low	166 Å²	166	133.9 Å²	133.9	82%	0.818	74%	0.736	S	S	*	*			trans	-109.6	144.7	152.5	-82.8	179.1	61.4	0	0	107.5
529	P	30.6	Very low	28.7	Very low	119 Å²	119	133.6 Å²	133.6	77%	0.773	73%	0.732	S	S	*	*				-137.2	175	108.4	17.5	4.1	0	0	0	111
530	S	28.2	Very low	28.8	Very low	100 Å²	100	133.3 Å²	133.3	70%	0.699	73%	0.733	S	S	*	*			cis	-159.1	135.2	-22	-94.3	0	0	0	0	105.3
531	V	27.2	Very low	29	Very low	116 Å²	116	132 Å²	132	70%	0.703	73%	0.733	S	S	*	*				53.5	107.6	83.7	-176.2	0	0	0	0	114.3
532	E	30.4	Very low	29	Very low	151 Å²	151	135.9 Å²	135.9	71%	0.706	74%	0.738	S	S	*	*			trans	-174.4	112.9	136.3	-90.3	-92.1	121.6	0	0	105.8
533	N	28.4	Very low	29.2	Very low	110 Å²	110	134.8 Å²	134.8	59%	0.588	74%	0.738	S	S	*	*				68.9	129.2	101.4	-74	-30.7	0	0	0	114.4
534	K	32.4	Very low	29.2	Very low	163 Å²	163	136.4 Å²	136.4	71%	0.709	74%	0.738	S	S	*	*			cis	-157.1	124.5	29.9	-107	136.5	-173.4	162.4	0	111.4
535	T	29.6	Very low	29.3	Very low	110 Å²	110	136.1 Å²	136.1	68%	0.675	74%	0.741	S	S	*	*				93	118.9	92.8	58	0	0	0	0	118.5
536	V	27.5	Very low	29.3	Very low	128 Å²	128	130.7 Å²	130.7	78%	0.776	74%	0.735	S	S	*	*				73.4	131.1	127	174.3	0	0	0	0	117.3
537	Q	31.9	Very low	29.2	Very low	184 Å²	184	130.6 Å²	130.6	86%	0.86	74%	0.739	S	S	*	*			cis	-127.6	171.9	33.1	-64.7	177.1	-18.1	0	0	115.1
538	T	27.1	Very low	29	Very low	136 Å²	136	129.5 Å²	129.5	83%	0.834	73%	0.731	S	S	*	*			trans	-135.3	-156.7	-171.5	53.7	0	0	0	0	112.6
539	P	36	Very low	28.9	Very low	95 Å²	95	127 Å²	127	62%	0.617	73%	0.725	S	S	*	*				-121.6	-166.4	-111.4	40	-19.5	0	0	0	114.7	Q541	P539-Q541 HydrophobicContact CG-CG 4.32Å
540	P	32.1	Very low	28.8	Very low	120 Å²	120	132.1 Å²	132.1	78%	0.779	73%	0.73	S	S	*	*				-135.1	146.2	101.8	37.3	-27.1	0	0	0	112.6
541	Q	28.3	Very low	28.7	Very low	158 Å²	158	130.3 Å²	130.3	74%	0.738	73%	0.728	S	S	*	*			cis	80.6	97.8	46.4	-80.4	-164.1	-5.2	0	0	116.7	P539	P539-Q541 HydrophobicContact CG-CG 4.32Å
542	F	30.6	Very low	28.7	Very low	197 Å²	197	133.5 Å²	133.5	86%	0.864	74%	0.735	S	S	*	*			trans	-162.1	115.2	138.4	-89.8	-77.8	0	0	0	103.3
543	T	27.3	Very low	28.5	Very low	100 Å²	100	132.1 Å²	132.1	61%	0.613	73%	0.732	S	S	*	*				56.8	124.6	58.6	77.6	0	0	0	0	111.4
544	D	29.6	Very low	28.6	Very low	135 Å²	135	134.2 Å²	134.2	72%	0.722	74%	0.743	S	S	*	*			cis	-135.6	157.2	23.3	-80.6	-64.1	0	0	0	112.4
545	S	27.2	Very low	28.3	Very low	100 Å²	100	132 Å²	132	70%	0.699	75%	0.747	S	S	*	*				57.1	145	81.1	124.8	0	0	0	0	114.3
546	C	27.6	Very low	28.2	Very low	105 Å²	105	131.2 Å²	131.2	71%	0.709	75%	0.746	S	S	*	*			cis	-140.9	163.5	-4.9	-92	0	0	0	0	107.9
547	V	24.8	Very low	28.4	Very low	122 Å²	122	133.6 Å²	133.6	74%	0.739	75%	0.748	S	S	*	*			cis	85.1	128.3	25.3	-176.7	0	0	0	0	114.6
548	S	25.7	Very low	28.3	Very low	104 Å²	104	129.1 Å²	129.1	73%	0.727	74%	0.737	S	S	*	*			trans	64.9	129.4	-177.4	20.6	0	0	0	0	115.8
549	V	24.6	Very low	28.5	Very low	115 Å²	115	130.7 Å²	130.7	70%	0.697	74%	0.735	S	S	*	*				83.8	133.6	67.8	179.6	0	0	0	0	113.1
550	Y	28.2	Very low	28.2	Very low	225 Å²	225	133.4 Å²	133.4	88%	0.882	74%	0.739	S	S	*	*			trans	66.3	154.7	-171.5	-56	-67.9	0	0	0	115.7
551	G	27.1	Very low	28.2	Very low	62 Å²	62	133.8 Å²	133.8	64%	0.639	73%	0.731	S	S	*	*			cis	133.7	105.7	-12	0	0	0	0	0	114.2
552	Q	27	Very low	28.1	Very low	183 Å²	183	131.6 Å²	131.6	86%	0.855	72%	0.724	S	S	*	*			trans	64.8	155.3	174.6	-63.4	-174.7	-97.5	0	0	114.7
553	D	26.1	Very low	28.1	Very low	122 Å²	122	128.9 Å²	128.9	65%	0.652	72%	0.718	S	S	*	*			cis	-156.2	-172.4	-14.8	-124.9	-44.4	0	0	0	109.7
554	L	29.4	Very low	28.1	Very low	155 Å²	155	129.9 Å²	129.9	81%	0.812	72%	0.724	S	S	*	*			trans	73.5	104.2	167.4	-47.1	-178.6	0	0	0	115.1
555	C	25.5	Very low	28	Very low	117 Å²	117	129.3 Å²	129.3	79%	0.791	73%	0.725	S	S	*	*				73.5	108	52.7	-166	0	0	0	0	115
556	S	29.5	Very low	28	Very low	93 Å²	93	129.3 Å²	129.3	65%	0.65	73%	0.726	S	S	*	*			trans	-167.7	124.6	131.3	-90.2	0	0	0	0	113
557	Q	31.6	Very low	27.9	Very low	178 Å²	178	132.1 Å²	132.1	83%	0.832	73%	0.733	S	S	*	*			trans	68.9	136.8	144.1	-61.5	168.7	49.8	0	0	118
558	S	28.8	Very low	27.9	Very low	90 Å²	90	132 Å²	132	63%	0.629	73%	0.733	S	S	*	*			cis	-164.5	141.3	-2.4	50.7	0	0	0	0	112.5
559	Q	30.7	Very low	27.8	Very low	169 Å²	169	135.9 Å²	135.9	79%	0.79	75%	0.745	S	S	*	*			trans	56	138.4	144.2	-60.5	-178.8	27.5	0	0	118.7
560	Q	30.9	Very low	27.9	Very low	151 Å²	151	137.3 Å²	137.3	71%	0.706	74%	0.744	S	S	*	*			cis	-163.9	177.8	7.5	-122.5	-176.2	95	0	0	107.2
561	H	30.8	Very low	27.7	Very low	129 Å²	129	138 Å²	138	60%	0.597	75%	0.746	S	S	*	*			cis	-155.2	127.3	7.5	153.7	-73.6	0	0	0	110.4
562	N	27.7	Very low	27.8	Very low	111 Å²	111	141.3 Å²	141.3	59%	0.594	75%	0.75	S	S	*	*			trans	39.1	145.8	147.2	-50.2	-25.2	0	0	0	124.8
563	N	29.7	Very low	27.9	Very low	140 Å²	140	135.7 Å²	135.7	75%	0.749	74%	0.74	S	S	*	*			trans	85	149.2	146.4	-66.5	-13.6	0	0	0	120.9
564	V	26.8	Very low	27.8	Very low	121 Å²	121	140.5 Å²	140.5	73%	0.733	75%	0.751	S	S	*	*			cis	-175.2	163	-36.1	116.2	0	0	0	0	108.6
565	V	28.2	Very low	27.5	Very low	123 Å²	123	144.9 Å²	144.9	75%	0.745	76%	0.757	S	S	*	*			trans	72.4	111.1	-175.6	-168.1	0	0	0	0	112.4
566	S	26.9	Very low	27.5	Very low	101 Å²	101	147.4 Å²	147.4	71%	0.706	76%	0.755	S	S	*	*				85.9	113.5	54.3	-57.5	0	0	0	0	115.3
567	N	25.1	Very low	27.5	Very low	164 Å²	164	148.6 Å²	148.6	88%	0.877	76%	0.76	S	S	*	*			trans	27.4	106	152	-57.4	-0.4	0	0	0	120.2
568	T	25.4	Very low	27.3	Very low	120 Å²	120	146.4 Å²	146.4	74%	0.736	75%	0.754	S	S	*	*			trans	-137.8	125.6	138	-31.9	0	0	0	0	110	E570	T568-E570 HydrophobicContact CG2-CG 3.91Å
569	L	24	Very low	27.2	Very low	185 Å²	185	148.7 Å²	148.7	97%	0.969	77%	0.765	S	S	*	*			trans	-87.5	106.1	163	-88.9	163.4	0	0	0	107.5
570	E	26.6	Very low	27	Very low	144 Å²	144	149 Å²	149	67%	0.673	76%	0.763	S	S	*	*			trans	-120	137.1	169.5	-76.8	-158.7	166.6	0	0	112.4	T568 N572	T568-E570 HydrophobicContact CG2-CG 3.91Å; E570-N572 WeakPolarHBondContact CB-ND2 3.48Å; E570-N572 PolarHBondContact O-N 3.46Å; E570-N572 PolarHBondContact OE2-ND2 3.15Å
571	Y	25.1	Very low	27	Very low	240 Å²	240	148.8 Å²	148.8	94%	0.941	77%	0.767	S	S	*	*			trans	-97.8	81.4	-176.4	-163.1	-93.1	0	0	0	109.4
572	N	29.1	Very low	26.9	Very low	132 Å²	132	148.2 Å²	148.2	71%	0.706	77%	0.773	S	S	*	*			trans	-112.1	131.3	-175.2	-76.8	-53.8	0	0	0	111.4	E570	E570-N572 WeakPolarHBondContact CB-ND2 3.48Å; E570-N572 PolarHBondContact O-N 3.46Å; E570-N572 PolarHBondContact OE2-ND2 3.15Å
573	G	27.4	Very low	26.7	Very low	64 Å²	64	152.9 Å²	152.9	66%	0.66	78%	0.784	S	S	*	*			cis	178	145.5	-7.1	0	0	0	0	0	112.2	R575	G573-R575 PolarHBondContact O-N 3.15Å
574	Y	24.1	Very low	26.4	Very low	223 Å²	223	158.2 Å²	158.2	88%	0.875	79%	0.793	S	S	*	*			trans	-67.5	128.5	176.8	-85.7	-104.6	0	0	0	111.4
575	R	24.7	Very low	26.2	Very low	247 Å²	247	158 Å²	158	93%	0.932	79%	0.787	S	S	*	*			trans	-103.9	81.9	178.2	-156.8	-179.5	-147.9	-172.3	8.6	112	G573	G573-R575 PolarHBondContact O-N 3.15Å
576	F	25.3	Very low	26.2	Very low	171 Å²	171	160.3 Å²	160.3	75%	0.75	79%	0.794	S	S	*	*			trans	-59.6	139.6	167.4	-81.4	-90.5	0	0	0	111.2	N578	F576-N578 PolarHBondContact O-N 3.32Å; F576-N578 VanDerWaalsContact O-N 3.12Å
577	P	28.7	Very low	26.1	Very low	118 Å²	118	161.1 Å²	161.1	77%	0.766	79%	0.79	S	S	*	*			trans	-68.3	107.9	168	28.4	-32.3	0	0	0	109.4	T579	P577-T579 PolarHBondContact O-N 2.86Å
578	N	27.8	Very low	26.2	Very low	132 Å²	132	161.7 Å²	161.7	71%	0.706	79%	0.792	S	S	*	*			trans	-75.7	108.7	-172.2	-169.7	-26.9	0	0	0	111.3	F576 K580	F576-N578 PolarHBondContact O-N 3.32Å; F576-N578 VanDerWaalsContact O-N 3.12Å; N578-K580 VanDerWaalsContact C-N 3.34Å; N578-K580 PolarHBondContact O-N 2.85Å
579	T	27.1	Very low	26.4	Very low	138 Å²	138	163.9 Å²	163.9	85%	0.847	79%	0.794	S	S	*	*			trans	-74.7	75.5	-175.2	38.9	0	0	0	0	113.2	P577 N581	P577-T579 PolarHBondContact O-N 2.86Å; T579-N581 PolarHBondContact O-N 3.12Å
580	K	26.6	Very low	26.4	Very low	174 Å²	174	164.7 Å²	164.7	76%	0.757	79%	0.79	S	S	*	*			trans	-84.9	103.5	165.8	-71.5	-173.2	177	-177.3	0	111.3	N578	N578-K580 VanDerWaalsContact C-N 3.34Å; N578-K580 PolarHBondContact O-N 2.85Å
581	N	29.7	Very low	26.5	Very low	147 Å²	147	163.6 Å²	163.6	79%	0.786	79%	0.789	S	S	*	*			trans	-166	130.8	130.4	-102	-21.8	0	0	0	115.2	T579	T579-N581 PolarHBondContact O-N 3.12Å
582	T	28.2	Very low	26.8	Very low	117 Å²	117	159.7 Å²	159.7	72%	0.718	78%	0.784	S	S	*	*			trans	48.4	83.6	148.7	56.8	0	0	0	0	120
583	Y	23.9	Very low	26.7	Very low	210 Å²	210	162.3 Å²	162.3	82%	0.824	79%	0.789	S	S	*	*				11.3	129.7	120.9	-67.3	-88.7	0	0	0	119.5	L585	Y583-L585 HydrophobicContact CD1-CD1 3.7Å; Y583-L585 HydrophobicContact CE1-CD1 4.26Å
584	R	25	Very low	26.8	Very low	251 Å²	251	165.9 Å²	165.9	95%	0.947	79%	0.793	S	S	*	*				-147.8	127	119.3	-118.3	177.9	-178.3	178.3	0.5	110.3
585	L	22.6	Very low	27	Very low	117 Å²	117	163.3 Å²	163.3	61%	0.613	79%	0.789	S	S	*	*			trans	-79	146.7	175.6	-77.1	68.9	0	0	0	110	Y583	Y583-L585 HydrophobicContact CD1-CD1 3.7Å; Y583-L585 HydrophobicContact CE1-CD1 4.26Å
586	I	26.4	Very low	27.2	Very low	172 Å²	172	156 Å²	156	88%	0.882	78%	0.781	S	S	*	*			trans	-128.6	134.2	130.4	-61.9	-174.8	0	0	0	106.6
587	N	25.1	Very low	27.2	Very low	118 Å²	118	158.4 Å²	158.4	63%	0.631	79%	0.786	S	S	*	*			trans	-74.3	164.1	-177.2	-59.9	-32.3	0	0	0	111.8
588	L	27.6	Very low	27.2	Very low	175 Å²	175	157.6 Å²	157.6	92%	0.916	78%	0.778	S	S	*	*				-166.7	149	109	-98.2	161.7	0	0	0	110.4
589	Q	28.9	Very low	27.2	Very low	166 Å²	166	158.5 Å²	158.5	78%	0.776	78%	0.778	S	S	*	*			trans	-77.7	162.4	-174.3	-83.2	161.9	-113.5	0	0	113.1	D591	Q589-D591 PolarHBondContact NE2-OD2 3.47Å
590	K	24.6	Very low	27.4	Very low	203 Å²	203	157.9 Å²	157.9	88%	0.883	77%	0.769	S	S	*	*			trans	-96.2	118.9	147.7	-90.2	-173.9	159.3	-156	0	107.7
591	D	28.9	Very low	27.4	Very low	121 Å²	121	155.3 Å²	155.3	65%	0.647	77%	0.768	S	S	*	*			trans	-160.8	144.7	153.5	-64.6	-58.3	0	0	0	102.5	Q589	Q589-D591 PolarHBondContact NE2-OD2 3.47Å
592	D	30.3	Very low	27.5	Very low	158 Å²	158	151.9 Å²	151.9	85%	0.845	76%	0.761	S	S	*	*			cis	-137.8	-178.7	17.6	-97.3	-58.4	0	0	0	112.9
593	F	27.1	Very low	27.7	Very low	187 Å²	187	153.7 Å²	153.7	82%	0.82	77%	0.766	S	S	*	*			trans	-90.5	168.1	170	-110	-102.9	0	0	0	112.4
594	N	31.4	Very low	28	Very low	138 Å²	138	148.2 Å²	148.2	74%	0.738	76%	0.759	S	S	*	*			trans	65.6	168.7	164.2	-59.3	-15.8	0	0	0	115.2
595	E	27	Very low	28.5	Very low	170 Å²	170	140.9 Å²	140.9	79%	0.794	74%	0.741	S	S	*	*			cis	-172.6	155.3	-36.1	176.1	172.6	-151.9	0	0	104.2
596	A	29.3	Very low	29.2	Very low	92 Å²	92	143 Å²	143	76%	0.76	75%	0.748	S	S	*	*			trans	64.1	166.9	171.6	0	0	0	0	0	115.8
597	R	26	Very low	29.5	Very low	223 Å²	223	140.7 Å²	140.7	84%	0.842	74%	0.742	S	S	*	*			cis	-169.2	140.7	-31.5	174.7	171.8	178.8	-177.9	1.7	108.2
598	V	28.1	Very low	29.9	Very low	100 Å²	100	139.6 Å²	139.6	61%	0.606	74%	0.743	S	S	*	*			trans	71.5	114.4	153.4	155.7	0	0	0	0	119.6
599	Q	27.9	Very low	30.2	Very low	152 Å²	152	137.2 Å²	137.2	71%	0.71	74%	0.736	S	S	*	*			trans	70.3	152.7	133.8	-67.3	-175.9	-96.9	0	0	123
600	D	30.2	Very low	30.3	Very low	124 Å²	124	134.6 Å²	134.6	66%	0.663	73%	0.734	S	S	*	*			trans	68.6	137	142.1	-69.6	4.8	0	0	0	121.2
601	T	28	Very low	30.5	Very low	120 Å²	120	132.3 Å²	132.3	74%	0.736	73%	0.728	S	S	*	*			cis	-161.3	168.7	-28.9	-0.4	0	0	0	0	109.6
602	A	31.3	Very low	30.7	Very low	75 Å²	75	132.4 Å²	132.4	62%	0.62	74%	0.735	S	S	*	*			trans	65.1	132.1	144.7	0	0	0	0	0	121.5
603	N	32.1	Very low	30.5	Very low	155 Å²	155	129.9 Å²	129.9	83%	0.829	73%	0.726	S	S	*	*			trans	71.6	147.6	144.8	-59.5	-11.4	0	0	0	118.8
604	S	31.1	Very low	30.6	Very low	96 Å²	96	125.9 Å²	125.9	67%	0.671	72%	0.721	S	S	*	*			cis	-170.6	178.9	-18.6	58.7	0	0	0	0	107.5
605	T	33.5	Very low	30.3	Very low	96 Å²	96	124.8 Å²	124.8	59%	0.589	72%	0.719	S	S	*	*			cis	-163.9	165.8	8.6	-16.6	0	0	0	0	109.8
606	H	39.3	Very low	30.3	Very low	163 Å²	163	121.8 Å²	121.8	76%	0.755	72%	0.717	S	S	*	*			trans	66	152.3	154.1	-59.4	-43.1	0	0	0	118
607	T	32.4	Very low	30.3	Very low	122 Å²	122	125.6 Å²	125.6	75%	0.748	72%	0.719	S	S	*	*			cis	-169.7	158.9	-13.2	24.2	0	0	0	0	105.5
608	S	33.4	Very low	30.3	Very low	95 Å²	95	119.5 Å²	119.5	66%	0.664	71%	0.71	S	S	*	*			cis	-164.9	175.4	-18.4	53.9	0	0	0	0	104.4
609	T	33.7	Very low	30.2	Very low	125 Å²	125	124.7 Å²	124.7	77%	0.767	72%	0.72	S	S	*	*			cis	-175.8	172.2	39.9	-8.3	0	0	0	0	105.5
610	P	31.4	Very low	30	Very low	111 Å²	111	125 Å²	125	72%	0.721	72%	0.724	S	S	*	*				-137.1	179.4	-125	42.8	-23.7	0	0	0	118.6
611	M	29.1	Very low	29.8	Very low	155 Å²	155	128.4 Å²	128.4	76%	0.764	73%	0.733	S	S	*	*			trans	27.1	142.6	137.6	-67.7	-58.7	-174.5	0	0	121.5	V613	M611-V613 HydrophobicContact CB-CG2 4.11Å; M611-V613 HydrophobicContact CG-CG2 4.05Å; M611-V613 HydrophobicContact SD-CG2 3.66Å
612	P	33	Very low	29.6	Very low	123 Å²	123	130.8 Å²	130.8	80%	0.799	74%	0.737	S	S	*	*				-128.4	163.2	67.1	39.2	-27.9	0	0	0	114.4
613	V	25.7	Very low	29.5	Very low	106 Å²	106	132.5 Å²	132.5	64%	0.642	74%	0.742	S	S	*	*			cis	84.1	100	23.5	-174.2	0	0	0	0	116.5	M611	M611-V613 HydrophobicContact CB-CG2 4.11Å; M611-V613 HydrophobicContact CG-CG2 4.05Å; M611-V613 HydrophobicContact SD-CG2 3.66Å
614	S	29.4	Very low	29.2	Very low	103 Å²	103	129.3 Å²	129.3	72%	0.72	74%	0.738	S	S	*	*			trans	-176	115.4	137.8	-174.7	0	0	0	0	107.9
615	T	25.3	Very low	28.9	Very low	115 Å²	115	128.9 Å²	128.9	71%	0.706	74%	0.74	S	S	*	*				67.4	99.8	58.7	63.9	0	0	0	0	116.8
616	S	26.9	Very low	28.5	Very low	106 Å²	106	131 Å²	131	74%	0.741	75%	0.748	S	S	*	*				-179	142.7	126.2	36.2	0	0	0	0	114.5
617	H	28.5	Very low	27.8	Very low	172 Å²	172	130.3 Å²	130.3	80%	0.796	75%	0.749	S	S	*	*			trans	49	110.8	145.2	-59.8	-23	0	0	0	120.8
618	S	26.3	Very low	27.5	Very low	95 Å²	95	132.9 Å²	132.9	66%	0.664	75%	0.753	S	S	*	*				82	140.7	78.3	79.8	0	0	0	0	113.8
619	Y	26	Very low	27.1	Very low	210 Å²	210	138 Å²	138	82%	0.824	76%	0.763	S	S	*	*			cis	-135.2	168.7	23	-113.1	-100.5	0	0	0	113.5
620	M	24	Very low	26.6	Very low	158 Å²	158	135.4 Å²	135.4	78%	0.778	76%	0.755	S	S	*	*			trans	-34.5	160.9	151.2	-62.5	171.4	161.9	0	0	114.7
621	K	25.7	Very low	26.4	Very low	196 Å²	196	137.1 Å²	137.1	85%	0.852	76%	0.758	S	S	*	*				-167.4	161.7	51.9	-142	171.8	-172.4	179.6	0	112.7
622	M	22.9	Very low	26.3	Very low	169 Å²	169	137.2 Å²	137.2	83%	0.833	76%	0.761	S	S	*	*			trans	-89.2	-174.4	164.2	-45.9	169.5	66	0	0	109.7
623	P	30.5	Very low	26	Very low	111 Å²	111	137.3 Å²	137.3	72%	0.721	76%	0.759	S	S	*	*			cis	-139.9	-167.9	-4.3	42.7	-23.2	0	0	0	115.5
624	A	24.4	Very low	26.2	Very low	89 Å²	89	135.6 Å²	135.6	74%	0.736	76%	0.762	S	S	*	*			trans	72.9	121.2	140.9	0	0	0	0	0	123.2
625	A	24.9	Very low	26.2	Very low	86 Å²	86	137.2 Å²	137.2	71%	0.711	76%	0.763	S	S	*	*				54.7	127	126.4	0	0	0	0	0	123.2
626	N	25.2	Very low	26.5	Very low	142 Å²	142	141 Å²	141	76%	0.759	77%	0.77	S	S	*	*			trans	76.8	118.2	145.6	-60.4	-4	0	0	0	120.9
627	N	25.2	Very low	26.7	Very low	147 Å²	147	144 Å²	144	79%	0.786	77%	0.772	S	S	*	*			trans	75.4	160.4	143.5	-59.6	-7.6	0	0	0	120.1
628	E	26.9	Very low	26.9	Very low	177 Å²	177	140.3 Å²	140.3	83%	0.827	76%	0.763	S	S	*	*			trans	66.2	119.6	172.5	-64.8	176.1	174.9	0	0	115.8
629	F	23.5	Very low	26.9	Very low	201 Å²	201	140.9 Å²	140.9	88%	0.882	77%	0.767	S	S	*	*				97.6	134	51.7	-106.8	-88	0	0	0	112.6
630	A	24.6	Very low	27.4	Very low	72 Å²	72	136 Å²	136	60%	0.595	76%	0.761	S	S	*	*			trans	67.3	112.6	158.4	0	0	0	0	0	120.7
631	D	27.2	Very low	27.9	Very low	146 Å²	146	134.7 Å²	134.7	78%	0.781	76%	0.762	S	S	*	*				90.1	152	116.8	-69.4	-1.9	0	0	0	124.6
632	L	26.5	Very low	28.3	Very low	157 Å²	157	131.8 Å²	131.8	82%	0.822	76%	0.76	S	S	*	*			trans	71	142.8	158.5	-64.2	140.4	0	0	0	119.2
633	V	26.5	Very low	28.5	Very low	126 Å²	126	132.6 Å²	132.6	76%	0.764	76%	0.759	S	S	*	*			cis	-164.3	154.7	-31.8	103.1	0	0	0	0	108.9
634	G	30.6	Very low	28.5	Very low	69 Å²	69	133.3 Å²	133.3	71%	0.711	76%	0.757	S	S	*	*			trans	-174.2	52.5	-176.4	0	0	0	0	0	120.2
635	N	28.4	Very low	28.8	Very low	137 Å²	137	136.2 Å²	136.2	73%	0.733	76%	0.759	S	S	*	*			trans	28.5	127.2	147.2	-58.7	-31.8	0	0	0	119.5
636	K	32.6	Very low	28.8	Very low	195 Å²	195	138.7 Å²	138.7	85%	0.848	76%	0.759	S	S	*	*			cis	-150.6	141.8	29.7	-56.1	169.9	-173.3	175.2	0	108.4
637	Q	29.4	Very low	28.8	Very low	169 Å²	169	138.1 Å²	138.1	79%	0.79	76%	0.761	S	S	*	*				66.3	143.1	55.5	-76.5	-104.7	-28.1	0	0	114.8
638	P	32.8	Very low	28.9	Very low	94 Å²	94	139.8 Å²	139.8	61%	0.61	76%	0.764	S	S	*	*			cis	-153.7	179.3	-26.5	40.1	-20.1	0	0	0	119.1
639	S	27.5	Very low	28.9	Very low	107 Å²	107	135.5 Å²	135.5	75%	0.748	76%	0.759	S	S	*	*			trans	79	162.2	135.9	-97.4	0	0	0	0	122.5
640	P	36.7	Very low	28.9	Very low	108 Å²	108	132.7 Å²	132.7	70%	0.701	75%	0.752	S	S	*	*				-144	-142.3	-59.2	39.7	-16.9	0	0	0	112.6
641	V	33.7	Very low	29	Very low	131 Å²	131	136.3 Å²	136.3	79%	0.794	76%	0.761	S	S	*	*			trans	83.4	123.4	168.6	-175.5	0	0	0	0	115.5
642	V	34	Very low	29.1	Very low	134 Å²	134	138.4 Å²	138.4	81%	0.812	77%	0.766	S	S	*	*			cis	-151.5	142.8	-9.4	110.8	0	0	0	0	111.3
643	K	27.7	Very low	29	Very low	186 Å²	186	136.9 Å²	136.9	81%	0.809	77%	0.767	S	S	*	*			trans	-57.2	179.1	164.1	-81.7	174.3	159.8	178.1	0	112.2
644	N	30.5	Very low	28.9	Very low	127 Å²	127	135.1 Å²	135.1	68%	0.679	76%	0.761	S	S	*	*			cis	-150.1	-141.7	20	-146.5	30.7	0	0	0	106.9
645	I	29.9	Very low	28.8	Very low	150 Å²	150	138.3 Å²	138.3	77%	0.769	76%	0.761	S	S	*	*			cis	-128.7	176.8	1.6	-85	-166.6	0	0	0	108.4
646	L	26.2	Very low	28.5	Very low	138 Å²	138	137.5 Å²	137.5	72%	0.723	76%	0.761	S	S	*	*			trans	-44.1	138.3	174.6	-90.9	58.9	0	0	0	119.9
647	T	25.4	Very low	28.3	Very low	129 Å²	129	137.3 Å²	137.3	79%	0.791	76%	0.763	S	S	*	*			trans	-32	129	131.7	-48.1	0	0	0	0	116.8
648	Q	26.1	Very low	27.9	Very low	182 Å²	182	135.6 Å²	135.6	85%	0.85	76%	0.764	S	S	*	*			trans	-177.4	159.5	137.6	-106.4	171.1	1.5	0	0	113.2
649	A	27.1	Very low	27.5	Very low	88 Å²	88	138 Å²	138	73%	0.727	77%	0.771	S	S	*	*			trans	59.5	123.8	-178.5	0	0	0	0	0	116.1
650	I	24.6	Very low	27.2	Very low	142 Å²	142	137.7 Å²	137.7	73%	0.728	77%	0.769	S	S	*	*			cis	79.2	101.9	32.4	-52.8	175	0	0	0	113.7
651	N	25.1	Very low	26.6	Very low	148 Å²	148	140.7 Å²	140.7	79%	0.791	77%	0.771	S	S	*	*			trans	60.2	136.8	163.2	-49.3	-16.8	0	0	0	115.4
652	Q	29.3	Very low	26	Very low	190 Å²	190	139.8 Å²	139.8	89%	0.888	77%	0.771	S	S	*	*			cis	-154.6	-175.2	44.5	-74.3	176.6	-26.5	0	0	112.8
653	C	24.7	Very low	25.6	Very low	124 Å²	124	139.4 Å²	139.4	84%	0.838	77%	0.768	S	S	*	*			trans	-43.4	160.6	165.3	-67.1	0	0	0	0	115.9
654	S	25.3	Very low	25.3	Very low	90 Å²	90	140.2 Å²	140.2	63%	0.629	77%	0.772	S	S	*	*			cis	-163.3	-173.5	-1.2	37.9	0	0	0	0	111.9
655	D	27.2	Very low	25.2	Very low	135 Å²	135	142.6 Å²	142.6	72%	0.722	78%	0.779	S	S	*	*			trans	81.9	101.8	153.2	-51.5	-46.4	0	0	0	120.3
656	T	23.3	Very low	24.8	Very low	121 Å²	121	143.3 Å²	143.3	74%	0.742	78%	0.779	S	S	*	*			trans	15	125.7	140.7	55.7	0	0	0	0	119.8
657	H	28	Very low	24.7	Very low	190 Å²	190	144 Å²	144	88%	0.88	78%	0.783	S	S	*	*				-153.3	153	123.7	-105.8	-71.3	0	0	0	111.8
658	V	21.8	Very low	24.7	Very low	133 Å²	133	144.8 Å²	144.8	81%	0.806	78%	0.782	S	S	*	*			trans	-74.3	131.9	178.6	175.4	0	0	0	0	110.5
659	L	23.7	Very low	24.6	Very low	144 Å²	144	147 Å²	147	75%	0.754	78%	0.784	S	S	*	*			trans	-130.5	117.1	163.7	-77.1	178.4	0	0	0	111.8	F661	L659-F661 HydrophobicContact CB-CD2 4.4Å; L659-F661 HydrophobicContact CB-CE2 4.19Å; L659-F661 HydrophobicContact CD1-CE2 4.32Å
660	S	21.4	Very low	24.6	Very low	101 Å²	101	148.6 Å²	148.6	71%	0.706	79%	0.787	S	S	*	*			trans	-70.2	137.2	162.9	176.5	0	0	0	0	109.8
661	F	24.1	Very low	24.6	Very low	171 Å²	171	146.7 Å²	146.7	75%	0.75	79%	0.787	S	S	*	*			trans	-124.1	94.1	168.2	-92.6	-81.9	0	0	0	111	L659 V663	L659-F661 HydrophobicContact CB-CD2 4.4Å; L659-F661 HydrophobicContact CB-CE2 4.19Å; L659-F661 HydrophobicContact CD1-CE2 4.32Å; F661-V663 PolarHBondContact O-N 2.88Å
662	S	21.6	Very low	24.9	Very low	113 Å²	113	148.8 Å²	148.8	79%	0.79	79%	0.791	S	S	*	*			trans	-68.3	114.3	162.5	-65.1	0	0	0	0	109.7
663	V	25.6	Very low	24.8	Very low	126 Å²	126	145 Å²	145	76%	0.764	79%	0.786	S	S	*	*			trans	-102.2	106.5	168.8	-179.6	0	0	0	0	109	F661	F661-V663 PolarHBondContact O-N 2.88Å
664	K	21.3	Very low	25	Very low	202 Å²	202	144.9 Å²	144.9	88%	0.878	79%	0.786	S	S	*	*			trans	-84.7	126.9	159.3	-76.4	-176.1	175.3	-177.7	0	108.5
665	Q	26.6	Very low	25.1	Very low	178 Å²	178	145.2 Å²	145.2	83%	0.832	79%	0.788	S	S	*	*			trans	-156.7	149.1	145	-124.5	167.3	-12.7	0	0	110.5
666	E	22.1	Very low	25.1	Very low	164 Å²	164	148.6 Å²	148.6	77%	0.766	80%	0.797	S	S	*	*			trans	-74	162.1	-176.9	-58.2	105.3	133	0	0	113.4
667	L	25.6	Very low	25.5	Very low	154 Å²	154	147.7 Å²	147.7	81%	0.806	79%	0.793	S	S	*	*				-177.6	115.4	128	-96.5	158.9	0	0	0	112.4
668	D	25.3	Very low	25.6	Very low	145 Å²	145	149.5 Å²	149.5	78%	0.775	79%	0.794	S	S	*	*			trans	41.6	114.3	151.7	-56.5	-18.7	0	0	0	122.7
669	Y	22.7	Very low	26	Very low	227 Å²	227	148.2 Å²	148.2	89%	0.89	79%	0.791	S	S	*	*			trans	-98	128.2	156.9	-82.8	-99.3	0	0	0	111.2
670	P	26.8	Very low	26.1	Very low	122 Å²	122	148.1 Å²	148.1	79%	0.792	79%	0.79	S	S	*	*			trans	-80.5	114.3	158.4	31.1	-29.5	0	0	0	109.8
671	S	25.7	Very low	26.5	Very low	103 Å²	103	150.2 Å²	150.2	72%	0.72	79%	0.793	S	S	*	*			trans	-86.6	133.3	177.4	52.6	0	0	0	0	111.9
672	H	31.5	Very low	26.6	Very low	192 Å²	192	148.9 Å²	148.9	89%	0.889	79%	0.789	S	S	*	*			trans	-136.9	98.8	162.6	-83.8	-50	0	0	0	110.8
673	S	25.8	Very low	26.8	Very low	111 Å²	111	150.8 Å²	150.8	78%	0.776	79%	0.788	S	S	*	*			trans	-86	153.7	166.2	50.2	0	0	0	0	110.9
674	S	30.2	Very low	26.7	Very low	120 Å²	120	150.9 Å²	150.9	84%	0.839	78%	0.784	S	S	*	*			trans	-145.2	85.5	159.3	64.9	0	0	0	0	109.3
675	S	27.2	Very low	26.8	Very low	97 Å²	97	145.6 Å²	145.6	68%	0.678	77%	0.771	S	S	*	*			trans	-86.5	154.4	175.3	50.3	0	0	0	0	111.8
676	F	27.1	Very low	26.7	Very low	206 Å²	206	142.7 Å²	142.7	90%	0.904	77%	0.766	S	S	*	*			trans	-135.5	111.5	162.4	-94.6	-74	0	0	0	110.4
677	P	30.5	Very low	26.7	Very low	102 Å²	102	141.2 Å²	141.2	66%	0.662	77%	0.768	S	S	*	*			trans	-113	159.6	174.8	39.2	-30.5	0	0	0	113.5
678	Y	31.3	Very low	26.7	Very low	228 Å²	228	139.4 Å²	139.4	89%	0.894	77%	0.768	S	S	*	*			trans	-163	140.9	161	-93.7	-81.6	0	0	0	106.6
679	S	29.3	Very low	26.7	Very low	107 Å²	107	136 Å²	136	75%	0.748	76%	0.759	S	S	*	*			cis	-154.9	170.4	-14.5	-140.2	0	0	0	0	110.2
680	I	25.6	Very low	26.8	Very low	141 Å²	141	134.7 Å²	134.7	72%	0.723	76%	0.759	S	S	*	*			trans	-102.4	158.4	-179.6	-65.4	167.1	0	0	0	110.9	E682	I680-E682 HydrophobicContact CG2-CG 4.47Å
681	N	30.5	Very low	26.8	Very low	145 Å²	145	140.5 Å²	140.5	78%	0.775	77%	0.765	S	S	*	*			trans	-164.1	123.7	138.1	-83.5	-14.8	0	0	0	105.3
682	E	26	Very low	26.9	Very low	144 Å²	144	142.6 Å²	142.6	67%	0.673	77%	0.768	S	S	*	*				61.8	133.8	72.4	-64.7	-169.2	163.3	0	0	112.4	I680	I680-E682 HydrophobicContact CG2-CG 4.47Å
683	M	26	Very low	26.9	Very low	153 Å²	153	139.2 Å²	139.2	75%	0.754	76%	0.763	S	S	*	*			cis	-163.3	172.8	8.9	-120.9	-179.3	-159.8	0	0	108.3
684	D	23.6	Very low	26.8	Very low	128 Å²	128	139.3 Å²	139.3	68%	0.684	76%	0.759	S	S	*	*			cis	-162.2	-177.3	-3.2	-169.5	20.3	0	0	0	110.3
685	C	24.1	Very low	26.6	Very low	90 Å²	90	139 Å²	139	61%	0.608	76%	0.756	S	S	*	*			trans	20.9	154	146.6	-78.7	0	0	0	0	123.2
686	T	23.2	Very low	26.7	Very low	118 Å²	118	139.3 Å²	139.3	72%	0.724	76%	0.759	S	S	*	*			cis	-162	147.3	13.4	5.7	0	0	0	0	113.5
687	V	23.2	Very low	26.5	Very low	133 Å²	133	139.3 Å²	139.3	81%	0.806	76%	0.758	S	S	*	*			trans	35.7	129.6	136.2	-176.4	0	0	0	0	122.4
688	S	25.2	Very low	26.3	Very low	116 Å²	116	140.8 Å²	140.8	81%	0.811	77%	0.766	S	S	*	*			trans	132.8	142.6	134.9	-165.3	0	0	0	0	115
689	A	24.5	Very low	26.4	Very low	72 Å²	72	138.5 Å²	138.5	60%	0.595	76%	0.76	S	S	*	*			cis	-171.9	152.5	-31.9	0	0	0	0	0	110.2
690	K	24.7	Very low	26.3	Very low	201 Å²	201	138.9 Å²	138.9	87%	0.874	76%	0.76	S	S	*	*			trans	62.3	128.7	164.6	-58.2	165.7	-178.1	174.6	0	115.8
691	R	28.2	Very low	26.2	Very low	243 Å²	243	138.7 Å²	138.7	92%	0.917	76%	0.759	S	S	*	*			cis	-150.2	142.1	39.7	-74.1	177.9	158.7	129.9	-7.6	113.2
692	N	27.4	Very low	25.8	Very low	148 Å²	148	136.6 Å²	136.6	79%	0.791	76%	0.756	S	S	*	*			trans	-73.8	160.2	154.6	-104.1	-10.5	0	0	0	109.8
693	P	31.3	Very low	25.7	Very low	121 Å²	121	135.4 Å²	135.4	79%	0.786	76%	0.759	S	S	*	*				-149	-173.2	60.7	40.9	-20.5	0	0	0	115.9
694	V	24.5	Very low	25.6	Very low	113 Å²	113	133.8 Å²	133.8	69%	0.685	76%	0.757	S	S	*	*			cis	-166.2	159.3	-34.6	146.1	0	0	0	0	106.6
695	S	25.8	Very low	25.6	Very low	112 Å²	112	135.9 Å²	135.9	78%	0.783	76%	0.76	S	S	*	*			trans	68.1	148.4	168.9	61	0	0	0	0	117.5
696	S	29.2	Very low	25.6	Very low	105 Å²	105	141.6 Å²	141.6	73%	0.734	77%	0.769	S	S	*	*			cis	-151.8	135.6	-7.4	41.6	0	0	0	0	108.3
697	F	23.6	Very low	25.7	Very low	205 Å²	205	142.4 Å²	142.4	90%	0.899	77%	0.765	S	S	*	*				53.2	112.6	66.7	-103.5	-78.7	0	0	0	115.3
698	V	24.7	Very low	25.8	Very low	134 Å²	134	142.6 Å²	142.6	81%	0.812	76%	0.761	S	S	*	*			trans	158.6	139.9	136.3	156.8	0	0	0	0	110.8
699	K	33.3	Very low	25.9	Very low	180 Å²	180	144.1 Å²	144.1	78%	0.783	76%	0.755	S	S	*	*			trans	-97.8	152.7	166.1	-60.7	178.7	179.1	-178.8	0	110
700	P	28.1	Very low	26.1	Very low	115 Å²	115	147.8 Å²	147.8	75%	0.747	76%	0.763	S	S	*	*				-127.6	166.2	123.3	4.5	17.7	0	0	0	110.8
701	I	23.4	Very low	26.4	Very low	136 Å²	136	143.5 Å²	143.5	70%	0.697	76%	0.756	S	S	*	*			cis	72.7	83	4.7	-49	-175.2	0	0	0	116.1
702	S	23.1	Very low	26.4	Very low	102 Å²	102	140.3 Å²	140.3	71%	0.713	76%	0.756	S	S	*	*			trans	99.3	143.1	130.7	86.8	0	0	0	0	121.9
703	T	23.3	Very low	26.2	Very low	119 Å²	119	138.1 Å²	138.1	73%	0.73	75%	0.751	S	S	*	*			trans	88.7	101.6	138.2	-43.6	0	0	0	0	121
704	V	22.6	Very low	26.1	Very low	119 Å²	119	139.6 Å²	139.6	72%	0.721	76%	0.758	S	S	*	*			trans	78	121.3	130.7	164.2	0	0	0	0	122.7
705	F	23.5	Very low	26.2	Very low	171 Å²	171	142 Å²	142	75%	0.75	76%	0.759	S	S	*	*			trans	59.8	132.4	144.1	-81.4	-128.2	0	0	0	123.2
706	R	24.8	Very low	26.4	Very low	210 Å²	210	140.4 Å²	140.4	79%	0.792	76%	0.76	S	S	*	*			trans	68.1	156.8	143.9	-75.8	-167.1	176	-167.4	-1.7	118.8
707	Q	25.5	Very low	26.3	Very low	136 Å²	136	142.2 Å²	142.2	64%	0.636	76%	0.757	S	S	*	*			cis	-172.5	153.4	-30.1	-152.3	172.3	-19.2	0	0	107.1
708	L	25.2	Very low	26.7	Very low	137 Å²	137	137.6 Å²	137.6	72%	0.717	75%	0.75	S	S	*	*			trans	68	162	173.6	-54.4	157.4	0	0	0	113.5
709	E	28.1	Very low	27.1	Very low	147 Å²	147	139.2 Å²	139.2	69%	0.687	75%	0.748	S	S	*	*			cis	-154.2	129.3	10.8	-145.8	145.6	-118.1	0	0	113.1
710	I	27.3	Very low	27.3	Very low	149 Å²	149	135.1 Å²	135.1	76%	0.764	74%	0.74	S	S	*	*			trans	65.7	143.7	133.4	-69.6	-179.3	0	0	0	122.8
711	P	32.1	Very low	27.4	Very low	112 Å²	112	135.3 Å²	135.3	73%	0.727	74%	0.735	S	S	*	*			trans	-110.8	-176.3	-170.1	43.7	-35.5	0	0	0	115.3
712	L	27	Very low	27.8	Very low	176 Å²	176	135.9 Å²	135.9	92%	0.921	74%	0.735	S	S	*	*			trans	-136.5	150.8	167.8	-99.8	170.6	0	0	0	113
713	C	23.9	Very low	28.2	Very low	102 Å²	102	136.2 Å²	136.2	69%	0.689	73%	0.728	S	S	*	*			trans	-108.4	160.1	-172.1	-57.5	0	0	0	0	112.9
714	V	29.8	Very low	28.7	Very low	152 Å²	152	138.9 Å²	138.9	92%	0.921	73%	0.732	S	S	*	*			trans	-135.7	135.9	152.8	-176.2	0	0	0	0	109.1
715	F	25.2	Very low	29.2	Very low	164 Å²	164	136.5 Å²	136.5	72%	0.719	73%	0.725	S	S	*	*			trans	-95.4	164.7	-174.7	-97.8	-108.3	0	0	0	113.6	H717	F715-H717 AromaticContact CD1-CD2 3.88Å; F715-H717 AromaticContact CD1-NE2 3.59Å; F715-H717 AromaticContact CE1-NE2 3.59Å
716	G	30.5	Very low	29.8	Very low	78 Å²	78	136.3 Å²	136.3	80%	0.804	73%	0.732	S	S	*	*			trans	-157.8	80.7	166.6	0	0	0	0	0	113.1
717	H	28.2	Very low	30.1	Very low	142 Å²	142	129.7 Å²	129.7	66%	0.657	73%	0.729	S	S	*	*			trans	-69.4	151.5	170.4	-74.4	-63.2	0	0	0	111	F715	F715-H717 AromaticContact CD1-CD2 3.88Å; F715-H717 AromaticContact CD1-NE2 3.59Å; F715-H717 AromaticContact CE1-NE2 3.59Å
718	S	31.9	Very low	30.6	Very low	109 Å²	109	128.7 Å²	128.7	76%	0.762	73%	0.734	S	S	*	*				-172.7	135.2	66.3	29	0	0	0	0	109.4
719	H	32	Very low	30.8	Very low	167 Å²	167	129.2 Å²	129.2	77%	0.773	74%	0.738	S	S	*	*				77.3	147.6	83.6	-97.2	-102.5	0	0	0	115.1
720	P	36.8	Very low	31	Very low	95 Å²	95	127.8 Å²	127.8	62%	0.617	74%	0.739	S	S	*	*				-142.7	-134.9	-118.2	37.4	-11.6	0	0	0	113.4
721	N	31.1	Very low	30.9	Very low	119 Å²	119	129.1 Å²	129.1	64%	0.636	74%	0.742	S	S	*	*			trans	93.8	118.5	170	-59.2	1.7	0	0	0	115.3
722	Q	31.5	Very low	30.8	Very low	147 Å²	147	131.8 Å²	131.8	69%	0.687	75%	0.749	S	S	*	*				83.3	144.6	96.4	-71	-178.6	-87.2	0	0	112.8
723	D	31.5	Very low	30.7	Very low	109 Å²	109	131.1 Å²	131.1	58%	0.583	74%	0.741	S	S	*	*			cis	-161.7	158.4	-0.5	-108.7	-18.5	0	0	0	110.2
724	H	34.2	Very low	31	Very low	176 Å²	176	131.4 Å²	131.4	82%	0.815	74%	0.736	S	S	*	*			trans	56.6	162.5	155	-68.1	-53	0	0	0	119.6
725	A	33.1	Very low	31	Very low	69 Å²	69	132 Å²	132	57%	0.57	73%	0.726	S	S	*	*			cis	-163	175.2	-28.2	0	0	0	0	0	109.5
726	D	35.9	Very low	31.1	Very low	166 Å²	166	132.6 Å²	132.6	89%	0.888	73%	0.731	S	S	*	*			trans	65.6	139.7	155.4	-56.4	-29.4	0	0	0	122.8
727	G	31.2	Very low	30.9	Very low	72 Å²	72	135.3 Å²	135.3	74%	0.742	73%	0.727	S	S	*	*			trans	105.7	90.7	138.6	0	0	0	0	0	119.2
728	P	35.5	Very low	31	Very low	114 Å²	114	136 Å²	136	74%	0.74	73%	0.728	S	S	*	*			trans	-87.7	152.1	163.5	35.7	-33.1	0	0	0	112.3
729	N	29.8	Very low	30.6	Very low	148 Å²	148	136.6 Å²	136.6	79%	0.791	73%	0.732	S	S	*	*			trans	167.2	159.7	133.6	-89.8	-39.3	0	0	0	113.2
730	T	31.6	Very low	30.3	Very low	117 Å²	117	137.5 Å²	137.5	72%	0.718	73%	0.734	S	S	*	*			trans	54.6	110.9	161.6	44.9	0	0	0	0	117
731	E	25.7	Very low	29.8	Very low	177 Å²	177	141.5 Å²	141.5	83%	0.827	75%	0.745	S	S	*	*				51.3	109.8	81.5	-65.7	-166.2	153.5	0	0	114
732	I	30.4	Very low	29.7	Very low	168 Å²	168	146 Å²	146	86%	0.862	76%	0.759	S	S	*	*				-170.5	149.1	124.1	-99.3	156.8	0	0	0	109.6
733	E	25.5	Very low	29.5	Very low	163 Å²	163	141.7 Å²	141.7	76%	0.762	75%	0.754	S	S	*	*			trans	-60.6	147.3	176.3	-45.4	169	124.9	0	0	112
734	N	29.5	Very low	29.4	Very low	107 Å²	107	143 Å²	143	57%	0.572	77%	0.767	S	S	*	*				179.3	148.3	105.2	-103.4	-91.8	0	0	0	114.4
735	K	31	Very low	29.1	Very low	165 Å²	165	142.7 Å²	142.7	72%	0.717	77%	0.77	S	S	*	*			trans	46.3	112.7	145.2	-67.5	169.7	-178.4	104.5	0	119.8
736	Q	26.1	Very low	28.8	Very low	177 Å²	177	146.1 Å²	146.1	83%	0.827	77%	0.774	S	S	*	*				35.5	106.9	118.9	-62.8	177.9	-19.2	0	0	117.4
737	N	27.3	Very low	28.5	Very low	134 Å²	134	149.4 Å²	149.4	72%	0.717	78%	0.776	S	S	*	*				-161.9	134	128.9	-105.9	-65.9	0	0	0	112.5
738	K	28.4	Very low	28.3	Very low	157 Å²	157	151 Å²	151	68%	0.683	77%	0.767	S	S	*	*			trans	47	102.4	143.4	-63.5	163	-174.5	167.5	0	118.6	F740	K738-F740 HydrophobicContact CB-CD2 4.24Å
739	S	24.4	Very low	28.1	Very low	121 Å²	121	151.6 Å²	151.6	85%	0.846	77%	0.769	S	S	*	*			trans	-44.7	137.4	137	49.9	0	0	0	0	111.6
740	F	26.2	Very low	27.9	Very low	186 Å²	186	151 Å²	151	82%	0.816	77%	0.771	S	S	*	*			trans	-139.1	144.9	167.8	-116.9	-87.7	0	0	0	110.1	K738	K738-F740 HydrophobicContact CB-CD2 4.24Å
741	E	25.1	Very low	28	Very low	179 Å²	179	153.5 Å²	153.5	84%	0.836	77%	0.774	S	S	*	*			trans	-102.6	149.4	-168.8	-62.1	167.1	107.1	0	0	112.9
742	F	28.9	Very low	28.2	Very low	213 Å²	213	153 Å²	153	93%	0.934	77%	0.772	S	S	*	*			trans	-144.2	140.7	154.2	-81.1	-90.7	0	0	0	107.5
743	G	28.2	Very low	28.4	Very low	57 Å²	57	149.9 Å²	149.9	59%	0.588	76%	0.762	S	S	*	*			cis	162.8	135.5	-7.6	0	0	0	0	0	112.2
744	T	29.4	Very low	28.6	Very low	138 Å²	138	148.8 Å²	148.8	85%	0.847	76%	0.761	S	S	*	*			trans	77.8	140.8	-179.9	75.8	0	0	0	0	116.6
745	L	27.7	Very low	28.4	Very low	169 Å²	169	150.8 Å²	150.8	89%	0.885	77%	0.765	S	S	*	*			cis	-110.8	154.1	4.6	-79.8	166.4	0	0	0	113.7
746	Q	26.7	Very low	28.3	Very low	141 Å²	141	151.7 Å²	151.7	66%	0.659	77%	0.765	S	S	*	*			trans	-83.4	159.4	-175	-62.2	163.1	-101.2	0	0	113.6	D748	Q746-D748 PolarHBondContact NE2-OD2 3.36Å
747	Y	30	Very low	28.3	Very low	235 Å²	235	148.2 Å²	148.2	92%	0.922	76%	0.756	S	S	*	*				-152.2	123.9	104.1	-109.2	-73.1	0	0	0	111.1
748	D	26.5	Very low	28.4	Very low	106 Å²	106	150 Å²	150	57%	0.567	76%	0.76	S	S	*	*			trans	-69.4	156.4	-176.2	-57.1	-90.8	0	0	0	112.2	Q746	Q746-D748 PolarHBondContact NE2-OD2 3.36Å
749	T	31.5	Very low	28.4	Very low	126 Å²	126	147.9 Å²	147.9	77%	0.773	77%	0.765	S	S	*	*				-168.2	151.7	57.1	30.8	0	0	0	0	111.8
750	T	25.9	Very low	28.5	Very low	135 Å²	135	148.4 Å²	148.4	83%	0.828	76%	0.763	S	S	*	*			trans	-137.4	126.2	156.6	55.2	0	0	0	0	112.1
751	H	34.3	Very low	28.8	Very low	169 Å²	169	145 Å²	145	78%	0.782	76%	0.76	S	S	*	*			trans	-156.6	144.7	169.1	-88.8	-96.7	0	0	0	106.8
752	Q	30	Very low	29	Very low	168 Å²	168	143.8 Å²	143.8	79%	0.785	77%	0.765	S	S	*	*			cis	-153.9	175.3	-20.7	-122	-159.3	5.4	0	0	107.6
753	P	34.4	Very low	28.8	Very low	102 Å²	102	137.9 Å²	137.9	66%	0.662	75%	0.75	S	S	*	*			trans	-85.1	162.8	-162	35.4	-39.1	0	0	0	115.2
754	N	29.4	Very low	29.1	Very low	139 Å²	139	140.2 Å²	140.2	74%	0.743	76%	0.755	S	S	*	*			trans	145.7	145.3	158.7	-84.4	-51	0	0	0	108.6
755	K	26	Very low	29	Very low	149 Å²	149	141 Å²	141	65%	0.648	75%	0.752	S	S	*	*			cis	-165.1	167.3	-17.4	-138.9	169	-170.9	158.6	0	108.1
756	Y	27.4	Very low	28.9	Very low	184 Å²	184	140.6 Å²	140.6	72%	0.722	75%	0.75	S	S	*	*			trans	62.8	109.9	157.1	-66.1	-51.7	0	0	0	122.1
757	T	26.4	Very low	28.9	Very low	105 Å²	105	138.8 Å²	138.8	64%	0.644	75%	0.753	S	S	*	*				76	126.3	124	55.7	0	0	0	0	125
758	H	28.9	Very low	28.6	Very low	172 Å²	172	134.9 Å²	134.9	80%	0.796	75%	0.748	S	S	*	*			trans	77.9	158.6	134.2	-66.7	-43.6	0	0	0	122.1
759	S	30	Very low	28.8	Very low	112 Å²	112	138.2 Å²	138.2	78%	0.783	76%	0.76	S	S	*	*			trans	77.4	78.6	164.1	-16.5	0	0	0	0	119.4
760	T	26.8	Very low	28.3	Very low	132 Å²	132	139.2 Å²	139.2	81%	0.81	77%	0.766	S	S	*	*			trans	-49.5	170.5	139	53.5	0	0	0	0	113.3
761	P	30.6	Very low	28.3	Very low	114 Å²	114	137.3 Å²	137.3	74%	0.74	76%	0.764	S	S	*	*			cis	-141.7	139.9	-46.9	38	-20.9	0	0	0	113.5
762	T	29.7	Very low	27.7	Very low	153 Å²	153	134.3 Å²	134.3	94%	0.939	76%	0.762	S	S	*	*			trans	-139.8	118.9	178.2	-15.6	0	0	0	0	115.3
763	S	26.3	Very low	27.5	Very low	90 Å²	90	134.4 Å²	134.4	63%	0.629	77%	0.766	S	S	*	*			trans	-116.4	160.7	164.1	62.5	0	0	0	0	108.7
764	P	33.1	Very low	27	Very low	106 Å²	106	134.8 Å²	134.8	69%	0.688	77%	0.767	S	S	*	*			cis	-134.4	-135.8	7.8	42.3	-22	0	0	0	111.8
765	I	27.2	Very low	26.8	Very low	153 Å²	153	136.4 Å²	136.4	79%	0.785	77%	0.774	S	S	*	*			trans	91	98.9	-178	-54.1	166.8	0	0	0	110.8
766	L	25.1	Very low	26.7	Very low	162 Å²	162	140.9 Å²	140.9	85%	0.848	79%	0.787	S	S	*	*				80.1	80.1	52.7	-164.3	98.7	0	0	0	113.4
767	S	27	Very low	26.7	Very low	103 Å²	103	136.8 Å²	136.8	72%	0.72	79%	0.786	S	S	*	*			trans	-141.9	139.2	159.7	56.3	0	0	0	0	109.7
768	N	25.1	Very low	26.9	Very low	152 Å²	152	141.4 Å²	141.4	81%	0.813	80%	0.797	S	S	*	*			trans	-81.1	124	-178.3	-57.1	-42.3	0	0	0	110.6
769	H	29	Very low	26.9	Very low	176 Å²	176	137.1 Å²	137.1	82%	0.815	79%	0.786	S	S	*	*			trans	-139.8	118.5	157.3	-88.4	-71.8	0	0	0	111.8
770	T	22.7	Very low	26.9	Very low	147 Å²	147	138.8 Å²	138.8	90%	0.902	79%	0.786	S	S	*	*			trans	-64.3	122.9	161.2	19.6	0	0	0	0	109.6
771	A	25.4	Very low	27.1	Very low	95 Å²	95	137.7 Å²	137.7	79%	0.785	78%	0.784	S	S	*	*			trans	-134.3	107.5	171	0	0	0	0	0	109.4
772	S	22.4	Very low	26.9	Very low	107 Å²	107	137.9 Å²	137.9	75%	0.748	78%	0.783	S	S	*	*			trans	-79.1	137.2	174.4	50.4	0	0	0	0	111.1
773	I	25.5	Very low	26.7	Very low	169 Å²	169	137 Å²	137	87%	0.867	78%	0.782	S	S	*	*			trans	-116.5	121.8	160	-62.6	-177.3	0	0	0	108.2
774	T	23.1	Very low	26.5	Very low	111 Å²	111	137.3 Å²	137.3	68%	0.681	78%	0.784	S	S	*	*			trans	-100.8	128.1	-174.9	-55.5	0	0	0	0	110.1
775	L	24.9	Very low	26.2	Very low	172 Å²	172	139 Å²	139	90%	0.901	79%	0.791	S	S	*	*			trans	-123.3	153.2	155	-73.6	177.1	0	0	0	109.7
776	R	24.3	Very low	26	Very low	243 Å²	243	137.4 Å²	137.4	92%	0.917	79%	0.789	S	S	*	*			trans	-111.2	131.9	-136.2	-158.8	178.1	-166.4	169.4	3.3	112.7
777	S	26.6	Very low	26.1	Very low	98 Å²	98	136.1 Å²	136.1	69%	0.685	79%	0.788	S	S	*	*			trans	-86.4	147.7	178.9	64.2	0	0	0	0	114.1
778	K	30.5	Very low	26.1	Very low	202 Å²	202	139.8 Å²	139.8	88%	0.878	79%	0.791	S	S	*	*			trans	-134.4	97.1	131.7	-69.6	-174.9	178.6	-179.7	0	106.4
779	S	30.8	Very low	26.1	Very low	83 Å²	83	138.4 Å²	138.4	58%	0.58	79%	0.79	S	S	*	*				63.9	133.1	70.9	76.4	0	0	0	0	113.5
780	N	28.9	Very low	26.1	Very low	146 Å²	146	138 Å²	138	78%	0.781	79%	0.793	S	S	*	*			cis	-163.6	158.8	-13.9	-91.9	-23.7	0	0	0	104
781	S	31	Very low	26.4	Very low	110 Å²	110	138.8 Å²	138.8	77%	0.769	79%	0.786	S	S	*	*			cis	-149.5	143.6	35.3	38.2	0	0	0	0	109.4
782	V	26.3	Very low	26.4	Very low	118 Å²	118	138.6 Å²	138.6	72%	0.715	78%	0.778	S	S	*	*				78.3	97.2	51	-179.9	0	0	0	0	113.9
783	C	25.4	Very low	26.8	Very low	134 Å²	134	142.9 Å²	142.9	91%	0.905	78%	0.784	S	S	*	*				-146.8	121.8	128.8	-158.4	0	0	0	0	108.6
784	S	23.3	Very low	26.9	Very low	96 Å²	96	142.1 Å²	142.1	67%	0.671	78%	0.78	S	S	*	*			trans	-139.3	120.2	-170.4	53.8	0	0	0	0	111.6
785	V	25.8	Very low	27.2	Very low	141 Å²	141	145.6 Å²	145.6	86%	0.855	79%	0.788	S	S	*	*			trans	-90.1	127.3	175.1	179.3	0	0	0	0	109.4
786	T	23.8	Very low	27.3	Very low	121 Å²	121	146 Å²	146	74%	0.742	78%	0.783	S	S	*	*			trans	-101.6	125.5	-179.6	43.1	0	0	0	0	111.2
787	V	26.6	Very low	27.7	Very low	135 Å²	135	140.3 Å²	140.3	82%	0.818	78%	0.777	S	S	*	*			trans	-105.4	120.4	169.7	-178.8	0	0	0	0	108.2
788	K	26.1	Very low	27.9	Very low	179 Å²	179	144 Å²	144	78%	0.778	78%	0.78	S	S	*	*			trans	-78.8	137.5	-175.8	-66.1	177	-179.5	174.2	0	111.1
789	P	25.7	Very low	27.9	Very low	124 Å²	124	140.3 Å²	140.3	81%	0.805	77%	0.77	S	S	*	*			trans	-71.9	131.4	166.9	30.7	-32.8	0	0	0	109.8
790	I	29.8	Very low	28	Very low	168 Å²	168	148.2 Å²	148.2	86%	0.862	79%	0.788	S	S	*	*			trans	-108.8	97.8	167.4	-59.2	-179.6	0	0	0	107.6
791	H	29.2	Very low	28.1	Very low	163 Å²	163	144.5 Å²	144.5	76%	0.755	78%	0.784	S	S	*	*			trans	-111.8	131.8	161.1	-153.9	-76.5	0	0	0	108.4
792	S	25.4	Very low	28.1	Very low	90 Å²	90	144.5 Å²	144.5	63%	0.629	78%	0.784	S	S	*	*			trans	-67.3	138.5	-178.6	56.3	0	0	0	0	111.9
793	F	30	Very low	28.2	Very low	197 Å²	197	144.7 Å²	144.7	86%	0.864	79%	0.789	S	S	*	*			trans	-152.2	145.1	140.5	-105.5	-68.2	0	0	0	112.5
794	I	26.5	Very low	28.5	Very low	153 Å²	153	143.9 Å²	143.9	79%	0.785	78%	0.782	S	S	*	*			trans	-84.8	133.4	-178.1	-64	163.1	0	0	0	109.5
795	H	31.1	Very low	29.2	Very low	184 Å²	184	144.5 Å²	144.5	85%	0.852	78%	0.784	S	S	*	*			trans	-133.9	138.9	164.1	-111.9	-99.4	0	0	0	111.7
796	K	27	Very low	29.4	Very low	182 Å²	182	144.8 Å²	144.8	79%	0.791	78%	0.781	S	S	*	*			trans	-89.3	151.5	-178.2	-56	179.2	179.9	-175.6	0	111.3
797	P	33	Very low	29.7	Very low	122 Å²	122	145.5 Å²	145.5	79%	0.792	78%	0.78	S	S	*	*			trans	-72.2	142.3	149.2	32.6	-31.6	0	0	0	110.5
798	K	30.1	Very low	29.8	Very low	175 Å²	175	146.8 Å²	146.8	76%	0.761	78%	0.781	S	S	*	*			trans	-104.3	177.7	147.2	-54.2	169.9	126.5	-139	0	107.1
799	D	30.8	Very low	29.8	Very low	125 Å²	125	142.7 Å²	142.7	67%	0.668	78%	0.775	S	S	*	*			cis	-140.1	156.1	2.9	-89.5	-67.4	0	0	0	108.2
800	R	32.2	Very low	29.8	Very low	249 Å²	249	144 Å²	144	94%	0.94	77%	0.774	S	S	*	*			trans	-168.4	124.5	143.8	-109.3	174.5	-162.5	-142.4	3.3	111.4
801	G	30.7	Very low	29.6	Very low	69 Å²	69	140.4 Å²	140.4	71%	0.711	76%	0.764	S	S	*	*			trans	64.4	109.2	147.4	0	0	0	0	0	120.7
802	S	31.7	Very low	29.5	Very low	109 Å²	109	137.3 Å²	137.3	76%	0.762	76%	0.76	S	S	*	*				11.2	147.5	127.4	55.1	0	0	0	0	120.7
803	C	28.5	Very low	29.6	Very low	122 Å²	122	142.6 Å²	142.6	82%	0.824	77%	0.772	S	S	*	*			cis	-160.7	170.1	-4.1	-108.3	0	0	0	0	109.6
804	P	32.1	Very low	29.6	Very low	117 Å²	117	137.2 Å²	137.2	76%	0.76	76%	0.764	S	S	*	*			trans	-107.7	-155.9	-157.4	47	-39.4	0	0	0	112.9
805	P	36.4	Very low	29.7	Very low	110 Å²	110	136.5 Å²	136.5	71%	0.714	76%	0.762	S	S	*	*				-118.9	173.2	-113.5	35	-15.6	0	0	0	114.3
806	N	31.7	Very low	29.7	Very low	147 Å²	147	132.5 Å²	132.5	79%	0.786	75%	0.746	S	S	*	*			trans	-161.3	141.1	152.4	-105	-27.5	0	0	0	115.7
807	L	29.2	Very low	29.8	Very low	136 Å²	136	130.6 Å²	130.6	71%	0.712	74%	0.741	S	S	*	*			trans	51.5	114.4	141	-60	169.7	0	0	0	122.6
808	L	27.7	Very low	29.7	Very low	161 Å²	161	131.6 Å²	131.6	84%	0.843	73%	0.734	S	S	*	*				78.6	143.4	128.8	-66	171.1	0	0	0	121.5
809	S	27.3	Very low	29.6	Very low	93 Å²	93	129.5 Å²	129.5	65%	0.65	73%	0.731	S	S	*	*			trans	-84.5	156.7	-179.5	52.9	0	0	0	0	113.7
810	L	25.6	Very low	29.5	Very low	153 Å²	153	128.4 Å²	128.4	80%	0.801	73%	0.725	S	S	*	*				-176.2	130.5	109.3	-100.2	162.9	0	0	0	115.3
811	S	24.9	Very low	29.2	Very low	92 Å²	92	123.7 Å²	123.7	64%	0.643	71%	0.713	S	S	*	*			trans	47	144.8	138.5	68.8	0	0	0	0	124.7
812	S	27	Very low	29.1	Very low	97 Å²	97	125.4 Å²	125.4	68%	0.678	71%	0.714	S	S	*	*			trans	84.6	128.6	146.8	89.2	0	0	0	0	116.1
813	K	28.6	Very low	28.9	Very low	202 Å²	202	124.7 Å²	124.7	88%	0.878	72%	0.715	S	S	*	*				72.5	140.1	98.2	-73.3	-174.1	176.4	-175.7	0	112.9
814	A	29.4	Very low	28.9	Very low	83 Å²	83	125.7 Å²	125.7	69%	0.686	71%	0.712	S	S	*	*			cis	-169	-162.4	-14.6	0	0	0	0	0	106.1
815	N	29.1	Very low	28.6	Very low	138 Å²	138	127 Å²	127	74%	0.738	71%	0.712	S	S	*	*			cis	-162	-164.1	-0.5	-150.2	53.3	0	0	0	107.8
816	N	30	Very low	28.2	Very low	100 Å²	100	126.7 Å²	126.7	54%	0.535	71%	0.713	S	S	.	*			trans	71.9	118.5	157.2	-67.9	32.8	0	0	0	116.8
817	E	29.3	Very low	28	Very low	143 Å²	143	123.3 Å²	123.3	67%	0.668	71%	0.713	S	S	*	*				81.2	154	85.1	-68.5	154.7	-162.9	0	0	112.7
818	H	32.4	Very low	27.9	Very low	143 Å²	143	126.2 Å²	126.2	66%	0.662	72%	0.719	S	S	*	*			cis	-122	156.4	4.9	-107.4	-92.4	0	0	0	109.2
819	L	27.7	Very low	27.9	Very low	131 Å²	131	125.3 Å²	125.3	69%	0.686	72%	0.715	S	S	*	*				42.5	143.2	96.5	-51.3	-164.6	0	0	0	115.8
820	N	27.5	Very low	28	Very low	102 Å²	102	125.5 Å²	125.5	55%	0.545	72%	0.716	S	S	.	*			cis	-155.4	175.9	11.1	-132.2	8	0	0	0	114.3
821	E	27.2	Very low	28.1	Very low	149 Å²	149	123.2 Å²	123.2	70%	0.696	71%	0.713	S	S	*	*			trans	34.5	120.2	146	-66.4	154.6	158.8	0	0	119.6
822	S	27	Very low	28.7	Very low	105 Å²	105	123.9 Å²	123.9	73%	0.734	72%	0.715	S	S	*	*				71.3	93.1	50.8	87	0	0	0	0	116.2
823	A	28.9	Very low	28.7	Very low	94 Å²	94	126.3 Å²	126.3	78%	0.777	72%	0.716	S	S	*	*			trans	-144	114.8	143.5	0	0	0	0	0	106.9
824	L	27.1	Very low	28.5	Very low	143 Å²	143	125.8 Å²	125.8	75%	0.749	71%	0.708	S	S	*	*				71.3	128.8	68.1	-79	166.7	0	0	0	114.1
825	N	27.4	Very low	28.4	Very low	144 Å²	144	127.1 Å²	127.1	77%	0.77	70%	0.704	S	S	*	*			trans	72.9	145.6	150.8	-64.6	-19.8	0	0	0	118.9
826	S	26.6	Very low	28.3	Very low	104 Å²	104	128.5 Å²	128.5	73%	0.727	71%	0.706	S	S	*	*			cis	-169.8	144.9	-15.3	48.8	0	0	0	0	112.7
827	G	28.1	Very low	28.1	Very low	76 Å²	76	129.2 Å²	129.2	78%	0.784	71%	0.713	S	S	*	*			trans	70.5	179.3	169.3	0	0	0	0	0	113.8
828	K	27.5	Very low	28	Very low	197 Å²	197	129 Å²	129	86%	0.857	72%	0.715	S	S	*	*			cis	-151.9	153.9	-2.1	-82.1	-169.3	-179.5	173.8	0	105.6
829	L	27.2	Very low	27.7	Very low	143 Å²	143	126.6 Å²	126.6	75%	0.749	71%	0.711	S	S	*	*			cis	-157.4	168.6	-1.7	-152.9	74	0	0	0	108.9
830	S	29.4	Very low	27.7	Very low	96 Å²	96	127.8 Å²	127.8	67%	0.671	71%	0.711	S	S	*	*			trans	43.4	110.5	142.7	64.5	0	0	0	0	121
831	S	28.8	Very low	28	Very low	106 Å²	106	132 Å²	132	74%	0.741	73%	0.727	S	S	*	*			trans	-60.7	-178.2	131.6	63.4	0	0	0	0	110.9
832	P	35.8	Very low	28	Very low	105 Å²	105	134.3 Å²	134.3	68%	0.682	73%	0.729	S	S	*	*			cis	-139.5	-134.8	10	32.5	-5.6	0	0	0	111.8
833	E	27.8	Very low	28.1	Very low	148 Å²	148	135.4 Å²	135.4	69%	0.692	73%	0.726	S	S	*	*			trans	75.6	153.7	161.3	-63.9	-153.8	130.8	0	0	117.6
834	R	25.1	Very low	28	Very low	191 Å²	191	139.3 Å²	139.3	72%	0.721	73%	0.725	S	S	*	*			cis	166.8	148.8	-31	-118.3	177.2	172	160.6	-5.9	104.7
835	N	25.8	Very low	28.2	Very low	111 Å²	111	139.3 Å²	139.3	59%	0.594	72%	0.721	S	S	*	*			trans	53.8	119.6	146.6	-60.5	-9.4	0	0	0	120.8
836	Q	26.9	Very low	28.3	Very low	167 Å²	167	139 Å²	139	78%	0.78	72%	0.716	S	S	*	*			trans	70.6	163.5	150.6	-53.7	153	24.5	0	0	111.9
837	V	27.1	Very low	28.3	Very low	115 Å²	115	140.4 Å²	140.4	70%	0.697	72%	0.715	S	S	*	*			cis	-148.1	128.6	33.8	162.3	0	0	0	0	105.3
838	I	27	Very low	28.2	Very low	138 Å²	138	141.5 Å²	141.5	71%	0.708	71%	0.71	S	S	*	*				61.9	136.1	84.7	-75.2	165.2	0	0	0	111.8
839	T	26.2	Very low	28.2	Very low	93 Å²	93	138.1 Å²	138.1	57%	0.571	71%	0.706	S	S	*	*			cis	178	162	-4	-93.1	0	0	0	0	109.9
840	K	26.7	Very low	28.1	Very low	156 Å²	156	136.6 Å²	136.6	68%	0.678	71%	0.707	S	S	*	*			trans	68.7	120.7	164.7	-73.2	148.7	-156.3	156	0	119.1
841	Q	34.9	Very low	28	Very low	192 Å²	192	137.7 Å²	137.7	90%	0.897	71%	0.706	S	S	*	*				-147.2	121.3	104.7	-93.9	166.3	15.9	0	0	105.3
842	R	26.1	Very low	28.1	Very low	196 Å²	196	142.2 Å²	142.2	74%	0.74	71%	0.707	S	S	*	*				56.2	124.7	56.6	-75.1	-172.7	170.6	177.6	-4.2	111
843	I	29.3	Very low	27.7	Very low	129 Å²	129	142.2 Å²	142.2	66%	0.662	71%	0.709	S	S	*	*			cis	-161.7	143.6	23.9	-114.5	154.3	0	0	0	110.1
844	K	27.2	Very low	28	Very low	175 Å²	175	140.5 Å²	140.5	76%	0.761	71%	0.711	S	S	*	*			trans	50.4	155	157.7	-62	175.8	-174.3	-178.6	0	118.2
845	Q	31.8	Very low	28	Very low	143 Å²	143	138.6 Å²	138.6	67%	0.668	71%	0.713	S	S	*	*			cis	-153.2	144.4	13.5	-135.5	150.6	-32.2	0	0	110
846	Q	28	Very low	28	Very low	139 Å²	139	137.7 Å²	137.7	65%	0.65	72%	0.715	S	S	*	*			trans	36.9	134.6	131.7	-74	-179.3	-104.6	0	0	123.1
847	D	28	Very low	28.1	Very low	132 Å²	132	136.4 Å²	136.4	71%	0.706	71%	0.714	S	S	*	*			trans	63.4	142.7	136	-48.4	-23.8	0	0	0	119.1
848	S	25.8	Very low	28.3	Very low	99 Å²	99	138.8 Å²	138.8	69%	0.692	72%	0.717	S	S	*	*			cis	-174	153.7	-15.3	56.5	0	0	0	0	110.5
849	V	27.8	Very low	28.5	Very low	127 Å²	127	138.9 Å²	138.9	77%	0.77	72%	0.719	S	S	*	*			trans	66.7	119.1	153.6	173	0	0	0	0	119.9
850	S	25.2	Very low	28.6	Very low	111 Å²	111	143.3 Å²	143.3	78%	0.776	73%	0.734	S	S	*	*			trans	56.3	160.6	150.1	-56.1	0	0	0	0	120.1
851	D	27.2	Very low	28.7	Very low	119 Å²	119	145.1 Å²	145.1	64%	0.636	74%	0.744	S	S	*	*			cis	-148	167.4	9.1	-156.6	4.9	0	0	0	112.5
852	R	31	Very low	28.4	Very low	201 Å²	201	143.3 Å²	143.3	76%	0.758	74%	0.741	S	S	*	*			trans	55.2	97.3	158.1	-69.7	155.5	-162.4	-109.3	-4.5	121.1
853	S	26.9	Very low	28.6	Very low	104 Å²	104	140.1 Å²	140.1	73%	0.727	74%	0.744	S	S	*	*				28.6	153	109.5	70.9	0	0	0	0	121.6
854	P	33.9	Very low	28.7	Very low	113 Å²	113	145.2 Å²	145.2	73%	0.734	75%	0.754	S	S	*	*			cis	-144.4	-169.1	17.9	32	-6.1	0	0	0	116.8
855	I	25.6	Very low	29	Very low	150 Å²	150	141.3 Å²	141.3	77%	0.769	75%	0.749	S	S	*	*			trans	93	109	156.6	-54.6	-177.6	0	0	0	119.9
856	S	25.7	Very low	29	Very low	92 Å²	92	140.7 Å²	140.7	64%	0.643	75%	0.746	S	S	*	*			trans	88.1	135.7	144.5	77.9	0	0	0	0	122.9
857	N	28.7	Very low	29.1	Very low	141 Å²	141	143.9 Å²	143.9	75%	0.754	75%	0.752	S	S	*	*			trans	83.8	118.3	141.3	-67.5	-9.2	0	0	0	123.2
858	Q	30.7	Very low	29.3	Very low	164 Å²	164	143 Å²	143	77%	0.766	75%	0.751	S	S	*	*			trans	104.1	137.3	135.2	-79.3	176.4	3.9	0	0	121.4
859	N	31.8	Very low	29.6	Very low	140 Å²	140	144.5 Å²	144.5	75%	0.749	75%	0.748	S	S	*	*			trans	68.6	96.5	165.2	-48.4	-24.9	0	0	0	114.5
860	E	27.8	Very low	29.7	Very low	186 Å²	186	143.3 Å²	143.3	87%	0.869	74%	0.736	S	S	*	*			cis	72.6	59.8	37.6	-60.9	-150.2	117.5	0	0	116.9
861	E	28.7	Very low	30.1	Very low	194 Å²	194	143.9 Å²	143.9	91%	0.907	73%	0.73	S	S	*	*			trans	-153	93	156.5	-133	174	-165	0	0	112.3
862	D	30.1	Very low	30.3	Very low	154 Å²	154	145.9 Å²	145.9	82%	0.824	73%	0.734	S	S	*	*			trans	179.1	-10.4	154.2	-120.3	-19.9	0	0	0	115.7	R864	D862-R864 PolarHBondContact O-N 2.94Å
863	T	29.2	Very low	30.3	Very low	130 Å²	130	141.4 Å²	141.4	80%	0.798	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	9.7	-163.9	52	0	0	0	0	117.1
864	R	32.3	Very low	30.5	Very low	235 Å²	235	140.1 Å²	140.1	89%	0.887	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-16.7	-172.2	-149.7	169.3	-171.2	164.1	3.2	115	D862	D862-R864 PolarHBondContact O-N 2.94Å
865	S	32.8	Very low	30.4	Very low	93 Å²	93	143.6 Å²	143.6	65%	0.65	71%	0.709	S	S	*	*	S	Bend	trans	-86.3	-37	-176.5	-162.5	0	0	0	0	114.3	R867	S865-R867 PolarHBondContact O-N 3.43Å
866	H	31.7	Very low	30.6	Very low	130 Å²	130	142.3 Å²	142.3	60%	0.602	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-22.7	-172.7	-85.9	-78.2	0	0	0	115.3	V868 Q869 L870	H866-V868 PolarHBondContact O-N 3.27Å; H866-V868 VanDerWaalsContact O-N 3.14Å; H866-Q869 PolarHBondContact O-N 3.38Å; H866-Q869 VanDerWaalsContact O-N 3.09Å; H866-L870 PolarHBondContact O-N 2.92Å
867	R	30.3	Very low	30.9	Very low	206 Å²	206	141.3 Å²	141.3	78%	0.777	69%	0.688	S	S	*	*	H	α-helix	trans	-63.1	-20.9	-178.1	-116.9	175.7	-180	161.1	1.2	114.1	S865	S865-R867 PolarHBondContact O-N 3.43Å
868	V	33	Very low	31.1	Very low	114 Å²	114	140.1 Å²	140.1	69%	0.691	68%	0.676	S	S	*	*	H	α-helix	trans	-83.2	-25.2	177.1	-178	0	0	0	0	112.4	H866	H866-V868 PolarHBondContact O-N 3.27Å; H866-V868 VanDerWaalsContact O-N 3.14Å
869	Q	31.5	Very low	31.1	Very low	131 Å²	131	135.4 Å²	135.4	61%	0.612	66%	0.661	S	S	*	*	H	α-helix	trans	-79.7	-36.1	176.3	-68.4	-171.9	-7.4	0	0	112.3	H866 N871 K872 L873	H866-Q869 PolarHBondContact O-N 3.38Å; H866-Q869 VanDerWaalsContact O-N 3.09Å; Q869-N871 VanDerWaalsContact C-N 3.29Å; Q869-N871 PolarHBondContact O-N 3.02Å; Q869-K872 WeakPolarHBondContact O-CB 3.49Å; Q869-K872 PolarHBondContact O-N 2.99Å; Q869-L873 PolarHBondContact O-N 2.68Å; Q869-L873 VanDerWaalsContact O-N 3.13Å
870	L	30.7	Very low	30.9	Very low	102 Å²	102	131.4 Å²	131.4	53%	0.534	65%	0.648	S	S	.	*	H	α-helix	trans	-57.8	-38.5	179	-78.1	163.6	0	0	0	112.8	H866 K872 L873 D874	H866-L870 PolarHBondContact O-N 2.92Å; L870-K872 VanDerWaalsContact C-N 3.27Å; L870-K872 PolarHBondContact O-N 3.05Å; L870-L873 PolarHBondContact O-N 2.98Å; L870-L873 VanDerWaalsContact O-N 3.08Å; L870-D874 PolarHBondContact O-N 3.23Å
871	N	31.9	Very low	31	Very low	122 Å²	122	129.6 Å²	129.6	65%	0.652	64%	0.637	S	S	*	*	H	α-helix	trans	-66.6	-24.4	176.7	-71.1	6.7	0	0	0	113.6	Q869 Y875	Q869-N871 VanDerWaalsContact C-N 3.29Å; Q869-N871 PolarHBondContact O-N 3.02Å; N871-Y875 PolarHBondContact O-N 3.25Å
872	K	32.5	Very low	31.2	Very low	162 Å²	162	128.3 Å²	128.3	70%	0.704	63%	0.625	S	S	*	*	H	α-helix	trans	-77.9	-35.5	170	-76.2	-175	174.8	180	0	111.8	Q869 L870 Y875 F876	Q869-K872 WeakPolarHBondContact O-CB 3.49Å; Q869-K872 PolarHBondContact O-N 2.99Å; L870-K872 VanDerWaalsContact C-N 3.27Å; L870-K872 PolarHBondContact O-N 3.05Å; K872-Y875 PolarHBondContact O-N 2.94Å; K872-F876 PolarHBondContact O-N 3.3Å
873	L	30.6	Very low	31.2	Very low	107 Å²	107	124.7 Å²	124.7	56%	0.56	61%	0.612	S	S	*	*	H	α-helix	trans	-68.8	-41.1	177.8	-162.9	69.2	0	0	0	111.3	Q869 L870 Y875 F876 V877	Q869-L873 PolarHBondContact O-N 2.68Å; Q869-L873 VanDerWaalsContact O-N 3.13Å; L870-L873 PolarHBondContact O-N 2.98Å; L870-L873 VanDerWaalsContact O-N 3.08Å; L873-Y875 VanDerWaalsContact C-N 3.32Å; L873-Y875 PolarHBondContact O-N 2.92Å; L873-F876 CarbonylContact O-C 3.58Å; L873-F876 WeakPolarHBondContact O-CA 3.33Å; L873-F876 WeakPolarHBondContact O-CB 3.42Å; L873-F876 PolarHBondContact O-N 2.81Å; L873-F876 VanDerWaalsContact O-N 3.08Å; L873-V877 WeakPolarHBondContact O-CG2 3.48Å; L873-V877 PolarHBondContact O-N 2.77Å
874	D	31.6	Very low	31.3	Very low	77 Å²	77	121.2 Å²	121.2	41%	0.412	59%	0.593	S	S	.	*	H	α-helix	trans	-65.2	-34.8	176	-170.5	52.9	0	0	0	112.3	L870 V877 K878	L870-D874 PolarHBondContact O-N 3.23Å; D874-V877 PolarHBondContact O-N 3.1Å; D874-K878 WeakPolarHBondContact O-CB 3.37Å; D874-K878 WeakPolarHBondContact O-CG 3.19Å; D874-K878 PolarHBondContact O-N 3.03Å; D874-K878 IonicContact OD1-NZ 2.79Å; D874-K878 WeakPolarHBondContact OD2-CE 3.37Å; D874-K878 IonicContact OD2-NZ 2.73Å; D874-K878 PolarHBondContact OD2-NZ 3.33Å
875	Y	30.8	Very low	31.2	Very low	186 Å²	186	118.2 Å²	118.2	73%	0.729	58%	0.583	S	S	*	*	H	α-helix	trans	-64.2	-40.8	168.9	-127.3	-82	0	0	0	112.2	N871 K872 L873 S879	N871-Y875 PolarHBondContact O-N 3.25Å; K872-Y875 PolarHBondContact O-N 2.94Å; L873-Y875 VanDerWaalsContact C-N 3.32Å; L873-Y875 PolarHBondContact O-N 2.92Å; Y875-S879 WeakPolarHBondContact O-CB 3.4Å; Y875-S879 PolarHBondContact O-N 3.48Å
876	F	29.9	Very low	31.1	Very low	122 Å²	122	118.5 Å²	118.5	54%	0.535	58%	0.576	S	S	.	*	H	α-helix	trans	-64	-45.9	174.1	-108.9	-82.6	0	0	0	111.8	K872 L873 K878 S879 A880	K872-F876 PolarHBondContact O-N 3.3Å; L873-F876 CarbonylContact O-C 3.58Å; L873-F876 WeakPolarHBondContact O-CA 3.33Å; L873-F876 WeakPolarHBondContact O-CB 3.42Å; L873-F876 PolarHBondContact O-N 2.81Å; L873-F876 VanDerWaalsContact O-N 3.08Å; F876-K878 PolarHBondContact O-N 3.15Å; F876-S879 WeakPolarHBondContact CA-OG 3.21Å; F876-S879 PolarHBondContact O-N 3.28Å; F876-S879 PolarHBondContact O-OG 3.35Å; F876-A880 WeakPolarHBondContact O-CB 3.47Å; F876-A880 PolarHBondContact O-N 3.35Å
877	V	31.8	Very low	31.3	Very low	71 Å²	71	115.1 Å²	115.1	43%	0.43	57%	0.567	S	S	.	*	H	α-helix	trans	-64	-39.6	177.6	172.3	0	0	0	0	111.4	L873 D874 A880 K881	L873-V877 WeakPolarHBondContact O-CG2 3.48Å; L873-V877 PolarHBondContact O-N 2.77Å; D874-V877 PolarHBondContact O-N 3.1Å; V877-A880 PolarHBondContact O-N 2.91Å; V877-K881 WeakPolarHBondContact O-CG 3.22Å; V877-K881 PolarHBondContact O-N 2.91Å
878	K	33	Very low	31.7	Very low	117 Å²	117	109.7 Å²	109.7	51%	0.509	55%	0.553	S	S	.	*	H	α-helix	trans	-63.1	-42.7	171.7	-77.8	164.6	178.1	159.6	0	111.9	D874 F876 A880 K881 Y882	D874-K878 WeakPolarHBondContact O-CB 3.37Å; D874-K878 WeakPolarHBondContact O-CG 3.19Å; D874-K878 PolarHBondContact O-N 3.03Å; D874-K878 IonicContact OD1-NZ 2.79Å; D874-K878 WeakPolarHBondContact OD2-CE 3.37Å; D874-K878 IonicContact OD2-NZ 2.73Å; D874-K878 PolarHBondContact OD2-NZ 3.33Å; F876-K878 PolarHBondContact O-N 3.15Å; K878-A880 VanDerWaalsContact C-N 3.35Å; K878-A880 PolarHBondContact O-N 3.22Å; K878-K881 PolarHBondContact O-N 3.46Å; K878-Y882 PolarHBondContact O-N 3.42Å
879	S	30.7	Very low	31.9	Very low	64 Å²	64	106.6 Å²	106.6	45%	0.448	54%	0.536	S	S	.	.	H	α-helix	trans	-65.1	-36.3	174.8	75.8	0	0	0	0	112.9	Y875 F876 Y882 S883	Y875-S879 WeakPolarHBondContact O-CB 3.4Å; Y875-S879 PolarHBondContact O-N 3.48Å; F876-S879 WeakPolarHBondContact CA-OG 3.21Å; F876-S879 PolarHBondContact O-N 3.28Å; F876-S879 PolarHBondContact O-OG 3.35Å; S879-Y882 PolarHBondContact O-N 3.48Å; S879-S883 WeakPolarHBondContact O-CB 3.16Å; S879-S883 PolarHBondContact O-N 3.25Å
880	A	27.7	Very low	32.2	Very low	57 Å²	57	104.2 Å²	104.2	47%	0.471	53%	0.531	S	S	.	.	H	α-helix	trans	-69.4	-42.6	176.9	0	0	0	0	0	111.9	F876 V877 K878 Y882 S883 S884	F876-A880 WeakPolarHBondContact O-CB 3.47Å; F876-A880 PolarHBondContact O-N 3.35Å; V877-A880 PolarHBondContact O-N 2.91Å; K878-A880 VanDerWaalsContact C-N 3.35Å; K878-A880 PolarHBondContact O-N 3.22Å; A880-Y882 VanDerWaalsContact C-N 3.35Å; A880-S883 WeakPolarHBondContact O-CB 3.33Å; A880-S883 PolarHBondContact O-N 2.87Å; A880-S884 PolarHBondContact O-N 3.38Å
881	K	30.6	Very low	33.2	Very low	147 Å²	147	103.8 Å²	103.8	64%	0.639	53%	0.526	S	S	*	.	H	α-helix	trans	-64.3	-36.7	172.7	-74.3	-172	175.4	-171.2	0	112.4	V877 K878 S884 Y885	V877-K881 WeakPolarHBondContact O-CG 3.22Å; V877-K881 PolarHBondContact O-N 2.91Å; K878-K881 PolarHBondContact O-N 3.46Å; K881-S884 PolarHBondContact O-OG 3.46Å; K881-S884 VanDerWaalsContact O-OG 3.09Å; K881-Y885 VanDerWaalsContact O-CB 3.27Å; K881-Y885 WeakPolarHBondContact O-CB 3.39Å; K881-Y885 PolarHBondContact O-N 3.24Å
882	Y	31.6	Very low	34	Very low	167 Å²	167	104.3 Å²	104.3	66%	0.655	53%	0.525	S	S	*	.	H	α-helix	trans	-64.4	-42.9	169.9	-102.6	-93.1	0	0	0	111.7	K878 S879 A880 Y885 I886	K878-Y882 PolarHBondContact O-N 3.42Å; S879-Y882 PolarHBondContact O-N 3.48Å; A880-Y882 VanDerWaalsContact C-N 3.35Å; Y882-Y885 PolarHBondContact O-N 2.67Å; Y882-I886 WeakPolarHBondContact O-CB 3.36Å; Y882-I886 WeakPolarHBondContact O-CD1 3.27Å; Y882-I886 VanDerWaalsContact O-CG1 3.23Å; Y882-I886 WeakPolarHBondContact O-CG1 3.47Å; Y882-I886 PolarHBondContact O-N 3.04Å
883	S	30.9	Very low	34.8	Very low	79 Å²	79	101.4 Å²	101.4	55%	0.552	51%	0.512	S	S	*	.	H	α-helix	trans	-65.3	-38.2	178	-167.3	0	0	0	0	112.7	S879 A880 S887	S879-S883 WeakPolarHBondContact O-CB 3.16Å; S879-S883 PolarHBondContact O-N 3.25Å; A880-S883 WeakPolarHBondContact O-CB 3.33Å; A880-S883 PolarHBondContact O-N 2.87Å; S883-S887 WeakPolarHBondContact O-CB 3.5Å; S883-S887 PolarHBondContact O-N 2.97Å
884	S	31.4	Very low	35.7	Very low	57 Å²	57	101.4 Å²	101.4	40%	0.399	51%	0.508	S	S	.	.	H	α-helix	trans	-69.4	-45.7	174.2	69	0	0	0	0	110.8	A880 K881 I886 S887 D888	A880-S884 PolarHBondContact O-N 3.38Å; K881-S884 PolarHBondContact O-OG 3.46Å; K881-S884 VanDerWaalsContact O-OG 3.09Å; S884-I886 VanDerWaalsContact C-N 3.3Å; S884-I886 PolarHBondContact O-N 2.78Å; S884-S887 CarbonylContact O-C 3.5Å; S884-S887 WeakPolarHBondContact O-CA 3.23Å; S884-S887 WeakPolarHBondContact O-CB 3.32Å; S884-S887 PolarHBondContact O-N 2.77Å; S884-D888 WeakPolarHBondContact O-CB 3.41Å; S884-D888 VanDerWaalsContact O-CG 3.28Å; S884-D888 PolarHBondContact O-N 3.26Å
885	Y	29.8	Very low	37	Very low	171 Å²	171	105.3 Å²	105.3	67%	0.671	52%	0.517	S	S	*	.	H	α-helix	trans	-61.4	-36.9	178	-166.2	-93.7	0	0	0	112.8	K881 Y882 S889	K881-Y885 VanDerWaalsContact O-CB 3.27Å; K881-Y885 WeakPolarHBondContact O-CB 3.39Å; K881-Y885 PolarHBondContact O-N 3.24Å; Y882-Y885 PolarHBondContact O-N 2.67Å; Y885-S889 WeakPolarHBondContact O-CB 3.47Å; Y885-S889 PolarHBondContact O-N 2.73Å; Y885-S889 PolarHBondContact O-OG 3.1Å
886	I	30.2	Very low	37.7	Very low	100 Å²	100	99.6 Å²	99.6	51%	0.513	50%	0.501	S	S	.	.	H	α-helix	trans	-67.5	-43.7	171.6	-70	165.7	0	0	0	110.9	Y882 S884 T890	Y882-I886 WeakPolarHBondContact O-CB 3.36Å; Y882-I886 WeakPolarHBondContact O-CD1 3.27Å; Y882-I886 VanDerWaalsContact O-CG1 3.23Å; Y882-I886 WeakPolarHBondContact O-CG1 3.47Å; Y882-I886 PolarHBondContact O-N 3.04Å; S884-I886 VanDerWaalsContact C-N 3.3Å; S884-I886 PolarHBondContact O-N 2.78Å; I886-T890 VanDerWaalsContact O-CB 3.22Å; I886-T890 WeakPolarHBondContact O-CB 3.37Å; I886-T890 PolarHBondContact O-N 2.88Å; I886-T890 PolarHBondContact O-OG1 3.41Å
887	S	37.1	Very low	38.4	Very low	58 Å²	58	94.4 Å²	94.4	41%	0.406	48%	0.479	S	S	.	.	H	α-helix	trans	-59.3	-47.6	175.2	169.6	0	0	0	0	111.8	S883 S884 T890 Q891	S883-S887 WeakPolarHBondContact O-CB 3.5Å; S883-S887 PolarHBondContact O-N 2.97Å; S884-S887 CarbonylContact O-C 3.5Å; S884-S887 WeakPolarHBondContact O-CA 3.23Å; S884-S887 WeakPolarHBondContact O-CB 3.32Å; S884-S887 PolarHBondContact O-N 2.77Å; S887-T890 CarbonylContact O-C 3.58Å; S887-T890 PolarHBondContact O-N 3Å; S887-Q891 PolarHBondContact O-N 3.47Å
888	D	39	Very low	39.6	Very low	92 Å²	92	95.3 Å²	95.3	49%	0.492	48%	0.481	S	S	.	.	H	α-helix	trans	-69.3	-42.9	-178.2	-64.7	-31	0	0	0	111.1	S884 T890 Q891 Q892	S884-D888 WeakPolarHBondContact O-CB 3.41Å; S884-D888 VanDerWaalsContact O-CG 3.28Å; S884-D888 PolarHBondContact O-N 3.26Å; D888-T890 VanDerWaalsContact C-N 3.28Å; D888-T890 PolarHBondContact O-N 3.4Å; D888-Q891 PolarHBondContact O-N 3.46Å; D888-Q892 VanDerWaalsContact O-CB 3.28Å; D888-Q892 WeakPolarHBondContact O-CB 3.45Å; D888-Q892 PolarHBondContact O-N 3.38Å
889	S	36.9	Very low	40.8	Very low	49 Å²	49	95.6 Å²	95.6	34%	0.343	49%	0.493	S	S	.	.	H	α-helix	trans	-59.8	-39.2	171.1	-60.9	0	0	0	0	111.8	Y885 Q892 F893	Y885-S889 WeakPolarHBondContact O-CB 3.47Å; Y885-S889 PolarHBondContact O-N 2.73Å; Y885-S889 PolarHBondContact O-OG 3.1Å; S889-Q892 PolarHBondContact O-N 3.31Å; S889-F893 VanDerWaalsContact O-CB 3.23Å; S889-F893 WeakPolarHBondContact O-CB 3.46Å; S889-F893 PolarHBondContact O-N 2.91Å
890	T	38.4	Very low	41.3	Very low	82 Å²	82	97 Å²	97	50%	0.503	49%	0.494	S	S	.	.	H	α-helix	trans	-71.9	-37.7	177.9	-56.5	0	0	0	0	111.5	I886 S887 D888 K894	I886-T890 VanDerWaalsContact O-CB 3.22Å; I886-T890 WeakPolarHBondContact O-CB 3.37Å; I886-T890 PolarHBondContact O-N 2.88Å; I886-T890 PolarHBondContact O-OG1 3.41Å; S887-T890 CarbonylContact O-C 3.58Å; S887-T890 PolarHBondContact O-N 3Å; D888-T890 VanDerWaalsContact C-N 3.28Å; D888-T890 PolarHBondContact O-N 3.4Å; T890-K894 WeakPolarHBondContact O-CB 3.34Å; T890-K894 PolarHBondContact O-N 2.95Å
891	Q	49.9	Very low	41.8	Very low	92 Å²	92	97.2 Å²	97.2	43%	0.43	50%	0.502	S	S	.	.	H	α-helix	trans	-66.8	-41.2	171.5	-79.5	-151	34.9	0	0	111.9	S887 D888 K894 R895	S887-Q891 PolarHBondContact O-N 3.47Å; D888-Q891 PolarHBondContact O-N 3.46Å; Q891-K894 PolarHBondContact O-N 2.97Å; Q891-R895 WeakPolarHBondContact O-CB 3.49Å; Q891-R895 VanDerWaalsContact O-CG 3.24Å; Q891-R895 WeakPolarHBondContact O-CG 3.47Å; Q891-R895 PolarHBondContact O-N 3.13Å
892	Q	50.4	Low	42.5	Very low	133 Å²	133	92.6 Å²	92.6	62%	0.621	48%	0.484	S	S	*	.	H	α-helix	trans	-66.2	-46	178.2	-168	168.7	5.9	0	0	110.1	D888 S889 K894 R895 T896	D888-Q892 VanDerWaalsContact O-CB 3.28Å; D888-Q892 WeakPolarHBondContact O-CB 3.45Å; D888-Q892 PolarHBondContact O-N 3.38Å; S889-Q892 PolarHBondContact O-N 3.31Å; Q892-K894 PolarHBondContact O-N 3.42Å; Q892-R895 WeakPolarHBondContact O-CB 3.09Å; Q892-R895 PolarHBondContact O-N 3.5Å; Q892-T896 PolarHBondContact O-N 2.81Å; Q892-T896 PolarHBondContact O-OG1 3.18Å
893	F	48.7	Very low	43	Very low	101 Å²	101	85.7 Å²	85.7	44%	0.443	46%	0.464	S	S	.	.	H	α-helix	trans	-59.5	-42.1	171.9	-176.3	-112.7	0	0	0	112.5	I421 S889 T896 L897	I421-F893 HydrophobicContact CD1-CZ 4.01Å; S889-F893 VanDerWaalsContact O-CB 3.23Å; S889-F893 WeakPolarHBondContact O-CB 3.46Å; S889-F893 PolarHBondContact O-N 2.91Å; F893-T896 PolarHBondContact O-N 2.69Å; F893-L897 HydrophobicContact CD1-CD1 3.87Å; F893-L897 HydrophobicContact CE1-CD1 3.43Å; F893-L897 VanDerWaalsContact CE1-CD1 3.43Å; F893-L897 HydrophobicContact CE1-CG 4.22Å; F893-L897 HydrophobicContact CE2-CD1 4.41Å; F893-L897 HydrophobicContact CE2-CG 4.36Å; F893-L897 HydrophobicContact CZ-CD1 3.74Å; F893-L897 HydrophobicContact CZ-CD2 4.41Å; F893-L897 HydrophobicContact CZ-CG 4.13Å; F893-L897 WeakPolarHBondContact O-CB 3.34Å; F893-L897 WeakPolarHBondContact O-CG 3.34Å; F893-L897 PolarHBondContact O-N 3.05Å
894	K	48.6	Very low	43.3	Very low	108 Å²	108	87 Å²	87	47%	0.47	47%	0.471	S	S	.	.	H	α-helix	trans	-63.7	-38.5	174.2	-177	172.5	-177.2	178.1	0	112.5	T890 Q891 Q892 N898 L906	T890-K894 WeakPolarHBondContact O-CB 3.34Å; T890-K894 PolarHBondContact O-N 2.95Å; Q891-K894 PolarHBondContact O-N 2.97Å; Q892-K894 PolarHBondContact O-N 3.42Å; K894-N898 VanDerWaalsContact O-CG 3.22Å; K894-N898 PolarHBondContact O-N 3.29Å; K894-N898 VanDerWaalsContact O-N 3.11Å; K894-N898 PolarHBondContact O-OD1 3.31Å; K894-L906 HydrophobicContact CB-CD2 4.49Å; K894-L906 HydrophobicContact CD-CD1 4.49Å; K894-L906 HydrophobicContact CG-CD1 3.81Å; K894-L906 HydrophobicContact CG-CD2 4.23Å
895	R	58.9	Low	43.6	Very low	159 Å²	159	88.3 Å²	88.3	60%	0.6	47%	0.473	S	S	*	.	H	α-helix	trans	-64.3	-52.2	172.3	-72.1	170.6	-159.3	-176.3	8.6	109.9	Q891 Q892 L897 N898 T899	Q891-R895 WeakPolarHBondContact O-CB 3.49Å; Q891-R895 VanDerWaalsContact O-CG 3.24Å; Q891-R895 WeakPolarHBondContact O-CG 3.47Å; Q891-R895 PolarHBondContact O-N 3.13Å; Q892-R895 WeakPolarHBondContact O-CB 3.09Å; Q892-R895 PolarHBondContact O-N 3.5Å; R895-L897 PolarHBondContact O-N 2.86Å; R895-N898 CarbonylContact O-C 3.48Å; R895-N898 WeakPolarHBondContact O-CA 3.2Å; R895-N898 WeakPolarHBondContact O-CB 3.48Å; R895-N898 PolarHBondContact O-N 2.87Å; R895-T899 PolarHBondContact O-N 3.49Å; R895-T899 PolarHBondContact O-OG1 2.9Å
896	T	46.8	Very low	44	Very low	65 Å²	65	81.5 Å²	81.5	40%	0.399	45%	0.449	S	S	.	.	H	α-helix	trans	-58.8	-42.5	179	-48.2	0	0	0	0	112.3	Q892 F893 N898 T899 M900	Q892-T896 PolarHBondContact O-N 2.81Å; Q892-T896 PolarHBondContact O-OG1 3.18Å; F893-T896 PolarHBondContact O-N 2.69Å; T896-N898 VanDerWaalsContact C-N 3.33Å; T896-N898 PolarHBondContact O-N 3.38Å; T896-T899 PolarHBondContact O-N 3.01Å; T896-M900 HydrophobicContact CG2-CE 3.93Å; T896-M900 HydrophobicContact CG2-CG 4.44Å; T896-M900 HydrophobicContact CG2-SD 4.17Å; T896-M900 WeakPolarHBondContact O-CB 3.46Å; T896-M900 VanDerWaalsContact O-CG 3.28Å; T896-M900 WeakPolarHBondContact O-CG 3.38Å; T896-M900 PolarHBondContact O-N 2.88Å
897	L	44.3	Very low	44.3	Very low	13 Å²	13	82.3 Å²	82.3	7%	0.068	45%	0.454	C	S	.	.	H	α-helix	trans	-60.6	-40.1	173.3	-78.8	175.1	0	0	0	112.4	F893 R895 M900 G901 L902 G903 L906	F893-L897 HydrophobicContact CD1-CD1 3.87Å; F893-L897 HydrophobicContact CE1-CD1 3.43Å; F893-L897 VanDerWaalsContact CE1-CD1 3.43Å; F893-L897 HydrophobicContact CE1-CG 4.22Å; F893-L897 HydrophobicContact CE2-CD1 4.41Å; F893-L897 HydrophobicContact CE2-CG 4.36Å; F893-L897 HydrophobicContact CZ-CD1 3.74Å; F893-L897 HydrophobicContact CZ-CD2 4.41Å; F893-L897 HydrophobicContact CZ-CG 4.13Å; F893-L897 WeakPolarHBondContact O-CB 3.34Å; F893-L897 WeakPolarHBondContact O-CG 3.34Å; F893-L897 PolarHBondContact O-N 3.05Å; R895-L897 PolarHBondContact O-N 2.86Å; L897-M900 HydrophobicContact CD2-CE 4.04Å; L897-M900 PolarHBondContact O-N 3.31Å; L897-G901 PolarHBondContact O-N 3.4Å; L897-L902 HydrophobicContact CD2-CB 3.77Å; L897-L902 HydrophobicContact CD2-CD1 4.38Å; L897-L902 CarbonylContact O-C 3.55Å; L897-L902 WeakPolarHBondContact O-CA 3.41Å; L897-L902 PolarHBondContact O-N 3.38Å; L897-G903 PolarHBondContact O-N 3.03Å; L897-G903 VanDerWaalsContact O-N 3.16Å; L897-L906 HydrophobicContact CD1-CD2 3.68Å; L897-L906 HydrophobicContact CD1-CG 4.09Å
898	N	55.7	Low	44	Very low	90 Å²	90	87 Å²	87	48%	0.481	47%	0.474	S	S	.	.	H	α-helix	trans	-66.9	-42	173.9	-70.7	-7.5	0	0	0	111.8	K894 R895 T896 M900 G901 G903	K894-N898 VanDerWaalsContact O-CG 3.22Å; K894-N898 PolarHBondContact O-N 3.29Å; K894-N898 VanDerWaalsContact O-N 3.11Å; K894-N898 PolarHBondContact O-OD1 3.31Å; R895-N898 CarbonylContact O-C 3.48Å; R895-N898 WeakPolarHBondContact O-CA 3.2Å; R895-N898 WeakPolarHBondContact O-CB 3.48Å; R895-N898 PolarHBondContact O-N 2.87Å; T896-N898 VanDerWaalsContact C-N 3.33Å; T896-N898 PolarHBondContact O-N 3.38Å; N898-M900 VanDerWaalsContact C-N 3.29Å; N898-M900 PolarHBondContact O-N 2.85Å; N898-G901 PolarHBondContact O-N 3.22Å; N898-G901 VanDerWaalsContact O-N 3.13Å; N898-G903 WeakPolarHBondContact OD1-CA 3.4Å
899	T	59.5	Low	43.6	Very low	124 Å²	124	86.3 Å²	86.3	76%	0.761	48%	0.476	S	S	*	.	H	α-helix	trans	-62.8	-34.6	176.5	-45.1	0	0	0	0	112.3	R895 T896 G901	R895-T899 PolarHBondContact O-N 3.49Å; R895-T899 PolarHBondContact O-OG1 2.9Å; T896-T899 PolarHBondContact O-N 3.01Å; T899-G901 VanDerWaalsContact C-N 3.27Å; T899-G901 PolarHBondContact O-N 3.15Å
900	M	41.8	Very low	43.3	Very low	93 Å²	93	87 Å²	87	46%	0.458	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	4.9	176.6	-65.5	-175.7	-56.4	0	0	113.7	T896 L897 N898 L902	T896-M900 HydrophobicContact CG2-CE 3.93Å; T896-M900 HydrophobicContact CG2-CG 4.44Å; T896-M900 HydrophobicContact CG2-SD 4.17Å; T896-M900 WeakPolarHBondContact O-CB 3.46Å; T896-M900 VanDerWaalsContact O-CG 3.28Å; T896-M900 WeakPolarHBondContact O-CG 3.38Å; T896-M900 PolarHBondContact O-N 2.88Å; L897-M900 HydrophobicContact CD2-CE 4.04Å; L897-M900 PolarHBondContact O-N 3.31Å; N898-M900 VanDerWaalsContact C-N 3.29Å; N898-M900 PolarHBondContact O-N 2.85Å; M900-L902 HydrophobicContact CB-CD1 4.23Å; M900-L902 HydrophobicContact CB-CG 4.28Å; M900-L902 HydrophobicContact CE-CD1 4.21Å; M900-L902 PolarHBondContact O-N 2.83Å; M900-L902 VanDerWaalsContact O-N 3.12Å
901	G	37.1	Very low	42.9	Very low	62 Å²	62	91.8 Å²	91.8	64%	0.639	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.3	-0.6	-174.7	0	0	0	0	0	114.9	L897 N898 T899 G903	L897-G901 PolarHBondContact O-N 3.4Å; N898-G901 PolarHBondContact O-N 3.22Å; N898-G901 VanDerWaalsContact O-N 3.13Å; T899-G901 VanDerWaalsContact C-N 3.27Å; T899-G901 PolarHBondContact O-N 3.15Å; G901-G903 VanDerWaalsContact C-N 3.26Å; G901-G903 PolarHBondContact O-N 2.87Å
902	L	45.3	Very low	42	Very low	50 Å²	50	92.7 Å²	92.7	26%	0.262	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-84.9	11.5	-177.4	-67.4	175.9	0	0	0	113.7	L897 M900 C904 L905	L897-L902 HydrophobicContact CD2-CB 3.77Å; L897-L902 HydrophobicContact CD2-CD1 4.38Å; L897-L902 CarbonylContact O-C 3.55Å; L897-L902 WeakPolarHBondContact O-CA 3.41Å; L897-L902 PolarHBondContact O-N 3.38Å; M900-L902 HydrophobicContact CB-CD1 4.23Å; M900-L902 HydrophobicContact CB-CG 4.28Å; M900-L902 HydrophobicContact CE-CD1 4.21Å; M900-L902 PolarHBondContact O-N 2.83Å; M900-L902 VanDerWaalsContact O-N 3.12Å; L902-C904 PolarHBondContact O-N 2.95Å; L902-L905 HydrophobicContact CB-CD1 4.23Å; L902-L905 HydrophobicContact CD2-CD1 4.14Å; L902-L905 WeakPolarHBondContact O-CB 2.99Å; L902-L905 PolarHBondContact O-N 2.92Å
903	G	42.1	Very low	40.9	Very low	22 Å²	22	96.2 Å²	96.2	23%	0.227	51%	0.513	C	S	.	.	G	3₁₀ helix	trans	-54.4	-24.7	178.5	0	0	0	0	0	114.2	L897 N898 G901 L905 L906	L897-G903 PolarHBondContact O-N 3.03Å; L897-G903 VanDerWaalsContact O-N 3.16Å; N898-G903 WeakPolarHBondContact OD1-CA 3.4Å; G901-G903 VanDerWaalsContact C-N 3.26Å; G901-G903 PolarHBondContact O-N 2.87Å; G903-L905 PolarHBondContact O-N 3.16Å; G903-L906 WeakPolarHBondContact O-CB 3.47Å; G903-L906 PolarHBondContact O-N 2.94Å
904	C	37.8	Very low	39.8	Very low	105 Å²	105	95.5 Å²	95.5	71%	0.709	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-59.9	-30.4	173.8	-60.8	0	0	0	0	113.5	L902 L906 N907	L902-C904 PolarHBondContact O-N 2.95Å; C904-L906 PolarHBondContact O-N 3.29Å; C904-N907 PolarHBondContact O-N 3.49Å
905	L	36.9	Very low	38.7	Very low	85 Å²	85	98.4 Å²	98.4	45%	0.445	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-68.6	-21.2	179.5	-63.3	-179.5	0	0	0	113.1	L902 G903 N907 L908	L902-L905 HydrophobicContact CB-CD1 4.23Å; L902-L905 HydrophobicContact CD2-CD1 4.14Å; L902-L905 WeakPolarHBondContact O-CB 2.99Å; L902-L905 PolarHBondContact O-N 2.92Å; G903-L905 PolarHBondContact O-N 3.16Å; L905-N907 PolarHBondContact O-N 3.24Å; L905-L908 PolarHBondContact O-N 3.42Å
906	L	39.5	Very low	37.2	Very low	29 Å²	29	96 Å²	96	15%	0.152	54%	0.541	C	S	.	.	G	3₁₀ helix	trans	-61.1	-28.6	179.3	-68.3	162.9	0	0	0	112.5	K894 L897 G903 C904 L908 S909 T910	K894-L906 HydrophobicContact CB-CD2 4.49Å; K894-L906 HydrophobicContact CD-CD1 4.49Å; K894-L906 HydrophobicContact CG-CD1 3.81Å; K894-L906 HydrophobicContact CG-CD2 4.23Å; L897-L906 HydrophobicContact CD1-CD2 3.68Å; L897-L906 HydrophobicContact CD1-CG 4.09Å; G903-L906 WeakPolarHBondContact O-CB 3.47Å; G903-L906 PolarHBondContact O-N 2.94Å; C904-L906 PolarHBondContact O-N 3.29Å; L906-L908 PolarHBondContact O-N 2.97Å; L906-S909 PolarHBondContact O-N 2.73Å; L906-T910 WeakPolarHBondContact O-CG2 3.25Å; L906-T910 PolarHBondContact O-N 2.86Å; L906-T910 PolarHBondContact O-OG1 2.91Å
907	N	35.1	Very low	36.3	Very low	117 Å²	117	99 Å²	99	63%	0.626	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-68.6	-11.1	-179	-77.2	-26.6	0	0	0	114.7	C904 L905	C904-N907 PolarHBondContact O-N 3.49Å; L905-N907 PolarHBondContact O-N 3.24Å
908	L	32.1	Very low	35.5	Very low	156 Å²	156	106.6 Å²	106.6	82%	0.817	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-94	-13.7	172.7	-77.9	153.2	0	0	0	113.1	L905 L906	L905-L908 PolarHBondContact O-N 3.42Å; L906-L908 PolarHBondContact O-N 2.97Å
909	S	30.9	Very low	34	Very low	77 Å²	77	110.5 Å²	110.5	54%	0.538	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.8	-16.8	-179.7	-172.4	0	0	0	0	113.9	L906	L906-S909 PolarHBondContact O-N 2.73Å
910	T	30.5	Very low	32.4	Very low	64 Å²	64	109.9 Å²	109.9	39%	0.393	61%	0.613	S	S	.	*	S	Bend	trans	-91.2	-21.7	-175	48.8	0	0	0	0	114.4	L906 T912 Y913 S914	L906-T910 WeakPolarHBondContact O-CG2 3.25Å; L906-T910 PolarHBondContact O-N 2.86Å; L906-T910 PolarHBondContact O-OG1 2.91Å; T910-T912 VanDerWaalsContact C-N 3.29Å; T910-T912 PolarHBondContact O-N 3.4Å; T910-Y913 PolarHBondContact O-N 2.82Å; T910-S914 PolarHBondContact O-OG 3.48Å
911	K	29.5	Very low	31.7	Very low	183 Å²	183	115.2 Å²	115.2	80%	0.796	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-1.3	-178.1	-77.9	-168.1	171.2	-172.5	0	115.5
912	T	29.9	Very low	31.1	Very low	110 Å²	110	120.1 Å²	120.1	68%	0.675	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	4.3	173.3	50.7	0	0	0	0	113.4	T910	T910-T912 VanDerWaalsContact C-N 3.29Å; T910-T912 PolarHBondContact O-N 3.4Å
913	Y	27	Very low	30.1	Very low	207 Å²	207	125 Å²	125	81%	0.812	66%	0.664	S	S	*	*	S	Bend	trans	-134.4	38.1	-177.7	-78	-75.5	0	0	0	112.1	T910	T910-Y913 PolarHBondContact O-N 2.82Å
914	S	26.4	Very low	29.4	Very low	86 Å²	86	132.1 Å²	132.1	60%	0.601	69%	0.692	S	S	*	*			trans	-136.3	42.6	-174	42.8	0	0	0	0	114.5	T910	T910-S914 PolarHBondContact O-OG 3.48Å
915	E	26.5	Very low	28.8	Very low	170 Å²	170	134 Å²	134	79%	0.794	69%	0.694	S	S	*	*			trans	-119.1	128	159.3	-73	-153	146.5	0	0	111.3	N917	E915-N917 PolarHBondContact O-N 3.13Å
916	P	26.9	Very low	28.3	Very low	109 Å²	109	135 Å²	135	71%	0.708	71%	0.706	S	S	*	*			trans	-89.1	9.1	-174.4	35.2	-36	0	0	0	115	L918	P916-L918 PolarHBondContact O-N 3.48Å
917	N	28.2	Very low	27.7	Very low	126 Å²	126	142 Å²	142	67%	0.674	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	7	-155.3	-73.2	-24.5	0	0	0	117.5	E915	E915-N917 PolarHBondContact O-N 3.13Å
918	L	26.8	Very low	27.1	Very low	174 Å²	174	147.4 Å²	147.4	91%	0.911	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107	11.4	-178.3	-93.4	151.7	0	0	0	115.2	P916 C920	P916-L918 PolarHBondContact O-N 3.48Å; L918-C920 VanDerWaalsContact C-N 3.31Å; L918-C920 PolarHBondContact O-N 2.85Å
919	L	24.9	Very low	26.9	Very low	172 Å²	172	146.7 Å²	146.7	90%	0.901	75%	0.751	S	S	*	*	S	Bend	trans	-90.1	32	178	-109.7	167.8	0	0	0	114.1
920	C	26.1	Very low	26.5	Very low	110 Å²	110	152.8 Å²	152.8	74%	0.743	77%	0.768	S	S	*	*			trans	-144	37.2	-175.2	-146.5	0	0	0	0	116.7	L918	L918-C920 VanDerWaalsContact C-N 3.31Å; L918-C920 PolarHBondContact O-N 2.85Å
921	F	26	Very low	26.3	Very low	205 Å²	205	156.8 Å²	156.8	90%	0.899	79%	0.786	S	S	*	*			trans	-134.8	73.6	166.7	-93.9	-74.9	0	0	0	112.8
922	K	24.2	Very low	26	Very low	165 Å²	165	156.8 Å²	156.8	72%	0.717	79%	0.786	S	S	*	*	S	Bend	trans	-148	127.4	165.5	-129.2	170.1	-172.8	168	0	108.1
923	N	24.8	Very low	25.9	Very low	152 Å²	152	160.1 Å²	160.1	81%	0.813	79%	0.788	S	S	*	*	S	Bend	trans	77.5	143.2	-162.8	-45.6	-38.6	0	0	0	112.9
924	Q	26.6	Very low	25.7	Very low	173 Å²	173	155.1 Å²	155.1	81%	0.808	78%	0.783	S	S	*	*			trans	64.4	138.3	-157.4	-51.3	-173.5	22.2	0	0	112.4
925	L	26.3	Very low	25.7	Very low	145 Å²	145	155.3 Å²	155.3	76%	0.759	78%	0.784	S	S	*	*			cis	-144.4	140.9	-6.2	-112.9	150.9	0	0	0	108.2
926	P	25.8	Very low	25.7	Very low	105 Å²	105	153.9 Å²	153.9	68%	0.682	78%	0.781	S	S	*	*			trans	-76.1	173.3	165.6	32.8	-37.1	0	0	0	112.1
927	Q	27.5	Very low	25.5	Very low	176 Å²	176	157.3 Å²	157.3	82%	0.822	79%	0.788	S	S	*	*			trans	95.4	119.6	172.3	-52.9	-165.5	52.2	0	0	117.8
928	R	23.2	Very low	25.4	Very low	231 Å²	231	159.8 Å²	159.8	87%	0.872	80%	0.795	S	S	*	*			trans	15.3	116	141	-62.6	170.8	169.4	178	-6.1	117.9
929	T	27.1	Very low	25.3	Very low	140 Å²	140	159 Å²	159	86%	0.859	79%	0.791	S	S	*	*				-166.3	161.7	113.7	12.5	0	0	0	0	111.7
930	K	23.3	Very low	25.4	Very low	206 Å²	206	154.8 Å²	154.8	90%	0.896	78%	0.781	S	S	*	*			trans	-84.6	125.2	171	-62.9	173.3	-179.6	175.4	0	108.9
931	L	26	Very low	25.3	Very low	147 Å²	147	157.3 Å²	157.3	77%	0.77	79%	0.785	S	S	*	*			trans	-128.5	124.1	159.7	-79.1	172.4	0	0	0	109.2
932	K	23.6	Very low	25.3	Very low	184 Å²	184	154 Å²	154	80%	0.8	78%	0.777	S	S	*	*			trans	-86	133.7	168.3	-67.9	-176.8	173.7	-169.7	0	107.9
933	Y	26.1	Very low	25.4	Very low	180 Å²	180	153.8 Å²	153.8	71%	0.706	78%	0.779	S	S	*	*			trans	-110.8	50.5	168.4	-101.4	-80	0	0	0	113	S935 L936	Y933-S935 PolarHBondContact O-N 3.45Å; Y933-S935 VanDerWaalsContact O-N 3.1Å; Y933-L936 HydrophobicContact CD1-CD1 4.46Å; Y933-L936 HydrophobicContact CD1-CG 4.41Å
934	S	23.9	Very low	25.5	Very low	101 Å²	101	154 Å²	154	71%	0.706	78%	0.779	S	S	*	*			trans	-80.7	53.2	161.9	57.6	0	0	0	0	110.5
935	S	25.5	Very low	25.5	Very low	90 Å²	90	150.4 Å²	150.4	63%	0.629	77%	0.773	S	S	*	*			trans	-159.8	39.1	-171.6	-62.1	0	0	0	0	115	Y933	Y933-S935 PolarHBondContact O-N 3.45Å; Y933-S935 VanDerWaalsContact O-N 3.1Å
936	L	26	Very low	25.7	Very low	140 Å²	140	148.2 Å²	148.2	73%	0.733	77%	0.769	S	S	*	*			trans	-135.3	50.7	167.4	-79.2	179.2	0	0	0	111.5	Y933	Y933-L936 HydrophobicContact CD1-CD1 4.46Å; Y933-L936 HydrophobicContact CD1-CG 4.41Å
937	Q	24.5	Very low	25.6	Very low	181 Å²	181	150.1 Å²	150.1	85%	0.846	77%	0.772	S	S	*	*	S	Bend	trans	-101.3	3.9	179.9	-154.3	170	6.5	0	0	113.5
938	H	25.5	Very low	25.6	Very low	178 Å²	178	150.9 Å²	150.9	82%	0.824	77%	0.773	S	S	*	*			trans	-141.5	104.2	173.2	-77.7	-82	0	0	0	110.4
939	L	24.9	Very low	25.7	Very low	158 Å²	158	144.2 Å²	144.2	83%	0.827	77%	0.767	S	S	*	*	S	Bend	trans	-169.5	131	153.8	-105.7	160.5	0	0	0	108.7	I941	L939-I941 PolarHBondContact O-N 2.92Å
940	A	26.3	Very low	25.5	Very low	83 Å²	83	145.8 Å²	145.8	69%	0.686	77%	0.769	S	S	*	*			trans	60.2	34.1	169.1	0	0	0	0	0	119.4	D942	A940-D942 VanDerWaalsContact C-N 3.28Å; A940-D942 PolarHBondContact O-N 3.34Å
941	I	25.2	Very low	25.8	Very low	163 Å²	163	141.3 Å²	141.3	84%	0.836	76%	0.762	S	S	*	*	S	Bend	trans	-78.8	85.9	145.9	-58.4	177.3	0	0	0	106.9	L939	L939-I941 PolarHBondContact O-N 2.92Å
942	D	25.7	Very low	25.8	Very low	135 Å²	135	140.4 Å²	140.4	72%	0.722	76%	0.762	S	S	*	*	S	Bend	trans	-166.2	-32.2	164.4	-102.4	-33.4	0	0	0	115.1	A940 L944 S945	A940-D942 VanDerWaalsContact C-N 3.28Å; A940-D942 PolarHBondContact O-N 3.34Å; D942-L944 PolarHBondContact O-N 3.42Å; D942-S945 PolarHBondContact O-OG 2.92Å
943	E	26.6	Very low	25.8	Very low	162 Å²	162	139.8 Å²	139.8	76%	0.757	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-72.9	-20.2	-168.7	-66.4	-160.4	128.7	0	0	116	S945	E943-S945 VanDerWaalsContact C-N 3.27Å; E943-S945 PolarHBondContact O-N 2.93Å
944	L	26.3	Very low	25.7	Very low	157 Å²	157	139.5 Å²	139.5	82%	0.822	76%	0.762	S	S	*	*	G	3₁₀ helix	trans	-82.3	2.6	-177.2	-76.5	170.7	0	0	0	114.9	D942 S946 I947	D942-L944 PolarHBondContact O-N 3.42Å; L944-S946 VanDerWaalsContact C-N 3.31Å; L944-I947 HydrophobicContact CD2-CD1 4.27Å
945	S	27.2	Very low	25.7	Very low	97 Å²	97	141.5 Å²	141.5	68%	0.678	76%	0.764	S	S	*	*	G	3₁₀ helix	trans	-76.9	-15.7	172.4	58.6	0	0	0	0	113.8	D942 E943	D942-S945 PolarHBondContact O-OG 2.92Å; E943-S945 VanDerWaalsContact C-N 3.27Å; E943-S945 PolarHBondContact O-N 2.93Å
946	S	28.7	Very low	25.7	Very low	98 Å²	98	145.4 Å²	145.4	69%	0.685	78%	0.776	S	S	*	*			trans	-103.3	-11.4	-164.3	-65.2	0	0	0	0	115.9	L944 K948	L944-S946 VanDerWaalsContact C-N 3.31Å; S946-K948 VanDerWaalsContact C-N 3.32Å; S946-K948 PolarHBondContact O-N 2.9Å
947	I	25.5	Very low	25.6	Very low	145 Å²	145	143 Å²	143	74%	0.744	76%	0.764	S	S	*	*			trans	-85.3	71.3	-175.5	-49.5	-176.5	0	0	0	111.3	L944	L944-I947 HydrophobicContact CD2-CD1 4.27Å
948	K	26.6	Very low	25.8	Very low	193 Å²	193	143.5 Å²	143.5	84%	0.839	76%	0.764	S	S	*	*			trans	-92.7	110.2	164.8	-82.2	-178	177.8	172.8	0	110.7	S946	S946-K948 VanDerWaalsContact C-N 3.32Å; S946-K948 PolarHBondContact O-N 2.9Å
949	A	25.4	Very low	25.9	Very low	90 Å²	90	142.1 Å²	142.1	74%	0.744	76%	0.758	S	S	*	*			trans	58.3	123.7	160.4	0	0	0	0	0	119.5
950	L	23.7	Very low	26	Very low	173 Å²	173	142.5 Å²	142.5	91%	0.906	75%	0.753	S	S	*	*				-153.8	150.5	119.1	-130.6	69.5	0	0	0	110.6
951	P	28.9	Very low	26.1	Very low	113 Å²	113	146 Å²	146	73%	0.734	76%	0.759	S	S	*	*			trans	-126.3	147.4	-165.6	40	-25.5	0	0	0	116.9
952	T	25.6	Very low	26.2	Very low	127 Å²	127	144.7 Å²	144.7	78%	0.779	75%	0.753	S	S	*	*			trans	-167.2	134.6	175.5	36	0	0	0	0	109.3
953	F	24.2	Very low	26.3	Very low	171 Å²	171	144.8 Å²	144.8	75%	0.75	75%	0.754	S	S	*	*			cis	-135.5	141.3	-11.4	-99.5	-101.5	0	0	0	105.9
954	K	24.1	Very low	26.2	Very low	175 Å²	175	142.3 Å²	142.3	76%	0.761	75%	0.75	S	S	*	*				44.3	129.7	93.7	-74	-177.6	178	-178.5	0	114.6
955	L	23.2	Very low	26.1	Very low	143 Å²	143	140.4 Å²	140.4	75%	0.749	75%	0.747	S	S	*	*			cis	-146.1	146.3	-0	-53	85.1	0	0	0	111
956	I	24.9	Very low	26	Very low	172 Å²	172	140.9 Å²	140.9	88%	0.882	75%	0.745	S	S	*	*	S	Bend	trans	-140.7	147.4	130.5	-64.7	-168.1	0	0	0	106.4	K958	I956-K958 PolarHBondContact O-N 3.49Å; I956-K958 VanDerWaalsContact O-N 3.15Å
957	N	25.3	Very low	25.8	Very low	90 Å²	90	145.6 Å²	145.6	48%	0.481	75%	0.754	S	S	.	*			trans	-67.5	107.9	-161.8	-74.5	-23.8	0	0	0	115.6	E959 K960	N957-E959 PolarHBondContact O-N 3.47Å; N957-E959 VanDerWaalsContact O-N 3.1Å; N957-K960 HydrophobicContact CB-CB 4.43Å; N957-K960 HydrophobicContact CB-CG 4.36Å; N957-K960 PolarHBondContact O-N 3.45Å
958	K	27.2	Very low	25.7	Very low	191 Å²	191	146 Å²	146	83%	0.83	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-9.5	165.7	-116.4	-178.3	179.5	-177.5	0	114.3	I956	I956-K958 PolarHBondContact O-N 3.49Å; I956-K958 VanDerWaalsContact O-N 3.15Å
959	E	27.9	Very low	25.6	Very low	149 Å²	149	141.3 Å²	141.3	70%	0.696	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-18.5	178.9	-64.2	179.1	148.8	0	0	113.6	N957 L961	N957-E959 PolarHBondContact O-N 3.47Å; N957-E959 VanDerWaalsContact O-N 3.1Å; E959-L961 VanDerWaalsContact C-N 3.35Å
960	K	28.5	Very low	25.5	Very low	166 Å²	166	146.4 Å²	146.4	72%	0.722	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	-16.4	177.4	-85	-164.4	171.7	-171.8	0	114.1	N957	N957-K960 HydrophobicContact CB-CB 4.43Å; N957-K960 HydrophobicContact CB-CG 4.36Å; N957-K960 PolarHBondContact O-N 3.45Å
961	L	28.1	Very low	25.6	Very low	155 Å²	155	144.8 Å²	144.8	81%	0.812	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-9.6	174.9	-96	160.3	0	0	0	114.3	E959	E959-L961 VanDerWaalsContact C-N 3.35Å
962	N	26.8	Very low	25.4	Very low	136 Å²	136	147.5 Å²	147.5	73%	0.727	75%	0.752	S	S	*	*	S	Bend	trans	-96.9	-0.1	178.5	-74.4	-11.4	0	0	0	113.8
963	N	27.1	Very low	25.2	Very low	137 Å²	137	148.1 Å²	148.1	73%	0.733	75%	0.75	S	S	*	*			trans	-126.6	23.1	-170.8	-86.9	-33.7	0	0	0	114.5
964	V	25.5	Very low	25.3	Very low	110 Å²	110	149.6 Å²	149.6	67%	0.667	76%	0.756	S	S	*	*			trans	-101.2	107.1	166.3	-178.7	0	0	0	0	108.6	V966	V964-V966 PolarHBondContact O-N 2.8Å
965	P	23.3	Very low	25.4	Very low	118 Å²	118	146.4 Å²	146.4	77%	0.766	76%	0.756	S	S	*	*			trans	-85	76.6	-165.7	33.9	-37.1	0	0	0	113.4	K967	P965-K967 PolarHBondContact O-N 2.88Å
966	V	26.4	Very low	25.4	Very low	107 Å²	107	147.1 Å²	147.1	65%	0.648	76%	0.761	S	S	*	*			trans	-75.3	105.8	165.9	-177.3	0	0	0	0	109.1	V964 I968	V964-V966 PolarHBondContact O-N 2.8Å; V966-I968 HydrophobicContact CG1-CG1 4.38Å; V966-I968 PolarHBondContact O-N 3.27Å
967	K	22.8	Very low	25.5	Very low	197 Å²	197	148.3 Å²	148.3	86%	0.857	76%	0.759	S	S	*	*			trans	-66.1	88.2	176	-74.8	-179.2	177.4	174	0	111.4	P965 S969	P965-K967 PolarHBondContact O-N 2.88Å; K967-S969 PolarHBondContact O-N 3.25Å; K967-S969 VanDerWaalsContact O-N 3.15Å
968	I	24.8	Very low	25.5	Very low	154 Å²	154	153.5 Å²	153.5	79%	0.79	78%	0.781	S	S	*	*			trans	-77.8	96	165.2	-56.4	179.7	0	0	0	108.1	V966	V966-I968 HydrophobicContact CG1-CG1 4.38Å; V966-I968 PolarHBondContact O-N 3.27Å
969	S	23.3	Very low	25.6	Very low	94 Å²	94	152.8 Å²	152.8	66%	0.657	78%	0.78	S	S	*	*			trans	-67.3	136.8	177.8	43.8	0	0	0	0	111.5	K967 N971	K967-S969 PolarHBondContact O-N 3.25Å; K967-S969 VanDerWaalsContact O-N 3.15Å; S969-N971 PolarHBondContact O-N 2.74Å
970	K	24.9	Very low	25.7	Very low	197 Å²	197	150.9 Å²	150.9	86%	0.857	78%	0.784	S	S	*	*	S	Bend	trans	-76.4	19.1	-171.2	-68.1	-175.8	174.8	179.4	0	115
971	N	25	Very low	25.9	Very low	139 Å²	139	149.9 Å²	149.9	74%	0.743	79%	0.786	S	S	*	*			trans	-97.6	15.4	-162.6	-71.9	20.3	0	0	0	115.2	S969	S969-N971 PolarHBondContact O-N 2.74Å
972	L	24.3	Very low	26.8	Very low	169 Å²	169	147.1 Å²	147.1	89%	0.885	78%	0.776	S	S	*	*			trans	-125	55.4	174.8	-71	172.8	0	0	0	112.2
973	L	22.2	Very low	27.9	Very low	140 Å²	140	143.3 Å²	143.3	73%	0.733	76%	0.76	S	S	*	*			trans	-78.8	172.9	136.6	-88.1	91	0	0	0	109
974	F	25.9	Very low	28.7	Very low	203 Å²	203	139.3 Å²	139.3	89%	0.89	74%	0.74	S	S	*	*			trans	71.1	140.7	-171.1	-52.1	-74.6	0	0	0	113.6
975	S	25.1	Very low	29.8	Very low	107 Å²	107	137.8 Å²	137.8	75%	0.748	73%	0.728	S	S	*	*			cis	-151.7	171.6	-21	-163.6	0	0	0	0	109.4	K977	S975-K977 PolarHBondContact O-N 3.25Å
976	N	23.5	Very low	31.3	Very low	159 Å²	159	134 Å²	134	85%	0.85	70%	0.704	S	S	*	*			trans	-65.2	120.6	-179.7	-63.3	-36.3	0	0	0	112.1
977	K	27.2	Very low	32.6	Very low	197 Å²	197	129.3 Å²	129.3	86%	0.857	68%	0.676	S	S	*	*			trans	-149.8	132.9	145.7	-103.4	-177.3	179.6	-172.8	0	108.9	S975	S975-K977 PolarHBondContact O-N 3.25Å
978	E	26.3	Very low	34	Very low	198 Å²	198	121.5 Å²	121.5	93%	0.925	64%	0.643	S	S	*	*			trans	-87	107.6	175.6	-65	-177.2	116.1	0	0	109.2
979	E	28.3	Very low	35.2	Very low	176 Å²	176	122.8 Å²	122.8	82%	0.822	64%	0.638	S	S	*	*			trans	-155.4	159.3	167.5	-121.2	152.4	-147.6	0	0	111.8	N981	E979-N981 PolarHBondContact O-N 3.08Å
980	S	29.4	Very low	36.8	Very low	110 Å²	110	125 Å²	125	77%	0.769	63%	0.632	S	S	*	*			trans	-73.3	120.6	-166.5	50.9	0	0	0	0	113.4
981	N	34.4	Very low	38.1	Very low	145 Å²	145	117 Å²	117	78%	0.775	60%	0.599	S	S	*	*			trans	-145.1	98.6	165.3	-100.5	-59.5	0	0	0	112.1	E979 S983	E979-N981 PolarHBondContact O-N 3.08Å; N981-S983 PolarHBondContact O-N 2.86Å
982	T	45.8	Very low	39.3	Very low	96 Å²	96	113.8 Å²	113.8	59%	0.589	58%	0.582	S	S	*	*			trans	-84.4	76	176.1	43.4	0	0	0	0	111.2	Y1012	T982-Y1012 HydrophobicContact CG2-CE1 4.44Å
983	S	49.5	Very low	40.7	Very low	57 Å²	57	107.8 Å²	107.8	40%	0.399	55%	0.554	S	S	.	*			trans	-97.7	147.6	169.7	70.4	0	0	0	0	111.8	N981 I985 S986 V987	N981-S983 PolarHBondContact O-N 2.86Å; S983-I985 PolarHBondContact O-N 3.25Å; S983-S986 PolarHBondContact N-OG 3.05Å; S983-S986 WeakPolarHBondContact O-CA 3.4Å; S983-S986 WeakPolarHBondContact O-CB 3.31Å; S983-S986 PolarHBondContact O-N 2.84Å; S983-S986 PolarHBondContact O-OG 3.29Å; S983-S986 PolarHBondContact OG-N 2.97Å; S983-V987 PolarHBondContact O-N 3.1Å; S983-V987 VanDerWaalsContact O-N 3.15Å
984	V	45.4	Very low	42.1	Very low	53 Å²	53	103.2 Å²	103.2	32%	0.321	53%	0.529	S	S	.	.	H	α-helix	trans	-51.9	-38.2	173.6	177.8	0	0	0	0	111.4	S986 V987 I988 D1019	V984-S986 VanDerWaalsContact C-N 3.33Å; V984-S986 PolarHBondContact O-N 2.79Å; V984-V987 PolarHBondContact O-N 2.96Å; V984-V987 VanDerWaalsContact O-N 3.13Å; V984-I988 HydrophobicContact CG1-CD1 3.7Å; V984-I988 HydrophobicContact CG1-CG1 4.17Å; V984-I988 WeakPolarHBondContact O-CG1 3.45Å; V984-I988 PolarHBondContact O-N 3.28Å; V984-D1019 HydrophobicContact CG2-CB 4.09Å; V984-D1019 WeakPolarHBondContact CG2-OD2 3.28Å
985	I	48.8	Very low	43	Very low	78 Å²	78	96.7 Å²	96.7	40%	0.4	51%	0.508	S	S	.	.	H	α-helix	trans	-62.1	-39	176.5	-57.9	177.2	0	0	0	111.5	S983 V987 R989	S983-I985 PolarHBondContact O-N 3.25Å; I985-V987 VanDerWaalsContact C-N 3.35Å; I985-R989 HydrophobicContact CG2-CG 4.36Å; I985-R989 VanDerWaalsContact O-CB 3.27Å; I985-R989 WeakPolarHBondContact O-CB 3.45Å; I985-R989 WeakPolarHBondContact O-CG 3.46Å; I985-R989 PolarHBondContact O-N 3.29Å
986	S	54.9	Low	43.9	Very low	39 Å²	39	95.6 Å²	95.6	27%	0.273	50%	0.501	S	S	.	.	H	α-helix	trans	-67.1	-35.9	174.8	80.4	0	0	0	0	112.3	S983 V984 R990	S983-S986 PolarHBondContact N-OG 3.05Å; S983-S986 WeakPolarHBondContact O-CA 3.4Å; S983-S986 WeakPolarHBondContact O-CB 3.31Å; S983-S986 PolarHBondContact O-N 2.84Å; S983-S986 PolarHBondContact O-OG 3.29Å; S983-S986 PolarHBondContact OG-N 2.97Å; V984-S986 VanDerWaalsContact C-N 3.33Å; V984-S986 PolarHBondContact O-N 2.79Å; S986-R990 VanDerWaalsContact O-CB 3.27Å; S986-R990 WeakPolarHBondContact O-CB 3.45Å; S986-R990 PolarHBondContact O-N 2.89Å; S986-R990 VanDerWaalsContact O-N 3.09Å
987	V	52.6	Low	44.7	Very low	8 Å²	8	92.2 Å²	92.2	5%	0.048	48%	0.482	C	S	.	.	H	α-helix	trans	-68	-50.9	176.2	179.4	0	0	0	0	110.4	S983 V984 I985 R989 R990 V991 F1008 Y1012 L1016	S983-V987 PolarHBondContact O-N 3.1Å; S983-V987 VanDerWaalsContact O-N 3.15Å; V984-V987 PolarHBondContact O-N 2.96Å; V984-V987 VanDerWaalsContact O-N 3.13Å; I985-V987 VanDerWaalsContact C-N 3.35Å; V987-R989 PolarHBondContact O-N 3.39Å; V987-R990 CarbonylContact O-C 3.57Å; V987-R990 PolarHBondContact O-N 2.98Å; V987-R990 VanDerWaalsContact O-N 3.1Å; V987-V991 WeakPolarHBondContact O-CG2 3.49Å; V987-V991 PolarHBondContact O-N 3.2Å; V987-F1008 HydrophobicContact CG1-CE1 3.9Å; V987-F1008 HydrophobicContact CG1-CZ 4.09Å; V987-Y1012 HydrophobicContact CG2-CD1 4.3Å; V987-Y1012 HydrophobicContact CG2-CG 4.38Å; V987-L1016 HydrophobicContact CG1-CD1 4.15Å; V987-L1016 HydrophobicContact CG1-CD2 4.19Å; V987-L1016 HydrophobicContact CG1-CG 4.33Å
988	I	51.5	Low	45.2	Very low	33 Å²	33	86.3 Å²	86.3	17%	0.169	48%	0.478	C	S	.	.	H	α-helix	trans	-61.3	-45.8	178.4	-67.6	175.1	0	0	0	111.3	V984 R990 V991 N992 I1052	V984-I988 HydrophobicContact CG1-CD1 3.7Å; V984-I988 HydrophobicContact CG1-CG1 4.17Å; V984-I988 WeakPolarHBondContact O-CG1 3.45Å; V984-I988 PolarHBondContact O-N 3.28Å; I988-R990 PolarHBondContact O-N 3.44Å; I988-V991 PolarHBondContact O-N 3.32Å; I988-N992 WeakPolarHBondContact O-CB 3.43Å; I988-N992 PolarHBondContact O-N 2.96Å; I988-I1052 HydrophobicContact CD1-CD1 4.1Å
989	R	51.8	Low	45.7	Very low	180 Å²	180	86.1 Å²	86.1	68%	0.679	48%	0.476	S	S	*	.	H	α-helix	trans	-57.6	-38.2	174.5	-76.1	173.9	-179.5	159.1	2.5	111.6	I985 V987 S993	I985-R989 HydrophobicContact CG2-CG 4.36Å; I985-R989 VanDerWaalsContact O-CB 3.27Å; I985-R989 WeakPolarHBondContact O-CB 3.45Å; I985-R989 WeakPolarHBondContact O-CG 3.46Å; I985-R989 PolarHBondContact O-N 3.29Å; V987-R989 PolarHBondContact O-N 3.39Å; R989-S993 PolarHBondContact O-N 3.38Å
990	R	55.9	Low	46.1	Very low	141 Å²	141	80.6 Å²	80.6	53%	0.532	46%	0.455	S	S	.	.	H	α-helix	trans	-74.6	-39.2	179.2	-168.3	155	-79.9	157	-5.2	112.5	S986 V987 I988 N992 S993 F994 F1008	S986-R990 VanDerWaalsContact O-CB 3.27Å; S986-R990 WeakPolarHBondContact O-CB 3.45Å; S986-R990 PolarHBondContact O-N 2.89Å; S986-R990 VanDerWaalsContact O-N 3.09Å; V987-R990 CarbonylContact O-C 3.57Å; V987-R990 PolarHBondContact O-N 2.98Å; V987-R990 VanDerWaalsContact O-N 3.1Å; I988-R990 PolarHBondContact O-N 3.44Å; R990-N992 PolarHBondContact O-N 3.4Å; R990-S993 WeakPolarHBondContact CA-OG 3.24Å; R990-S993 PolarHBondContact O-N 2.63Å; R990-S993 PolarHBondContact O-OG 2.9Å; R990-F994 HydrophobicContact CG-CE2 3.98Å; R990-F994 WeakPolarHBondContact O-CD2 3.29Å; R990-F994 PolarHBondContact O-N 2.85Å; R990-F1008 HydrophobicContact CB-CE1 4.24Å; R990-F1008 HydrophobicContact CB-CE2 4.26Å; R990-F1008 HydrophobicContact CB-CZ 3.75Å; R990-F1008 VanDerWaalsContact CD-CE2 3.41Å; R990-F1008 HydrophobicContact CG-CD2 4.33Å; R990-F1008 HydrophobicContact CG-CE1 4.28Å; R990-F1008 HydrophobicContact CG-CE2 3.75Å; R990-F1008 HydrophobicContact CG-CZ 3.73Å
991	V	53	Low	46.8	Very low	28 Å²	28	78.5 Å²	78.5	17%	0.17	44%	0.44	C	S	.	.	H	α-helix	trans	-56.9	-48	168.6	173.2	0	0	0	0	110.8	V987 I988 S993 F994 S995 Y1005 F1008 L1009	V987-V991 WeakPolarHBondContact O-CG2 3.49Å; V987-V991 PolarHBondContact O-N 3.2Å; I988-V991 PolarHBondContact O-N 3.32Å; V991-S993 VanDerWaalsContact C-N 3.31Å; V991-S993 PolarHBondContact O-N 3.04Å; V991-F994 WeakPolarHBondContact O-CB 3.46Å; V991-F994 PolarHBondContact O-N 3.49Å; V991-F994 VanDerWaalsContact O-N 3.12Å; V991-S995 PolarHBondContact O-N 3.36Å; V991-Y1005 HydrophobicContact CG1-CE2 4.38Å; V991-F1008 HydrophobicContact CG2-CD1 4.29Å; V991-F1008 HydrophobicContact CG2-CE1 3.9Å; V991-L1009 HydrophobicContact CG2-CD2 4.24Å
992	N	49.3	Very low	47.5	Very low	72 Å²	72	74.9 Å²	74.9	39%	0.385	43%	0.426	S	S	.	.	H	α-helix	trans	-63.4	-35.6	177.9	-73.6	-14.9	0	0	0	112.3	I988 R990 F994 S995 S996	I988-N992 WeakPolarHBondContact O-CB 3.43Å; I988-N992 PolarHBondContact O-N 2.96Å; R990-N992 PolarHBondContact O-N 3.4Å; N992-F994 VanDerWaalsContact C-N 3.3Å; N992-F994 PolarHBondContact O-N 3.08Å; N992-S995 WeakPolarHBondContact O-CA 3.49Å; N992-S995 WeakPolarHBondContact O-CB 3.47Å; N992-S995 PolarHBondContact O-N 2.85Å; N992-S996 PolarHBondContact O-N 3.18Å
993	S	54.6	Low	47.8	Very low	44 Å²	44	76.9 Å²	76.9	31%	0.308	43%	0.432	S	S	.	.	H	α-helix	trans	-65.6	-27.3	174.3	78	0	0	0	0	114.2	R989 R990 V991 S995 S996 N997	R989-S993 PolarHBondContact O-N 3.38Å; R990-S993 WeakPolarHBondContact CA-OG 3.24Å; R990-S993 PolarHBondContact O-N 2.63Å; R990-S993 PolarHBondContact O-OG 2.9Å; V991-S993 VanDerWaalsContact C-N 3.31Å; V991-S993 PolarHBondContact O-N 3.04Å; S993-S995 VanDerWaalsContact C-N 3.34Å; S993-S996 PolarHBondContact O-OG 2.86Å; S993-S996 VanDerWaalsContact O-OG 3.07Å; S993-N997 WeakPolarHBondContact O-CB 3.43Å; S993-N997 PolarHBondContact O-N 2.77Å; S993-N997 PolarHBondContact O-ND2 2.89Å
994	F	51.3	Low	48	Very low	43 Å²	43	80.5 Å²	80.5	19%	0.189	44%	0.44	C	S	.	.	H	α-helix	trans	-75.6	-24	169.1	-68.8	-66.3	0	0	0	112.4	R990 V991 N992 K1004 Y1005 F1008	R990-F994 HydrophobicContact CG-CE2 3.98Å; R990-F994 WeakPolarHBondContact O-CD2 3.29Å; R990-F994 PolarHBondContact O-N 2.85Å; V991-F994 WeakPolarHBondContact O-CB 3.46Å; V991-F994 PolarHBondContact O-N 3.49Å; V991-F994 VanDerWaalsContact O-N 3.12Å; N992-F994 VanDerWaalsContact C-N 3.3Å; N992-F994 PolarHBondContact O-N 3.08Å; F994-K1004 HydrophobicContact CE1-CB 4.12Å; F994-K1004 HydrophobicContact CZ-CB 4.48Å; F994-Y1005 HydrophobicContact CB-CD2 3.56Å; F994-Y1005 HydrophobicContact CB-CE2 4Å; F994-Y1005 AromaticContact CD2-CD2 3.74Å; F994-Y1005 HydrophobicContact CD2-CD2 3.74Å; F994-Y1005 HydrophobicContact CD2-CE2 4.39Å; F994-Y1005 AromaticContact CG-CD2 3.72Å; F994-Y1005 HydrophobicContact CG-CD2 3.72Å; F994-Y1005 HydrophobicContact CG-CE2 4.49Å; F994-F1008 HydrophobicContact CE2-CB 3.96Å; F994-F1008 HydrophobicContact CE2-CD1 4.04Å; F994-F1008 HydrophobicContact CE2-CD2 4.31Å; F994-F1008 AromaticContact CE2-CG 3.83Å; F994-F1008 HydrophobicContact CE2-CG 3.83Å; F994-F1008 HydrophobicContact CZ-CB 4.35Å
995	S	45.1	Very low	48.3	Very low	67 Å²	67	80.6 Å²	80.6	47%	0.469	44%	0.435	S	S	.	.	H	α-helix	trans	-80	-30.1	176.7	-154	0	0	0	0	112.7	V991 N992 S993 K1067	V991-S995 PolarHBondContact O-N 3.36Å; N992-S995 WeakPolarHBondContact O-CA 3.49Å; N992-S995 WeakPolarHBondContact O-CB 3.47Å; N992-S995 PolarHBondContact O-N 2.85Å; S993-S995 VanDerWaalsContact C-N 3.34Å; S995-K1067 PolarHBondContact OG-NZ 3.44Å
996	S	43.7	Very low	48.3	Very low	84 Å²	84	81.7 Å²	81.7	59%	0.587	44%	0.438	S	S	*	.	H	α-helix	trans	-77.6	-32.8	174.3	60.8	0	0	0	0	113.6	N992 S993 G998	N992-S996 PolarHBondContact O-N 3.18Å; S993-S996 PolarHBondContact O-OG 2.86Å; S993-S996 VanDerWaalsContact O-OG 3.07Å; S996-G998 PolarHBondContact O-N 3.4Å
997	N	40.2	Very low	48.4	Very low	87 Å²	87	83 Å²	83	47%	0.465	45%	0.448	S	S	.	.			trans	-91.9	81.5	-171	-64.1	-5.3	0	0	0	111.2	S993 H999 T1000	S993-N997 WeakPolarHBondContact O-CB 3.43Å; S993-N997 PolarHBondContact O-N 2.77Å; S993-N997 PolarHBondContact O-ND2 2.89Å; N997-H999 PolarHBondContact O-N 2.95Å; N997-T1000 HydrophobicContact CB-CG2 3.75Å; N997-T1000 PolarHBondContact O-N 2.96Å; N997-T1000 PolarHBondContact O-OG1 3.32Å
998	G	38.1	Very low	48.8	Very low	73 Å²	73	83.7 Å²	83.7	75%	0.753	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	7.4	-172.4	0	0	0	0	0	118.8	S996	S996-G998 PolarHBondContact O-N 3.4Å
999	H	36.6	Very low	49	Very low	195 Å²	195	84.2 Å²	84.2	90%	0.903	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.7	7.1	176	-69	-58.5	0	0	0	114.6	N997 S1001	N997-H999 PolarHBondContact O-N 2.95Å; H999-S1001 PolarHBondContact O-N 3.09Å
1000	T	36.4	Very low	49.2	Very low	60 Å²	60	83.1 Å²	83.1	37%	0.368	45%	0.449	S	S	.	.			trans	-71.5	124.9	178.4	48.9	0	0	0	0	112.5	N997 S1002	N997-T1000 HydrophobicContact CB-CG2 3.75Å; N997-T1000 PolarHBondContact O-N 2.96Å; N997-T1000 PolarHBondContact O-OG1 3.32Å; T1000-S1002 PolarHBondContact O-N 2.88Å
1001	S	43.7	Very low	49.4	Very low	66 Å²	66	83.2 Å²	83.2	46%	0.462	45%	0.453	S	S	.	.			trans	-55.1	128.4	-175.4	56.8	0	0	0	0	114.2	H999 I1003 K1004	H999-S1001 PolarHBondContact O-N 3.09Å; S1001-I1003 PolarHBondContact O-N 3.35Å; S1001-K1004 PolarHBondContact O-N 3.31Å
1002	S	50.3	Low	49.5	Very low	69 Å²	69	84.1 Å²	84.1	48%	0.483	45%	0.454	S	S	.	.	H	α-helix	trans	-39.3	-45.8	180	172.9	0	0	0	0	114.7	T1000 K1004 Y1005 H1006	T1000-S1002 PolarHBondContact O-N 2.88Å; S1002-K1004 VanDerWaalsContact C-N 3.26Å; S1002-K1004 PolarHBondContact O-N 3.22Å; S1002-Y1005 PolarHBondContact O-N 3.23Å; S1002-Y1005 VanDerWaalsContact O-N 3.08Å; S1002-H1006 PolarHBondContact O-N 3.23Å
1003	I	52.3	Low	49.7	Very low	137 Å²	137	83.2 Å²	83.2	70%	0.703	45%	0.454	S	S	*	.	H	α-helix	trans	-53	-41.1	-178.9	-58	172.4	0	0	0	112	S1001 S1007	S1001-I1003 PolarHBondContact O-N 3.35Å; I1003-S1007 VanDerWaalsContact O-CB 3.29Å; I1003-S1007 WeakPolarHBondContact O-CB 3.16Å; I1003-S1007 PolarHBondContact O-N 2.78Å; I1003-S1007 PolarHBondContact O-OG 3.48Å
1004	K	53.9	Low	49.5	Very low	133 Å²	133	84.8 Å²	84.8	58%	0.578	46%	0.464	S	S	*	.	H	α-helix	trans	-66.6	-44.3	-179.8	-71.1	-173.6	176.7	-178.3	0	111.4	F994 S1001 S1002 S1007 F1008	F994-K1004 HydrophobicContact CE1-CB 4.12Å; F994-K1004 HydrophobicContact CZ-CB 4.48Å; S1001-K1004 PolarHBondContact O-N 3.31Å; S1002-K1004 VanDerWaalsContact C-N 3.26Å; S1002-K1004 PolarHBondContact O-N 3.22Å; K1004-S1007 PolarHBondContact O-N 3Å; K1004-S1007 PolarHBondContact O-OG 3.11Å; K1004-F1008 WeakPolarHBondContact O-CB 3.36Å; K1004-F1008 PolarHBondContact O-N 3Å
1005	Y	51	Low	49.6	Very low	55 Å²	55	85.7 Å²	85.7	22%	0.216	47%	0.471	C	S	.	.	H	α-helix	trans	-63.8	-47.1	177	-175	-107.3	0	0	0	111.9	V991 F994 S1002 S1007 F1008 L1009	V991-Y1005 HydrophobicContact CG1-CE2 4.38Å; F994-Y1005 HydrophobicContact CB-CD2 3.56Å; F994-Y1005 HydrophobicContact CB-CE2 4Å; F994-Y1005 AromaticContact CD2-CD2 3.74Å; F994-Y1005 HydrophobicContact CD2-CD2 3.74Å; F994-Y1005 HydrophobicContact CD2-CE2 4.39Å; F994-Y1005 AromaticContact CG-CD2 3.72Å; F994-Y1005 HydrophobicContact CG-CD2 3.72Å; F994-Y1005 HydrophobicContact CG-CE2 4.49Å; S1002-Y1005 PolarHBondContact O-N 3.23Å; S1002-Y1005 VanDerWaalsContact O-N 3.08Å; Y1005-S1007 PolarHBondContact O-N 3.35Å; Y1005-F1008 PolarHBondContact O-N 2.77Å; Y1005-L1009 HydrophobicContact CD1-CD1 4.08Å; Y1005-L1009 HydrophobicContact CE1-CD1 3.46Å; Y1005-L1009 VanDerWaalsContact CE1-CD1 3.46Å; Y1005-L1009 HydrophobicContact CE1-CG 4.27Å; Y1005-L1009 HydrophobicContact CE2-CD1 4.41Å; Y1005-L1009 PolarHBondContact O-N 3.35Å
1006	H	49.2	Very low	49.8	Very low	101 Å²	101	84.5 Å²	84.5	47%	0.468	46%	0.459	S	S	.	.	H	α-helix	trans	-62.4	-43.3	176.8	-105.6	-74	0	0	0	112.6	S1002 F1008 L1009 R1010	S1002-H1006 PolarHBondContact O-N 3.23Å; H1006-F1008 VanDerWaalsContact C-N 3.28Å; H1006-F1008 PolarHBondContact O-N 2.97Å; H1006-L1009 PolarHBondContact O-N 3.4Å; H1006-R1010 VanDerWaalsContact O-CB 3.31Å; H1006-R1010 WeakPolarHBondContact O-CB 3.49Å; H1006-R1010 PolarHBondContact O-N 2.93Å
1007	S	57.1	Low	50.3	Low	68 Å²	68	86.2 Å²	86.2	48%	0.476	46%	0.461	S	S	.	.	H	α-helix	trans	-63.5	-34.7	175.8	72.9	0	0	0	0	112.4	I1003 K1004 Y1005 K1011	I1003-S1007 VanDerWaalsContact O-CB 3.29Å; I1003-S1007 WeakPolarHBondContact O-CB 3.16Å; I1003-S1007 PolarHBondContact O-N 2.78Å; I1003-S1007 PolarHBondContact O-OG 3.48Å; K1004-S1007 PolarHBondContact O-N 3Å; K1004-S1007 PolarHBondContact O-OG 3.11Å; Y1005-S1007 PolarHBondContact O-N 3.35Å; S1007-K1011 WeakPolarHBondContact O-CB 3.36Å; S1007-K1011 PolarHBondContact O-N 3.22Å; S1007-K1011 VanDerWaalsContact O-N 3.08Å
1008	F	60.6	Low	50.8	Low	22 Å²	22	87.9 Å²	87.9	10%	0.096	46%	0.464	C	S	.	.	H	α-helix	trans	-69.2	-49.7	177.6	-172.1	-96.1	0	0	0	111.3	V987 R990 V991 F994 K1004 Y1005 H1006 K1011 Y1012	V987-F1008 HydrophobicContact CG1-CE1 3.9Å; V987-F1008 HydrophobicContact CG1-CZ 4.09Å; R990-F1008 HydrophobicContact CB-CE1 4.24Å; R990-F1008 HydrophobicContact CB-CE2 4.26Å; R990-F1008 HydrophobicContact CB-CZ 3.75Å; R990-F1008 VanDerWaalsContact CD-CE2 3.41Å; R990-F1008 HydrophobicContact CG-CD2 4.33Å; R990-F1008 HydrophobicContact CG-CE1 4.28Å; R990-F1008 HydrophobicContact CG-CE2 3.75Å; R990-F1008 HydrophobicContact CG-CZ 3.73Å; V991-F1008 HydrophobicContact CG2-CD1 4.29Å; V991-F1008 HydrophobicContact CG2-CE1 3.9Å; F994-F1008 HydrophobicContact CE2-CB 3.96Å; F994-F1008 HydrophobicContact CE2-CD1 4.04Å; F994-F1008 HydrophobicContact CE2-CD2 4.31Å; F994-F1008 AromaticContact CE2-CG 3.83Å; F994-F1008 HydrophobicContact CE2-CG 3.83Å; F994-F1008 HydrophobicContact CZ-CB 4.35Å; K1004-F1008 WeakPolarHBondContact O-CB 3.36Å; K1004-F1008 PolarHBondContact O-N 3Å; Y1005-F1008 PolarHBondContact O-N 2.77Å; H1006-F1008 VanDerWaalsContact C-N 3.28Å; H1006-F1008 PolarHBondContact O-N 2.97Å; F1008-K1011 PolarHBondContact O-N 3.05Å; F1008-Y1012 HydrophobicContact CD1-CD2 4.33Å; F1008-Y1012 AromaticContact CD2-CD2 3.74Å; F1008-Y1012 HydrophobicContact CD2-CD2 3.74Å; F1008-Y1012 AromaticContact CD2-CE2 3.67Å; F1008-Y1012 HydrophobicContact CD2-CE2 3.67Å; F1008-Y1012 HydrophobicContact CE1-CD2 4.11Å; F1008-Y1012 AromaticContact CE2-CD2 3.48Å; F1008-Y1012 HydrophobicContact CE2-CD2 3.48Å; F1008-Y1012 VanDerWaalsContact CE2-CD2 3.48Å; F1008-Y1012 AromaticContact CE2-CE2 3.33Å; F1008-Y1012 HydrophobicContact CE2-CE2 3.33Å; F1008-Y1012 HydrophobicContact CG-CD2 4.15Å; F1008-Y1012 HydrophobicContact CG-CE2 4.5Å; F1008-Y1012 AromaticContact CZ-CD2 3.67Å; F1008-Y1012 HydrophobicContact CZ-CD2 3.67Å; F1008-Y1012 AromaticContact CZ-CE2 3.94Å; F1008-Y1012 HydrophobicContact CZ-CE2 3.94Å; F1008-Y1012 HydrophobicContact CZ-CG 4.5Å; F1008-Y1012 WeakPolarHBondContact O-CD2 3.4Å; F1008-Y1012 PolarHBondContact O-N 3.41Å; F1008-Y1012 VanDerWaalsContact O-N 3.12Å
1009	L	56	Low	51.2	Low	44 Å²	44	87.1 Å²	87.1	23%	0.23	44%	0.443	C	S	.	.	H	α-helix	trans	-61.9	-44.4	176	-69	-175.8	0	0	0	112	V991 Y1005 H1006 K1011 Y1012 S1013	V991-L1009 HydrophobicContact CG2-CD2 4.24Å; Y1005-L1009 HydrophobicContact CD1-CD1 4.08Å; Y1005-L1009 HydrophobicContact CE1-CD1 3.46Å; Y1005-L1009 VanDerWaalsContact CE1-CD1 3.46Å; Y1005-L1009 HydrophobicContact CE1-CG 4.27Å; Y1005-L1009 HydrophobicContact CE2-CD1 4.41Å; Y1005-L1009 PolarHBondContact O-N 3.35Å; H1006-L1009 PolarHBondContact O-N 3.4Å; L1009-K1011 PolarHBondContact O-N 3.41Å; L1009-Y1012 PolarHBondContact O-N 3.13Å; L1009-S1013 VanDerWaalsContact O-CB 3.3Å; L1009-S1013 WeakPolarHBondContact O-CB 3.42Å; L1009-S1013 PolarHBondContact O-N 2.83Å; L1009-S1013 PolarHBondContact O-OG 3.18Å
1010	R	56	Low	51.5	Low	156 Å²	156	81.3 Å²	81.3	59%	0.589	42%	0.418	S	S	*	.	H	α-helix	trans	-63.6	-24.9	177.7	-158.7	-177.1	-164.9	-156.3	6.5	112.7	H1006 A1086	H1006-R1010 VanDerWaalsContact O-CB 3.31Å; H1006-R1010 WeakPolarHBondContact O-CB 3.49Å; H1006-R1010 PolarHBondContact O-N 2.93Å; R1010-A1086 PolarHBondContact NH1-O 2.93Å; R1010-A1086 PolarHBondContact NH2-O 3.14Å; R1010-A1086 VanDerWaalsContact NH2-O 3.15Å
1011	K	59.1	Low	52	Low	143 Å²	143	86.3 Å²	86.3	62%	0.622	43%	0.43	S	S	*	.	H	α-helix	trans	-85.3	-27	177.8	-177.3	167	-179.6	169.7	0	114.1	S1007 F1008 L1009	S1007-K1011 WeakPolarHBondContact O-CB 3.36Å; S1007-K1011 PolarHBondContact O-N 3.22Å; S1007-K1011 VanDerWaalsContact O-N 3.08Å; F1008-K1011 PolarHBondContact O-N 3.05Å; L1009-K1011 PolarHBondContact O-N 3.41Å
1012	Y	54.5	Low	52.2	Low	47 Å²	47	85.5 Å²	85.5	18%	0.184	42%	0.421	C	S	.	.	H	α-helix	trans	-118.2	-0.1	-174	-65.3	-71.6	0	0	0	114.9	T982 V987 F1008 L1009 S1014 L1015 L1016	T982-Y1012 HydrophobicContact CG2-CE1 4.44Å; V987-Y1012 HydrophobicContact CG2-CD1 4.3Å; V987-Y1012 HydrophobicContact CG2-CG 4.38Å; F1008-Y1012 HydrophobicContact CD1-CD2 4.33Å; F1008-Y1012 AromaticContact CD2-CD2 3.74Å; F1008-Y1012 HydrophobicContact CD2-CD2 3.74Å; F1008-Y1012 AromaticContact CD2-CE2 3.67Å; F1008-Y1012 HydrophobicContact CD2-CE2 3.67Å; F1008-Y1012 HydrophobicContact CE1-CD2 4.11Å; F1008-Y1012 AromaticContact CE2-CD2 3.48Å; F1008-Y1012 HydrophobicContact CE2-CD2 3.48Å; F1008-Y1012 VanDerWaalsContact CE2-CD2 3.48Å; F1008-Y1012 AromaticContact CE2-CE2 3.33Å; F1008-Y1012 HydrophobicContact CE2-CE2 3.33Å; F1008-Y1012 HydrophobicContact CG-CD2 4.15Å; F1008-Y1012 HydrophobicContact CG-CE2 4.5Å; F1008-Y1012 AromaticContact CZ-CD2 3.67Å; F1008-Y1012 HydrophobicContact CZ-CD2 3.67Å; F1008-Y1012 AromaticContact CZ-CE2 3.94Å; F1008-Y1012 HydrophobicContact CZ-CE2 3.94Å; F1008-Y1012 HydrophobicContact CZ-CG 4.5Å; F1008-Y1012 WeakPolarHBondContact O-CD2 3.4Å; F1008-Y1012 PolarHBondContact O-N 3.41Å; F1008-Y1012 VanDerWaalsContact O-N 3.12Å; L1009-Y1012 PolarHBondContact O-N 3.13Å; Y1012-S1014 VanDerWaalsContact C-N 3.29Å; Y1012-S1014 PolarHBondContact O-N 3.33Å; Y1012-L1015 PolarHBondContact O-N 3.03Å; Y1012-L1016 WeakPolarHBondContact O-CG 3.4Å; Y1012-L1016 PolarHBondContact O-N 3.31Å
1013	S	54.6	Low	51.9	Low	54 Å²	54	87.9 Å²	87.9	38%	0.378	42%	0.423	S	S	.	.	H	α-helix	trans	-60.2	-35.7	176.6	55.2	0	0	0	0	113.4	L1009 L1017	L1009-S1013 VanDerWaalsContact O-CB 3.3Å; L1009-S1013 WeakPolarHBondContact O-CB 3.42Å; L1009-S1013 PolarHBondContact O-N 2.83Å; L1009-S1013 PolarHBondContact O-OG 3.18Å; S1013-L1017 WeakPolarHBondContact O-CB 3.4Å; S1013-L1017 VanDerWaalsContact O-CG 3.29Å; S1013-L1017 WeakPolarHBondContact O-CG 3.39Å; S1013-L1017 PolarHBondContact O-N 3.42Å
1014	S	50.7	Low	51.3	Low	76 Å²	76	84.7 Å²	84.7	53%	0.531	41%	0.407	S	S	.	.	H	α-helix	trans	-69.1	-41.2	176.9	50.5	0	0	0	0	112.8	Y1012 L1017 K1018	Y1012-S1014 VanDerWaalsContact C-N 3.29Å; Y1012-S1014 PolarHBondContact O-N 3.33Å; S1014-L1017 PolarHBondContact O-N 2.82Å; S1014-K1018 WeakPolarHBondContact O-CB 3.15Å; S1014-K1018 PolarHBondContact O-N 3.11Å
1015	L	52.6	Low	50.8	Low	62 Å²	62	83.4 Å²	83.4	33%	0.325	40%	0.403	S	S	.	.	H	α-helix	trans	-61.7	-50.1	171.5	-90.7	83.1	0	0	0	110.6	Y1012 L1017 K1018 D1019	Y1012-L1015 PolarHBondContact O-N 3.03Å; L1015-L1017 VanDerWaalsContact C-N 3.28Å; L1015-L1017 PolarHBondContact O-N 2.93Å; L1015-K1018 PolarHBondContact O-N 3.02Å; L1015-K1018 VanDerWaalsContact O-N 3.07Å; L1015-D1019 WeakPolarHBondContact O-CB 3.42Å; L1015-D1019 VanDerWaalsContact O-CG 3.31Å; L1015-D1019 PolarHBondContact O-N 3.4Å
1016	L	50.3	Low	50.4	Low	43 Å²	43	85.2 Å²	85.2	23%	0.225	42%	0.416	C	S	.	.	H	α-helix	trans	-56.9	-41.3	179.4	-72.7	166.5	0	0	0	112.2	V987 Y1012 L1020	V987-L1016 HydrophobicContact CG1-CD1 4.15Å; V987-L1016 HydrophobicContact CG1-CD2 4.19Å; V987-L1016 HydrophobicContact CG1-CG 4.33Å; Y1012-L1016 WeakPolarHBondContact O-CG 3.4Å; Y1012-L1016 PolarHBondContact O-N 3.31Å; L1016-L1020 VanDerWaalsContact O-CB 3.28Å; L1016-L1020 WeakPolarHBondContact O-CB 3.36Å; L1016-L1020 WeakPolarHBondContact O-CD1 3.33Å; L1016-L1020 WeakPolarHBondContact O-CG 3.09Å; L1016-L1020 PolarHBondContact O-N 2.72Å
1017	L	52.3	Low	49.9	Very low	120 Å²	120	83.8 Å²	83.8	63%	0.628	42%	0.417	S	S	*	.	H	α-helix	trans	-74.1	-28.3	177	-73.5	169.2	0	0	0	113.8	S1013 S1014 L1015 R1021	S1013-L1017 WeakPolarHBondContact O-CB 3.4Å; S1013-L1017 VanDerWaalsContact O-CG 3.29Å; S1013-L1017 WeakPolarHBondContact O-CG 3.39Å; S1013-L1017 PolarHBondContact O-N 3.42Å; S1014-L1017 PolarHBondContact O-N 2.82Å; L1015-L1017 VanDerWaalsContact C-N 3.28Å; L1015-L1017 PolarHBondContact O-N 2.93Å; L1017-R1021 PolarHBondContact O-N 3.16Å
1018	K	52.3	Low	49	Very low	122 Å²	122	87 Å²	87	53%	0.53	42%	0.423	S	S	.	.	H	α-helix	trans	-74.5	-52.8	174.7	-165.3	-161.5	175.6	-117.8	0	110.7	S1014 L1015 L1020 R1021 D1022	S1014-K1018 WeakPolarHBondContact O-CB 3.15Å; S1014-K1018 PolarHBondContact O-N 3.11Å; L1015-K1018 PolarHBondContact O-N 3.02Å; L1015-K1018 VanDerWaalsContact O-N 3.07Å; K1018-L1020 PolarHBondContact O-N 2.98Å; K1018-R1021 WeakPolarHBondContact O-CA 3.43Å; K1018-R1021 WeakPolarHBondContact O-CB 3.41Å; K1018-R1021 PolarHBondContact O-N 2.77Å; K1018-D1022 WeakPolarHBondContact CE-OD2 3.46Å; K1018-D1022 IonicContact NZ-OD2 2.79Å; K1018-D1022 PolarHBondContact NZ-OD2 2.97Å; K1018-D1022 PolarHBondContact O-N 3.34Å
1019	D	45.5	Very low	48.1	Very low	57 Å²	57	91.7 Å²	91.7	31%	0.305	45%	0.449	S	S	.	.	H	α-helix	trans	-62.2	-28.6	-178.7	-60.2	-9.4	0	0	0	111.2	V984 L1015 F1023	V984-D1019 HydrophobicContact CG2-CB 4.09Å; V984-D1019 WeakPolarHBondContact CG2-OD2 3.28Å; L1015-D1019 WeakPolarHBondContact O-CB 3.42Å; L1015-D1019 VanDerWaalsContact O-CG 3.31Å; L1015-D1019 PolarHBondContact O-N 3.4Å; D1019-F1023 WeakPolarHBondContact O-CB 3.46Å; D1019-F1023 PolarHBondContact O-N 3.13Å
1020	L	42.7	Very low	47.1	Very low	73 Å²	73	97.6 Å²	97.6	38%	0.382	48%	0.475	S	S	.	.	H	α-helix	trans	-66.4	-33.4	169.5	-84.9	171.2	0	0	0	114.2	L1016 K1018 N1024 F1057	L1016-L1020 VanDerWaalsContact O-CB 3.28Å; L1016-L1020 WeakPolarHBondContact O-CB 3.36Å; L1016-L1020 WeakPolarHBondContact O-CD1 3.33Å; L1016-L1020 WeakPolarHBondContact O-CG 3.09Å; L1016-L1020 PolarHBondContact O-N 2.72Å; K1018-L1020 PolarHBondContact O-N 2.98Å; L1020-N1024 WeakPolarHBondContact O-CB 3.33Å; L1020-N1024 PolarHBondContact O-N 3.25Å; L1020-F1057 HydrophobicContact CD1-CE1 4.3Å; L1020-F1057 HydrophobicContact CD1-CZ 4.04Å; L1020-F1057 HydrophobicContact CD2-CE1 3.74Å; L1020-F1057 HydrophobicContact CD2-CZ 3.77Å; L1020-F1057 HydrophobicContact CG-CZ 4.26Å
1021	R	46.9	Very low	46	Very low	164 Å²	164	95.2 Å²	95.2	62%	0.619	48%	0.482	S	S	*	.	H	α-helix	trans	-73.1	-51.2	173	-174.3	-177.9	-58.2	-173.4	1.1	109.8	L1017 K1018 F1023 N1024 E1025	L1017-R1021 PolarHBondContact O-N 3.16Å; K1018-R1021 WeakPolarHBondContact O-CA 3.43Å; K1018-R1021 WeakPolarHBondContact O-CB 3.41Å; K1018-R1021 PolarHBondContact O-N 2.77Å; R1021-F1023 PolarHBondContact O-N 2.98Å; R1021-N1024 PolarHBondContact O-N 3.46Å; R1021-E1025 WeakPolarHBondContact CG-OE1 3.34Å; R1021-E1025 PolarHBondContact O-N 2.93Å
1022	D	49.4	Very low	44.7	Very low	50 Å²	50	95.7 Å²	95.7	27%	0.267	50%	0.497	S	S	.	.	H	α-helix	trans	-60.6	-34.3	-178.4	-60.2	6.5	0	0	0	110.6	K1018 N1026	K1018-D1022 WeakPolarHBondContact CE-OD2 3.46Å; K1018-D1022 IonicContact NZ-OD2 2.79Å; K1018-D1022 PolarHBondContact NZ-OD2 2.97Å; K1018-D1022 PolarHBondContact O-N 3.34Å; D1022-N1026 WeakPolarHBondContact O-CB 3.46Å; D1022-N1026 PolarHBondContact O-N 3.47Å; D1022-N1026 PolarHBondContact O-ND2 3.33Å
1023	F	42.5	Very low	43.6	Very low	119 Å²	119	97.3 Å²	97.3	52%	0.522	53%	0.527	S	S	.	.	H	α-helix	trans	-67.9	-43.3	171.9	-176.4	-95.7	0	0	0	113.4	D1019 R1021 E1025 N1026 S1027	D1019-F1023 WeakPolarHBondContact O-CB 3.46Å; D1019-F1023 PolarHBondContact O-N 3.13Å; R1021-F1023 PolarHBondContact O-N 2.98Å; F1023-E1025 VanDerWaalsContact C-N 3.3Å; F1023-E1025 PolarHBondContact O-N 3.28Å; F1023-N1026 PolarHBondContact O-N 2.88Å; F1023-S1027 WeakPolarHBondContact O-CB 3.45Å; F1023-S1027 PolarHBondContact O-N 3.19Å; F1023-S1027 PolarHBondContact O-OG 3.24Å
1024	N	39.6	Very low	42.8	Very low	69 Å²	69	100.6 Å²	100.6	37%	0.369	54%	0.541	S	S	.	.	H	α-helix	trans	-71.9	-21.2	179.1	-175.1	20.1	0	0	0	113.1	L1020 R1021 S1027 K1028	L1020-N1024 WeakPolarHBondContact O-CB 3.33Å; L1020-N1024 PolarHBondContact O-N 3.25Å; R1021-N1024 PolarHBondContact O-N 3.46Å; N1024-S1027 PolarHBondContact O-OG 3.33Å; N1024-K1028 VanDerWaalsContact O-CD 3.27Å; N1024-K1028 WeakPolarHBondContact O-CD 3.35Å; N1024-K1028 VanDerWaalsContact O-CE 3.25Å; N1024-K1028 WeakPolarHBondContact O-CE 3.36Å; N1024-K1028 WeakPolarHBondContact O-CG 3.47Å; N1024-K1028 WeakPolarHBondContact OD1-CE 3.34Å; N1024-K1028 PolarHBondContact OD1-NZ 3.29Å
1025	E	44	Very low	42.1	Very low	107 Å²	107	104.2 Å²	104.2	50%	0.5	55%	0.547	S	S	.	.	H	α-helix	trans	-81.9	-46.2	169.4	-71.2	178.9	-158.4	0	0	110.7	R1021 F1023 S1027 K1028 N1029	R1021-E1025 WeakPolarHBondContact CG-OE1 3.34Å; R1021-E1025 PolarHBondContact O-N 2.93Å; F1023-E1025 VanDerWaalsContact C-N 3.3Å; F1023-E1025 PolarHBondContact O-N 3.28Å; E1025-S1027 VanDerWaalsContact C-N 3.35Å; E1025-S1027 PolarHBondContact O-N 3.16Å; E1025-K1028 PolarHBondContact O-N 2.82Å; E1025-K1028 VanDerWaalsContact O-N 3.1Å; E1025-N1029 PolarHBondContact O-ND2 3.48Å
1026	N	41.8	Very low	41.2	Very low	93 Å²	93	107.9 Å²	107.9	50%	0.497	57%	0.567	S	S	.	*	H	α-helix	trans	-64.9	-33.4	177.3	-74.5	-52.4	0	0	0	113.7	D1022 F1023 K1028 N1029	D1022-N1026 WeakPolarHBondContact O-CB 3.46Å; D1022-N1026 PolarHBondContact O-N 3.47Å; D1022-N1026 PolarHBondContact O-ND2 3.33Å; F1023-N1026 PolarHBondContact O-N 2.88Å; N1026-K1028 PolarHBondContact O-N 3.4Å; N1026-N1029 PolarHBondContact O-N 2.91Å; N1026-N1029 VanDerWaalsContact O-N 3.17Å
1027	S	38.6	Very low	40.5	Very low	70 Å²	70	111.6 Å²	111.6	49%	0.49	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.2	-9.2	175.1	71	0	0	0	0	114.1	F1023 N1024 E1025	F1023-S1027 WeakPolarHBondContact O-CB 3.45Å; F1023-S1027 PolarHBondContact O-N 3.19Å; F1023-S1027 PolarHBondContact O-OG 3.24Å; N1024-S1027 PolarHBondContact O-OG 3.33Å; E1025-S1027 VanDerWaalsContact C-N 3.35Å; E1025-S1027 PolarHBondContact O-N 3.16Å
1028	K	39.5	Very low	39.6	Very low	137 Å²	137	114.2 Å²	114.2	60%	0.596	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-13.5	173.9	-66.9	170.9	-173.7	171.1	0	113.1	N1024 E1025 N1026	N1024-K1028 VanDerWaalsContact O-CD 3.27Å; N1024-K1028 WeakPolarHBondContact O-CD 3.35Å; N1024-K1028 VanDerWaalsContact O-CE 3.25Å; N1024-K1028 WeakPolarHBondContact O-CE 3.36Å; N1024-K1028 WeakPolarHBondContact O-CG 3.47Å; N1024-K1028 WeakPolarHBondContact OD1-CE 3.34Å; N1024-K1028 PolarHBondContact OD1-NZ 3.29Å; E1025-K1028 PolarHBondContact O-N 2.82Å; E1025-K1028 VanDerWaalsContact O-N 3.1Å; N1026-K1028 PolarHBondContact O-N 3.4Å
1029	N	40.7	Very low	38.5	Very low	120 Å²	120	113.5 Å²	113.5	64%	0.642	61%	0.611	S	S	*	*	S	Bend	trans	-99.4	-1.1	-174	-64.8	-20.3	0	0	0	113.6	E1025 N1026	E1025-N1029 PolarHBondContact O-ND2 3.48Å; N1026-N1029 PolarHBondContact O-N 2.91Å; N1026-N1029 VanDerWaalsContact O-N 3.17Å
1030	H	35.5	Very low	37.8	Very low	168 Å²	168	114.4 Å²	114.4	78%	0.778	63%	0.633	S	S	*	*			trans	-123	73.8	-177.8	-82	-64.5	0	0	0	112.5
1031	S	32.3	Very low	36.9	Very low	106 Å²	106	118.6 Å²	118.6	74%	0.741	66%	0.656	S	S	*	*			trans	-152.7	26.4	173.8	74.3	0	0	0	0	116.8
1032	V	31.4	Very low	36	Very low	153 Å²	153	116.9 Å²	116.9	93%	0.927	66%	0.663	S	S	*	*			trans	-141.2	133.3	163.9	-174	0	0	0	0	108.6
1033	G	33	Very low	34.7	Very low	80 Å²	80	120.4 Å²	120.4	83%	0.825	69%	0.686	S	S	*	*			trans	153.9	61.5	-177.6	0	0	0	0	0	112.7
1034	D	37	Very low	33.9	Very low	124 Å²	124	122.1 Å²	122.1	66%	0.663	70%	0.7	S	S	*	*			trans	-102.7	127.2	176.7	-162.5	40.4	0	0	0	109.5
1035	K	35	Very low	33.2	Very low	151 Å²	151	127.4 Å²	127.4	66%	0.657	72%	0.723	S	S	*	*			trans	52.2	137.7	158.4	-64.2	-179.2	-163.4	70	0	119.3
1036	D	35.5	Very low	32.3	Very low	139 Å²	139	130.9 Å²	130.9	74%	0.743	74%	0.739	S	S	*	*			cis	-158.2	171.9	1.3	-102.7	-31.9	0	0	0	110.3
1037	D	34.5	Very low	31.6	Very low	121 Å²	121	131.3 Å²	131.3	65%	0.647	75%	0.749	S	S	*	*			trans	72.5	114.7	151.4	-104.3	-3.5	0	0	0	123
1038	K	34.1	Very low	31	Very low	175 Å²	175	135.5 Å²	135.5	76%	0.761	77%	0.766	S	S	*	*			trans	93.9	111.8	135.7	-71.1	159.9	-178.7	145.8	0	122.3
1039	A	29.2	Very low	30.5	Very low	108 Å²	108	132.8 Å²	132.8	89%	0.893	76%	0.764	S	S	*	*			trans	76.3	116.9	143	0	0	0	0	0	119.7
1040	G	29.5	Very low	30.1	Very low	75 Å²	75	131.9 Å²	131.9	77%	0.773	77%	0.767	S	S	*	*			trans	154.1	90	169.6	0	0	0	0	0	112.9	V1042	G1040-V1042 PolarHBondContact O-N 3.49Å
1041	D	25	Very low	29.9	Very low	161 Å²	161	131.4 Å²	131.4	86%	0.861	77%	0.77	S	S	*	*			trans	-69.4	112.2	-175.9	-70.3	-69.9	0	0	0	113.9
1042	V	26.9	Very low	30.2	Very low	128 Å²	128	130.1 Å²	130.1	78%	0.776	75%	0.754	S	S	*	*			trans	-136.2	100.7	152.4	-176.9	0	0	0	0	109	G1040 L1044	G1040-V1042 PolarHBondContact O-N 3.49Å; V1042-L1044 PolarHBondContact O-N 3.34Å
1043	V	23.5	Very low	30.7	Very low	124 Å²	124	125.3 Å²	125.3	75%	0.752	73%	0.727	S	S	*	*			trans	-79.1	118	174.6	178.8	0	0	0	0	109.7
1044	L	25.7	Very low	31.1	Very low	155 Å²	155	127.9 Å²	127.9	81%	0.812	72%	0.72	S	S	*	*			trans	-119.4	129.3	161.8	-77.7	171.3	0	0	0	109	V1042	V1042-L1044 PolarHBondContact O-N 3.34Å
1045	E	25.1	Very low	31.3	Very low	180 Å²	180	129.4 Å²	129.4	84%	0.841	72%	0.723	S	S	*	*			trans	-69.5	136.4	-166	-62.8	-171.1	127.3	0	0	113.8	S1047	E1045-S1047 PolarHBondContact O-N 2.72Å
1046	Q	25.3	Very low	31.7	Very low	180 Å²	180	125.4 Å²	125.4	84%	0.841	71%	0.712	S	S	*	*			trans	-72.4	84.5	173	-69	-177.7	-12.1	0	0	111.6	N1048	Q1046-N1048 PolarHBondContact O-N 3.18Å; Q1046-N1048 VanDerWaalsContact O-N 3.09Å; Q1046-N1048 PolarHBondContact O-ND2 3.48Å
1047	S	27.2	Very low	32.1	Very low	102 Å²	102	121.7 Å²	121.7	71%	0.713	69%	0.689	S	S	*	*			trans	-68.6	107.1	172.2	70.1	0	0	0	0	110.5	E1045 S1049	E1045-S1047 PolarHBondContact O-N 2.72Å; S1047-S1049 VanDerWaalsContact C-N 3.31Å; S1047-S1049 PolarHBondContact O-N 3.42Å
1048	N	25	Very low	32.5	Very low	159 Å²	159	121.5 Å²	121.5	85%	0.85	68%	0.68	S	S	*	*			trans	-71.6	75.4	-176.5	-85.7	-90.4	0	0	0	112.9	Q1046	Q1046-N1048 PolarHBondContact O-N 3.18Å; Q1046-N1048 VanDerWaalsContact O-N 3.09Å; Q1046-N1048 PolarHBondContact O-ND2 3.48Å
1049	S	30	Very low	33.4	Very low	79 Å²	79	120.1 Å²	120.1	55%	0.552	68%	0.676	S	S	*	*			trans	-89.6	110.4	165.9	59.9	0	0	0	0	110.3	S1047 L1051	S1047-S1049 VanDerWaalsContact C-N 3.31Å; S1047-S1049 PolarHBondContact O-N 3.42Å; S1049-L1051 PolarHBondContact O-N 2.92Å; S1049-L1051 VanDerWaalsContact O-N 3.15Å
1050	S	32	Very low	34.3	Very low	101 Å²	101	118.5 Å²	118.5	71%	0.706	65%	0.652	S	S	*	*			trans	-54.1	115.6	-179.3	56	0	0	0	0	112.5	I1052	S1050-I1052 PolarHBondContact O-N 3.45Å
1051	L	31.4	Very low	35.2	Very low	158 Å²	158	118.5 Å²	118.5	83%	0.827	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-59.1	122.2	169.9	-74.1	164.6	0	0	0	109.5	S1049	S1049-L1051 PolarHBondContact O-N 2.92Å; S1049-L1051 VanDerWaalsContact O-N 3.15Å
1052	I	37.7	Very low	36.3	Very low	80 Å²	80	113.5 Å²	113.5	41%	0.41	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-74.7	126.9	169.6	-61.4	177.4	0	0	0	106.4	I988 S1050 T1056 F1057	I988-I1052 HydrophobicContact CD1-CD1 4.1Å; S1050-I1052 PolarHBondContact O-N 3.45Å; I1052-T1056 VanDerWaalsContact CG2-OG1 3.28Å; I1052-T1056 WeakPolarHBondContact CG2-OG1 3.45Å; I1052-F1057 HydrophobicContact CG2-CB 4.09Å
1053	S	42.3	Very low	37.2	Very low	51 Å²	51	110 Å²	110	36%	0.357	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-65.2	151	176.5	70.7	0	0	0	0	110.5	E1055 T1056 F1057	S1053-E1055 PolarHBondContact O-N 2.9Å; S1053-T1056 PolarHBondContact N-OG1 3.03Å; S1053-T1056 PolarHBondContact O-N 2.91Å; S1053-T1056 PolarHBondContact O-OG1 3.01Å; S1053-T1056 VanDerWaalsContact O-OG1 3.07Å; S1053-T1056 PolarHBondContact OG-N 2.82Å; S1053-T1056 VanDerWaalsContact OG-N 3.12Å; S1053-T1056 PolarHBondContact OG-OG1 3.26Å; S1053-F1057 PolarHBondContact O-N 2.84Å
1054	I	40.4	Very low	38.1	Very low	134 Å²	134	105.6 Å²	105.6	69%	0.687	57%	0.572	S	S	*	*	H	α-helix	trans	-55.5	-37.4	178	-63.9	174.4	0	0	0	110.4	F1057 Y1058	I1054-F1057 PolarHBondContact O-N 3.26Å; I1054-Y1058 WeakPolarHBondContact O-CB 3.42Å; I1054-Y1058 PolarHBondContact O-N 3.49Å
1055	E	42.1	Very low	38.9	Very low	156 Å²	156	102.7 Å²	102.7	73%	0.729	56%	0.557	S	S	*	*	H	α-helix	trans	-61.2	-49.1	173.4	-58.1	172	129.9	0	0	112.8	S1053 F1057 Y1058 E1059	S1053-E1055 PolarHBondContact O-N 2.9Å; E1055-F1057 VanDerWaalsContact C-N 3.3Å; E1055-F1057 PolarHBondContact O-N 3.45Å; E1055-Y1058 WeakPolarHBondContact O-CB 3.36Å; E1055-Y1058 PolarHBondContact O-N 2.98Å; E1055-Y1058 VanDerWaalsContact O-N 3.11Å; E1055-E1059 WeakPolarHBondContact O-CB 3.42Å; E1055-E1059 WeakPolarHBondContact O-CG 3.38Å; E1055-E1059 PolarHBondContact O-N 3Å
1056	T	44.3	Very low	39.8	Very low	68 Å²	68	97.3 Å²	97.3	42%	0.417	54%	0.539	S	S	.	.	H	α-helix	trans	-70.9	-26.4	-179.4	48.1	0	0	0	0	112.7	I1052 S1053 L1060	I1052-T1056 VanDerWaalsContact CG2-OG1 3.28Å; I1052-T1056 WeakPolarHBondContact CG2-OG1 3.45Å; S1053-T1056 PolarHBondContact N-OG1 3.03Å; S1053-T1056 PolarHBondContact O-N 2.91Å; S1053-T1056 PolarHBondContact O-OG1 3.01Å; S1053-T1056 VanDerWaalsContact O-OG1 3.07Å; S1053-T1056 PolarHBondContact OG-N 2.82Å; S1053-T1056 VanDerWaalsContact OG-N 3.12Å; S1053-T1056 PolarHBondContact OG-OG1 3.26Å; T1056-L1060 WeakPolarHBondContact O-CD1 3.26Å; T1056-L1060 WeakPolarHBondContact O-CG 3.45Å; T1056-L1060 PolarHBondContact O-N 2.93Å
1057	F	43.8	Very low	40.7	Very low	61 Å²	61	93.5 Å²	93.5	27%	0.268	52%	0.52	S	S	.	.	H	α-helix	trans	-67.7	-43.9	166.4	-178	-92.8	0	0	0	111.8	L1020 I1052 S1053 I1054 E1055 L1060 L1061	L1020-F1057 HydrophobicContact CD1-CE1 4.3Å; L1020-F1057 HydrophobicContact CD1-CZ 4.04Å; L1020-F1057 HydrophobicContact CD2-CE1 3.74Å; L1020-F1057 HydrophobicContact CD2-CZ 3.77Å; L1020-F1057 HydrophobicContact CG-CZ 4.26Å; I1052-F1057 HydrophobicContact CG2-CB 4.09Å; S1053-F1057 PolarHBondContact O-N 2.84Å; I1054-F1057 PolarHBondContact O-N 3.26Å; E1055-F1057 VanDerWaalsContact C-N 3.3Å; E1055-F1057 PolarHBondContact O-N 3.45Å; F1057-L1060 PolarHBondContact O-N 2.83Å; F1057-L1061 HydrophobicContact CE1-CD2 4.42Å; F1057-L1061 PolarHBondContact O-N 3.05Å
1058	Y	43.1	Very low	41.3	Very low	117 Å²	117	92.8 Å²	92.8	46%	0.459	51%	0.505	S	S	.	.	H	α-helix	trans	-65.9	-41.8	179.9	-162.3	-90.1	0	0	0	112.4	I1054 E1055 L1061 C1062	I1054-Y1058 WeakPolarHBondContact O-CB 3.42Å; I1054-Y1058 PolarHBondContact O-N 3.49Å; E1055-Y1058 WeakPolarHBondContact O-CB 3.36Å; E1055-Y1058 PolarHBondContact O-N 2.98Å; E1055-Y1058 VanDerWaalsContact O-N 3.11Å; Y1058-L1061 PolarHBondContact O-N 2.85Å; Y1058-C1062 WeakPolarHBondContact CE1-SG 3.36Å; Y1058-C1062 WeakPolarHBondContact O-CB 3.43Å; Y1058-C1062 PolarHBondContact O-N 2.79Å; Y1058-C1062 PolarHBondContact O-SG 2.87Å
1059	E	51.8	Low	41.9	Very low	146 Å²	146	90.1 Å²	90.1	68%	0.682	48%	0.483	S	S	*	.	H	α-helix	trans	-53	-51.3	169.1	-80.6	-92.7	125.6	0	0	111.5	E1055 L1061 C1062 A1063	E1055-E1059 WeakPolarHBondContact O-CB 3.42Å; E1055-E1059 WeakPolarHBondContact O-CG 3.38Å; E1055-E1059 PolarHBondContact O-N 3Å; E1059-L1061 PolarHBondContact O-N 3.46Å; E1059-C1062 PolarHBondContact O-N 2.97Å; E1059-A1063 WeakPolarHBondContact O-CB 3.42Å; E1059-A1063 PolarHBondContact O-N 2.96Å
1060	L	47.3	Very low	42.5	Very low	73 Å²	73	93 Å²	93	38%	0.382	49%	0.488	S	S	.	.	H	α-helix	trans	-62.9	-41.3	179.4	-79.9	167.1	0	0	0	112.4	T1056 F1057 A1063 A1064	T1056-L1060 WeakPolarHBondContact O-CD1 3.26Å; T1056-L1060 WeakPolarHBondContact O-CG 3.45Å; T1056-L1060 PolarHBondContact O-N 2.93Å; F1057-L1060 PolarHBondContact O-N 2.83Å; L1060-A1063 PolarHBondContact O-N 3.02Å; L1060-A1064 WeakPolarHBondContact O-CB 3.46Å; L1060-A1064 PolarHBondContact O-N 2.71Å
1061	L	50.3	Low	42.5	Very low	76 Å²	76	96.6 Å²	96.6	40%	0.398	49%	0.487	S	S	.	.	H	α-helix	trans	-64.1	-46.2	176.4	-174	66.4	0	0	0	111.2	F1057 Y1058 E1059 A1063 A1064 L1065	F1057-L1061 HydrophobicContact CE1-CD2 4.42Å; F1057-L1061 PolarHBondContact O-N 3.05Å; Y1058-L1061 PolarHBondContact O-N 2.85Å; E1059-L1061 PolarHBondContact O-N 3.46Å; L1061-A1063 PolarHBondContact O-N 3.44Å; L1061-A1064 PolarHBondContact O-N 2.97Å; L1061-L1065 HydrophobicContact CD1-CD1 4.47Å; L1061-L1065 HydrophobicContact CG-CD1 4.15Å; L1061-L1065 WeakPolarHBondContact O-CG 3.39Å; L1061-L1065 PolarHBondContact O-N 3.13Å
1062	C	46.3	Very low	42.9	Very low	56 Å²	56	93 Å²	93	38%	0.378	47%	0.474	S	S	.	.	H	α-helix	trans	-63.2	-40.9	176.6	-69.5	0	0	0	0	112.1	Y1058 E1059 L1065 S1066	Y1058-C1062 WeakPolarHBondContact CE1-SG 3.36Å; Y1058-C1062 WeakPolarHBondContact O-CB 3.43Å; Y1058-C1062 PolarHBondContact O-N 2.79Å; Y1058-C1062 PolarHBondContact O-SG 2.87Å; E1059-C1062 PolarHBondContact O-N 2.97Å; C1062-L1065 PolarHBondContact O-N 3.02Å; C1062-S1066 WeakPolarHBondContact O-CB 3.19Å; C1062-S1066 PolarHBondContact O-N 3.03Å
1063	A	47.4	Very low	42.9	Very low	55 Å²	55	94.8 Å²	94.8	46%	0.455	49%	0.485	S	S	.	.	H	α-helix	trans	-64	-39.6	175.9	0	0	0	0	0	112.4	E1059 L1060 L1061 K1067	E1059-A1063 WeakPolarHBondContact O-CB 3.42Å; E1059-A1063 PolarHBondContact O-N 2.96Å; L1060-A1063 PolarHBondContact O-N 3.02Å; L1061-A1063 PolarHBondContact O-N 3.44Å; A1063-K1067 PolarHBondContact O-N 3.26Å
1064	A	41.2	Very low	42.4	Very low	30 Å²	30	100.6 Å²	100.6	25%	0.248	50%	0.499	C	S	.	.	H	α-helix	trans	-65.5	-48.4	176	0	0	0	0	0	112	L1060 L1061 S1066 K1067 Q1068	L1060-A1064 WeakPolarHBondContact O-CB 3.46Å; L1060-A1064 PolarHBondContact O-N 2.71Å; L1061-A1064 PolarHBondContact O-N 2.97Å; A1064-S1066 VanDerWaalsContact C-N 3.34Å; A1064-S1066 PolarHBondContact O-N 3.22Å; A1064-K1067 PolarHBondContact O-N 3.48Å; A1064-Q1068 PolarHBondContact O-N 3.45Å
1065	L	43.2	Very low	42.1	Very low	95 Å²	95	99.2 Å²	99.2	50%	0.497	50%	0.498	S	S	.	.	H	α-helix	trans	-64.9	-36.3	177.4	-67.8	170.9	0	0	0	112.1	L1061 C1062 Q1068 R1069	L1061-L1065 HydrophobicContact CD1-CD1 4.47Å; L1061-L1065 HydrophobicContact CG-CD1 4.15Å; L1061-L1065 WeakPolarHBondContact O-CG 3.39Å; L1061-L1065 PolarHBondContact O-N 3.13Å; C1062-L1065 PolarHBondContact O-N 3.02Å; L1065-Q1068 PolarHBondContact O-N 2.88Å; L1065-R1069 WeakPolarHBondContact O-CB 3.49Å; L1065-R1069 PolarHBondContact O-N 2.82Å
1066	S	43.2	Very low	42	Very low	67 Å²	67	99 Å²	99	47%	0.469	50%	0.498	S	S	.	.	H	α-helix	trans	-65.5	-44.3	175	-174	0	0	0	0	112.1	C1062 A1064 Q1068 R1069 Q1070	C1062-S1066 WeakPolarHBondContact O-CB 3.19Å; C1062-S1066 PolarHBondContact O-N 3.03Å; A1064-S1066 VanDerWaalsContact C-N 3.34Å; A1064-S1066 PolarHBondContact O-N 3.22Å; S1066-Q1068 PolarHBondContact O-N 3.46Å; S1066-R1069 PolarHBondContact O-N 2.65Å; S1066-Q1070 PolarHBondContact O-N 3.09Å
1067	K	44.3	Very low	41.5	Very low	100 Å²	100	104.8 Å²	104.8	44%	0.435	51%	0.512	S	S	.	.	H	α-helix	trans	-61	-43.5	171.7	-87.6	-170.2	174.7	-175.8	0	111.9	S995 A1063 A1064 R1069 Q1070 Y1071	S995-K1067 PolarHBondContact OG-NZ 3.44Å; A1063-K1067 PolarHBondContact O-N 3.26Å; A1064-K1067 PolarHBondContact O-N 3.48Å; K1067-R1069 VanDerWaalsContact C-N 3.31Å; K1067-R1069 PolarHBondContact O-N 3.05Å; K1067-Q1070 PolarHBondContact O-N 3.08Å; K1067-Y1071 WeakPolarHBondContact O-CD2 3.47Å; K1067-Y1071 PolarHBondContact O-N 3.31Å; K1067-Y1071 VanDerWaalsContact O-N 3.17Å
1068	Q	39.7	Very low	41	Very low	86 Å²	86	107 Å²	107	40%	0.402	53%	0.526	S	S	.	.	H	α-helix	trans	-57.7	-45.7	175.2	-176.4	178.4	-11.5	0	0	110.8	A1064 L1065 S1066 Q1070 Y1071 C1072	A1064-Q1068 PolarHBondContact O-N 3.45Å; L1065-Q1068 PolarHBondContact O-N 2.88Å; S1066-Q1068 PolarHBondContact O-N 3.46Å; Q1068-Q1070 PolarHBondContact O-N 3Å; Q1068-Y1071 PolarHBondContact O-N 3.49Å; Q1068-C1072 PolarHBondContact O-N 3.33Å; Q1068-C1072 VanDerWaalsContact O-N 3.08Å; Q1068-C1072 PolarHBondContact O-SG 2.84Å; Q1068-C1072 VanDerWaalsContact O-SG 3.33Å
1069	R	38.8	Very low	40.6	Very low	103 Å²	103	106.4 Å²	106.4	39%	0.389	54%	0.539	S	S	.	.	H	α-helix	trans	-61.9	-40.5	177.9	-166.5	172.5	-165	145.8	13	113.4	T426 L1065 S1066 K1067 Y1071	T426-R1069 PolarHBondContact O-NH2 2.99Å; L1065-R1069 WeakPolarHBondContact O-CB 3.49Å; L1065-R1069 PolarHBondContact O-N 2.82Å; S1066-R1069 PolarHBondContact O-N 2.65Å; K1067-R1069 VanDerWaalsContact C-N 3.31Å; K1067-R1069 PolarHBondContact O-N 3.05Å; R1069-Y1071 VanDerWaalsContact C-N 3.31Å; R1069-Y1071 PolarHBondContact O-N 3.22Å
1070	Q	41.8	Very low	39.7	Very low	141 Å²	141	107 Å²	107	66%	0.659	54%	0.542	S	S	*	.	H	α-helix	trans	-64.2	-33.8	175.3	-75.9	-172.9	-17.7	0	0	113	S1066 K1067 Q1068	S1066-Q1070 PolarHBondContact O-N 3.09Å; K1067-Q1070 PolarHBondContact O-N 3.08Å; Q1068-Q1070 PolarHBondContact O-N 3Å
1071	Y	33.3	Very low	38.9	Very low	176 Å²	176	108.1 Å²	108.1	69%	0.69	55%	0.546	S	S	*	.	H	α-helix	trans	-79.4	-30.3	179.6	-91.6	-89	0	0	0	114	K1067 Q1068 R1069 N1073	K1067-Y1071 WeakPolarHBondContact O-CD2 3.47Å; K1067-Y1071 PolarHBondContact O-N 3.31Å; K1067-Y1071 VanDerWaalsContact O-N 3.17Å; Q1068-Y1071 PolarHBondContact O-N 3.49Å; R1069-Y1071 VanDerWaalsContact C-N 3.31Å; R1069-Y1071 PolarHBondContact O-N 3.22Å; Y1071-N1073 VanDerWaalsContact C-N 3.27Å; Y1071-N1073 PolarHBondContact O-N 3.11Å
1072	C	37.9	Very low	38	Very low	81 Å²	81	109.1 Å²	109.1	55%	0.547	55%	0.552	S	S	.	*	H	α-helix	trans	-68.5	-22.8	176.5	-66.4	0	0	0	0	113.6	Q1068 R1074	Q1068-C1072 PolarHBondContact O-N 3.33Å; Q1068-C1072 VanDerWaalsContact O-N 3.08Å; Q1068-C1072 PolarHBondContact O-SG 2.84Å; Q1068-C1072 VanDerWaalsContact O-SG 3.33Å; C1072-R1074 PolarHBondContact O-N 3.4Å
1073	N	38.4	Very low	37.5	Very low	118 Å²	118	113.7 Å²	113.7	63%	0.631	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	30.6	-178	-75	8.2	0	0	0	114.3	Y1071	Y1071-N1073 VanDerWaalsContact C-N 3.27Å; Y1071-N1073 PolarHBondContact O-N 3.11Å
1074	R	32.8	Very low	36.8	Very low	174 Å²	174	116.8 Å²	116.8	66%	0.657	57%	0.57	S	S	*	*			trans	-119.4	105.3	171.3	-74.1	-166	177.8	-143	1.5	110.3	C1072 E1076	C1072-R1074 PolarHBondContact O-N 3.4Å; R1074-E1076 VanDerWaalsContact C-N 3.26Å; R1074-E1076 PolarHBondContact O-N 2.88Å
1075	P	33.2	Very low	36.4	Very low	104 Å²	104	122.4 Å²	122.4	68%	0.675	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-66.5	-26.8	-173.2	25.6	-33.9	0	0	0	113.5	R1077 L1078	P1075-R1077 PolarHBondContact O-N 3.13Å; P1075-L1078 PolarHBondContact O-N 2.84Å
1076	E	40.6	Very low	35.8	Very low	152 Å²	152	119.2 Å²	119.2	71%	0.71	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-63.4	0.9	-173.4	-55.9	173.3	135.1	0	0	115.9	R1074	R1074-E1076 VanDerWaalsContact C-N 3.26Å; R1074-E1076 PolarHBondContact O-N 2.88Å
1077	R	34	Very low	35.2	Very low	189 Å²	189	121.4 Å²	121.4	71%	0.713	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-127.6	1	179.6	-77.9	-172.8	171.6	165.4	0.5	115.6	P1075	P1075-R1077 PolarHBondContact O-N 3.13Å
1078	L	32.3	Very low	34.6	Very low	108 Å²	108	125.2 Å²	125.2	57%	0.565	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-23.8	175.1	-76.1	163	0	0	0	112.4	P1075	P1075-L1078 PolarHBondContact O-N 2.84Å
1079	S	34.7	Very low	34.2	Very low	105 Å²	105	125.7 Å²	125.7	73%	0.734	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-21.6	-179.3	47.1	0	0	0	0	115.1
1080	E	33	Very low	33.9	Very low	159 Å²	159	125.2 Å²	125.2	74%	0.743	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-6.8	178.9	-61.1	-174.1	139.7	0	0	113	N1082	E1080-N1082 PolarHBondContact O-N 3.08Å
1081	M	29.8	Very low	33.4	Very low	96 Å²	96	125.4 Å²	125.4	47%	0.473	63%	0.627	S	S	.	*			trans	-92	90.3	-167.1	-165.4	157.1	178	0	0	111.8	W1083	M1081-W1083 HydrophobicContact CE-CH2 3.85Å; M1081-W1083 HydrophobicContact CE-CZ2 4.07Å; M1081-W1083 HydrophobicContact CE-CZ3 4.12Å; M1081-W1083 HydrophobicContact CG-CZ2 4.26Å; M1081-W1083 PolarHBondContact O-N 3.3Å; M1081-W1083 PolarHBondContact O-NE1 3.3Å; M1081-W1083 HydrophobicContact SD-CH2 4.26Å; M1081-W1083 HydrophobicContact SD-CZ2 3.91Å
1082	N	31.7	Very low	33.3	Very low	96 Å²	96	125.2 Å²	125.2	51%	0.513	63%	0.632	S	S	.	*			trans	-70.4	95.8	175.5	-174	-6.1	0	0	0	111.3	E1080 D1084	E1080-N1082 PolarHBondContact O-N 3.08Å; N1082-D1084 PolarHBondContact O-N 3Å
1083	W	36.3	Very low	32.8	Very low	153 Å²	153	130.5 Å²	130.5	58%	0.58	65%	0.646	S	S	*	*	H	α-helix	trans	-64.4	-33.1	-172.2	-72.1	92.7	0	0	0	114.4	M1081 Q1085 A1086 L1087	M1081-W1083 HydrophobicContact CE-CH2 3.85Å; M1081-W1083 HydrophobicContact CE-CZ2 4.07Å; M1081-W1083 HydrophobicContact CE-CZ3 4.12Å; M1081-W1083 HydrophobicContact CG-CZ2 4.26Å; M1081-W1083 PolarHBondContact O-N 3.3Å; M1081-W1083 PolarHBondContact O-NE1 3.3Å; M1081-W1083 HydrophobicContact SD-CH2 4.26Å; M1081-W1083 HydrophobicContact SD-CZ2 3.91Å; W1083-Q1085 PolarHBondContact O-N 3.35Å; W1083-A1086 PolarHBondContact O-N 2.74Å; W1083-A1086 VanDerWaalsContact O-N 3.08Å; W1083-L1087 PolarHBondContact O-N 3.34Å
1084	D	32.1	Very low	32.7	Very low	120 Å²	120	134.6 Å²	134.6	64%	0.642	68%	0.679	S	S	*	*	H	α-helix	trans	-65.5	-37.7	-173.5	-65.7	-35.1	0	0	0	112.5	N1082 A1086	N1082-D1084 PolarHBondContact O-N 3Å; D1084-A1086 VanDerWaalsContact C-N 3.32Å; D1084-A1086 PolarHBondContact O-N 3.09Å
1085	Q	33.6	Very low	32.7	Very low	147 Å²	147	132.6 Å²	132.6	69%	0.687	68%	0.68	S	S	*	*	H	α-helix	trans	-72.2	-24	175.4	-70	-170.8	-21.4	0	0	113.3	W1083 L1087 S1089	W1083-Q1085 PolarHBondContact O-N 3.35Å; Q1085-L1087 VanDerWaalsContact C-N 3.34Å; Q1085-S1089 PolarHBondContact O-OG 2.64Å; Q1085-S1089 VanDerWaalsContact O-OG 3.13Å
1086	A	30.3	Very low	32.6	Very low	29 Å²	29	134.1 Å²	134.1	24%	0.24	68%	0.68	C	S	.	*	H	α-helix	trans	-84.2	-7.3	-178	0	0	0	0	0	114.2	R1010 W1083 D1084	R1010-A1086 PolarHBondContact NH1-O 2.93Å; R1010-A1086 PolarHBondContact NH2-O 3.14Å; R1010-A1086 VanDerWaalsContact NH2-O 3.15Å; W1083-A1086 PolarHBondContact O-N 2.74Å; W1083-A1086 VanDerWaalsContact O-N 3.08Å; D1084-A1086 VanDerWaalsContact C-N 3.32Å; D1084-A1086 PolarHBondContact O-N 3.09Å
1087	L	31.3	Very low	32.2	Very low	112 Å²	112	133.1 Å²	133.1	59%	0.586	68%	0.679	S	S	*	*	H	α-helix	trans	-100.6	-49.1	178.9	-141.6	75.1	0	0	0	112.2	W1083 Q1085 S1089	W1083-L1087 PolarHBondContact O-N 3.34Å; Q1085-L1087 VanDerWaalsContact C-N 3.34Å; L1087-S1089 VanDerWaalsContact C-N 3.28Å; L1087-S1089 PolarHBondContact O-N 2.81Å
1088	F	31.1	Very low	32.1	Very low	180 Å²	180	129.8 Å²	129.8	79%	0.789	68%	0.677	S	S	*	*	H	α-helix	trans	-64.4	-25.7	-175.1	-91.4	-85.7	0	0	0	114.9	T1090	F1088-T1090 VanDerWaalsContact C-N 3.27Å; F1088-T1090 PolarHBondContact O-N 2.73Å
1089	S	30.9	Very low	32.1	Very low	97 Å²	97	131.2 Å²	131.2	68%	0.678	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	6.8	-172.4	47.8	0	0	0	0	115.7	Q1085 L1087	Q1085-S1089 PolarHBondContact O-OG 2.64Å; Q1085-S1089 VanDerWaalsContact O-OG 3.13Å; L1087-S1089 VanDerWaalsContact C-N 3.28Å; L1087-S1089 PolarHBondContact O-N 2.81Å
1090	T	32.8	Very low	31.9	Very low	93 Å²	93	132.9 Å²	132.9	57%	0.571	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.1	8.6	-169.8	-31.2	0	0	0	0	114.8	F1088	F1088-T1090 VanDerWaalsContact C-N 3.27Å; F1088-T1090 PolarHBondContact O-N 2.73Å
1091	I	31.9	Very low	31.8	Very low	144 Å²	144	131.1 Å²	131.1	74%	0.738	68%	0.676	S	S	*	*	S	Bend	trans	-115.8	-7.3	-170.5	-64.6	178.1	0	0	0	113.7
1092	E	30	Very low	32	Very low	172 Å²	172	133.8 Å²	133.8	80%	0.804	69%	0.691	S	S	*	*			trans	-99.4	133.8	175.2	-71.5	-163.7	154.3	0	0	114
1093	K	28.6	Very low	32	Very low	192 Å²	192	136.9 Å²	136.9	84%	0.835	71%	0.706	S	S	*	*			trans	94.6	139.5	169.9	-61.2	172.3	-176.1	172.7	0	115.4
1094	P	35	Very low	31.6	Very low	204 Å²	204	135.5 Å²	135.5	100%	1.325	72%	0.718	S	S	*	*				-91.7	0	-105.2	31.4	-39	0	0	0	114.9

Retrieved 1,094 of 1,094 residues in 1199 ms (Link to these results)

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