A0A3Q0KPN7_SCHMA Loading...

Tyrosine-protein kinase

AlphaFold DB , UniProt , Accession A0A3Q0KPN7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,257 aa.

						>A0A3Q0KPN7_SCHMA|A0A3Q0KPN7
MHNNILINNNSTTTTNNNSNMNVTNNVVVTPAHLLTLLPGAIPPESTNYFYGKITREQAEELLFTNGANEGLFLLRESVNRNYAVSICHLGRVHHYNVERQTDCSYRIQTVELVQHHSTQLDGFLTLAQLPLNRPVGMSPIVLQGLNANDLEHNLRLKAIEMGLKGQSVEEALNGPMRNHLRFLVIKDLHLLQPWYHHTIRRYEAESRLASEGNQDGAFLVRYRKEDRTYVLSLTSQNEPKHYRIEEYLSRWSIEGGQYFETIMELIDHYHFRQDGLLCKLQKPIPVSNFTCSFSGSGGISKITTIDDFKIPIISDKNQQYKPQTMTSNNWNGSHSLPSLNSIPVTGVNPFNINTNTNIQSIVSNGVNDTITSKTITTMTTTISSTTATTTITTTTTSTINNTPTLTTNPIRQDLISFNDWPNVTMLLSNQNPSNEIITTTPTTGSIIPGTNTTITTNEQACNFINRYPNSQTIFTPFTTNLSSSGQTPLKMTNSHNTTNNNRLISSNRFIQTSTTKVTTTTTTPPVESSMTTPSNSSNFTNAMLIGSTLIPQMALFDREINEVTKLMNGQTTSVSTNIHNTTMSNNNNVKDSRVGCLKPIRLNEPLTTMSKAFAEVDNAIAQVVSNAFSSPSTNRQSISPITSTITTVITTTTTVMTTMIAPSIDNLKNSSCINTHFIHNQCNHTTTNNTMDHHNDNVNIIDKRITINKEFIPTQTLHFPPILDTPWEEPDCSEEHAQSTSSSGGSFGSGCASGGSSSSVGAGSCGNSGLTPTNTNISTFIGNNPFLPLISPTLTRRTSSLNNSNHLMNKINFTDNNNETLCSTTTTTNNNSNNNTVGNIGPMETQSNRSAWANAISPENAQQIYDELPPSNFLLNSQTVTLKERLGGGNFGHVVKGLYRTPSGQEVPVAVKTLKPNQIANSGEREILAEARTMAQLKHRHIVRLIGVCKEEQFMLVLELAPLGPINKYLKKRPDVSVHTLTELMHQVALGMAYLESCKFVHRDLAARNVLLVTRHFAKISDFGMSKALNFGSDYYRAATAGKWPLKWYAPECIYYFRFDSKSDVWSYGITLWEVYSYGERPYRDMKGAQILAMLDQGLRLSRPSRCPESIYSIMQQCWNFEGVHRPTFAELVLTISRILRAMPSPQTNICIPNHHHHHHTNNSGSNNINTSNSNNNVLSSNLPTKFDHLHSPTHQHNNSNKNDNNNNNNTTIIHNNNTGLHPIEFSPLRRLGGIGTSTSSGGSGVNSGGSDGTSF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	24.3	Very low	27.6	Very low	245 Å²	245	153.5 Å²	153.5	100%	1.207	81%	0.81	S	S	*	*				0	165.4	0	-70.2	176.4	177.2	0	0	108.3
2	H	25.9	Very low	27.9	Very low	173 Å²	173	152.1 Å²	152.1	80%	0.801	81%	0.813	S	S	*	*			trans	-77.5	151.9	-166.8	-91.9	62.4	0	0	0	114.8
3	N	26	Very low	28	Very low	133 Å²	133	150.8 Å²	150.8	71%	0.711	81%	0.814	S	S	*	*			trans	47.1	118.8	148.6	-58.7	-0.3	0	0	0	120.3
4	N	29	Very low	28.1	Very low	153 Å²	153	149.8 Å²	149.8	82%	0.818	82%	0.816	S	S	*	*				-160.9	99	122.7	-102.9	-23.4	0	0	0	111.2
5	I	29.6	Very low	28.2	Very low	155 Å²	155	148.2 Å²	148.2	80%	0.795	81%	0.813	S	S	*	*			trans	-95.9	107.1	163.6	-61.2	176.9	0	0	0	106.7	I7	I5-I7 HydrophobicContact CG2-CG1 4.07Å; I5-I7 PolarHBondContact O-N 3.49Å
6	L	28.2	Very low	28.3	Very low	154 Å²	154	149.3 Å²	149.3	81%	0.806	82%	0.818	S	S	*	*			trans	-77.9	88.2	174.2	-106.8	126.1	0	0	0	109.9	N8	L6-N8 PolarHBondContact O-N 3.34Å
7	I	28.9	Very low	28.2	Very low	122 Å²	122	149.4 Å²	149.4	63%	0.626	82%	0.817	S	S	*	*			trans	-70.3	114	165	-56.3	179.6	0	0	0	107.3	I5 N9	I5-I7 HydrophobicContact CG2-CG1 4.07Å; I5-I7 PolarHBondContact O-N 3.49Å; I7-N9 WeakPolarHBondContact CG2-OD1 3.41Å; I7-N9 PolarHBondContact O-N 3.22Å
8	N	27.6	Very low	28.2	Very low	146 Å²	146	149.7 Å²	149.7	78%	0.781	82%	0.817	S	S	*	*			trans	-80	63.5	-175.2	-159.1	13	0	0	0	111.8	L6 N10	L6-N8 PolarHBondContact O-N 3.34Å; N8-N10 PolarHBondContact O-N 2.6Å
9	N	25.6	Very low	28.1	Very low	138 Å²	138	147.3 Å²	147.3	74%	0.738	81%	0.813	S	S	*	*			trans	-75.1	90	179.4	-84.2	-11.6	0	0	0	111	I7	I7-N9 WeakPolarHBondContact CG2-OD1 3.41Å; I7-N9 PolarHBondContact O-N 3.22Å
10	N	27.1	Very low	28	Very low	153 Å²	153	148.3 Å²	148.3	82%	0.818	82%	0.817	S	S	*	*			trans	-141.2	62.9	169.1	-117.2	-17.8	0	0	0	112.1	N8	N8-N10 PolarHBondContact O-N 2.6Å
11	S	31.4	Very low	27.9	Very low	116 Å²	116	149.4 Å²	149.4	81%	0.811	82%	0.818	S	S	*	*			trans	-138.1	124.1	160.3	53.8	0	0	0	0	108.9
12	T	31.5	Very low	28	Very low	137 Å²	137	145 Å²	145	84%	0.84	80%	0.8	S	S	*	*			trans	-79.5	137.6	-171.8	36.1	0	0	0	0	111.7	T14	T12-T14 PolarHBondContact O-N 3.1Å
13	T	28.6	Very low	28.1	Very low	135 Å²	135	141.7 Å²	141.7	83%	0.828	79%	0.791	S	S	*	*			trans	-77.3	112.2	179.2	48.4	0	0	0	0	111.6
14	T	30.3	Very low	28.3	Very low	137 Å²	137	140 Å²	140	84%	0.84	79%	0.786	S	S	*	*			trans	-112.9	106	152.8	44.8	0	0	0	0	108.7	T12 N16	T12-T14 PolarHBondContact O-N 3.1Å; T14-N16 PolarHBondContact O-N 3.05Å
15	T	28.5	Very low	28.6	Very low	126 Å²	126	138.7 Å²	138.7	77%	0.773	78%	0.779	S	S	*	*			trans	-71.4	125.1	179.8	50.1	0	0	0	0	111.3
16	N	30.4	Very low	28.9	Very low	166 Å²	166	136.4 Å²	136.4	89%	0.888	77%	0.769	S	S	*	*			trans	-150.6	126.6	153.6	-105.6	-31.5	0	0	0	109.7	T14	T14-N16 PolarHBondContact O-N 3.05Å
17	N	26.9	Very low	29.4	Very low	150 Å²	150	132.2 Å²	132.2	80%	0.802	75%	0.749	S	S	*	*			trans	-85	125.4	-177.3	-66.5	-31.3	0	0	0	110.6
18	N	27.4	Very low	30	Very low	155 Å²	155	130.4 Å²	130.4	83%	0.829	74%	0.743	S	S	*	*				-179.6	150.5	124.5	-95	-29.4	0	0	0	114.7
19	S	27.2	Very low	30.8	Very low	104 Å²	104	124.2 Å²	124.2	73%	0.727	71%	0.711	S	S	*	*	S	Bend	trans	58.5	118.5	156.4	55	0	0	0	0	120.8
20	N	26.2	Very low	31.4	Very low	168 Å²	168	122.7 Å²	122.7	90%	0.898	71%	0.707	S	S	*	*			trans	52.9	88	148.8	-64.3	1.5	0	0	0	119.1
21	M	25.8	Very low	32.1	Very low	171 Å²	171	118.4 Å²	118.4	84%	0.842	69%	0.687	S	S	*	*			trans	-112.5	123.4	154.5	-94.1	-71.1	-161.1	0	0	110.3	V23	M21-V23 HydrophobicContact CB-CG2 4.12Å; M21-V23 PolarHBondContact O-N 3.12Å
22	N	26.1	Very low	32.1	Very low	154 Å²	154	116.8 Å²	116.8	82%	0.824	68%	0.681	S	S	*	*			trans	-86.5	83.6	174.4	-167.6	10.2	0	0	0	109	T24	N22-T24 PolarHBondContact O-N 3.38Å
23	V	27.2	Very low	32.3	Very low	103 Å²	103	115.9 Å²	115.9	62%	0.624	67%	0.667	S	S	*	*			trans	-73	101	-167.5	-174.3	0	0	0	0	111.6	M21 N25	M21-V23 HydrophobicContact CB-CG2 4.12Å; M21-V23 PolarHBondContact O-N 3.12Å; V23-N25 WeakPolarHBondContact CG1-OD1 3.44Å; V23-N25 PolarHBondContact O-N 3.07Å; V23-N25 VanDerWaalsContact O-N 3.12Å
24	T	31.1	Very low	32.3	Very low	98 Å²	98	116.3 Å²	116.3	60%	0.601	66%	0.664	S	S	*	*			trans	-73.7	97.1	170.1	53.1	0	0	0	0	110.4	N22 N26	N22-T24 PolarHBondContact O-N 3.38Å; T24-N26 VanDerWaalsContact C-N 3.28Å; T24-N26 PolarHBondContact O-N 3.3Å
25	N	34.1	Very low	32.3	Very low	124 Å²	124	115 Å²	115	66%	0.663	65%	0.651	S	S	*	*			trans	-67.6	79.8	175.1	-75.4	-12.8	0	0	0	112.1	V23 V27	V23-N25 WeakPolarHBondContact CG1-OD1 3.44Å; V23-N25 PolarHBondContact O-N 3.07Å; V23-N25 VanDerWaalsContact O-N 3.12Å; N25-V27 PolarHBondContact O-N 2.86Å
26	N	37.4	Very low	32.3	Very low	108 Å²	108	114.6 Å²	114.6	58%	0.578	65%	0.648	S	S	*	*			trans	-82.4	93.8	166.9	-74.9	-14.6	0	0	0	109.3	T24	T24-N26 VanDerWaalsContact C-N 3.28Å; T24-N26 PolarHBondContact O-N 3.3Å
27	V	38.4	Very low	32.6	Very low	65 Å²	65	109.6 Å²	109.6	39%	0.394	62%	0.621	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82	115.2	169.7	-179	0	0	0	0	108.5	N25 V29 Y96	N25-V27 PolarHBondContact O-N 2.86Å; V27-V29 HydrophobicContact CG1-CG2 4.31Å; V27-Y96 HydrophobicContact CB-CD1 3.99Å; V27-Y96 HydrophobicContact CB-CE1 3.97Å; V27-Y96 HydrophobicContact CG1-CD1 4.24Å; V27-Y96 HydrophobicContact CG1-CE1 4.18Å; V27-Y96 HydrophobicContact CG2-CE1 4.45Å
28	V	42.2	Very low	32.9	Very low	84 Å²	84	109.3 Å²	109.3	51%	0.509	62%	0.619	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.2	112.5	172.4	179.8	0	0	0	0	108.2	T30	V28-T30 HydrophobicContact CG1-CG2 4.43Å; V28-T30 PolarHBondContact O-N 3.06Å
29	V	43.1	Very low	33.1	Very low	17 Å²	17	108.3 Å²	108.3	10%	0.103	62%	0.621	C	S	.	*			trans	-88.7	96.5	177.5	-178.4	0	0	0	0	108.7	V27 P31 Y96 F124	V27-V29 HydrophobicContact CG1-CG2 4.31Å; V29-P31 WeakPolarHBondContact O-CD 3.47Å; V29-Y96 HydrophobicContact CG2-CD1 3.74Å; V29-Y96 HydrophobicContact CG2-CG 4.41Å; V29-F124 HydrophobicContact CB-CE2 4.49Å; V29-F124 HydrophobicContact CG1-CE2 4.33Å; V29-F124 HydrophobicContact CG2-CD2 4.1Å; V29-F124 HydrophobicContact CG2-CE2 3.9Å
30	T	39.4	Very low	34.1	Very low	105 Å²	105	106.8 Å²	106.8	64%	0.644	62%	0.621	S	S	*	*			trans	-75.4	120	168.7	53.1	0	0	0	0	109.1	V28 A32	V28-T30 HydrophobicContact CG1-CG2 4.43Å; V28-T30 PolarHBondContact O-N 3.06Å; T30-A32 PolarHBondContact O-N 3.16Å
31	P	40.9	Very low	35.3	Very low	63 Å²	63	100.2 Å²	100.2	41%	0.409	59%	0.59	S	S	.	*			trans	-69	96.9	-177.7	26.5	-33.6	0	0	0	110.9	V29 H33 I108 L113	V29-P31 WeakPolarHBondContact O-CD 3.47Å; P31-H33 PolarHBondContact O-N 3.3Å; P31-H33 VanDerWaalsContact O-N 3.12Å; P31-I108 HydrophobicContact CB-CD1 4.23Å; P31-L113 HydrophobicContact CB-CD1 4.48Å
32	A	31.5	Very low	37.2	Very low	83 Å²	83	96 Å²	96	69%	0.686	57%	0.57	S	S	*	*			trans	-83.5	27.2	-170.6	0	0	0	0	0	114.7	T30	T30-A32 PolarHBondContact O-N 3.16Å
33	H	35.1	Very low	39.3	Very low	118 Å²	118	91.8 Å²	91.8	55%	0.546	55%	0.552	S	S	.	*			trans	-136.3	121.8	170	-83.9	109	0	0	0	111	P31 L35	P31-H33 PolarHBondContact O-N 3.3Å; P31-H33 VanDerWaalsContact O-N 3.12Å; H33-L35 VanDerWaalsContact C-N 3.26Å; H33-L35 PolarHBondContact O-N 3.45Å
34	L	28.9	Very low	41.7	Very low	144 Å²	144	87.3 Å²	87.3	75%	0.754	52%	0.524	S	S	*	.			trans	-86.3	66	-175.2	-155.2	158.3	0	0	0	110.3
35	L	30	Very low	44	Very low	109 Å²	109	87.5 Å²	87.5	57%	0.571	52%	0.518	S	S	*	.			trans	-86.7	109.3	175.1	-76.9	167.2	0	0	0	110.3	H33	H33-L35 VanDerWaalsContact C-N 3.26Å; H33-L35 PolarHBondContact O-N 3.45Å
36	T	28.5	Very low	46.3	Very low	117 Å²	117	84.9 Å²	84.9	72%	0.718	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-64.6	127.7	166.3	49	0	0	0	0	109.8
37	L	37	Very low	48.7	Very low	61 Å²	61	80.3 Å²	80.3	32%	0.319	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-103.3	150	-176.2	-88.5	150.7	0	0	0	113.8	I108 E112	L37-I108 HydrophobicContact CD1-CB 4.41Å; L37-I108 HydrophobicContact CD1-CG1 4.39Å; L37-E112 WeakPolarHBondContact CD1-OE2 3.44Å
38	L	32.8	Very low	51.3	Low	144 Å²	144	81.9 Å²	81.9	75%	0.754	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-80.4	159.8	-172.5	-65.8	161.1	0	0	0	111.3	G40	L38-G40 PolarHBondContact O-N 3.23Å
39	P	33.2	Very low	53.8	Low	135 Å²	135	79.3 Å²	79.3	88%	0.877	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	122.8	167.5	25.8	-34.3	0	0	0	110.3
40	G	46.6	Very low	56.2	Low	71 Å²	71	79 Å²	79	73%	0.732	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	134.6	-4.6	-179	0	0	0	0	0	115.9	L38	L38-G40 PolarHBondContact O-N 3.23Å
41	A	52.5	Low	58.8	Low	30 Å²	30	74.4 Å²	74.4	25%	0.248	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-55.2	135.7	-179.7	0	0	0	0	0	113.6	Q109 E112	A41-Q109 VanDerWaalsContact CB-CD 3.4Å; A41-Q109 HydrophobicContact CB-CG 3.93Å; A41-Q109 VanDerWaalsContact CB-NE2 3.32Å; A41-E112 WeakPolarHBondContact CB-OE1 3.11Å
42	I	65.2	Low	61.3	Low	83 Å²	83	71.5 Å²	71.5	43%	0.426	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-92.2	122.1	-162.7	-61	174.6	0	0	0	111.3	S46 T47 Q109 V111	I42-S46 VanDerWaalsContact CG2-OG 3.27Å; I42-S46 WeakPolarHBondContact CG2-OG 3.4Å; I42-T47 HydrophobicContact CG2-CG2 4.35Å; I42-Q109 PolarHBondContact O-OE1 3.37Å; I42-Q109 VanDerWaalsContact O-OE1 3.09Å; I42-V111 HydrophobicContact CB-CB 4.36Å; I42-V111 HydrophobicContact CB-CG1 4.13Å; I42-V111 HydrophobicContact CB-CG2 4.4Å; I42-V111 HydrophobicContact CG2-CG1 4.35Å; I42-V111 HydrophobicContact CG2-CG2 4.3Å; I42-V111 WeakPolarHBondContact O-CG2 3.21Å
43	P	70	Confident	64.2	Low	66 Å²	66	69.3 Å²	69.3	43%	0.429	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-66.5	131.9	179.2	26.2	-32.6	0	0	0	111	E45 S46	P43-E45 PolarHBondContact O-N 3.21Å; P43-E45 VanDerWaalsContact O-N 3.08Å; P43-S46 WeakPolarHBondContact O-CB 3.26Å; P43-S46 PolarHBondContact O-N 3.49Å; P43-S46 PolarHBondContact O-OG 3.24Å
44	P	78.2	Confident	67	Low	8 Å²	8	63.9 Å²	63.9	5%	0.052	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-50.9	-35.9	-177.8	-32	39	0	0	0	114.6	S46 T47 F50 L75 Y83 V111	P44-S46 PolarHBondContact O-N 3.16Å; P44-T47 WeakPolarHBondContact O-CB 3.46Å; P44-T47 PolarHBondContact O-N 2.93Å; P44-T47 PolarHBondContact O-OG1 2.9Å; P44-F50 HydrophobicContact CB-CD2 4.46Å; P44-F50 VanDerWaalsContact O-CB 3.23Å; P44-F50 WeakPolarHBondContact O-CB 3.17Å; P44-L75 HydrophobicContact CB-CD2 3.92Å; P44-Y83 HydrophobicContact CB-CE1 4.06Å; P44-Y83 HydrophobicContact CG-CE1 4.33Å; P44-Y83 HydrophobicContact CG-CE2 3.98Å; P44-V111 HydrophobicContact CB-CG2 4.49Å; P44-V111 HydrophobicContact CG-CG2 4.25Å
45	E	79.8	Confident	70	Confident	102 Å²	102	57.5 Å²	57.5	48%	0.477	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-60.5	-23.4	179.1	-57.1	91.7	151.3	0	0	113.5	P43 F50 Y83	P43-E45 PolarHBondContact O-N 3.21Å; P43-E45 VanDerWaalsContact O-N 3.08Å; E45-F50 HydrophobicContact CB-CE1 4.35Å; E45-F50 HydrophobicContact CG-CE1 3.95Å; E45-F50 HydrophobicContact CG-CZ 4.49Å; E45-Y83 PolarHBondContact OE1-OH 2.98Å
46	S	81.5	Confident	73	Confident	70 Å²	70	56.9 Å²	56.9	49%	0.49	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-85.4	-13.2	176.2	70.2	0	0	0	0	114	I42 P43 P44	I42-S46 VanDerWaalsContact CG2-OG 3.27Å; I42-S46 WeakPolarHBondContact CG2-OG 3.4Å; P43-S46 WeakPolarHBondContact O-CB 3.26Å; P43-S46 PolarHBondContact O-N 3.49Å; P43-S46 PolarHBondContact O-OG 3.24Å; P44-S46 PolarHBondContact O-N 3.16Å
47	T	88.7	Confident	76	Confident	12 Å²	12	54.8 Å²	54.8	7%	0.074	31%	0.312	C	S	.	.	S	Bend	trans	-78.5	149.4	179.5	69	0	0	0	0	111.5	I42 P44 Y49 F50 V111 R134	I42-T47 HydrophobicContact CG2-CG2 4.35Å; P44-T47 WeakPolarHBondContact O-CB 3.46Å; P44-T47 PolarHBondContact O-N 2.93Å; P44-T47 PolarHBondContact O-OG1 2.9Å; T47-Y49 HydrophobicContact CG2-CE1 4.33Å; T47-Y49 HydrophobicContact CG2-CE2 4.26Å; T47-F50 WeakPolarHBondContact OG1-CB 3.38Å; T47-V111 HydrophobicContact CG2-CB 4.49Å; T47-V111 HydrophobicContact CG2-CG1 4.19Å; T47-V111 HydrophobicContact CG2-CG2 3.46Å; T47-V111 VanDerWaalsContact CG2-CG2 3.46Å; T47-R134 PolarHBondContact O-NH1 2.85Å
48	N	92.5	Very high	78.8	Confident	97 Å²	97	54.2 Å²	54.2	52%	0.519	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-18	-179.7	-76.6	-24.4	0	0	0	113.8	N133 R134	N48-N133 HydrophobicContact CB-CB 4.07Å; N48-N133 WeakPolarHBondContact CB-OD1 3.49Å; N48-N133 WeakPolarHBondContact O-CA 3.46Å; N48-R134 WeakPolarHBondContact O-CB 3.47Å; N48-R134 WeakPolarHBondContact O-CG 3.42Å; N48-R134 PolarHBondContact O-N 3.02Å; N48-R134 PolarHBondContact O-NH1 3.17Å
49	Y	93.9	Very high	81.8	Confident	30 Å²	30	47.4 Å²	47.4	12%	0.118	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	4.8	178.3	52.7	-101	0	0	0	114.1	T47 Y51 F73 L75 V114 P131 L132 N133	T47-Y49 HydrophobicContact CG2-CE1 4.33Å; T47-Y49 HydrophobicContact CG2-CE2 4.26Å; Y49-Y51 WeakPolarHBondContact O-CD2 3.47Å; Y49-F73 AromaticContact CD2-CE2 3.87Å; Y49-F73 HydrophobicContact CD2-CE2 3.87Å; Y49-F73 HydrophobicContact CE2-CE2 4.09Å; Y49-F73 HydrophobicContact CG-CE2 4.18Å; Y49-L75 HydrophobicContact CD2-CB 3.92Å; Y49-L75 HydrophobicContact CE2-CB 4.27Å; Y49-L75 HydrophobicContact CE2-CD2 4.45Å; Y49-L75 PolarHBondContact O-N 2.77Å; Y49-V114 HydrophobicContact CE2-CG1 4.09Å; Y49-P131 HydrophobicContact CD1-CB 3.57Å; Y49-P131 HydrophobicContact CE1-CB 4.33Å; Y49-P131 HydrophobicContact CG-CB 3.97Å; Y49-L132 WeakPolarHBondContact CA-O 3.26Å; Y49-L132 WeakPolarHBondContact CB-O 3.42Å; Y49-N133 PolarHBondContact N-OD1 3.15Å
50	F	93.8	Very high	84.8	Confident	10 Å²	10	43.1 Å²	43.1	4%	0.044	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-89.8	112.6	174.5	174.6	-107.2	0	0	0	112.2	P44 E45 T47 G52 L75 Y83 R134 P140	P44-F50 HydrophobicContact CB-CD2 4.46Å; P44-F50 VanDerWaalsContact O-CB 3.23Å; P44-F50 WeakPolarHBondContact O-CB 3.17Å; E45-F50 HydrophobicContact CB-CE1 4.35Å; E45-F50 HydrophobicContact CG-CE1 3.95Å; E45-F50 HydrophobicContact CG-CZ 4.49Å; T47-F50 WeakPolarHBondContact OG1-CB 3.38Å; F50-G52 VanDerWaalsContact CZ-CA 3.5Å; F50-L75 CarbonylContact C-O 3.53Å; F50-L75 VanDerWaalsContact CA-O 3.32Å; F50-L75 WeakPolarHBondContact CA-O 3.26Å; F50-L75 HydrophobicContact CD2-CB 4.33Å; F50-L75 HydrophobicContact CD2-CD2 4.02Å; F50-L75 HydrophobicContact CD2-CG 4Å; F50-Y83 HydrophobicContact CD2-CE1 4.45Å; F50-Y83 AromaticContact CE2-CD1 3.86Å; F50-Y83 HydrophobicContact CE2-CD1 3.86Å; F50-Y83 AromaticContact CE2-CE1 3.6Å; F50-Y83 HydrophobicContact CE2-CE1 3.6Å; F50-Y83 HydrophobicContact CZ-CE1 4.02Å; F50-R134 WeakPolarHBondContact O-CD 3.28Å; F50-R134 PolarHBondContact O-NH1 3.37Å; F50-P140 HydrophobicContact CD1-CB 3.97Å; F50-P140 HydrophobicContact CD1-CG 3.87Å; F50-P140 HydrophobicContact CE1-CB 3.95Å; F50-P140 HydrophobicContact CE1-CG 4.24Å
51	Y	95.3	Very high	87.1	Confident	9 Å²	9	45.9 Å²	45.9	4%	0.035	23%	0.234	C	C	.	.			trans	-88.1	-6.1	-176.3	-77.6	-101.8	0	0	0	114.4	Y49 I54 L62 L74 L75 L132 N133 R134 M138 I141	Y49-Y51 WeakPolarHBondContact O-CD2 3.47Å; Y51-I54 HydrophobicContact CD1-CD1 4.36Å; Y51-I54 HydrophobicContact CG-CD1 3.92Å; Y51-L62 HydrophobicContact CD1-CD1 3.68Å; Y51-L62 HydrophobicContact CE1-CD1 3.64Å; Y51-L62 HydrophobicContact CE1-CD2 4.27Å; Y51-L62 HydrophobicContact CG-CD1 4.35Å; Y51-L74 HydrophobicContact CD2-CB 3.87Å; Y51-L74 HydrophobicContact CD2-CD1 4.39Å; Y51-L74 HydrophobicContact CD2-CD2 4.09Å; Y51-L74 HydrophobicContact CD2-CG 4.35Å; Y51-L74 HydrophobicContact CE2-CB 3.82Å; Y51-L74 HydrophobicContact CE2-CD2 4.09Å; Y51-L75 PolarHBondContact N-O 2.82Å; Y51-L132 WeakPolarHBondContact CE2-O 3.4Å; Y51-N133 PolarHBondContact OH-O 3.08Å; Y51-R134 HydrophobicContact CD1-CG 3.99Å; Y51-R134 HydrophobicContact CD2-CG 4.24Å; Y51-R134 HydrophobicContact CE1-CG 3.82Å; Y51-R134 HydrophobicContact CE2-CG 4.07Å; Y51-R134 HydrophobicContact CG-CG 4.2Å; Y51-R134 PolarHBondContact OH-N 2.85Å; Y51-M138 HydrophobicContact CE1-SD 4.42Å; Y51-I141 PolarHBondContact O-N 2.72Å
52	G	93.1	Very high	89.2	Confident	2 Å²	2	46.8 Å²	46.8	2%	0.021	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	74.6	-143.8	-171.8	0	0	0	0	0	111.9	F50 I54 R76 E77 I141	F50-G52 VanDerWaalsContact CZ-CA 3.5Å; G52-I54 VanDerWaalsContact C-N 3.31Å; G52-I54 PolarHBondContact O-N 3.4Å; G52-R76 WeakPolarHBondContact O-CA 3.41Å; G52-R76 WeakPolarHBondContact O-CB 3.36Å; G52-E77 PolarHBondContact O-N 2.85Å; G52-I141 CarbonylContact C-O 3.54Å; G52-I141 WeakPolarHBondContact CA-O 3.39Å
53	K	92.1	Very high	90.7	Very high	38 Å²	38	42.8 Å²	42.8	17%	0.165	21%	0.214	C	C	.	.	S	Bend	trans	-77.1	70.5	178.6	-78.7	-165.6	177.4	177.9	0	113.1	E77 I141 Q144 D268 F272	K53-E77 WeakPolarHBondContact CE-OE1 3.37Å; K53-E77 HydrophobicContact CG-CB 3.99Å; K53-E77 HydrophobicContact CG-CG 4.36Å; K53-E77 WeakPolarHBondContact CG-OE2 3.45Å; K53-I141 HydrophobicContact CB-CG2 4.33Å; K53-I141 PolarHBondContact N-O 2.87Å; K53-I141 WeakPolarHBondContact O-CG2 3.32Å; K53-Q144 PolarHBondContact O-NE2 3.15Å; K53-D268 WeakPolarHBondContact CD-OD2 3.27Å; K53-D268 IonicContact NZ-OD2 2.72Å; K53-D268 PolarHBondContact NZ-OD2 3.43Å; K53-F272 HydrophobicContact CB-CZ 4Å; K53-F272 HydrophobicContact CD-CE2 4.46Å
54	I	93.1	Very high	92	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.021	22%	0.216	C	C	.	.			trans	-94.4	145.4	162.6	58.5	167	0	0	0	111.3	Y51 G52 Q58 A59 L62 L74 R76 I141 F272	Y51-I54 HydrophobicContact CD1-CD1 4.36Å; Y51-I54 HydrophobicContact CG-CD1 3.92Å; G52-I54 VanDerWaalsContact C-N 3.31Å; G52-I54 PolarHBondContact O-N 3.4Å; I54-Q58 VanDerWaalsContact CA-OE1 3.29Å; I54-Q58 HydrophobicContact CB-CB 4Å; I54-A59 HydrophobicContact CD1-CB 3.79Å; I54-A59 HydrophobicContact CG1-CB 4.48Å; I54-L62 HydrophobicContact CD1-CD1 3.8Å; I54-L74 HydrophobicContact CD1-CD1 3.92Å; I54-L74 HydrophobicContact CD1-CD2 4.12Å; I54-R76 HydrophobicContact CD1-CB 4.3Å; I54-R76 HydrophobicContact CG1-CB 3.66Å; I54-R76 HydrophobicContact CG1-CG 4.34Å; I54-I141 HydrophobicContact CG2-CD1 3.74Å; I54-F272 WeakPolarHBondContact O-CE1 3.29Å
55	T	92.8	Very high	92.8	Very high	9 Å²	9	49.6 Å²	49.6	6%	0.055	25%	0.246	C	C	.	.			trans	-65.9	171.7	175.3	70.3	0	0	0	0	111.3	E57 Q58 A59 H271 F272	T55-E57 VanDerWaalsContact C-N 3.28Å; T55-E57 WeakPolarHBondContact CB-OE2 3.48Å; T55-E57 PolarHBondContact OG1-OE2 2.83Å; T55-Q58 WeakPolarHBondContact OG1-CB 3.09Å; T55-Q58 VanDerWaalsContact OG1-CG 3.3Å; T55-Q58 WeakPolarHBondContact OG1-CG 3.4Å; T55-Q58 PolarHBondContact OG1-N 3.34Å; T55-A59 PolarHBondContact O-N 2.84Å; T55-A59 VanDerWaalsContact O-N 3.15Å; T55-H271 HydrophobicContact CG2-CB 4.16Å; T55-F272 HydrophobicContact CG2-CD1 4.23Å; T55-F272 HydrophobicContact CG2-CE1 4.03Å; T55-F272 HydrophobicContact CG2-CZ 4.34Å
56	R	92.3	Very high	93.5	Very high	97 Å²	97	48.5 Å²	48.5	37%	0.366	24%	0.243	S	C	.	.	H	α-helix	trans	-63.3	-44.2	173.8	-179.4	-171.1	161	134.1	8.5	109.5	A59 E60 H95	R56-A59 WeakPolarHBondContact O-CB 3.38Å; R56-A59 PolarHBondContact O-N 2.93Å; R56-A59 VanDerWaalsContact O-N 3.13Å; R56-E60 IonicContact CZ-OE1 3.34Å; R56-E60 IonicContact NE-OE1 3.46Å; R56-E60 PolarHBondContact NE-OE1 2.77Å; R56-E60 IonicContact NH2-OE1 2.89Å; R56-E60 PolarHBondContact NH2-OE1 2.62Å; R56-E60 WeakPolarHBondContact O-CG 3.42Å; R56-E60 PolarHBondContact O-N 2.73Å; R56-H95 VanDerWaalsContact CG-NE2 3.34Å; R56-H95 WeakPolarHBondContact CG-NE2 3.28Å; R56-H95 PolarHBondContact NE-CD2 3.43Å; R56-H95 PolarHBondContact NE-NE2 3.47Å; R56-H95 PolarHBondContact NH2-CD2 3.16Å
57	E	92.6	Very high	94	Very high	72 Å²	72	47.5 Å²	47.5	34%	0.336	25%	0.245	S	C	.	.	H	α-helix	trans	-64	-43.5	-177.6	-60.1	80.8	175.4	0	0	111.3	T55 A59 E60 E61 K280	T55-E57 VanDerWaalsContact C-N 3.28Å; T55-E57 WeakPolarHBondContact CB-OE2 3.48Å; T55-E57 PolarHBondContact OG1-OE2 2.83Å; E57-A59 VanDerWaalsContact C-N 3.32Å; E57-A59 PolarHBondContact O-N 2.75Å; E57-E60 PolarHBondContact O-N 3.49Å; E57-E61 WeakPolarHBondContact O-CB 3.34Å; E57-E61 PolarHBondContact O-N 2.92Å; E57-K280 IonicContact OE1-NZ 3.74Å; E57-K280 PolarHBondContact OE1-NZ 2.96Å; E57-K280 IonicContact OE2-NZ 2.75Å
58	Q	94.6	Very high	94.1	Very high	50 Å²	50	47.6 Å²	47.6	23%	0.234	25%	0.247	C	C	.	.	H	α-helix	trans	-63	-35.9	172	-75.3	168.4	-15.1	0	0	112.3	I54 T55 L62	I54-Q58 VanDerWaalsContact CA-OE1 3.29Å; I54-Q58 HydrophobicContact CB-CB 4Å; T55-Q58 WeakPolarHBondContact OG1-CB 3.09Å; T55-Q58 VanDerWaalsContact OG1-CG 3.3Å; T55-Q58 WeakPolarHBondContact OG1-CG 3.4Å; T55-Q58 PolarHBondContact OG1-N 3.34Å; Q58-L62 WeakPolarHBondContact O-CB 3.4Å; Q58-L62 WeakPolarHBondContact O-CD1 3.33Å; Q58-L62 VanDerWaalsContact O-CG 3.26Å; Q58-L62 WeakPolarHBondContact O-CG 3.38Å; Q58-L62 PolarHBondContact O-N 2.74Å
59	A	96	Very high	94.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-71.5	-37.5	176.2	0	0	0	0	0	112.6	I54 T55 R56 E57 L63 L74	I54-A59 HydrophobicContact CD1-CB 3.79Å; I54-A59 HydrophobicContact CG1-CB 4.48Å; T55-A59 PolarHBondContact O-N 2.84Å; T55-A59 VanDerWaalsContact O-N 3.15Å; R56-A59 WeakPolarHBondContact O-CB 3.38Å; R56-A59 PolarHBondContact O-N 2.93Å; R56-A59 VanDerWaalsContact O-N 3.13Å; E57-A59 VanDerWaalsContact C-N 3.32Å; E57-A59 PolarHBondContact O-N 2.75Å; A59-L63 WeakPolarHBondContact O-CB 3.38Å; A59-L63 WeakPolarHBondContact O-CD1 3.48Å; A59-L63 VanDerWaalsContact O-CG 3.28Å; A59-L63 WeakPolarHBondContact O-CG 3.45Å; A59-L63 PolarHBondContact O-N 3.17Å; A59-L74 HydrophobicContact CB-CD1 4.02Å; A59-L74 HydrophobicContact CB-CD2 4.25Å
60	E	96.4	Very high	94.2	Very high	45 Å²	45	49.6 Å²	49.6	21%	0.21	26%	0.257	C	S	.	.	H	α-helix	trans	-63.4	-49.8	172.7	-72.1	175.9	167.4	0	0	110.6	R56 E57 L62 L63 F64 V93 H95	R56-E60 IonicContact CZ-OE1 3.34Å; R56-E60 IonicContact NE-OE1 3.46Å; R56-E60 PolarHBondContact NE-OE1 2.77Å; R56-E60 IonicContact NH2-OE1 2.89Å; R56-E60 PolarHBondContact NH2-OE1 2.62Å; R56-E60 WeakPolarHBondContact O-CG 3.42Å; R56-E60 PolarHBondContact O-N 2.73Å; E57-E60 PolarHBondContact O-N 3.49Å; E60-L62 PolarHBondContact O-N 2.78Å; E60-L63 PolarHBondContact O-N 3.04Å; E60-F64 HydrophobicContact CB-CD2 4.25Å; E60-F64 HydrophobicContact CB-CE2 3.97Å; E60-F64 WeakPolarHBondContact O-CD2 3.41Å; E60-F64 WeakPolarHBondContact O-CG 3.46Å; E60-F64 PolarHBondContact O-N 3.49Å; E60-V93 HydrophobicContact CG-CB 3.99Å; E60-V93 HydrophobicContact CG-CG1 3.96Å; E60-V93 HydrophobicContact CG-CG2 4.42Å; E60-H95 IonicContact OE1-NE2 2.65Å; E60-H95 PolarHBondContact OE1-NE2 3.2Å; E60-H95 VanDerWaalsContact OE1-NE2 3.16Å
61	E	95.4	Very high	94.1	Very high	129 Å²	129	49.2 Å²	49.2	60%	0.603	26%	0.255	S	S	*	.	H	α-helix	trans	-54.2	-53.6	175.7	-178	177.8	-154.6	0	0	112	E57 L63 F64 T65	E57-E61 WeakPolarHBondContact O-CB 3.34Å; E57-E61 PolarHBondContact O-N 2.92Å; E61-L63 VanDerWaalsContact C-N 3.28Å; E61-L63 PolarHBondContact O-N 3.11Å; E61-F64 PolarHBondContact O-N 3.47Å; E61-T65 WeakPolarHBondContact O-CB 3.24Å; E61-T65 PolarHBondContact O-N 2.89Å; E61-T65 PolarHBondContact O-OG1 3.48Å; E61-T65 VanDerWaalsContact O-OG1 3.06Å
62	L	96.6	Very high	94.2	Very high	49 Å²	49	49.5 Å²	49.5	26%	0.257	26%	0.257	S	S	.	.	H	α-helix	trans	-55.6	-41.2	178.6	-77.5	166.9	0	0	0	112.8	Y51 I54 Q58 E60 N66 L74 L132	Y51-L62 HydrophobicContact CD1-CD1 3.68Å; Y51-L62 HydrophobicContact CE1-CD1 3.64Å; Y51-L62 HydrophobicContact CE1-CD2 4.27Å; Y51-L62 HydrophobicContact CG-CD1 4.35Å; I54-L62 HydrophobicContact CD1-CD1 3.8Å; Q58-L62 WeakPolarHBondContact O-CB 3.4Å; Q58-L62 WeakPolarHBondContact O-CD1 3.33Å; Q58-L62 VanDerWaalsContact O-CG 3.26Å; Q58-L62 WeakPolarHBondContact O-CG 3.38Å; Q58-L62 PolarHBondContact O-N 2.74Å; E60-L62 PolarHBondContact O-N 2.78Å; L62-N66 WeakPolarHBondContact O-CB 3.36Å; L62-N66 PolarHBondContact O-N 3.27Å; L62-N66 PolarHBondContact O-ND2 2.97Å; L62-L74 HydrophobicContact CB-CD2 4.13Å; L62-L74 HydrophobicContact CD1-CD2 4.23Å; L62-L132 HydrophobicContact CB-CD2 4.32Å
63	L	96.9	Very high	94.3	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-72.5	-39.8	179.6	-74.4	169.2	0	0	0	112.3	A59 E60 E61 N66 G67 A68 L72 L74 V93 L132	A59-L63 WeakPolarHBondContact O-CB 3.38Å; A59-L63 WeakPolarHBondContact O-CD1 3.48Å; A59-L63 VanDerWaalsContact O-CG 3.28Å; A59-L63 WeakPolarHBondContact O-CG 3.45Å; A59-L63 PolarHBondContact O-N 3.17Å; E60-L63 PolarHBondContact O-N 3.04Å; E61-L63 VanDerWaalsContact C-N 3.28Å; E61-L63 PolarHBondContact O-N 3.11Å; L63-N66 CarbonylContact O-C 3.57Å; L63-N66 PolarHBondContact O-N 3.29Å; L63-G67 PolarHBondContact O-N 2.78Å; L63-A68 WeakPolarHBondContact O-CA 3.01Å; L63-A68 PolarHBondContact O-N 3.34Å; L63-L72 HydrophobicContact CD2-CB 4.49Å; L63-L72 HydrophobicContact CD2-CD2 3.91Å; L63-L72 HydrophobicContact CD2-CG 3.81Å; L63-L74 HydrophobicContact CD1-CD2 4.47Å; L63-L74 HydrophobicContact CD1-CG 4.4Å; L63-L74 HydrophobicContact CD2-CD2 4.47Å; L63-L74 HydrophobicContact CG-CD2 4.1Å; L63-L74 HydrophobicContact CG-CG 4.43Å; L63-V93 HydrophobicContact CB-CG2 3.91Å; L63-V93 HydrophobicContact CD1-CB 4.47Å; L63-V93 HydrophobicContact CD1-CG1 3.59Å; L63-V93 HydrophobicContact CD1-CG2 3.99Å; L63-L132 HydrophobicContact CD2-CB 4.45Å; L63-L132 HydrophobicContact CD2-CD2 3.9Å; L63-L132 HydrophobicContact CG-CD2 4.44Å
64	F	96.2	Very high	94.5	Very high	104 Å²	104	47.8 Å²	47.8	46%	0.456	25%	0.25	S	C	.	.	H	α-helix	trans	-67.4	-44	175.6	-70.1	-54.5	0	0	0	112.5	E60 E61 N66 G67 A68 V93	E60-F64 HydrophobicContact CB-CD2 4.25Å; E60-F64 HydrophobicContact CB-CE2 3.97Å; E60-F64 WeakPolarHBondContact O-CD2 3.41Å; E60-F64 WeakPolarHBondContact O-CG 3.46Å; E60-F64 PolarHBondContact O-N 3.49Å; E61-F64 PolarHBondContact O-N 3.47Å; F64-N66 PolarHBondContact O-N 3.39Å; F64-G67 PolarHBondContact O-N 3.49Å; F64-A68 HydrophobicContact CD1-CB 3.78Å; F64-A68 HydrophobicContact CE1-CB 4.28Å; F64-V93 HydrophobicContact CE1-CG2 4.13Å; F64-V93 HydrophobicContact CE2-CG2 4.16Å; F64-V93 HydrophobicContact CZ-CG2 3.88Å
65	T	95.1	Very high	94.6	Very high	113 Å²	113	47.6 Å²	47.6	69%	0.693	25%	0.249	S	C	*	.	H	α-helix	trans	-64.6	-25.3	177.2	-54.3	0	0	0	0	112.5	E61 G67	E61-T65 WeakPolarHBondContact O-CB 3.24Å; E61-T65 PolarHBondContact O-N 2.89Å; E61-T65 PolarHBondContact O-OG1 3.48Å; E61-T65 VanDerWaalsContact O-OG1 3.06Å; T65-G67 VanDerWaalsContact C-N 3.3Å
66	N	94.8	Very high	94.6	Very high	78 Å²	78	47.9 Å²	47.9	42%	0.417	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	23.6	172.1	-70.1	-88.7	0	0	0	113.2	L62 L63 F64 N69 L72 L132	L62-N66 WeakPolarHBondContact O-CB 3.36Å; L62-N66 PolarHBondContact O-N 3.27Å; L62-N66 PolarHBondContact O-ND2 2.97Å; L63-N66 CarbonylContact O-C 3.57Å; L63-N66 PolarHBondContact O-N 3.29Å; F64-N66 PolarHBondContact O-N 3.39Å; N66-N69 PolarHBondContact O-ND2 3.28Å; N66-L72 HydrophobicContact CB-CD2 4.15Å; N66-L132 HydrophobicContact CB-CD1 3.8Å; N66-L132 HydrophobicContact CB-CD2 4.16Å
67	G	91.7	Very high	94.4	Very high	50 Å²	50	45.2 Å²	45.2	52%	0.515	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	-1.3	167.3	0	0	0	0	0	116.3	L63 F64 T65 N69	L63-G67 PolarHBondContact O-N 2.78Å; F64-G67 PolarHBondContact O-N 3.49Å; T65-G67 VanDerWaalsContact C-N 3.3Å; G67-N69 PolarHBondContact O-N 3.01Å; G67-N69 VanDerWaalsContact O-N 3.08Å
68	A	91	Very high	93.6	Very high	14 Å²	14	42.4 Å²	42.4	12%	0.116	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.2	34.5	178.8	0	0	0	0	0	115.6	L63 F64	L63-A68 WeakPolarHBondContact O-CA 3.01Å; L63-A68 PolarHBondContact O-N 3.34Å; F64-A68 HydrophobicContact CD1-CB 3.78Å; F64-A68 HydrophobicContact CE1-CB 4.28Å
69	N	93.5	Very high	92.5	Very high	91 Å²	91	43.3 Å²	43.3	49%	0.487	24%	0.237	S	C	.	.			trans	-57.9	146.8	180	-63.9	-65.8	0	0	0	112.1	N66 G67 G71 L72 C88 L130	N66-N69 PolarHBondContact O-ND2 3.28Å; G67-N69 PolarHBondContact O-N 3.01Å; G67-N69 VanDerWaalsContact O-N 3.08Å; N69-G71 PolarHBondContact O-N 3.46Å; N69-L72 HydrophobicContact CB-CB 4.32Å; N69-L72 WeakPolarHBondContact O-CB 3.27Å; N69-L72 PolarHBondContact O-N 3.19Å; N69-C88 WeakPolarHBondContact O-CB 3.39Å; N69-L130 HydrophobicContact CB-CD1 4.47Å
70	E	94.9	Very high	91.1	Very high	78 Å²	78	48.7 Å²	48.7	36%	0.364	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	127.6	176.5	-172.4	62	-146	0	0	111.4	L72 H89 L90 T126	E70-L72 VanDerWaalsContact C-N 3.26Å; E70-L72 PolarHBondContact O-N 3.22Å; E70-H89 IonicContact OE1-CE1 2.6Å; E70-H89 IonicContact OE1-CG 3.16Å; E70-H89 IonicContact OE1-ND1 2.73Å; E70-H89 PolarHBondContact OE1-ND1 3.06Å; E70-H89 WeakPolarHBondContact OE2-CA 3.42Å; E70-H89 IonicContact OE2-ND1 3.18Å; E70-L90 PolarHBondContact OE2-N 3.26Å; E70-T126 WeakPolarHBondContact OE1-CB 3.44Å; E70-T126 WeakPolarHBondContact OE1-CG2 3.29Å; E70-T126 PolarHBondContact OE1-OG1 3.48Å
71	G	92.8	Very high	89.7	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.01	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.7	2.6	-178.4	0	0	0	0	0	115.7	N69 F73 C88 L127 Q129 L130	N69-G71 PolarHBondContact O-N 3.46Å; G71-F73 PolarHBondContact O-N 3.04Å; G71-C88 PolarHBondContact N-O 3.44Å; G71-L127 VanDerWaalsContact CA-O 3.28Å; G71-L127 WeakPolarHBondContact CA-O 3.42Å; G71-Q129 PolarHBondContact O-N 2.9Å; G71-L130 PolarHBondContact O-N 3.01Å
72	L	96	Very high	88.8	Confident	15 Å²	15	50.9 Å²	50.9	8%	0.079	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	122.5	171.2	-174	73.9	0	0	0	110	L63 N66 N69 E70 I87 C88 L130 L132	L63-L72 HydrophobicContact CD2-CB 4.49Å; L63-L72 HydrophobicContact CD2-CD2 3.91Å; L63-L72 HydrophobicContact CD2-CG 3.81Å; N66-L72 HydrophobicContact CB-CD2 4.15Å; N69-L72 HydrophobicContact CB-CB 4.32Å; N69-L72 WeakPolarHBondContact O-CB 3.27Å; N69-L72 PolarHBondContact O-N 3.19Å; E70-L72 VanDerWaalsContact C-N 3.26Å; E70-L72 PolarHBondContact O-N 3.22Å; L72-I87 CarbonylContact O-C 3.57Å; L72-I87 WeakPolarHBondContact O-CA 3.4Å; L72-C88 HydrophobicContact CB-CB 4.15Å; L72-C88 PolarHBondContact O-N 3.32Å; L72-L130 CarbonylContact C-O 3.59Å; L72-L130 WeakPolarHBondContact CA-O 3.5Å; L72-L130 HydrophobicContact CB-CB 4.42Å; L72-L130 HydrophobicContact CD1-CB 4.08Å; L72-L132 HydrophobicContact CD1-CB 4.02Å; L72-L132 HydrophobicContact CG-CB 4.34Å
73	F	96.3	Very high	88.3	Confident	5 Å²	5	49.3 Å²	49.3	2%	0.022	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	158	-175.8	79.1	-88	0	0	0	114	Y49 G71 V85 S86 I87 V114 A128 L130 P131 L132	Y49-F73 AromaticContact CD2-CE2 3.87Å; Y49-F73 HydrophobicContact CD2-CE2 3.87Å; Y49-F73 HydrophobicContact CE2-CE2 4.09Å; Y49-F73 HydrophobicContact CG-CE2 4.18Å; G71-F73 PolarHBondContact O-N 3.04Å; F73-V85 HydrophobicContact CB-CG1 4.36Å; F73-V85 HydrophobicContact CD2-CG1 4.27Å; F73-S86 CarbonylContact C-O 3.54Å; F73-S86 WeakPolarHBondContact CA-O 3.45Å; F73-S86 WeakPolarHBondContact CB-O 3.27Å; F73-I87 HydrophobicContact CB-CB 3.76Å; F73-I87 HydrophobicContact CB-CD1 4.1Å; F73-I87 HydrophobicContact CB-CG1 3.82Å; F73-V114 HydrophobicContact CD2-CG1 4.43Å; F73-V114 HydrophobicContact CE1-CG1 4.45Å; F73-V114 HydrophobicContact CE2-CG1 3.39Å; F73-V114 HydrophobicContact CE2-CG2 4.37Å; F73-V114 HydrophobicContact CZ-CG1 3.39Å; F73-A128 HydrophobicContact CD1-CB 3.76Å; F73-A128 HydrophobicContact CE1-CB 3.9Å; F73-A128 VanDerWaalsContact CE1-O 3.23Å; F73-A128 WeakPolarHBondContact CE1-O 3.43Å; F73-A128 HydrophobicContact CG-CB 4.17Å; F73-A128 HydrophobicContact CZ-CB 4.44Å; F73-L130 WeakPolarHBondContact CD1-O 3.3Å; F73-L130 PolarHBondContact N-O 2.98Å; F73-P131 HydrophobicContact CE1-CB 3.87Å; F73-P131 HydrophobicContact CE1-CG 4.44Å; F73-P131 HydrophobicContact CE2-CB 4.33Å; F73-P131 HydrophobicContact CZ-CB 3.66Å; F73-P131 HydrophobicContact CZ-CG 4.48Å; F73-L132 WeakPolarHBondContact O-CB 3.43Å; F73-L132 PolarHBondContact O-N 2.89Å
74	L	96.2	Very high	87.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	162.6	166.1	66.2	76.8	0	0	0	111.1	Y51 I54 A59 L62 L63 R76 S86 L132	Y51-L74 HydrophobicContact CD2-CB 3.87Å; Y51-L74 HydrophobicContact CD2-CD1 4.39Å; Y51-L74 HydrophobicContact CD2-CD2 4.09Å; Y51-L74 HydrophobicContact CD2-CG 4.35Å; Y51-L74 HydrophobicContact CE2-CB 3.82Å; Y51-L74 HydrophobicContact CE2-CD2 4.09Å; I54-L74 HydrophobicContact CD1-CD1 3.92Å; I54-L74 HydrophobicContact CD1-CD2 4.12Å; A59-L74 HydrophobicContact CB-CD1 4.02Å; A59-L74 HydrophobicContact CB-CD2 4.25Å; L62-L74 HydrophobicContact CB-CD2 4.13Å; L62-L74 HydrophobicContact CD1-CD2 4.23Å; L63-L74 HydrophobicContact CD1-CD2 4.47Å; L63-L74 HydrophobicContact CD1-CG 4.4Å; L63-L74 HydrophobicContact CD2-CD2 4.47Å; L63-L74 HydrophobicContact CG-CD2 4.1Å; L63-L74 HydrophobicContact CG-CG 4.43Å; L74-R76 HydrophobicContact CD1-CB 4.27Å; L74-R76 HydrophobicContact CD1-CG 4.24Å; L74-S86 PolarHBondContact N-O 2.91Å; L74-S86 PolarHBondContact O-N 3.23Å; L74-L132 HydrophobicContact CD2-CD2 4.38Å
75	L	94.2	Very high	87.8	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	142.9	172.8	-170.5	69.9	0	0	0	110.4	P44 Y49 F50 Y51 V85 T110 V114	P44-L75 HydrophobicContact CB-CD2 3.92Å; Y49-L75 HydrophobicContact CD2-CB 3.92Å; Y49-L75 HydrophobicContact CE2-CB 4.27Å; Y49-L75 HydrophobicContact CE2-CD2 4.45Å; Y49-L75 PolarHBondContact O-N 2.77Å; F50-L75 CarbonylContact C-O 3.53Å; F50-L75 VanDerWaalsContact CA-O 3.32Å; F50-L75 WeakPolarHBondContact CA-O 3.26Å; F50-L75 HydrophobicContact CD2-CB 4.33Å; F50-L75 HydrophobicContact CD2-CD2 4.02Å; F50-L75 HydrophobicContact CD2-CG 4Å; Y51-L75 PolarHBondContact N-O 2.82Å; L75-V85 HydrophobicContact CD1-CG2 3.73Å; L75-T110 HydrophobicContact CD1-CG2 3.51Å; L75-T110 HydrophobicContact CD2-CG2 3.73Å; L75-T110 HydrophobicContact CG-CG2 4.24Å; L75-V114 HydrophobicContact CD1-CG2 4.48Å
76	R	93.3	Very high	87.8	Confident	14 Å²	14	39.1 Å²	39.1	5%	0.053	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	162.3	177.5	58.1	-178.7	177.5	79.8	0	111.9	G52 I54 L74 A84 S86 H95	G52-R76 WeakPolarHBondContact O-CA 3.41Å; G52-R76 WeakPolarHBondContact O-CB 3.36Å; I54-R76 HydrophobicContact CD1-CB 4.3Å; I54-R76 HydrophobicContact CG1-CB 3.66Å; I54-R76 HydrophobicContact CG1-CG 4.34Å; L74-R76 HydrophobicContact CD1-CB 4.27Å; L74-R76 HydrophobicContact CD1-CG 4.24Å; R76-A84 HydrophobicContact CG-CB 4.23Å; R76-A84 WeakPolarHBondContact CG-O 3.21Å; R76-A84 PolarHBondContact N-O 3.45Å; R76-A84 PolarHBondContact O-N 2.63Å; R76-S86 PolarHBondContact NE-OG 2.94Å; R76-H95 PolarHBondContact NH2-ND1 2.9Å
77	E	88.1	Confident	87.8	Confident	42 Å²	42	35.4 Å²	35.4	20%	0.196	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	146.3	164.9	-159.6	-175.4	141.2	0	0	108.8	G52 K53	G52-E77 PolarHBondContact O-N 2.85Å; K53-E77 WeakPolarHBondContact CE-OE1 3.37Å; K53-E77 HydrophobicContact CG-CB 3.99Å; K53-E77 HydrophobicContact CG-CG 4.36Å; K53-E77 WeakPolarHBondContact CG-OE2 3.45Å
78	S	76.8	Confident	88	Confident	13 Å²	13	33 Å²	33	9%	0.091	16%	0.162	C	C	.	.			trans	-94.1	165	171.7	78.5	0	0	0	0	110.6	N80 R81 N82	S78-N80 PolarHBondContact O-N 3.46Å; S78-N80 PolarHBondContact OG-N 3.02Å; S78-R81 PolarHBondContact O-N 2.97Å; S78-R81 VanDerWaalsContact O-N 3.13Å; S78-N82 WeakPolarHBondContact CA-O 3.45Å; S78-N82 WeakPolarHBondContact CB-O 3.4Å; S78-N82 PolarHBondContact N-O 2.94Å; S78-N82 WeakPolarHBondContact OG-CA 3.02Å; S78-N82 WeakPolarHBondContact OG-CB 3.45Å; S78-N82 PolarHBondContact OG-N 3.02Å; S78-N82 PolarHBondContact OG-O 3.46Å
79	V	70.3	Confident	88.2	Confident	69 Å²	69	34.1 Å²	34.1	42%	0.418	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-27.5	176.5	-168.2	0	0	0	0	113.4	F272 R273	V79-F272 HydrophobicContact CB-CB 4.46Å; V79-F272 HydrophobicContact CG1-CB 3.88Å; V79-F272 HydrophobicContact CG2-CB 3.93Å; V79-F272 HydrophobicContact CG2-CD1 4.03Å; V79-F272 HydrophobicContact CG2-CG 4.31Å; V79-R273 VanDerWaalsContact CG1-CD 3.47Å; V79-R273 HydrophobicContact CG1-CG 3.49Å; V79-R273 VanDerWaalsContact CG1-CG 3.49Å
80	N	66.5	Low	88.1	Confident	113 Å²	113	36.1 Å²	36.1	60%	0.604	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.8	20.2	-173.8	-62.7	-0.9	0	0	0	113.2	S78 N82	S78-N80 PolarHBondContact O-N 3.46Å; S78-N80 PolarHBondContact OG-N 3.02Å; N80-N82 PolarHBondContact O-N 2.86Å
81	R	66.5	Low	87.8	Confident	186 Å²	186	34.7 Å²	34.7	70%	0.702	18%	0.181	S	C	*	.	S	Bend	trans	61.5	2.1	-174.2	-53.7	-176.3	-179.6	-171.5	-1.2	116.1	S78	S78-R81 PolarHBondContact O-N 2.97Å; S78-R81 VanDerWaalsContact O-N 3.13Å
82	N	76.8	Confident	87.8	Confident	33 Å²	33	43.3 Å²	43.3	18%	0.176	21%	0.213	C	C	.	.	S	Bend	trans	-69.7	174.8	157.3	-71.7	-18.3	0	0	0	109.6	S78 N80 V98 R100	S78-N82 WeakPolarHBondContact CA-O 3.45Å; S78-N82 WeakPolarHBondContact CB-O 3.4Å; S78-N82 PolarHBondContact N-O 2.94Å; S78-N82 WeakPolarHBondContact OG-CA 3.02Å; S78-N82 WeakPolarHBondContact OG-CB 3.45Å; S78-N82 PolarHBondContact OG-N 3.02Å; S78-N82 PolarHBondContact OG-O 3.46Å; N80-N82 PolarHBondContact O-N 2.86Å; N82-V98 WeakPolarHBondContact CB-O 3.43Å; N82-R100 VanDerWaalsContact OD1-CB 3.29Å; N82-R100 WeakPolarHBondContact OD1-CB 3.5Å; N82-R100 PolarHBondContact OD1-N 3.45Å
83	Y	86.2	Confident	87.8	Confident	17 Å²	17	43.3 Å²	43.3	7%	0.067	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	167.7	173.8	-66.6	-73.4	0	0	0	112.1	P44 E45 F50 V98 T110	P44-Y83 HydrophobicContact CB-CE1 4.06Å; P44-Y83 HydrophobicContact CG-CE1 4.33Å; P44-Y83 HydrophobicContact CG-CE2 3.98Å; E45-Y83 PolarHBondContact OE1-OH 2.98Å; F50-Y83 HydrophobicContact CD2-CE1 4.45Å; F50-Y83 AromaticContact CE2-CD1 3.86Å; F50-Y83 HydrophobicContact CE2-CD1 3.86Å; F50-Y83 AromaticContact CE2-CE1 3.6Å; F50-Y83 HydrophobicContact CE2-CE1 3.6Å; F50-Y83 HydrophobicContact CZ-CE1 4.02Å; Y83-V98 PolarHBondContact N-O 2.79Å; Y83-V98 PolarHBondContact O-N 3.33Å; Y83-T110 HydrophobicContact CD2-CG2 4.11Å; Y83-T110 WeakPolarHBondContact CD2-OG1 3.4Å; Y83-T110 WeakPolarHBondContact CE2-OG1 3.48Å; Y83-T110 HydrophobicContact CG-CG2 4.03Å
84	A	89.7	Confident	87.6	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	131.4	167.8	0	0	0	0	0	111.4	R76 Y96	R76-A84 HydrophobicContact CG-CB 4.23Å; R76-A84 WeakPolarHBondContact CG-O 3.21Å; R76-A84 PolarHBondContact N-O 3.45Å; R76-A84 PolarHBondContact O-N 2.63Å; A84-Y96 CarbonylContact C-O 3.56Å; A84-Y96 VanDerWaalsContact CA-O 3.27Å; A84-Y96 WeakPolarHBondContact CA-O 3.34Å
85	V	92.3	Very high	87.4	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.012	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	134.8	167.5	-176.1	0	0	0	0	107.9	F73 L75 H95 Y96 V98 V114 F124	F73-V85 HydrophobicContact CB-CG1 4.36Å; F73-V85 HydrophobicContact CD2-CG1 4.27Å; L75-V85 HydrophobicContact CD1-CG2 3.73Å; V85-H95 CarbonylContact O-C 3.53Å; V85-H95 VanDerWaalsContact O-CA 3.3Å; V85-H95 WeakPolarHBondContact O-CA 3.35Å; V85-Y96 PolarHBondContact N-O 2.91Å; V85-Y96 PolarHBondContact O-N 3.48Å; V85-V98 HydrophobicContact CG2-CG2 4.17Å; V85-V114 HydrophobicContact CG2-CG2 3.93Å; V85-F124 HydrophobicContact CB-CE1 4.14Å; V85-F124 HydrophobicContact CB-CZ 4.13Å; V85-F124 HydrophobicContact CG1-CE1 3.89Å; V85-F124 HydrophobicContact CG1-CZ 4.32Å; V85-F124 HydrophobicContact CG2-CZ 4.22Å
86	S	95.4	Very high	87.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121.4	173.9	-50.7	0	0	0	0	107.7	F73 L74 R76 H94 H95	F73-S86 CarbonylContact C-O 3.54Å; F73-S86 WeakPolarHBondContact CA-O 3.45Å; F73-S86 WeakPolarHBondContact CB-O 3.27Å; L74-S86 PolarHBondContact N-O 2.91Å; L74-S86 PolarHBondContact O-N 3.23Å; R76-S86 PolarHBondContact NE-OG 2.94Å; S86-H94 CarbonylContact C-O 3.54Å; S86-H94 WeakPolarHBondContact CA-O 3.44Å; S86-H95 VanDerWaalsContact CB-ND1 3.27Å; S86-H95 WeakPolarHBondContact CB-ND1 3.1Å; S86-H95 PolarHBondContact OG-ND1 2.92Å
87	I	95.3	Very high	86.6	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	141.5	-167.6	-176.7	166.7	0	0	0	112.1	L72 F73 H94 Y96 F124 T126 A128	L72-I87 CarbonylContact O-C 3.57Å; L72-I87 WeakPolarHBondContact O-CA 3.4Å; F73-I87 HydrophobicContact CB-CB 3.76Å; F73-I87 HydrophobicContact CB-CD1 4.1Å; F73-I87 HydrophobicContact CB-CG1 3.82Å; I87-H94 HydrophobicContact CG2-CB 4.4Å; I87-H94 PolarHBondContact N-O 2.86Å; I87-H94 PolarHBondContact O-N 3.28Å; I87-Y96 HydrophobicContact CG2-CD2 3.87Å; I87-Y96 HydrophobicContact CG2-CE2 3.49Å; I87-Y96 VanDerWaalsContact CG2-CE2 3.49Å; I87-F124 HydrophobicContact CD1-CD1 4.38Å; I87-F124 HydrophobicContact CG2-CD1 4.23Å; I87-F124 HydrophobicContact CG2-CE1 4.35Å; I87-T126 HydrophobicContact CD1-CG2 3.72Å; I87-T126 HydrophobicContact CG1-CG2 3.96Å; I87-A128 HydrophobicContact CD1-CB 4.07Å
88	C	96.6	Very high	86.1	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	129.4	178.5	-68.2	0	0	0	0	112.2	N69 G71 L72 R92 T126	N69-C88 WeakPolarHBondContact O-CB 3.39Å; G71-C88 PolarHBondContact N-O 3.44Å; L72-C88 HydrophobicContact CB-CB 4.15Å; L72-C88 PolarHBondContact O-N 3.32Å; C88-R92 CarbonylContact C-O 3.56Å; C88-R92 VanDerWaalsContact CA-O 3.32Å; C88-R92 WeakPolarHBondContact CA-O 3.42Å; C88-T126 WeakPolarHBondContact O-CG2 3.38Å
89	H	94.1	Very high	85.6	Confident	37 Å²	37	52.3 Å²	52.3	17%	0.171	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	128.2	172.8	178.1	60.6	0	0	0	109	E70 G91 R92 L125 T126	E70-H89 IonicContact OE1-CE1 2.6Å; E70-H89 IonicContact OE1-CG 3.16Å; E70-H89 IonicContact OE1-ND1 2.73Å; E70-H89 PolarHBondContact OE1-ND1 3.06Å; E70-H89 WeakPolarHBondContact OE2-CA 3.42Å; E70-H89 IonicContact OE2-ND1 3.18Å; H89-G91 PolarHBondContact O-N 3.27Å; H89-R92 PolarHBondContact N-O 3.33Å; H89-R92 PolarHBondContact O-N 2.96Å; H89-R92 VanDerWaalsContact O-O 3.11Å; H89-L125 PolarHBondContact CE1-O 2.87Å; H89-T126 HydrophobicContact CB-CG2 3.91Å
90	L	91.9	Very high	85	Confident	133 Å²	133	56.7 Å²	56.7	70%	0.696	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	42.1	179.2	-57.4	176.8	0	0	0	113.7	E70 R92	E70-L90 PolarHBondContact OE2-N 3.26Å; L90-R92 VanDerWaalsContact C-N 3.28Å; L90-R92 PolarHBondContact O-N 3.2Å
91	G	88.1	Confident	84.2	Confident	48 Å²	48	55.5 Å²	55.5	50%	0.495	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	16	-179.5	0	0	0	0	0	114.9	H89	H89-G91 PolarHBondContact O-N 3.27Å
92	R	93.2	Very high	83.3	Confident	182 Å²	182	53.4 Å²	53.4	69%	0.687	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.7	150.1	176.9	-64	-179.7	177.1	177.9	-0.8	110.9	C88 H89 L90	C88-R92 CarbonylContact C-O 3.56Å; C88-R92 VanDerWaalsContact CA-O 3.32Å; C88-R92 WeakPolarHBondContact CA-O 3.42Å; H89-R92 PolarHBondContact N-O 3.33Å; H89-R92 PolarHBondContact O-N 2.96Å; H89-R92 VanDerWaalsContact O-O 3.11Å; L90-R92 VanDerWaalsContact C-N 3.28Å; L90-R92 PolarHBondContact O-N 3.2Å
93	V	95.2	Very high	81.7	Confident	14 Å²	14	56.1 Å²	56.1	9%	0.085	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	131.4	175.5	-178.4	0	0	0	0	110.2	E60 L63 F64 H95	E60-V93 HydrophobicContact CG-CB 3.99Å; E60-V93 HydrophobicContact CG-CG1 3.96Å; E60-V93 HydrophobicContact CG-CG2 4.42Å; L63-V93 HydrophobicContact CB-CG2 3.91Å; L63-V93 HydrophobicContact CD1-CB 4.47Å; L63-V93 HydrophobicContact CD1-CG1 3.59Å; L63-V93 HydrophobicContact CD1-CG2 3.99Å; F64-V93 HydrophobicContact CE1-CG2 4.13Å; F64-V93 HydrophobicContact CE2-CG2 4.16Å; F64-V93 HydrophobicContact CZ-CG2 3.88Å; V93-H95 VanDerWaalsContact CG1-CE1 3.45Å; V93-H95 WeakPolarHBondContact CG1-CE1 3.1Å
94	H	93.8	Very high	79.3	Confident	47 Å²	47	61.5 Å²	61.5	22%	0.218	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	146.3	174.8	-66	-98.3	0	0	0	109.4	S86 I87 Y96 L125	S86-H94 CarbonylContact C-O 3.54Å; S86-H94 WeakPolarHBondContact CA-O 3.44Å; I87-H94 HydrophobicContact CG2-CB 4.4Å; I87-H94 PolarHBondContact N-O 2.86Å; I87-H94 PolarHBondContact O-N 3.28Å; H94-Y96 HydrophobicContact CB-CE2 3.83Å; H94-L125 VanDerWaalsContact CE1-CD1 3.41Å; H94-L125 WeakPolarHBondContact CE1-CD1 3.38Å; H94-L125 WeakPolarHBondContact ND1-CD1 3.3Å
95	H	92	Very high	76.6	Confident	19 Å²	19	64.2 Å²	64.2	9%	0.088	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	129.9	179.2	-50.1	-87.6	0	0	0	111	R56 E60 R76 V85 S86 V93	R56-H95 VanDerWaalsContact CG-NE2 3.34Å; R56-H95 WeakPolarHBondContact CG-NE2 3.28Å; R56-H95 PolarHBondContact NE-CD2 3.43Å; R56-H95 PolarHBondContact NE-NE2 3.47Å; R56-H95 PolarHBondContact NH2-CD2 3.16Å; E60-H95 IonicContact OE1-NE2 2.65Å; E60-H95 PolarHBondContact OE1-NE2 3.2Å; E60-H95 VanDerWaalsContact OE1-NE2 3.16Å; R76-H95 PolarHBondContact NH2-ND1 2.9Å; V85-H95 CarbonylContact O-C 3.53Å; V85-H95 VanDerWaalsContact O-CA 3.3Å; V85-H95 WeakPolarHBondContact O-CA 3.35Å; S86-H95 VanDerWaalsContact CB-ND1 3.27Å; S86-H95 WeakPolarHBondContact CB-ND1 3.1Å; S86-H95 PolarHBondContact OG-ND1 2.92Å; V93-H95 VanDerWaalsContact CG1-CE1 3.45Å; V93-H95 WeakPolarHBondContact CG1-CE1 3.1Å
96	Y	87.8	Confident	73.8	Confident	4 Å²	4	73 Å²	73	2%	0.016	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	119.4	179.5	-59	-92.2	0	0	0	108	V27 V29 A84 V85 I87 H94 F124 L125	V27-Y96 HydrophobicContact CB-CD1 3.99Å; V27-Y96 HydrophobicContact CB-CE1 3.97Å; V27-Y96 HydrophobicContact CG1-CD1 4.24Å; V27-Y96 HydrophobicContact CG1-CE1 4.18Å; V27-Y96 HydrophobicContact CG2-CE1 4.45Å; V29-Y96 HydrophobicContact CG2-CD1 3.74Å; V29-Y96 HydrophobicContact CG2-CG 4.41Å; A84-Y96 CarbonylContact C-O 3.56Å; A84-Y96 VanDerWaalsContact CA-O 3.27Å; A84-Y96 WeakPolarHBondContact CA-O 3.34Å; V85-Y96 PolarHBondContact N-O 2.91Å; V85-Y96 PolarHBondContact O-N 3.48Å; I87-Y96 HydrophobicContact CG2-CD2 3.87Å; I87-Y96 HydrophobicContact CG2-CE2 3.49Å; I87-Y96 VanDerWaalsContact CG2-CE2 3.49Å; H94-Y96 HydrophobicContact CB-CE2 3.83Å; Y96-F124 HydrophobicContact CD1-CD2 4.35Å; Y96-F124 HydrophobicContact CD1-CE2 4.37Å; Y96-F124 AromaticContact CD2-CD1 3.81Å; Y96-F124 HydrophobicContact CD2-CD1 3.81Å; Y96-F124 AromaticContact CD2-CE1 3.6Å; Y96-F124 HydrophobicContact CD2-CE1 3.6Å; Y96-F124 HydrophobicContact CD2-CG 4.35Å; Y96-F124 AromaticContact CD2-CZ 3.99Å; Y96-F124 HydrophobicContact CD2-CZ 3.99Å; Y96-F124 HydrophobicContact CE1-CG 4.38Å; Y96-F124 AromaticContact CE2-CD1 3.8Å; Y96-F124 HydrophobicContact CE2-CD1 3.8Å; Y96-F124 HydrophobicContact CE2-CE1 4.08Å; Y96-F124 HydrophobicContact CE2-CG 4.24Å; Y96-F124 HydrophobicContact CG-CD1 4.3Å; Y96-F124 HydrophobicContact CG-CD2 4.42Å; Y96-F124 AromaticContact CG-CE1 4Å; Y96-F124 HydrophobicContact CG-CE1 4Å; Y96-F124 HydrophobicContact CG-CE2 4.12Å; Y96-F124 HydrophobicContact CG-CG 4.5Å; Y96-F124 AromaticContact CG-CZ 3.9Å; Y96-F124 HydrophobicContact CG-CZ 3.9Å; Y96-L125 WeakPolarHBondContact OH-CG 3.46Å; Y96-L125 PolarHBondContact OH-N 3.08Å
97	N	82.8	Confident	71.5	Confident	61 Å²	61	79.1 Å²	79.1	33%	0.326	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	134.9	175	-73.7	-24.5	0	0	0	109.4
98	V	77	Confident	69.3	Low	13 Å²	13	80.7 Å²	80.7	8%	0.079	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	102.1	178.6	179	0	0	0	0	108.1	N82 Y83 V85 T110 L113	N82-V98 WeakPolarHBondContact CB-O 3.43Å; Y83-V98 PolarHBondContact N-O 2.79Å; Y83-V98 PolarHBondContact O-N 3.33Å; V85-V98 HydrophobicContact CG2-CG2 4.17Å; V98-T110 HydrophobicContact CB-CG2 4.45Å; V98-T110 HydrophobicContact CG1-CG2 4.12Å; V98-L113 HydrophobicContact CB-CD2 4.18Å; V98-L113 HydrophobicContact CG1-CD2 3.44Å; V98-L113 VanDerWaalsContact CG1-CD2 3.44Å; V98-L113 HydrophobicContact CG2-CD2 3.64Å
99	E	65.2	Low	67.5	Low	119 Å²	119	84.1 Å²	84.1	56%	0.556	42%	0.419	S	S	*	.			trans	-73.9	133.4	-174.9	-58.8	-161.6	140.3	0	0	112.6	Q101	E99-Q101 PolarHBondContact O-N 2.87Å
100	R	58.6	Low	66.3	Low	162 Å²	162	83 Å²	83	61%	0.611	42%	0.415	S	S	*	.			trans	-86.5	104.5	177.7	-156.8	175.8	-164	-91.5	5.6	107.6	N82	N82-R100 VanDerWaalsContact OD1-CB 3.29Å; N82-R100 WeakPolarHBondContact OD1-CB 3.5Å; N82-R100 PolarHBondContact OD1-N 3.45Å
101	Q	50.8	Low	65.3	Low	87 Å²	87	77 Å²	77	41%	0.407	38%	0.383	S	S	.	.			trans	-59.5	143.7	-176.5	-58.6	-102.5	-74.5	0	0	110.7	E99 R107	E99-Q101 PolarHBondContact O-N 2.87Å; Q101-R107 VanDerWaalsContact OE1-CD 3.29Å
102	T	46.8	Very low	64.5	Low	142 Å²	142	76.2 Å²	76.2	87%	0.871	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-1.1	-161.7	46.9	0	0	0	0	115.4
103	D	42.9	Very low	63.6	Low	90 Å²	90	68 Å²	68	48%	0.481	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-5	-169	67.6	-15	0	0	0	114.5	S105	D103-S105 VanDerWaalsContact CG-OG 3.28Å; D103-S105 PolarHBondContact O-N 2.81Å; D103-S105 PolarHBondContact OD1-N 2.8Å; D103-S105 PolarHBondContact OD1-OG 3.34Å; D103-S105 WeakPolarHBondContact OD2-CB 3.45Å; D103-S105 PolarHBondContact OD2-OG 3Å
104	C	36.9	Very low	62.8	Low	130 Å²	130	67.7 Å²	67.7	88%	0.878	33%	0.334	S	S	*	.			trans	57.3	21.4	-170.8	-62.6	0	0	0	0	114.5
105	S	32.9	Very low	62.3	Low	58 Å²	58	71.3 Å²	71.3	41%	0.406	35%	0.352	S	S	.	.			trans	-93	160.8	176.1	90.2	0	0	0	0	112.4	D103 R107	D103-S105 VanDerWaalsContact CG-OG 3.28Å; D103-S105 PolarHBondContact O-N 2.81Å; D103-S105 PolarHBondContact OD1-N 2.8Å; D103-S105 PolarHBondContact OD1-OG 3.34Å; D103-S105 WeakPolarHBondContact OD2-CB 3.45Å; D103-S105 PolarHBondContact OD2-OG 3Å; S105-R107 PolarHBondContact O-N 3.32Å
106	Y	33.5	Very low	61.8	Low	185 Å²	185	72.8 Å²	72.8	73%	0.725	36%	0.359	S	S	*	.			trans	-74.4	98	-169.6	-61.3	-87.3	0	0	0	112.2
107	R	45.9	Very low	61.5	Low	129 Å²	129	72.8 Å²	72.8	49%	0.487	36%	0.358	S	S	.	.			trans	-129.3	139.9	164.7	-70.8	-178.6	168.7	175.1	-3.1	109.6	Q101 S105 Q109	Q101-R107 VanDerWaalsContact OE1-CD 3.29Å; S105-R107 PolarHBondContact O-N 3.32Å; R107-Q109 PolarHBondContact O-N 2.88Å
108	I	48.6	Very low	61.7	Low	34 Å²	34	71.8 Å²	71.8	17%	0.174	36%	0.357	C	S	.	.			trans	-20.9	116.1	-174.7	-51.3	179.2	0	0	0	113.2	P31 L37 L113	P31-I108 HydrophobicContact CB-CD1 4.23Å; L37-I108 HydrophobicContact CD1-CB 4.41Å; L37-I108 HydrophobicContact CD1-CG1 4.39Å; I108-L113 HydrophobicContact CG2-CB 3.96Å; I108-L113 VanDerWaalsContact CG2-N 3.3Å
109	Q	59	Low	62	Low	73 Å²	73	75.5 Å²	75.5	34%	0.341	38%	0.379	S	S	.	.			trans	-66.4	160.2	175.9	-65.7	-160.3	4.2	0	0	109.8	A41 I42 R107 V111 E112 L113	A41-Q109 VanDerWaalsContact CB-CD 3.4Å; A41-Q109 HydrophobicContact CB-CG 3.93Å; A41-Q109 VanDerWaalsContact CB-NE2 3.32Å; I42-Q109 PolarHBondContact O-OE1 3.37Å; I42-Q109 VanDerWaalsContact O-OE1 3.09Å; R107-Q109 PolarHBondContact O-N 2.88Å; Q109-V111 PolarHBondContact O-N 2.87Å; Q109-V111 VanDerWaalsContact O-N 3.13Å; Q109-E112 WeakPolarHBondContact CB-OE2 3.48Å; Q109-E112 PolarHBondContact N-OE2 2.91Å; Q109-E112 CarbonylContact O-C 3.54Å; Q109-E112 WeakPolarHBondContact O-CA 3.48Å; Q109-E112 PolarHBondContact O-N 3.04Å; Q109-L113 PolarHBondContact O-N 2.98Å
110	T	69.8	Low	62.9	Low	13 Å²	13	74.5 Å²	74.5	8%	0.08	38%	0.375	C	S	.	.	H	α-helix	trans	-63.7	-26.3	-174.5	-43.4	0	0	0	0	113	L75 Y83 V98 V114	L75-T110 HydrophobicContact CD1-CG2 3.51Å; L75-T110 HydrophobicContact CD2-CG2 3.73Å; L75-T110 HydrophobicContact CG-CG2 4.24Å; Y83-T110 HydrophobicContact CD2-CG2 4.11Å; Y83-T110 WeakPolarHBondContact CD2-OG1 3.4Å; Y83-T110 WeakPolarHBondContact CE2-OG1 3.48Å; Y83-T110 HydrophobicContact CG-CG2 4.03Å; V98-T110 HydrophobicContact CB-CG2 4.45Å; V98-T110 HydrophobicContact CG1-CG2 4.12Å; T110-V114 WeakPolarHBondContact O-CB 3.39Å; T110-V114 VanDerWaalsContact O-CG2 3.31Å; T110-V114 WeakPolarHBondContact O-CG2 3.39Å; T110-V114 PolarHBondContact O-N 3.34Å; T110-V114 VanDerWaalsContact O-N 3.07Å
111	V	70.2	Confident	64	Low	6 Å²	6	71 Å²	71	4%	0.036	37%	0.368	C	S	.	.	H	α-helix	trans	-70.8	-44.7	169.6	-176.6	0	0	0	0	111	I42 P44 T47 Q109 L113 V114 Q115	I42-V111 HydrophobicContact CB-CB 4.36Å; I42-V111 HydrophobicContact CB-CG1 4.13Å; I42-V111 HydrophobicContact CB-CG2 4.4Å; I42-V111 HydrophobicContact CG2-CG1 4.35Å; I42-V111 HydrophobicContact CG2-CG2 4.3Å; I42-V111 WeakPolarHBondContact O-CG2 3.21Å; P44-V111 HydrophobicContact CB-CG2 4.49Å; P44-V111 HydrophobicContact CG-CG2 4.25Å; T47-V111 HydrophobicContact CG2-CB 4.49Å; T47-V111 HydrophobicContact CG2-CG1 4.19Å; T47-V111 HydrophobicContact CG2-CG2 3.46Å; T47-V111 VanDerWaalsContact CG2-CG2 3.46Å; Q109-V111 PolarHBondContact O-N 2.87Å; Q109-V111 VanDerWaalsContact O-N 3.13Å; V111-L113 VanDerWaalsContact C-N 3.3Å; V111-L113 PolarHBondContact O-N 2.85Å; V111-V114 PolarHBondContact O-N 2.77Å; V111-Q115 WeakPolarHBondContact O-CB 3.33Å; V111-Q115 PolarHBondContact O-N 3.19Å
112	E	71.2	Confident	65.1	Low	33 Å²	33	70.2 Å²	70.2	15%	0.154	37%	0.366	C	S	.	.	H	α-helix	trans	-40.1	-56.8	165.1	48.3	57.4	166.4	0	0	113.3	L37 A41 Q109 Q115 H116	L37-E112 WeakPolarHBondContact CD1-OE2 3.44Å; A41-E112 WeakPolarHBondContact CB-OE1 3.11Å; Q109-E112 WeakPolarHBondContact CB-OE2 3.48Å; Q109-E112 PolarHBondContact N-OE2 2.91Å; Q109-E112 CarbonylContact O-C 3.54Å; Q109-E112 WeakPolarHBondContact O-CA 3.48Å; Q109-E112 PolarHBondContact O-N 3.04Å; E112-Q115 HydrophobicContact CB-CB 4.43Å; E112-Q115 PolarHBondContact O-N 3.38Å; E112-H116 WeakPolarHBondContact O-CB 3.4Å; E112-H116 PolarHBondContact O-N 3.43Å
113	L	74.2	Confident	66.4	Low	9 Å²	9	65.8 Å²	65.8	5%	0.047	35%	0.349	C	S	.	.	H	α-helix	trans	-69.3	-42.7	-174	-172.4	66.3	0	0	0	111.6	P31 V98 I108 Q109 V111 H116 H117	P31-L113 HydrophobicContact CB-CD1 4.48Å; V98-L113 HydrophobicContact CB-CD2 4.18Å; V98-L113 HydrophobicContact CG1-CD2 3.44Å; V98-L113 VanDerWaalsContact CG1-CD2 3.44Å; V98-L113 HydrophobicContact CG2-CD2 3.64Å; I108-L113 HydrophobicContact CG2-CB 3.96Å; I108-L113 VanDerWaalsContact CG2-N 3.3Å; Q109-L113 PolarHBondContact O-N 2.98Å; V111-L113 VanDerWaalsContact C-N 3.3Å; V111-L113 PolarHBondContact O-N 2.85Å; L113-H116 PolarHBondContact O-N 2.9Å; L113-H117 WeakPolarHBondContact CD1-NE2 3.25Å; L113-H117 PolarHBondContact O-CD2 2.93Å; L113-H117 PolarHBondContact O-N 3.23Å
114	V	79.6	Confident	68.3	Low	7 Å²	7	62 Å²	62	4%	0.042	33%	0.328	C	S	.	.	H	α-helix	trans	-61.7	-43.4	173.2	163.3	0	0	0	0	111	Y49 F73 L75 V85 T110 V111 H117 S118	Y49-V114 HydrophobicContact CE2-CG1 4.09Å; F73-V114 HydrophobicContact CD2-CG1 4.43Å; F73-V114 HydrophobicContact CE1-CG1 4.45Å; F73-V114 HydrophobicContact CE2-CG1 3.39Å; F73-V114 HydrophobicContact CE2-CG2 4.37Å; F73-V114 HydrophobicContact CZ-CG1 3.39Å; L75-V114 HydrophobicContact CD1-CG2 4.48Å; V85-V114 HydrophobicContact CG2-CG2 3.93Å; T110-V114 WeakPolarHBondContact O-CB 3.39Å; T110-V114 VanDerWaalsContact O-CG2 3.31Å; T110-V114 WeakPolarHBondContact O-CG2 3.39Å; T110-V114 PolarHBondContact O-N 3.34Å; T110-V114 VanDerWaalsContact O-N 3.07Å; V111-V114 PolarHBondContact O-N 2.77Å; V114-H117 PolarHBondContact O-N 3.31Å; V114-S118 PolarHBondContact O-N 3.17Å; V114-S118 VanDerWaalsContact O-N 3.07Å
115	Q	82.1	Confident	70.6	Confident	124 Å²	124	60.2 Å²	60.2	58%	0.579	31%	0.309	S	S	*	.	H	α-helix	trans	-66.9	-39.9	178.6	-174.1	171.2	-13	0	0	111.6	V111 E112 S118	V111-Q115 WeakPolarHBondContact O-CB 3.33Å; V111-Q115 PolarHBondContact O-N 3.19Å; E112-Q115 HydrophobicContact CB-CB 4.43Å; E112-Q115 PolarHBondContact O-N 3.38Å; Q115-S118 WeakPolarHBondContact O-CB 3.21Å; Q115-S118 PolarHBondContact O-N 2.68Å; Q115-S118 PolarHBondContact O-OG 3.25Å
116	H	81.2	Confident	73.4	Confident	50 Å²	50	58.4 Å²	58.4	23%	0.231	30%	0.296	C	S	.	.	H	α-helix	trans	-57.2	-51.9	170.9	-177	74.1	0	0	0	111.3	E112 L113 S118 T119 Q120 D122	E112-H116 WeakPolarHBondContact O-CB 3.4Å; E112-H116 PolarHBondContact O-N 3.43Å; L113-H116 PolarHBondContact O-N 2.9Å; H116-S118 PolarHBondContact O-N 2.88Å; H116-S118 VanDerWaalsContact O-N 3.13Å; H116-T119 PolarHBondContact O-N 2.97Å; H116-T119 PolarHBondContact O-OG1 3.06Å; H116-T119 VanDerWaalsContact O-OG1 3.13Å; H116-Q120 PolarHBondContact O-N 3.01Å; H116-D122 IonicContact CD2-OD2 3.59Å; H116-D122 IonicContact CE1-OD2 2.66Å; H116-D122 IonicContact NE2-OD2 3.6Å; H116-D122 PolarHBondContact NE2-OD2 2.8Å
117	H	83.5	Confident	76.1	Confident	3 Å²	3	51.4 Å²	51.4	1%	0.014	27%	0.271	C	S	.	.	H	α-helix	trans	-69.7	-6.4	-179.9	-69.1	-63.4	0	0	0	115.3	L113 V114 Q120 L121 F124 L127 A128	L113-H117 WeakPolarHBondContact CD1-NE2 3.25Å; L113-H117 PolarHBondContact O-CD2 2.93Å; L113-H117 PolarHBondContact O-N 3.23Å; V114-H117 PolarHBondContact O-N 3.31Å; H117-Q120 VanDerWaalsContact CA-O 3.28Å; H117-Q120 WeakPolarHBondContact CA-O 3.37Å; H117-Q120 PolarHBondContact ND1-O 2.93Å; H117-L121 PolarHBondContact CE1-O 2.91Å; H117-L121 PolarHBondContact ND1-O 3.44Å; H117-F124 HydrophobicContact CB-CD2 4.44Å; H117-F124 HydrophobicContact CB-CE2 4.48Å; H117-F124 AromaticContact CD2-CD2 3.77Å; H117-F124 AromaticContact CD2-CE2 3.33Å; H117-F124 WeakPolarHBondContact CD2-CE2 3.22Å; H117-F124 AromaticContact CD2-CZ 3.88Å; H117-F124 AromaticContact CE1-CD2 3.45Å; H117-F124 VanDerWaalsContact CE1-CD2 3.45Å; H117-F124 WeakPolarHBondContact CE1-CD2 3.38Å; H117-F124 AromaticContact CE1-CE2 3.68Å; H117-F124 AromaticContact CG-CD2 3.69Å; H117-F124 AromaticContact CG-CE2 3.7Å; H117-F124 AromaticContact ND1-CD2 3.48Å; H117-F124 WeakPolarHBondContact ND1-CD2 3.35Å; H117-F124 AromaticContact ND1-CE2 3.89Å; H117-F124 AromaticContact NE2-CD2 3.66Å; H117-F124 AromaticContact NE2-CE2 3.35Å; H117-F124 VanDerWaalsContact NE2-CE2 3.35Å; H117-F124 WeakPolarHBondContact NE2-CE2 3.4Å; H117-L127 CarbonylContact O-C 3.45Å; H117-L127 WeakPolarHBondContact O-CA 3.41Å; H117-L127 WeakPolarHBondContact O-CD2 3.33Å; H117-A128 HydrophobicContact CB-CB 4.29Å; H117-A128 PolarHBondContact O-N 2.83Å
118	S	86.2	Confident	78.2	Confident	41 Å²	41	45.5 Å²	45.5	29%	0.287	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-19	166.8	77.4	0	0	0	0	113	V114 Q115 H116 A128	V114-S118 PolarHBondContact O-N 3.17Å; V114-S118 VanDerWaalsContact O-N 3.07Å; Q115-S118 WeakPolarHBondContact O-CB 3.21Å; Q115-S118 PolarHBondContact O-N 2.68Å; Q115-S118 PolarHBondContact O-OG 3.25Å; H116-S118 PolarHBondContact O-N 2.88Å; H116-S118 VanDerWaalsContact O-N 3.13Å; S118-A128 WeakPolarHBondContact CA-O 3.48Å; S118-A128 WeakPolarHBondContact CB-O 3.13Å
119	T	83.9	Confident	80	Confident	91 Å²	91	49.6 Å²	49.6	56%	0.558	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.9	-26.4	-177	66.1	0	0	0	0	114.9	H116	H116-T119 PolarHBondContact O-N 2.97Å; H116-T119 PolarHBondContact O-OG1 3.06Å; H116-T119 VanDerWaalsContact O-OG1 3.13Å
120	Q	82.8	Confident	81.6	Confident	98 Å²	98	50.2 Å²	50.2	46%	0.458	27%	0.273	S	S	.	.			trans	-120.4	140.6	177.7	-60.7	-57.2	-36.2	0	0	110.9	H116 H117 L127	H116-Q120 PolarHBondContact O-N 3.01Å; H117-Q120 VanDerWaalsContact CA-O 3.28Å; H117-Q120 WeakPolarHBondContact CA-O 3.37Å; H117-Q120 PolarHBondContact ND1-O 2.93Å; Q120-L127 VanDerWaalsContact C-CD2 3.42Å
121	L	81.9	Confident	82.8	Confident	88 Å²	88	52 Å²	52	46%	0.461	29%	0.285	S	S	.	.			trans	-71.7	-51.2	177.7	-71.6	172.2	0	0	0	111.4	H117 G123 F124 T126 L127	H117-L121 PolarHBondContact CE1-O 2.91Å; H117-L121 PolarHBondContact ND1-O 3.44Å; L121-G123 PolarHBondContact O-N 2.84Å; L121-F124 WeakPolarHBondContact O-CB 3.31Å; L121-F124 PolarHBondContact O-N 2.88Å; L121-T126 VanDerWaalsContact CD2-C 3.47Å; L121-L127 HydrophobicContact CD2-CD2 3.85Å; L121-L127 HydrophobicContact CD2-CG 3.92Å; L121-L127 HydrophobicContact CG-CD2 4.08Å; L121-L127 HydrophobicContact CG-CG 4.48Å
122	D	74.9	Confident	84.1	Confident	70 Å²	70	52.4 Å²	52.4	37%	0.374	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	42.3	40.1	174.7	-75.6	22.3	0	0	0	115.1	H116	H116-D122 IonicContact CD2-OD2 3.59Å; H116-D122 IonicContact CE1-OD2 2.66Å; H116-D122 IonicContact NE2-OD2 3.6Å; H116-D122 PolarHBondContact NE2-OD2 2.8Å
123	G	74.2	Confident	85.2	Confident	50 Å²	50	54.5 Å²	54.5	52%	0.515	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.1	-11	178.9	0	0	0	0	0	115.4	L121	L121-G123 PolarHBondContact O-N 2.84Å
124	F	81.7	Confident	86.2	Confident	10 Å²	10	55.7 Å²	55.7	4%	0.044	30%	0.303	C	S	.	.			trans	-75.8	147.4	165.7	-78.5	-124.3	0	0	0	110.5	V29 V85 I87 Y96 H117 L121 T126	V29-F124 HydrophobicContact CB-CE2 4.49Å; V29-F124 HydrophobicContact CG1-CE2 4.33Å; V29-F124 HydrophobicContact CG2-CD2 4.1Å; V29-F124 HydrophobicContact CG2-CE2 3.9Å; V85-F124 HydrophobicContact CB-CE1 4.14Å; V85-F124 HydrophobicContact CB-CZ 4.13Å; V85-F124 HydrophobicContact CG1-CE1 3.89Å; V85-F124 HydrophobicContact CG1-CZ 4.32Å; V85-F124 HydrophobicContact CG2-CZ 4.22Å; I87-F124 HydrophobicContact CD1-CD1 4.38Å; I87-F124 HydrophobicContact CG2-CD1 4.23Å; I87-F124 HydrophobicContact CG2-CE1 4.35Å; Y96-F124 HydrophobicContact CD1-CD2 4.35Å; Y96-F124 HydrophobicContact CD1-CE2 4.37Å; Y96-F124 AromaticContact CD2-CD1 3.81Å; Y96-F124 HydrophobicContact CD2-CD1 3.81Å; Y96-F124 AromaticContact CD2-CE1 3.6Å; Y96-F124 HydrophobicContact CD2-CE1 3.6Å; Y96-F124 HydrophobicContact CD2-CG 4.35Å; Y96-F124 AromaticContact CD2-CZ 3.99Å; Y96-F124 HydrophobicContact CD2-CZ 3.99Å; Y96-F124 HydrophobicContact CE1-CG 4.38Å; Y96-F124 AromaticContact CE2-CD1 3.8Å; Y96-F124 HydrophobicContact CE2-CD1 3.8Å; Y96-F124 HydrophobicContact CE2-CE1 4.08Å; Y96-F124 HydrophobicContact CE2-CG 4.24Å; Y96-F124 HydrophobicContact CG-CD1 4.3Å; Y96-F124 HydrophobicContact CG-CD2 4.42Å; Y96-F124 AromaticContact CG-CE1 4Å; Y96-F124 HydrophobicContact CG-CE1 4Å; Y96-F124 HydrophobicContact CG-CE2 4.12Å; Y96-F124 HydrophobicContact CG-CG 4.5Å; Y96-F124 AromaticContact CG-CZ 3.9Å; Y96-F124 HydrophobicContact CG-CZ 3.9Å; H117-F124 HydrophobicContact CB-CD2 4.44Å; H117-F124 HydrophobicContact CB-CE2 4.48Å; H117-F124 AromaticContact CD2-CD2 3.77Å; H117-F124 AromaticContact CD2-CE2 3.33Å; H117-F124 WeakPolarHBondContact CD2-CE2 3.22Å; H117-F124 AromaticContact CD2-CZ 3.88Å; H117-F124 AromaticContact CE1-CD2 3.45Å; H117-F124 VanDerWaalsContact CE1-CD2 3.45Å; H117-F124 WeakPolarHBondContact CE1-CD2 3.38Å; H117-F124 AromaticContact CE1-CE2 3.68Å; H117-F124 AromaticContact CG-CD2 3.69Å; H117-F124 AromaticContact CG-CE2 3.7Å; H117-F124 AromaticContact ND1-CD2 3.48Å; H117-F124 WeakPolarHBondContact ND1-CD2 3.35Å; H117-F124 AromaticContact ND1-CE2 3.89Å; H117-F124 AromaticContact NE2-CD2 3.66Å; H117-F124 AromaticContact NE2-CE2 3.35Å; H117-F124 VanDerWaalsContact NE2-CE2 3.35Å; H117-F124 WeakPolarHBondContact NE2-CE2 3.4Å; L121-F124 WeakPolarHBondContact O-CB 3.31Å; L121-F124 PolarHBondContact O-N 2.88Å; F124-T126 VanDerWaalsContact C-N 3.3Å; F124-T126 WeakPolarHBondContact CB-O 3.27Å
125	L	85.6	Confident	86.8	Confident	92 Å²	92	58.9 Å²	58.9	48%	0.482	32%	0.324	S	S	.	.	S	Bend	trans	-73.6	-20	174.5	-68.9	168	0	0	0	113.6	H89 H94 Y96	H89-L125 PolarHBondContact CE1-O 2.87Å; H94-L125 VanDerWaalsContact CE1-CD1 3.41Å; H94-L125 WeakPolarHBondContact CE1-CD1 3.38Å; H94-L125 WeakPolarHBondContact ND1-CD1 3.3Å; Y96-L125 WeakPolarHBondContact OH-CG 3.46Å; Y96-L125 PolarHBondContact OH-N 3.08Å
126	T	90.8	Very high	87.1	Confident	21 Å²	21	60.6 Å²	60.6	13%	0.129	34%	0.342	C	S	.	.	S	Bend	trans	-153.7	164.2	177.8	-163.1	0	0	0	0	110.9	E70 I87 C88 H89 L121 F124	E70-T126 WeakPolarHBondContact OE1-CB 3.44Å; E70-T126 WeakPolarHBondContact OE1-CG2 3.29Å; E70-T126 PolarHBondContact OE1-OG1 3.48Å; I87-T126 HydrophobicContact CD1-CG2 3.72Å; I87-T126 HydrophobicContact CG1-CG2 3.96Å; C88-T126 WeakPolarHBondContact O-CG2 3.38Å; H89-T126 HydrophobicContact CB-CG2 3.91Å; L121-T126 VanDerWaalsContact CD2-C 3.47Å; F124-T126 VanDerWaalsContact C-N 3.3Å; F124-T126 WeakPolarHBondContact CB-O 3.27Å
127	L	90.9	Very high	87.3	Confident	38 Å²	38	61.5 Å²	61.5	20%	0.199	37%	0.366	C	S	.	.			trans	-78.4	138.2	-178.1	-65.9	174.2	0	0	0	111.3	G71 H117 Q120 L121 Q129	G71-L127 VanDerWaalsContact CA-O 3.28Å; G71-L127 WeakPolarHBondContact CA-O 3.42Å; H117-L127 CarbonylContact O-C 3.45Å; H117-L127 WeakPolarHBondContact O-CA 3.41Å; H117-L127 WeakPolarHBondContact O-CD2 3.33Å; Q120-L127 VanDerWaalsContact C-CD2 3.42Å; L121-L127 HydrophobicContact CD2-CD2 3.85Å; L121-L127 HydrophobicContact CD2-CG 3.92Å; L121-L127 HydrophobicContact CG-CD2 4.08Å; L121-L127 HydrophobicContact CG-CG 4.48Å; L127-Q129 HydrophobicContact CB-CG 3.7Å; L127-Q129 PolarHBondContact O-N 3.4Å
128	A	89.4	Confident	87.7	Confident	4 Å²	4	65.8 Å²	65.8	3%	0.033	39%	0.387	C	S	.	.			trans	-76.7	67.7	177.5	0	0	0	0	0	111.5	F73 I87 H117 S118	F73-A128 HydrophobicContact CD1-CB 3.76Å; F73-A128 HydrophobicContact CE1-CB 3.9Å; F73-A128 VanDerWaalsContact CE1-O 3.23Å; F73-A128 WeakPolarHBondContact CE1-O 3.43Å; F73-A128 HydrophobicContact CG-CB 4.17Å; F73-A128 HydrophobicContact CZ-CB 4.44Å; I87-A128 HydrophobicContact CD1-CB 4.07Å; H117-A128 HydrophobicContact CB-CB 4.29Å; H117-A128 PolarHBondContact O-N 2.83Å; S118-A128 WeakPolarHBondContact CA-O 3.48Å; S118-A128 WeakPolarHBondContact CB-O 3.13Å
129	Q	87.8	Confident	88	Confident	121 Å²	121	64.4 Å²	64.4	57%	0.565	38%	0.377	S	S	*	.			trans	-88.7	-30.5	-170.3	-66.1	-176.2	-8.6	0	0	114.3	G71 L127 P131	G71-Q129 PolarHBondContact O-N 2.9Å; L127-Q129 HydrophobicContact CB-CG 3.7Å; L127-Q129 PolarHBondContact O-N 3.4Å; Q129-P131 WeakPolarHBondContact O-CD 3.37Å
130	L	92.6	Very high	88.5	Confident	85 Å²	85	60.9 Å²	60.9	45%	0.445	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	92.2	-169.6	-73.5	168.1	0	0	0	110.8	N69 G71 L72 F73 L132	N69-L130 HydrophobicContact CB-CD1 4.47Å; G71-L130 PolarHBondContact O-N 3.01Å; L72-L130 CarbonylContact C-O 3.59Å; L72-L130 WeakPolarHBondContact CA-O 3.5Å; L72-L130 HydrophobicContact CB-CB 4.42Å; L72-L130 HydrophobicContact CD1-CB 4.08Å; F73-L130 WeakPolarHBondContact CD1-O 3.3Å; F73-L130 PolarHBondContact N-O 2.98Å; L130-L132 PolarHBondContact O-N 2.9Å
131	P	94.6	Very high	89	Confident	51 Å²	51	58.6 Å²	58.6	33%	0.331	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	113.6	175.9	25.4	-31.9	0	0	0	110.9	Y49 F73 Q129 N133	Y49-P131 HydrophobicContact CD1-CB 3.57Å; Y49-P131 HydrophobicContact CE1-CB 4.33Å; Y49-P131 HydrophobicContact CG-CB 3.97Å; F73-P131 HydrophobicContact CE1-CB 3.87Å; F73-P131 HydrophobicContact CE1-CG 4.44Å; F73-P131 HydrophobicContact CE2-CB 4.33Å; F73-P131 HydrophobicContact CZ-CB 3.66Å; F73-P131 HydrophobicContact CZ-CG 4.48Å; Q129-P131 WeakPolarHBondContact O-CD 3.37Å; P131-N133 PolarHBondContact O-N 3.49Å; P131-N133 PolarHBondContact O-ND2 3.07Å
132	L	96.5	Very high	89.3	Confident	14 Å²	14	55.6 Å²	55.6	7%	0.073	33%	0.332	C	S	.	.			trans	-70.3	98.1	166.6	-179.1	58.2	0	0	0	108.2	Y49 Y51 L62 L63 N66 L72 F73 L74 L130	Y49-L132 WeakPolarHBondContact CA-O 3.26Å; Y49-L132 WeakPolarHBondContact CB-O 3.42Å; Y51-L132 WeakPolarHBondContact CE2-O 3.4Å; L62-L132 HydrophobicContact CB-CD2 4.32Å; L63-L132 HydrophobicContact CD2-CB 4.45Å; L63-L132 HydrophobicContact CD2-CD2 3.9Å; L63-L132 HydrophobicContact CG-CD2 4.44Å; N66-L132 HydrophobicContact CB-CD1 3.8Å; N66-L132 HydrophobicContact CB-CD2 4.16Å; L72-L132 HydrophobicContact CD1-CB 4.02Å; L72-L132 HydrophobicContact CG-CB 4.34Å; F73-L132 WeakPolarHBondContact O-CB 3.43Å; F73-L132 PolarHBondContact O-N 2.89Å; L74-L132 HydrophobicContact CD2-CD2 4.38Å; L130-L132 PolarHBondContact O-N 2.9Å
133	N	95.6	Very high	90.1	Very high	77 Å²	77	52.4 Å²	52.4	41%	0.412	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-79	141.6	179.2	-67.8	-64.7	0	0	0	111	N48 Y49 Y51 P131	N48-N133 HydrophobicContact CB-CB 4.07Å; N48-N133 WeakPolarHBondContact CB-OD1 3.49Å; N48-N133 WeakPolarHBondContact O-CA 3.46Å; Y49-N133 PolarHBondContact N-OD1 3.15Å; Y51-N133 PolarHBondContact OH-O 3.08Å; P131-N133 PolarHBondContact O-N 3.49Å; P131-N133 PolarHBondContact O-ND2 3.07Å
134	R	94.5	Very high	90.9	Very high	34 Å²	34	51.1 Å²	51.1	13%	0.128	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-53.2	140.7	169.3	-67	-172.6	-47.4	-78.7	-12.2	110.3	T47 N48 F50 Y51 M138	T47-R134 PolarHBondContact O-NH1 2.85Å; N48-R134 WeakPolarHBondContact O-CB 3.47Å; N48-R134 WeakPolarHBondContact O-CG 3.42Å; N48-R134 PolarHBondContact O-N 3.02Å; N48-R134 PolarHBondContact O-NH1 3.17Å; F50-R134 WeakPolarHBondContact O-CD 3.28Å; F50-R134 PolarHBondContact O-NH1 3.37Å; Y51-R134 HydrophobicContact CD1-CG 3.99Å; Y51-R134 HydrophobicContact CD2-CG 4.24Å; Y51-R134 HydrophobicContact CE1-CG 3.82Å; Y51-R134 HydrophobicContact CE2-CG 4.07Å; Y51-R134 HydrophobicContact CG-CG 4.2Å; Y51-R134 PolarHBondContact OH-N 2.85Å; R134-M138 HydrophobicContact CB-CB 4.33Å; R134-M138 HydrophobicContact CB-SD 4.5Å; R134-M138 PolarHBondContact NE-O 3.36Å
135	P	92.6	Very high	91.1	Very high	75 Å²	75	53.2 Å²	53.2	49%	0.487	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-52.6	147.9	169.6	-27.7	35.6	0	0	0	112.9	G137 M138	P135-G137 PolarHBondContact O-N 3.24Å; P135-M138 HydrophobicContact CB-CE 4.48Å; P135-M138 HydrophobicContact CG-CE 4Å; P135-M138 VanDerWaalsContact O-CB 3.27Å; P135-M138 WeakPolarHBondContact O-CB 3.41Å; P135-M138 PolarHBondContact O-N 3.31Å
136	V	88.5	Confident	91.4	Very high	159 Å²	159	49.1 Å²	49.1	96%	0.964	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	128.8	-179.1	-179	0	0	0	0	110.5
137	G	85.2	Confident	91.5	Very high	70 Å²	70	50.2 Å²	50.2	72%	0.722	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	90	-16.8	-176.1	0	0	0	0	0	115.1	P135 S139	P135-G137 PolarHBondContact O-N 3.24Å; G137-S139 PolarHBondContact O-N 3.19Å
138	M	91.6	Very high	91.5	Very high	93 Å²	93	50 Å²	50	46%	0.458	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-77	119.7	175.3	-173.3	-176.9	-69	0	0	110.7	Y51 R134 P135	Y51-M138 HydrophobicContact CE1-SD 4.42Å; R134-M138 HydrophobicContact CB-CB 4.33Å; R134-M138 HydrophobicContact CB-SD 4.5Å; R134-M138 PolarHBondContact NE-O 3.36Å; P135-M138 HydrophobicContact CB-CE 4.48Å; P135-M138 HydrophobicContact CG-CE 4Å; P135-M138 VanDerWaalsContact O-CB 3.27Å; P135-M138 WeakPolarHBondContact O-CB 3.41Å; P135-M138 PolarHBondContact O-N 3.31Å
139	S	92.5	Very high	91.7	Very high	11 Å²	11	54.5 Å²	54.5	8%	0.077	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-94	160.1	171.9	78.5	0	0	0	0	111.5	G137 N147 A148 N149	G137-S139 PolarHBondContact O-N 3.19Å; S139-N147 WeakPolarHBondContact OG-CB 3.44Å; S139-N147 VanDerWaalsContact OG-CG 3.31Å; S139-N147 PolarHBondContact OG-OD1 2.79Å; S139-A148 PolarHBondContact OG-N 3.24Å; S139-A148 VanDerWaalsContact OG-N 3.16Å; S139-N149 WeakPolarHBondContact CB-OD1 3.38Å; S139-N149 PolarHBondContact OG-N 3.44Å; S139-N149 VanDerWaalsContact OG-N 3.1Å
140	P	93.9	Very high	91.9	Very high	18 Å²	18	52.1 Å²	52.1	12%	0.117	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-58.7	146.3	179.7	-24.4	34.8	0	0	0	113.2	F50 N147 A148	F50-P140 HydrophobicContact CD1-CB 3.97Å; F50-P140 HydrophobicContact CD1-CG 3.87Å; F50-P140 HydrophobicContact CE1-CB 3.95Å; F50-P140 HydrophobicContact CE1-CG 4.24Å; P140-N147 CarbonylContact O-C 3.58Å; P140-N147 WeakPolarHBondContact O-CA 3.27Å; P140-A148 PolarHBondContact O-N 3.27Å
141	I	93	Very high	91.8	Very high	50 Å²	50	48.2 Å²	48.2	26%	0.256	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	131.8	175.9	-71.1	168.7	0	0	0	109.6	Y51 G52 K53 I54 L143	Y51-I141 PolarHBondContact O-N 2.72Å; G52-I141 CarbonylContact C-O 3.54Å; G52-I141 WeakPolarHBondContact CA-O 3.39Å; K53-I141 HydrophobicContact CB-CG2 4.33Å; K53-I141 PolarHBondContact N-O 2.87Å; K53-I141 WeakPolarHBondContact O-CG2 3.32Å; I54-I141 HydrophobicContact CG2-CD1 3.74Å; I141-L143 WeakPolarHBondContact CG2-O 3.22Å
142	V	90.1	Very high	91.7	Very high	25 Å²	25	48.5 Å²	48.5	15%	0.152	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	-31.8	-175.8	-180	0	0	0	0	112.2	L146 A148 L151	V142-L146 PolarHBondContact N-O 3.13Å; V142-A148 HydrophobicContact CG2-CB 3.85Å; V142-L151 HydrophobicContact CG1-CD2 3.83Å
143	L	91	Very high	91.6	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.016	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	155.7	163.2	-61.9	174.3	0	0	0	107.1	I141 G145 L146 I186 M264 D268	I141-L143 WeakPolarHBondContact CG2-O 3.22Å; L143-G145 PolarHBondContact O-N 3.23Å; L143-G145 VanDerWaalsContact O-N 3.08Å; L143-L146 HydrophobicContact CB-CB 4.33Å; L143-L146 HydrophobicContact CD1-CD2 4.4Å; L143-L146 PolarHBondContact N-O 3.01Å; L143-L146 PolarHBondContact O-N 2.96Å; L143-I186 HydrophobicContact CD1-CD1 4.14Å; L143-I186 HydrophobicContact CD1-CG1 4.44Å; L143-I186 HydrophobicContact CD1-CG2 3.67Å; L143-M264 HydrophobicContact CB-CE 4.4Å; L143-M264 HydrophobicContact CD1-CB 3.99Å; L143-M264 HydrophobicContact CD1-CE 4.33Å; L143-D268 VanDerWaalsContact CA-OD1 3.3Å; L143-D268 WeakPolarHBondContact CA-OD1 3.39Å; L143-D268 HydrophobicContact CB-CB 4.41Å; L143-D268 HydrophobicContact CD2-CB 3.86Å; L143-D268 WeakPolarHBondContact CD2-OD2 3.36Å
144	Q	90.9	Very high	91.4	Very high	22 Å²	22	52 Å²	52	10%	0.103	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	118.5	172.8	-67.9	-69.8	-32	0	0	110.6	K53 D268 H271	K53-Q144 PolarHBondContact O-NE2 3.15Å; Q144-D268 PolarHBondContact N-OD1 2.94Å; Q144-H271 HydrophobicContact CG-CB 4.06Å
145	G	86	Confident	91.1	Very high	55 Å²	55	50.4 Å²	50.4	57%	0.567	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.3	6.2	-172.7	0	0	0	0	0	116.6	L143	L143-G145 PolarHBondContact O-N 3.23Å; L143-G145 VanDerWaalsContact O-N 3.08Å
146	L	91.6	Very high	91.2	Very high	6 Å²	6	51 Å²	51	3%	0.031	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	117.9	179.3	179.9	70.3	0	0	0	112.1	V142 L143 D150 L151 I186 L189	V142-L146 PolarHBondContact N-O 3.13Å; L143-L146 HydrophobicContact CB-CB 4.33Å; L143-L146 HydrophobicContact CD1-CD2 4.4Å; L143-L146 PolarHBondContact N-O 3.01Å; L143-L146 PolarHBondContact O-N 2.96Å; L146-D150 HydrophobicContact CD1-CB 3.71Å; L146-L151 HydrophobicContact CD1-CB 4.31Å; L146-L151 HydrophobicContact CD2-CB 4.18Å; L146-L151 HydrophobicContact CD2-CD1 4.3Å; L146-L151 HydrophobicContact CG-CB 4.29Å; L146-I186 HydrophobicContact CD2-CG1 4.49Å; L146-L189 HydrophobicContact CB-CD2 4.46Å; L146-L189 HydrophobicContact CD1-CD2 3.98Å; L146-L189 HydrophobicContact CD2-CD2 3.75Å; L146-L189 HydrophobicContact CG-CD2 4.28Å
147	N	92.9	Very high	91.4	Very high	43 Å²	43	47.5 Å²	47.5	23%	0.23	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	170.5	174	76.9	60.6	0	0	0	112.8	S139 P140 N149 D150 L151	S139-N147 WeakPolarHBondContact OG-CB 3.44Å; S139-N147 VanDerWaalsContact OG-CG 3.31Å; S139-N147 PolarHBondContact OG-OD1 2.79Å; P140-N147 CarbonylContact O-C 3.58Å; P140-N147 WeakPolarHBondContact O-CA 3.27Å; N147-N149 PolarHBondContact O-N 3.05Å; N147-N149 WeakPolarHBondContact OD1-CA 3.15Å; N147-N149 WeakPolarHBondContact OD1-CB 3.33Å; N147-N149 PolarHBondContact OD1-N 3.27Å; N147-D150 VanDerWaalsContact CG-CG 3.45Å; N147-D150 VanDerWaalsContact CG-OD2 3.31Å; N147-D150 PolarHBondContact ND2-OD1 3.15Å; N147-D150 VanDerWaalsContact ND2-OD1 3.16Å; N147-D150 PolarHBondContact ND2-OD2 3.3Å; N147-D150 PolarHBondContact O-N 3Å; N147-D150 PolarHBondContact OD1-N 3.43Å; N147-D150 PolarHBondContact OD1-OD1 3.13Å; N147-L151 PolarHBondContact O-N 2.83Å
148	A	91.3	Very high	91.5	Very high	33 Å²	33	45.9 Å²	45.9	27%	0.273	25%	0.248	S	C	.	.	H	α-helix	trans	-65.1	-37.8	-175.4	0	0	0	0	0	113.7	S139 P140 V142 L151 E152	S139-A148 PolarHBondContact OG-N 3.24Å; S139-A148 VanDerWaalsContact OG-N 3.16Å; P140-A148 PolarHBondContact O-N 3.27Å; V142-A148 HydrophobicContact CG2-CB 3.85Å; A148-L151 PolarHBondContact O-N 2.91Å; A148-E152 PolarHBondContact O-N 2.87Å
149	N	92.9	Very high	91.1	Very high	99 Å²	99	41.4 Å²	41.4	53%	0.529	23%	0.226	S	C	.	.	H	α-helix	trans	-67.5	-43.8	176.7	-67.3	-7	0	0	0	111.1	S139 N147 L151 E152 H153	S139-N149 WeakPolarHBondContact CB-OD1 3.38Å; S139-N149 PolarHBondContact OG-N 3.44Å; S139-N149 VanDerWaalsContact OG-N 3.1Å; N147-N149 PolarHBondContact O-N 3.05Å; N147-N149 WeakPolarHBondContact OD1-CA 3.15Å; N147-N149 WeakPolarHBondContact OD1-CB 3.33Å; N147-N149 PolarHBondContact OD1-N 3.27Å; N149-L151 VanDerWaalsContact C-N 3.32Å; N149-L151 PolarHBondContact O-N 2.91Å; N149-E152 PolarHBondContact O-N 3.4Å; N149-H153 WeakPolarHBondContact O-CB 3.4Å; N149-H153 PolarHBondContact O-N 2.83Å
150	D	91.8	Very high	91	Very high	71 Å²	71	45.2 Å²	45.2	38%	0.38	25%	0.245	S	C	.	.	H	α-helix	trans	-61.2	-42.5	177.2	-60.7	-12	0	0	0	110.9	L146 N147 H153 N154	L146-D150 HydrophobicContact CD1-CB 3.71Å; N147-D150 VanDerWaalsContact CG-CG 3.45Å; N147-D150 VanDerWaalsContact CG-OD2 3.31Å; N147-D150 PolarHBondContact ND2-OD1 3.15Å; N147-D150 VanDerWaalsContact ND2-OD1 3.16Å; N147-D150 PolarHBondContact ND2-OD2 3.3Å; N147-D150 PolarHBondContact O-N 3Å; N147-D150 PolarHBondContact OD1-N 3.43Å; N147-D150 PolarHBondContact OD1-OD1 3.13Å; D150-H153 PolarHBondContact O-N 3.2Å; D150-N154 WeakPolarHBondContact O-CB 3.38Å; D150-N154 PolarHBondContact O-N 2.72Å; D150-N154 PolarHBondContact O-ND2 2.79Å
151	L	90.5	Very high	90.7	Very high	4 Å²	4	50.9 Å²	50.9	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-63.4	-47.1	175.8	176.9	58.4	0	0	0	111.2	V142 L146 N147 A148 N149 H153 N154 L155 V185 I186	V142-L151 HydrophobicContact CG1-CD2 3.83Å; L146-L151 HydrophobicContact CD1-CB 4.31Å; L146-L151 HydrophobicContact CD2-CB 4.18Å; L146-L151 HydrophobicContact CD2-CD1 4.3Å; L146-L151 HydrophobicContact CG-CB 4.29Å; N147-L151 PolarHBondContact O-N 2.83Å; A148-L151 PolarHBondContact O-N 2.91Å; N149-L151 VanDerWaalsContact C-N 3.32Å; N149-L151 PolarHBondContact O-N 2.91Å; L151-H153 VanDerWaalsContact C-N 3.31Å; L151-H153 PolarHBondContact O-N 2.93Å; L151-N154 PolarHBondContact O-N 3.01Å; L151-L155 HydrophobicContact CD1-CD1 4.24Å; L151-L155 HydrophobicContact CD1-CD2 4.46Å; L151-L155 HydrophobicContact CD1-CG 3.99Å; L151-L155 HydrophobicContact CG-CD1 4.01Å; L151-L155 HydrophobicContact CG-CG 4.25Å; L151-L155 WeakPolarHBondContact O-CB 3.23Å; L151-L155 WeakPolarHBondContact O-CG 3.21Å; L151-L155 PolarHBondContact O-N 2.84Å; L151-V185 HydrophobicContact CD1-CG1 3.97Å; L151-I186 HydrophobicContact CD1-CD1 4.45Å; L151-I186 HydrophobicContact CD1-CG1 4.33Å
152	E	93	Very high	90	Very high	57 Å²	57	52.3 Å²	52.3	27%	0.266	28%	0.276	S	S	.	.	H	α-helix	trans	-63.8	-36.6	179.1	-168.7	58.3	-144.3	0	0	112.3	A148 N149 R156 R178	A148-E152 PolarHBondContact O-N 2.87Å; N149-E152 PolarHBondContact O-N 3.4Å; E152-R156 WeakPolarHBondContact O-CB 3.35Å; E152-R156 PolarHBondContact O-N 3.03Å; E152-R178 IonicContact OE2-CZ 3.68Å; E152-R178 IonicContact OE2-NE 2.68Å; E152-R178 IonicContact OE2-NH2 3.69Å; E152-R178 PolarHBondContact OE2-NH2 3.19Å
153	H	93.7	Very high	89.6	Confident	115 Å²	115	53.4 Å²	53.4	53%	0.532	29%	0.293	S	S	.	.	H	α-helix	trans	-62.6	-49	172.2	-173.4	80	0	0	0	111.8	N149 D150 L151 L155 R156 L157	N149-H153 WeakPolarHBondContact O-CB 3.4Å; N149-H153 PolarHBondContact O-N 2.83Å; D150-H153 PolarHBondContact O-N 3.2Å; L151-H153 VanDerWaalsContact C-N 3.31Å; L151-H153 PolarHBondContact O-N 2.93Å; H153-L155 PolarHBondContact O-N 3.44Å; H153-R156 WeakPolarHBondContact O-CB 3.47Å; H153-R156 PolarHBondContact O-N 3.07Å; H153-L157 WeakPolarHBondContact O-CG 3.28Å; H153-L157 PolarHBondContact O-N 3.28Å
154	N	92.4	Very high	89	Confident	50 Å²	50	55.2 Å²	55.2	27%	0.267	30%	0.302	S	S	.	.	H	α-helix	trans	-66.7	-36.2	178.7	-80.3	-83.7	0	0	0	112.8	D150 L151 R156 L157 K158 V185	D150-N154 WeakPolarHBondContact O-CB 3.38Å; D150-N154 PolarHBondContact O-N 2.72Å; D150-N154 PolarHBondContact O-ND2 2.79Å; L151-N154 PolarHBondContact O-N 3.01Å; N154-R156 VanDerWaalsContact C-N 3.32Å; N154-R156 PolarHBondContact O-N 3.37Å; N154-L157 PolarHBondContact O-N 3.07Å; N154-K158 WeakPolarHBondContact O-CB 3.49Å; N154-K158 PolarHBondContact O-N 2.9Å; N154-V185 HydrophobicContact CB-CG1 3.64Å; N154-V185 HydrophobicContact CB-CG2 4.2Å; N154-V185 WeakPolarHBondContact O-CG2 3.32Å
155	L	87.6	Confident	88.8	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-58	-45.6	171.9	-75.6	172.3	0	0	0	111.1	L151 H153 K158 A159 L173 R178 L181 R182 V185	L151-L155 HydrophobicContact CD1-CD1 4.24Å; L151-L155 HydrophobicContact CD1-CD2 4.46Å; L151-L155 HydrophobicContact CD1-CG 3.99Å; L151-L155 HydrophobicContact CG-CD1 4.01Å; L151-L155 HydrophobicContact CG-CG 4.25Å; L151-L155 WeakPolarHBondContact O-CB 3.23Å; L151-L155 WeakPolarHBondContact O-CG 3.21Å; L151-L155 PolarHBondContact O-N 2.84Å; H153-L155 PolarHBondContact O-N 3.44Å; L155-K158 PolarHBondContact O-N 3.12Å; L155-A159 WeakPolarHBondContact O-CB 3.48Å; L155-A159 PolarHBondContact O-N 3.36Å; L155-L173 HydrophobicContact CB-CD2 3.58Å; L155-R178 HydrophobicContact CD1-CG 4.39Å; L155-L181 VanDerWaalsContact CD2-C 3.41Å; L155-L181 HydrophobicContact CD2-CB 3.58Å; L155-R182 VanDerWaalsContact CD2-CA 3.49Å; L155-R182 HydrophobicContact CD2-CB 3.96Å; L155-V185 HydrophobicContact CD2-CG2 4.33Å
156	R	95.5	Very high	89	Confident	86 Å²	86	62.2 Å²	62.2	33%	0.325	33%	0.333	S	S	.	.	H	α-helix	trans	-65.1	-42.7	177.9	-178.1	172.9	-69.7	-91.1	-8.7	112.1	E152 H153 N154 A159 I160 V169 E170 L173	E152-R156 WeakPolarHBondContact O-CB 3.35Å; E152-R156 PolarHBondContact O-N 3.03Å; H153-R156 WeakPolarHBondContact O-CB 3.47Å; H153-R156 PolarHBondContact O-N 3.07Å; N154-R156 VanDerWaalsContact C-N 3.32Å; N154-R156 PolarHBondContact O-N 3.37Å; R156-A159 PolarHBondContact O-N 3.13Å; R156-I160 HydrophobicContact CG-CD1 4.27Å; R156-I160 WeakPolarHBondContact O-CD1 3.44Å; R156-I160 WeakPolarHBondContact O-CG1 3.33Å; R156-I160 PolarHBondContact O-N 2.74Å; R156-V169 HydrophobicContact CG-CG1 4.14Å; R156-E170 IonicContact CZ-OE1 2.81Å; R156-E170 IonicContact CZ-OE2 2.62Å; R156-E170 IonicContact NH1-OE1 3.92Å; R156-E170 PolarHBondContact NH1-OE1 3.35Å; R156-E170 IonicContact NH1-OE2 3.58Å; R156-E170 IonicContact NH2-OE1 2.68Å; R156-E170 PolarHBondContact NH2-OE1 2.94Å; R156-E170 IonicContact NH2-OE2 3.79Å; R156-E170 PolarHBondContact NH2-OE2 2.85Å; R156-L173 HydrophobicContact CB-CD1 3.97Å; R156-L173 HydrophobicContact CG-CD1 4.24Å
157	L	92.8	Very high	88.8	Confident	86 Å²	86	68.6 Å²	68.6	45%	0.45	36%	0.363	S	S	.	.	H	α-helix	trans	-61.5	-46.4	173	-69.4	-179.8	0	0	0	111.6	H153 N154 A159 I160 E161	H153-L157 WeakPolarHBondContact O-CG 3.28Å; H153-L157 PolarHBondContact O-N 3.28Å; N154-L157 PolarHBondContact O-N 3.07Å; L157-A159 VanDerWaalsContact C-N 3.33Å; L157-A159 PolarHBondContact O-N 3.13Å; L157-I160 PolarHBondContact O-N 3.17Å; L157-I160 VanDerWaalsContact O-N 3.14Å; L157-E161 PolarHBondContact O-N 3.17Å
158	K	87.3	Confident	88.1	Confident	36 Å²	36	68.7 Å²	68.7	16%	0.157	37%	0.367	C	S	.	.	H	α-helix	trans	-62.5	-38.2	178.9	-159.6	78.4	-154.6	167.4	0	112.2	N154 L155 I160 E161 M162 L181 L184 V185	N154-K158 WeakPolarHBondContact O-CB 3.49Å; N154-K158 PolarHBondContact O-N 2.9Å; L155-K158 PolarHBondContact O-N 3.12Å; K158-I160 VanDerWaalsContact C-N 3.35Å; K158-I160 PolarHBondContact O-N 2.77Å; K158-E161 WeakPolarHBondContact CD-OE2 3.21Å; K158-E161 WeakPolarHBondContact CE-OE1 3.36Å; K158-E161 VanDerWaalsContact CE-OE2 3.3Å; K158-E161 WeakPolarHBondContact CE-OE2 3.09Å; K158-E161 IonicContact NZ-OE1 3.28Å; K158-E161 PolarHBondContact NZ-OE1 2.99Å; K158-E161 IonicContact NZ-OE2 2.7Å; K158-E161 PolarHBondContact NZ-OE2 3.18Å; K158-E161 PolarHBondContact O-N 3.08Å; K158-M162 WeakPolarHBondContact O-CB 3.48Å; K158-M162 VanDerWaalsContact O-CG 3.27Å; K158-M162 WeakPolarHBondContact O-CG 3.28Å; K158-M162 PolarHBondContact O-N 3.3Å; K158-L181 HydrophobicContact CB-CD2 4.08Å; K158-L181 HydrophobicContact CG-CD2 4.12Å; K158-L184 HydrophobicContact CD-CB 4.48Å; K158-L184 HydrophobicContact CG-CB 4.25Å; K158-V185 HydrophobicContact CB-CG2 3.7Å; K158-V185 HydrophobicContact CD-CG2 4.41Å; K158-V185 HydrophobicContact CG-CG2 4.09Å
159	A	82.6	Confident	87.8	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-61.4	-42.3	174	0	0	0	0	0	112.2	L155 R156 L157 M162 G163 L164 V169 L181	L155-A159 WeakPolarHBondContact O-CB 3.48Å; L155-A159 PolarHBondContact O-N 3.36Å; R156-A159 PolarHBondContact O-N 3.13Å; L157-A159 VanDerWaalsContact C-N 3.33Å; L157-A159 PolarHBondContact O-N 3.13Å; A159-M162 PolarHBondContact O-N 2.89Å; A159-G163 PolarHBondContact O-N 3.32Å; A159-L164 HydrophobicContact CB-CD1 4.09Å; A159-L164 VanDerWaalsContact O-CB 3.27Å; A159-L164 WeakPolarHBondContact O-CB 3.49Å; A159-L164 PolarHBondContact O-N 2.97Å; A159-L164 VanDerWaalsContact O-N 3.11Å; A159-V169 HydrophobicContact CB-CG1 4Å; A159-L181 HydrophobicContact CB-CD1 4.03Å; A159-L181 HydrophobicContact CB-CD2 4.15Å
160	I	90.6	Very high	87.6	Confident	91 Å²	91	65.9 Å²	65.9	47%	0.467	35%	0.345	S	S	.	.	H	α-helix	trans	-69.2	-40.2	177.2	-65.9	164.4	0	0	0	111.3	R156 L157 K158 M162 G163 V169	R156-I160 HydrophobicContact CG-CD1 4.27Å; R156-I160 WeakPolarHBondContact O-CD1 3.44Å; R156-I160 WeakPolarHBondContact O-CG1 3.33Å; R156-I160 PolarHBondContact O-N 2.74Å; L157-I160 PolarHBondContact O-N 3.17Å; L157-I160 VanDerWaalsContact O-N 3.14Å; K158-I160 VanDerWaalsContact C-N 3.35Å; K158-I160 PolarHBondContact O-N 2.77Å; I160-M162 VanDerWaalsContact C-N 3.31Å; I160-M162 PolarHBondContact O-N 2.95Å; I160-G163 WeakPolarHBondContact O-CA 3.21Å; I160-G163 PolarHBondContact O-N 3.11Å; I160-V169 HydrophobicContact CG1-CG2 3.96Å
161	E	87.1	Confident	86.7	Confident	136 Å²	136	66.5 Å²	66.5	64%	0.636	35%	0.346	S	S	*	.	H	α-helix	trans	-59.1	-41	173.4	-171.2	-159.3	131.7	0	0	111.7	L157 K158 G163	L157-E161 PolarHBondContact O-N 3.17Å; K158-E161 WeakPolarHBondContact CD-OE2 3.21Å; K158-E161 WeakPolarHBondContact CE-OE1 3.36Å; K158-E161 VanDerWaalsContact CE-OE2 3.3Å; K158-E161 WeakPolarHBondContact CE-OE2 3.09Å; K158-E161 IonicContact NZ-OE1 3.28Å; K158-E161 PolarHBondContact NZ-OE1 2.99Å; K158-E161 IonicContact NZ-OE2 2.7Å; K158-E161 PolarHBondContact NZ-OE2 3.18Å; K158-E161 PolarHBondContact O-N 3.08Å; E161-G163 PolarHBondContact O-N 2.83Å; E161-G163 VanDerWaalsContact O-N 3.1Å
162	M	79.2	Confident	85.7	Confident	80 Å²	80	66.7 Å²	66.7	39%	0.394	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	6	173.2	-66.5	179.4	80.6	0	0	113.7	K158 A159 I160 M177 L181 L184	K158-M162 WeakPolarHBondContact O-CB 3.48Å; K158-M162 VanDerWaalsContact O-CG 3.27Å; K158-M162 WeakPolarHBondContact O-CG 3.28Å; K158-M162 PolarHBondContact O-N 3.3Å; A159-M162 PolarHBondContact O-N 2.89Å; I160-M162 VanDerWaalsContact C-N 3.31Å; I160-M162 PolarHBondContact O-N 2.95Å; M162-M177 HydrophobicContact CE-CE 3.48Å; M162-M177 VanDerWaalsContact CE-CE 3.48Å; M162-M177 HydrophobicContact SD-CE 3.72Å; M162-L181 HydrophobicContact SD-CD2 3.66Å; M162-L184 HydrophobicContact CE-CD1 3.92Å; M162-L184 HydrophobicContact SD-CD1 3.62Å
163	G	80.2	Confident	85	Confident	49 Å²	49	64 Å²	64	51%	0.505	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.7	2.3	171.5	0	0	0	0	0	115.7	A159 I160 E161	A159-G163 PolarHBondContact O-N 3.32Å; I160-G163 WeakPolarHBondContact O-CA 3.21Å; I160-G163 PolarHBondContact O-N 3.11Å; E161-G163 PolarHBondContact O-N 2.83Å; E161-G163 VanDerWaalsContact O-N 3.1Å
164	L	78.8	Confident	84.2	Confident	41 Å²	41	64.8 Å²	64.8	22%	0.215	34%	0.343	C	S	.	.			trans	-72.5	146.4	177.6	-56.6	173.8	0	0	0	111.1	A159 V169 A172 M177	A159-L164 HydrophobicContact CB-CD1 4.09Å; A159-L164 VanDerWaalsContact O-CB 3.27Å; A159-L164 WeakPolarHBondContact O-CB 3.49Å; A159-L164 PolarHBondContact O-N 2.97Å; A159-L164 VanDerWaalsContact O-N 3.11Å; L164-V169 HydrophobicContact CB-CG2 3.84Å; L164-V169 WeakPolarHBondContact O-CG2 3.17Å; L164-A172 HydrophobicContact CD1-CB 3.47Å; L164-A172 VanDerWaalsContact CD1-CB 3.47Å; L164-M177 HydrophobicContact CD1-CE 4.25Å; L164-M177 HydrophobicContact CD1-SD 3.94Å
165	K	87.3	Confident	82.7	Confident	166 Å²	166	63 Å²	63	72%	0.722	34%	0.337	S	S	*	.			trans	-143.4	142.2	-174.9	-61.7	-174.2	-176.7	-177.5	0	112.7	Q167 S168	K165-Q167 PolarHBondContact O-N 2.69Å; K165-S168 PolarHBondContact N-OG 2.95Å; K165-S168 PolarHBondContact O-N 3.08Å; K165-S168 PolarHBondContact O-OG 3.47Å
166	G	89.2	Confident	81	Confident	58 Å²	58	67.8 Å²	67.8	60%	0.598	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	-132.6	178.5	0	0	0	0	0	112	S168 V169	G166-S168 PolarHBondContact O-N 2.7Å; G166-V169 WeakPolarHBondContact O-CB 3.46Å; G166-V169 PolarHBondContact O-N 2.9Å
167	Q	87.3	Confident	79.6	Confident	140 Å²	140	66.4 Å²	66.4	65%	0.654	37%	0.366	S	S	*	.	H	α-helix	trans	-49	-35.1	-179.5	-153	90.8	35.2	0	0	113.9	K165 V169 E170 E171	K165-Q167 PolarHBondContact O-N 2.69Å; Q167-V169 PolarHBondContact O-N 2.81Å; Q167-E170 PolarHBondContact O-N 1.77Å; Q167-E170 VanDerWaalsContact O-N 3.09Å; Q167-E171 HydrophobicContact CG-CG 4.4Å; Q167-E171 WeakPolarHBondContact O-CG 3.37Å; Q167-E171 PolarHBondContact O-N 3.41Å
168	S	78.3	Confident	78.9	Confident	44 Å²	44	65.7 Å²	65.7	31%	0.308	36%	0.357	S	S	.	.	H	α-helix	trans	-67.4	-20.5	-179.2	64.2	0	0	0	0	114	K165 G166 A172	K165-S168 PolarHBondContact N-OG 2.95Å; K165-S168 PolarHBondContact O-N 3.08Å; K165-S168 PolarHBondContact O-OG 3.47Å; G166-S168 PolarHBondContact O-N 2.7Å; S168-A172 WeakPolarHBondContact O-CB 3.4Å; S168-A172 PolarHBondContact O-N 2.85Å; S168-A172 VanDerWaalsContact O-N 3.17Å
169	V	84.9	Confident	77.9	Confident	5 Å²	5	68.1 Å²	68.1	3%	0.03	37%	0.372	C	S	.	.	H	α-helix	trans	-71.6	-48.4	169.1	177.6	0	0	0	0	109.4	R156 A159 I160 L164 G166 Q167 E171 A172 L173	R156-V169 HydrophobicContact CG-CG1 4.14Å; A159-V169 HydrophobicContact CB-CG1 4Å; I160-V169 HydrophobicContact CG1-CG2 3.96Å; L164-V169 HydrophobicContact CB-CG2 3.84Å; L164-V169 WeakPolarHBondContact O-CG2 3.17Å; G166-V169 WeakPolarHBondContact O-CB 3.46Å; G166-V169 PolarHBondContact O-N 2.9Å; Q167-V169 PolarHBondContact O-N 2.81Å; V169-E171 VanDerWaalsContact C-N 3.33Å; V169-E171 PolarHBondContact O-N 2.78Å; V169-A172 PolarHBondContact O-N 2.99Å; V169-A172 VanDerWaalsContact O-N 3.14Å; V169-L173 HydrophobicContact CG1-CD1 3.75Å; V169-L173 HydrophobicContact CG1-CG 4.23Å; V169-L173 WeakPolarHBondContact O-CB 3.36Å; V169-L173 VanDerWaalsContact O-CG 3.28Å; V169-L173 WeakPolarHBondContact O-CG 3.44Å; V169-L173 PolarHBondContact O-N 2.8Å
170	E	89.4	Confident	77.4	Confident	69 Å²	69	72.7 Å²	72.7	32%	0.322	39%	0.393	S	S	.	.	H	α-helix	trans	-62.3	-39.5	177.3	-47.7	-54.4	157.1	0	0	112	R156 Q167 A172 L173 N174	R156-E170 IonicContact CZ-OE1 2.81Å; R156-E170 IonicContact CZ-OE2 2.62Å; R156-E170 IonicContact NH1-OE1 3.92Å; R156-E170 PolarHBondContact NH1-OE1 3.35Å; R156-E170 IonicContact NH1-OE2 3.58Å; R156-E170 IonicContact NH2-OE1 2.68Å; R156-E170 PolarHBondContact NH2-OE1 2.94Å; R156-E170 IonicContact NH2-OE2 3.79Å; R156-E170 PolarHBondContact NH2-OE2 2.85Å; Q167-E170 PolarHBondContact O-N 1.77Å; Q167-E170 VanDerWaalsContact O-N 3.09Å; E170-A172 VanDerWaalsContact C-N 3.29Å; E170-A172 PolarHBondContact O-N 3.28Å; E170-L173 PolarHBondContact O-N 2.87Å; E170-N174 WeakPolarHBondContact O-CB 3.42Å; E170-N174 PolarHBondContact O-N 3.23Å; E170-N174 PolarHBondContact O-ND2 3.26Å
171	E	72.6	Confident	76.7	Confident	84 Å²	84	68.4 Å²	68.4	39%	0.393	37%	0.371	S	S	.	.	H	α-helix	trans	-68	-27.4	176.6	-69.7	177.1	158	0	0	112.4	Q167 V169 G175 R602	Q167-E171 HydrophobicContact CG-CG 4.4Å; Q167-E171 WeakPolarHBondContact O-CG 3.37Å; Q167-E171 PolarHBondContact O-N 3.41Å; V169-E171 VanDerWaalsContact C-N 3.33Å; V169-E171 PolarHBondContact O-N 2.78Å; E171-G175 VanDerWaalsContact O-CA 3.26Å; E171-G175 WeakPolarHBondContact O-CA 3.41Å; E171-G175 PolarHBondContact O-N 2.62Å; E171-G175 VanDerWaalsContact O-N 3.13Å; E171-R602 IonicContact OE1-CZ 2.74Å; E171-R602 IonicContact OE1-NH1 2.67Å; E171-R602 PolarHBondContact OE1-NH1 3.44Å; E171-R602 IonicContact OE1-NH2 3.29Å; E171-R602 PolarHBondContact OE1-NH2 3.4Å; E171-R602 IonicContact OE2-NH2 2.72Å
172	A	70.9	Confident	76.4	Confident	7 Å²	7	65.5 Å²	65.5	6%	0.058	35%	0.354	C	S	.	.	H	α-helix	trans	-81.7	-36.4	172.7	0	0	0	0	0	113	L164 S168 V169 E170 M177 R178 L181	L164-A172 HydrophobicContact CD1-CB 3.47Å; L164-A172 VanDerWaalsContact CD1-CB 3.47Å; S168-A172 WeakPolarHBondContact O-CB 3.4Å; S168-A172 PolarHBondContact O-N 2.85Å; S168-A172 VanDerWaalsContact O-N 3.17Å; V169-A172 PolarHBondContact O-N 2.99Å; V169-A172 VanDerWaalsContact O-N 3.14Å; E170-A172 VanDerWaalsContact C-N 3.29Å; E170-A172 PolarHBondContact O-N 3.28Å; A172-M177 HydrophobicContact CB-CB 4.04Å; A172-M177 HydrophobicContact CB-CG 4.36Å; A172-M177 HydrophobicContact CB-SD 3.96Å; A172-R178 PolarHBondContact O-N 2.83Å; A172-L181 HydrophobicContact CB-CD1 4.14Å
173	L	77.3	Confident	76.2	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-73.2	-35.2	178.1	-69.4	174.7	0	0	0	112.9	L155 R156 V169 E170 R178 L181	L155-L173 HydrophobicContact CB-CD2 3.58Å; R156-L173 HydrophobicContact CB-CD1 3.97Å; R156-L173 HydrophobicContact CG-CD1 4.24Å; V169-L173 HydrophobicContact CG1-CD1 3.75Å; V169-L173 HydrophobicContact CG1-CG 4.23Å; V169-L173 WeakPolarHBondContact O-CB 3.36Å; V169-L173 VanDerWaalsContact O-CG 3.28Å; V169-L173 WeakPolarHBondContact O-CG 3.44Å; V169-L173 PolarHBondContact O-N 2.8Å; E170-L173 PolarHBondContact O-N 2.87Å; L173-R178 WeakPolarHBondContact O-CB 3.41Å; L173-R178 WeakPolarHBondContact O-CD 3.46Å; L173-R178 WeakPolarHBondContact O-CG 3.45Å; L173-R178 PolarHBondContact O-NE 3.43Å; L173-L181 HydrophobicContact CD2-CD1 4.32Å
174	N	77.2	Confident	76	Confident	132 Å²	132	64.7 Å²	64.7	71%	0.706	34%	0.336	S	S	*	.	S	Bend	trans	-98.1	-6.5	178.2	-61.7	-80.8	0	0	0	113	E170	E170-N174 WeakPolarHBondContact O-CB 3.42Å; E170-N174 PolarHBondContact O-N 3.23Å; E170-N174 PolarHBondContact O-ND2 3.26Å
175	G	59.8	Low	76.3	Confident	13 Å²	13	63.3 Å²	63.3	13%	0.134	33%	0.329	C	S	.	.	S	Bend	trans	-110.6	-168.4	-177.5	0	0	0	0	0	114.2	E171 M177 R178 F1032	E171-G175 VanDerWaalsContact O-CA 3.26Å; E171-G175 WeakPolarHBondContact O-CA 3.41Å; E171-G175 PolarHBondContact O-N 2.62Å; E171-G175 VanDerWaalsContact O-N 3.13Å; G175-M177 PolarHBondContact O-N 3.3Å; G175-R178 WeakPolarHBondContact O-CB 3.28Å; G175-R178 PolarHBondContact O-N 3.16Å; G175-R178 VanDerWaalsContact O-N 3.13Å; G175-F1032 WeakPolarHBondContact O-CE1 3.34Å
176	P	51.8	Low	76.2	Confident	100 Å²	100	55.6 Å²	55.6	65%	0.649	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-16.3	-168.8	25.2	-34.4	0	0	0	114.9	R178 F1032	P176-R178 VanDerWaalsContact C-N 3.27Å; P176-R178 PolarHBondContact O-N 2.83Å; P176-F1032 VanDerWaalsContact CA-CE2 3.42Å; P176-F1032 HydrophobicContact CB-CD2 3.82Å; P176-F1032 HydrophobicContact CB-CE2 3.98Å; P176-F1032 HydrophobicContact CB-CG 4.33Å; P176-F1032 WeakPolarHBondContact O-CE2 3.27Å; P176-F1032 VanDerWaalsContact O-CZ 3.26Å; P176-F1032 WeakPolarHBondContact O-CZ 3.29Å
177	M	66.4	Low	75.8	Confident	57 Å²	57	56.6 Å²	56.6	28%	0.281	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-18	177.7	-166.3	171.2	175.7	0	0	112.9	M162 L164 A172 G175 N179 H180 L181	M162-M177 HydrophobicContact CE-CE 3.48Å; M162-M177 VanDerWaalsContact CE-CE 3.48Å; M162-M177 HydrophobicContact SD-CE 3.72Å; L164-M177 HydrophobicContact CD1-CE 4.25Å; L164-M177 HydrophobicContact CD1-SD 3.94Å; A172-M177 HydrophobicContact CB-CB 4.04Å; A172-M177 HydrophobicContact CB-CG 4.36Å; A172-M177 HydrophobicContact CB-SD 3.96Å; G175-M177 PolarHBondContact O-N 3.3Å; M177-N179 VanDerWaalsContact C-N 3.28Å; M177-N179 PolarHBondContact O-N 2.8Å; M177-H180 WeakPolarHBondContact O-CB 3.41Å; M177-H180 PolarHBondContact O-N 3.23Å; M177-L181 HydrophobicContact CE-CD2 4.29Å; M177-L181 HydrophobicContact CE-CG 4.46Å; M177-L181 HydrophobicContact CG-CD1 4.19Å; M177-L181 HydrophobicContact CG-CG 4.14Å; M177-L181 PolarHBondContact O-N 3.41Å
178	R	79.5	Confident	75.6	Confident	70 Å²	70	52.3 Å²	52.3	26%	0.264	27%	0.266	S	S	.	.	H	α-helix	trans	-55.4	-39	-175.7	-162.8	-166.8	-168.9	-102.1	-4.4	113.5	E152 L155 A172 L173 G175 P176 L181 R182 F1032	E152-R178 IonicContact OE2-CZ 3.68Å; E152-R178 IonicContact OE2-NE 2.68Å; E152-R178 IonicContact OE2-NH2 3.69Å; E152-R178 PolarHBondContact OE2-NH2 3.19Å; L155-R178 HydrophobicContact CD1-CG 4.39Å; A172-R178 PolarHBondContact O-N 2.83Å; L173-R178 WeakPolarHBondContact O-CB 3.41Å; L173-R178 WeakPolarHBondContact O-CD 3.46Å; L173-R178 WeakPolarHBondContact O-CG 3.45Å; L173-R178 PolarHBondContact O-NE 3.43Å; G175-R178 WeakPolarHBondContact O-CB 3.28Å; G175-R178 PolarHBondContact O-N 3.16Å; G175-R178 VanDerWaalsContact O-N 3.13Å; P176-R178 VanDerWaalsContact C-N 3.27Å; P176-R178 PolarHBondContact O-N 2.83Å; R178-L181 PolarHBondContact O-N 3.45Å; R178-R182 WeakPolarHBondContact O-CB 3.48Å; R178-R182 PolarHBondContact O-N 3.27Å; R178-F1032 HydrophobicContact CB-CE1 4.27Å; R178-F1032 HydrophobicContact CB-CZ 4.49Å
179	N	65.3	Low	76.1	Confident	88 Å²	88	51 Å²	51	47%	0.471	26%	0.255	S	S	.	.	H	α-helix	trans	-71.3	-35	179.9	-73.6	-8.6	0	0	0	112	M177 R182 F183 F1032	M177-N179 VanDerWaalsContact C-N 3.28Å; M177-N179 PolarHBondContact O-N 2.8Å; N179-R182 PolarHBondContact O-N 2.84Å; N179-F183 PolarHBondContact O-N 2.82Å; N179-F1032 HydrophobicContact CB-CE2 4.29Å; N179-F1032 HydrophobicContact CB-CZ 3.81Å; N179-F1032 VanDerWaalsContact ND2-CZ 3.27Å; N179-F1032 WeakPolarHBondContact ND2-CZ 3.43Å
180	H	72.3	Confident	76.4	Confident	96 Å²	96	51 Å²	51	44%	0.444	26%	0.255	S	S	.	.	H	α-helix	trans	-68.8	-43.3	173.8	-177.1	57	0	0	0	111.4	M177 R182 F183 L184	M177-H180 WeakPolarHBondContact O-CB 3.41Å; M177-H180 PolarHBondContact O-N 3.23Å; H180-R182 VanDerWaalsContact C-N 3.3Å; H180-R182 PolarHBondContact O-N 3.04Å; H180-F183 PolarHBondContact O-N 3.1Å; H180-L184 WeakPolarHBondContact O-CG 3.31Å; H180-L184 PolarHBondContact O-N 3.4Å
181	L	75.1	Confident	76.5	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-58.3	-42.1	171.3	-70.6	166.2	0	0	0	111.3	L155 K158 A159 M162 A172 L173 M177 R178 L184 V185	L155-L181 VanDerWaalsContact CD2-C 3.41Å; L155-L181 HydrophobicContact CD2-CB 3.58Å; K158-L181 HydrophobicContact CB-CD2 4.08Å; K158-L181 HydrophobicContact CG-CD2 4.12Å; A159-L181 HydrophobicContact CB-CD1 4.03Å; A159-L181 HydrophobicContact CB-CD2 4.15Å; M162-L181 HydrophobicContact SD-CD2 3.66Å; A172-L181 HydrophobicContact CB-CD1 4.14Å; L173-L181 HydrophobicContact CD2-CD1 4.32Å; M177-L181 HydrophobicContact CE-CD2 4.29Å; M177-L181 HydrophobicContact CE-CG 4.46Å; M177-L181 HydrophobicContact CG-CD1 4.19Å; M177-L181 HydrophobicContact CG-CG 4.14Å; M177-L181 PolarHBondContact O-N 3.41Å; R178-L181 PolarHBondContact O-N 3.45Å; L181-L184 PolarHBondContact O-N 3.27Å; L181-V185 WeakPolarHBondContact O-CB 3.35Å; L181-V185 WeakPolarHBondContact O-CG2 3.45Å; L181-V185 PolarHBondContact O-N 3.08Å
182	R	81.9	Confident	77.3	Confident	76 Å²	76	50 Å²	50	29%	0.287	25%	0.253	S	S	.	.	H	α-helix	trans	-62.8	-45.1	177.6	-179.4	173.9	173.2	133.1	5.9	112.1	L155 R178 N179 H180 I186	L155-R182 VanDerWaalsContact CD2-CA 3.49Å; L155-R182 HydrophobicContact CD2-CB 3.96Å; R178-R182 WeakPolarHBondContact O-CB 3.48Å; R178-R182 PolarHBondContact O-N 3.27Å; N179-R182 PolarHBondContact O-N 2.84Å; H180-R182 VanDerWaalsContact C-N 3.3Å; H180-R182 PolarHBondContact O-N 3.04Å; R182-I186 HydrophobicContact CG-CD1 3.55Å; R182-I186 HydrophobicContact CG-CG1 4.38Å; R182-I186 WeakPolarHBondContact O-CB 3.4Å; R182-I186 VanDerWaalsContact O-CG1 3.28Å; R182-I186 WeakPolarHBondContact O-CG1 3.3Å; R182-I186 PolarHBondContact O-N 2.62Å
183	F	75.1	Confident	78.3	Confident	72 Å²	72	50.5 Å²	50.5	32%	0.316	26%	0.255	S	S	.	.	H	α-helix	trans	-58.8	-51.7	173	171.1	-97.5	0	0	0	110.9	N179 H180 V185 I186 K187 E261	N179-F183 PolarHBondContact O-N 2.82Å; H180-F183 PolarHBondContact O-N 3.1Å; F183-V185 VanDerWaalsContact C-N 3.33Å; F183-V185 PolarHBondContact O-N 3.39Å; F183-I186 PolarHBondContact O-N 3.23Å; F183-K187 HydrophobicContact CE1-CD 4.22Å; F183-K187 HydrophobicContact CZ-CD 4.16Å; F183-K187 HydrophobicContact CZ-CG 4.4Å; F183-K187 WeakPolarHBondContact O-CB 3.33Å; F183-K187 PolarHBondContact O-N 3.09Å; F183-E261 HydrophobicContact CD2-CB 4.48Å; F183-E261 HydrophobicContact CE2-CB 4.19Å
184	L	75.8	Confident	79.1	Confident	39 Å²	39	53.5 Å²	53.5	20%	0.204	27%	0.274	C	S	.	.	H	α-helix	trans	-60.8	-37.6	-179.2	-71.1	179.1	0	0	0	113.6	K158 M162 H180 L181	K158-L184 HydrophobicContact CD-CB 4.48Å; K158-L184 HydrophobicContact CG-CB 4.25Å; M162-L184 HydrophobicContact CE-CD1 3.92Å; M162-L184 HydrophobicContact SD-CD1 3.62Å; H180-L184 WeakPolarHBondContact O-CG 3.31Å; H180-L184 PolarHBondContact O-N 3.4Å; L181-L184 PolarHBondContact O-N 3.27Å
185	V	84.9	Confident	79.9	Confident	12 Å²	12	47.6 Å²	47.6	7%	0.073	24%	0.242	C	C	.	.	H	α-helix	trans	-66.5	-54.8	174.8	165.6	0	0	0	0	110.6	L151 N154 L155 K158 L181 F183 K187 L189	L151-V185 HydrophobicContact CD1-CG1 3.97Å; N154-V185 HydrophobicContact CB-CG1 3.64Å; N154-V185 HydrophobicContact CB-CG2 4.2Å; N154-V185 WeakPolarHBondContact O-CG2 3.32Å; L155-V185 HydrophobicContact CD2-CG2 4.33Å; K158-V185 HydrophobicContact CB-CG2 3.7Å; K158-V185 HydrophobicContact CD-CG2 4.41Å; K158-V185 HydrophobicContact CG-CG2 4.09Å; L181-V185 WeakPolarHBondContact O-CB 3.35Å; L181-V185 WeakPolarHBondContact O-CG2 3.45Å; L181-V185 PolarHBondContact O-N 3.08Å; F183-V185 VanDerWaalsContact C-N 3.33Å; F183-V185 PolarHBondContact O-N 3.39Å; V185-K187 VanDerWaalsContact C-N 3.3Å; V185-K187 PolarHBondContact O-N 3.33Å; V185-L189 WeakPolarHBondContact O-CB 3.49Å; V185-L189 PolarHBondContact O-N 2.77Å
186	I	84.8	Confident	81.7	Confident	5 Å²	5	47.6 Å²	47.6	3%	0.026	24%	0.238	C	C	.	.	H	α-helix	trans	-69.9	-29.2	-171.9	-62.9	173.2	0	0	0	111.6	L143 L146 L151 R182 F183 D188 L189 T262 M264	L143-I186 HydrophobicContact CD1-CD1 4.14Å; L143-I186 HydrophobicContact CD1-CG1 4.44Å; L143-I186 HydrophobicContact CD1-CG2 3.67Å; L146-I186 HydrophobicContact CD2-CG1 4.49Å; L151-I186 HydrophobicContact CD1-CD1 4.45Å; L151-I186 HydrophobicContact CD1-CG1 4.33Å; R182-I186 HydrophobicContact CG-CD1 3.55Å; R182-I186 HydrophobicContact CG-CG1 4.38Å; R182-I186 WeakPolarHBondContact O-CB 3.4Å; R182-I186 VanDerWaalsContact O-CG1 3.28Å; R182-I186 WeakPolarHBondContact O-CG1 3.3Å; R182-I186 PolarHBondContact O-N 2.62Å; F183-I186 PolarHBondContact O-N 3.23Å; I186-D188 PolarHBondContact O-N 2.99Å; I186-L189 PolarHBondContact O-N 3.43Å; I186-T262 HydrophobicContact CB-CG2 4.4Å; I186-T262 HydrophobicContact CG2-CG2 3.95Å; I186-M264 HydrophobicContact CG2-CB 3.66Å; I186-M264 HydrophobicContact CG2-CG 4.1Å; I186-M264 WeakPolarHBondContact O-CG 3.34Å
187	K	81.3	Confident	83.8	Confident	79 Å²	79	43.2 Å²	43.2	34%	0.343	21%	0.209	S	C	.	.	H	α-helix	trans	-56.9	-45.3	-177.4	-174.3	-159.9	170.4	-148.8	0	113.8	F183 V185 H190 T262	F183-K187 HydrophobicContact CE1-CD 4.22Å; F183-K187 HydrophobicContact CZ-CD 4.16Å; F183-K187 HydrophobicContact CZ-CG 4.4Å; F183-K187 WeakPolarHBondContact O-CB 3.33Å; F183-K187 PolarHBondContact O-N 3.09Å; V185-K187 VanDerWaalsContact C-N 3.3Å; V185-K187 PolarHBondContact O-N 3.33Å; K187-H190 PolarHBondContact O-CE1 3.25Å; K187-H190 VanDerWaalsContact O-CE1 3.22Å; K187-H190 PolarHBondContact O-ND1 2.97Å; K187-T262 HydrophobicContact CB-CG2 4.15Å
188	D	82.1	Confident	85.1	Confident	50 Å²	50	44.5 Å²	44.5	27%	0.267	21%	0.214	S	C	.	.	H	α-helix	trans	-104.3	-4.9	-174.5	-56.6	-34.8	0	0	0	112.1	I186 H190 L191 I311	I186-D188 PolarHBondContact O-N 2.99Å; D188-H190 VanDerWaalsContact C-N 3.25Å; D188-H190 PolarHBondContact O-N 2.87Å; D188-L191 HydrophobicContact CB-CD1 4.44Å; D188-L191 VanDerWaalsContact O-CB 3.32Å; D188-L191 WeakPolarHBondContact O-CB 3.41Å; D188-L191 WeakPolarHBondContact O-CG 3.44Å; D188-L191 PolarHBondContact O-N 3.4Å; D188-L191 VanDerWaalsContact O-N 3.12Å; D188-I311 HydrophobicContact CB-CD1 4.4Å
189	L	89.2	Confident	85.8	Confident	15 Å²	15	44.2 Å²	44.2	8%	0.079	22%	0.22	C	C	.	.	H	α-helix	trans	-61.6	-26.5	-176.9	-178.2	66.2	0	0	0	113.9	L146 V185 I186 L191 L192 M264	L146-L189 HydrophobicContact CB-CD2 4.46Å; L146-L189 HydrophobicContact CD1-CD2 3.98Å; L146-L189 HydrophobicContact CD2-CD2 3.75Å; L146-L189 HydrophobicContact CG-CD2 4.28Å; V185-L189 WeakPolarHBondContact O-CB 3.49Å; V185-L189 PolarHBondContact O-N 2.77Å; I186-L189 PolarHBondContact O-N 3.43Å; L189-L191 PolarHBondContact O-N 2.68Å; L189-L191 VanDerWaalsContact O-N 3.16Å; L189-L192 HydrophobicContact CD1-CD1 4.46Å; L189-L192 PolarHBondContact O-N 2.99Å; L189-M264 HydrophobicContact CB-CG 4Å; L189-M264 HydrophobicContact CB-SD 4.37Å; L189-M264 HydrophobicContact CD2-CE 4.08Å; L189-M264 HydrophobicContact CD2-CG 4.33Å; L189-M264 HydrophobicContact CD2-SD 4.29Å; L189-M264 HydrophobicContact CG-CG 4.36Å; L189-M264 HydrophobicContact CG-SD 4.18Å
190	H	90.8	Very high	87.1	Confident	5 Å²	5	40.8 Å²	40.8	2%	0.023	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-59.7	-25.2	176.3	64.8	-78.5	0	0	0	112.5	K187 D188 L192 Q193 W195 Y196 Y230 I263 M264	K187-H190 PolarHBondContact O-CE1 3.25Å; K187-H190 VanDerWaalsContact O-CE1 3.22Å; K187-H190 PolarHBondContact O-ND1 2.97Å; D188-H190 VanDerWaalsContact C-N 3.25Å; D188-H190 PolarHBondContact O-N 2.87Å; H190-L192 PolarHBondContact O-N 2.9Å; H190-Q193 PolarHBondContact O-N 2.75Å; H190-W195 HydrophobicContact CB-CH2 3.63Å; H190-W195 HydrophobicContact CB-CZ3 4.14Å; H190-Y196 WeakPolarHBondContact O-CB 3.19Å; H190-Y230 AromaticContact CD2-CE1 3.98Å; H190-Y230 AromaticContact NE2-CE1 3.86Å; H190-Y230 AromaticContact NE2-CZ 3.65Å; H190-Y230 PolarHBondContact NE2-OH 3.06Å; H190-Y230 VanDerWaalsContact NE2-OH 3.09Å; H190-I263 HydrophobicContact CB-CB 4.11Å; H190-I263 HydrophobicContact CB-CG2 4.2Å; H190-M264 HydrophobicContact CB-CG 4.23Å; H190-M264 HydrophobicContact CB-SD 4.16Å
191	L	91.8	Very high	88.2	Confident	40 Å²	40	43.8 Å²	43.8	21%	0.209	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-65	-23.1	176.8	-59.6	176.4	0	0	0	112.9	D188 L189 Y196	D188-L191 HydrophobicContact CB-CD1 4.44Å; D188-L191 VanDerWaalsContact O-CB 3.32Å; D188-L191 WeakPolarHBondContact O-CB 3.41Å; D188-L191 WeakPolarHBondContact O-CG 3.44Å; D188-L191 PolarHBondContact O-N 3.4Å; D188-L191 VanDerWaalsContact O-N 3.12Å; L189-L191 PolarHBondContact O-N 2.68Å; L189-L191 VanDerWaalsContact O-N 3.16Å; L191-Y196 HydrophobicContact CB-CE1 4.49Å; L191-Y196 HydrophobicContact CD2-CD1 4.3Å; L191-Y196 HydrophobicContact CD2-CE1 3.58Å
192	L	90.1	Very high	89.1	Confident	92 Å²	92	50.4 Å²	50.4	48%	0.482	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-100	-1.9	-180	-56	-179.8	0	0	0	113.1	L189 H190 F309	L189-L192 HydrophobicContact CD1-CD1 4.46Å; L189-L192 PolarHBondContact O-N 2.99Å; H190-L192 PolarHBondContact O-N 2.9Å; L192-F309 HydrophobicContact CD2-CB 4.37Å; L192-F309 HydrophobicContact CD2-CD1 3.57Å; L192-F309 HydrophobicContact CD2-CD2 3.86Å; L192-F309 HydrophobicContact CD2-CE1 3.69Å; L192-F309 HydrophobicContact CD2-CE2 3.96Å; L192-F309 HydrophobicContact CD2-CG 3.66Å; L192-F309 HydrophobicContact CD2-CZ 3.88Å
193	Q	92.5	Very high	89.8	Confident	19 Å²	19	53.1 Å²	53.1	9%	0.089	25%	0.245	C	C	.	.	S	Bend	trans	-78.2	144	-174.6	-70.3	-66.1	-55.6	0	0	112.4	H190 W195 Y196 M264	H190-Q193 PolarHBondContact O-N 2.75Å; Q193-W195 HydrophobicContact CB-CD2 3.78Å; Q193-W195 VanDerWaalsContact CB-CE2 3.48Å; Q193-W195 HydrophobicContact CB-CE3 4.29Å; Q193-W195 HydrophobicContact CB-CG 4.2Å; Q193-W195 HydrophobicContact CB-CH2 4.31Å; Q193-W195 HydrophobicContact CB-CZ2 3.8Å; Q193-W195 HydrophobicContact CG-CH2 4.27Å; Q193-W195 HydrophobicContact CG-CZ2 3.62Å; Q193-W195 PolarHBondContact O-N 2.87Å; Q193-W195 VanDerWaalsContact O-N 3.16Å; Q193-Y196 PolarHBondContact O-N 3.12Å; Q193-M264 HydrophobicContact CG-CE 4.2Å; Q193-M264 HydrophobicContact CG-SD 3.45Å; Q193-M264 WeakPolarHBondContact CG-SD 3.46Å
194	P	93.1	Very high	90.8	Very high	64 Å²	64	52.5 Å²	52.5	42%	0.416	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-30.2	-179.1	24.6	-34.1	0	0	0	112.6	Y196 H197 P286 V287	P194-Y196 VanDerWaalsContact C-N 3.3Å; P194-Y196 PolarHBondContact O-N 2.99Å; P194-H197 PolarHBondContact O-NE2 3.01Å; P194-P286 HydrophobicContact CB-CB 4.03Å; P194-P286 CarbonylContact O-C 3.05Å; P194-P286 VanDerWaalsContact O-CA 3.29Å; P194-P286 WeakPolarHBondContact O-CA 3.23Å; P194-V287 WeakPolarHBondContact O-CG2 3.16Å; P194-V287 PolarHBondContact O-N 2.84Å
195	W	95.2	Very high	91.8	Very high	7 Å²	7	50.7 Å²	50.7	3%	0.027	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-3	177.3	49.5	-104.9	0	0	0	114.7	H190 Q193 H197 F219 L220 V221 I263 M264 I267 P284	H190-W195 HydrophobicContact CB-CH2 3.63Å; H190-W195 HydrophobicContact CB-CZ3 4.14Å; Q193-W195 HydrophobicContact CB-CD2 3.78Å; Q193-W195 VanDerWaalsContact CB-CE2 3.48Å; Q193-W195 HydrophobicContact CB-CE3 4.29Å; Q193-W195 HydrophobicContact CB-CG 4.2Å; Q193-W195 HydrophobicContact CB-CH2 4.31Å; Q193-W195 HydrophobicContact CB-CZ2 3.8Å; Q193-W195 HydrophobicContact CG-CH2 4.27Å; Q193-W195 HydrophobicContact CG-CZ2 3.62Å; Q193-W195 PolarHBondContact O-N 2.87Å; Q193-W195 VanDerWaalsContact O-N 3.16Å; W195-H197 PolarHBondContact O-CD2 3.02Å; W195-F219 HydrophobicContact CB-CD2 4.42Å; W195-F219 HydrophobicContact CB-CE2 3.73Å; W195-F219 HydrophobicContact CB-CZ 4.12Å; W195-F219 AromaticContact CD1-CZ 3.97Å; W195-F219 HydrophobicContact CD2-CE2 4.11Å; W195-F219 AromaticContact CG-CE2 3.72Å; W195-F219 HydrophobicContact CG-CE2 3.72Å; W195-F219 HydrophobicContact CG-CZ 4.01Å; W195-L220 WeakPolarHBondContact O-CA 3.4Å; W195-V221 HydrophobicContact CE3-CB 3.77Å; W195-V221 HydrophobicContact CE3-CG2 3.57Å; W195-V221 HydrophobicContact CZ3-CB 3.83Å; W195-V221 HydrophobicContact CZ3-CG1 4.46Å; W195-V221 HydrophobicContact CZ3-CG2 3.62Å; W195-V221 PolarHBondContact O-N 2.91Å; W195-I263 HydrophobicContact CH2-CG2 4.14Å; W195-I263 HydrophobicContact CZ3-CG2 4.3Å; W195-M264 HydrophobicContact CH2-SD 4.26Å; W195-M264 HydrophobicContact CZ2-SD 3.79Å; W195-I267 HydrophobicContact CD2-CG2 4.44Å; W195-I267 HydrophobicContact CH2-CB 4.13Å; W195-I267 HydrophobicContact CH2-CG1 3.73Å; W195-I267 HydrophobicContact CH2-CG2 4.36Å; W195-I267 HydrophobicContact CZ2-CB 3.97Å; W195-I267 HydrophobicContact CZ2-CG1 4.06Å; W195-I267 HydrophobicContact CZ2-CG2 3.82Å; W195-I267 HydrophobicContact CZ3-CG1 4.02Å; W195-P284 HydrophobicContact CB-CB 3.83Å; W195-P284 HydrophobicContact CG-CB 4.31Å
196	Y	97	Very high	92.3	Very high	14 Å²	14	52.4 Å²	52.4	6%	0.055	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-97.5	98.6	-178.7	176.9	-114.7	0	0	0	113.2	H190 L191 Q193 P194 H198 V221 Y223 Y230 V287	H190-Y196 WeakPolarHBondContact O-CB 3.19Å; L191-Y196 HydrophobicContact CB-CE1 4.49Å; L191-Y196 HydrophobicContact CD2-CD1 4.3Å; L191-Y196 HydrophobicContact CD2-CE1 3.58Å; Q193-Y196 PolarHBondContact O-N 3.12Å; P194-Y196 VanDerWaalsContact C-N 3.3Å; P194-Y196 PolarHBondContact O-N 2.99Å; Y196-H198 AromaticContact CD1-CE1 3.59Å; Y196-H198 AromaticContact CD1-ND1 3.42Å; Y196-H198 WeakPolarHBondContact CD1-ND1 3.44Å; Y196-H198 HydrophobicContact CE1-CB 4.31Å; Y196-H198 AromaticContact CE1-CE1 3.67Å; Y196-H198 AromaticContact CE1-CG 3.68Å; Y196-H198 AromaticContact CE1-ND1 3.45Å; Y196-H198 WeakPolarHBondContact CE1-ND1 3.4Å; Y196-H198 PolarHBondContact O-N 3.1Å; Y196-H198 VanDerWaalsContact O-N 3.15Å; Y196-H198 PolarHBondContact O-ND1 3.49Å; Y196-V221 CarbonylContact C-O 3.58Å; Y196-V221 WeakPolarHBondContact CA-O 3.5Å; Y196-V221 HydrophobicContact CD2-CB 4.42Å; Y196-V221 HydrophobicContact CD2-CG1 4.32Å; Y196-Y223 WeakPolarHBondContact OH-CB 3.39Å; Y196-Y230 HydrophobicContact CD2-CE1 4.45Å; Y196-Y230 AromaticContact CE2-CD1 3.88Å; Y196-Y230 HydrophobicContact CE2-CD1 3.88Å; Y196-Y230 AromaticContact CE2-CE1 3.59Å; Y196-Y230 HydrophobicContact CE2-CE1 3.59Å; Y196-Y230 AromaticContact CZ-CE1 3.98Å; Y196-V287 WeakPolarHBondContact O-CG2 3.42Å
197	H	96.2	Very high	92.9	Very high	7 Å²	7	55.9 Å²	55.9	3%	0.032	27%	0.266	C	S	.	.			trans	-84.1	16.4	-172	-71.3	-133.7	0	0	0	114.3	P194 W195 I200 R208 L220 V221 I285 V287 F290	P194-H197 PolarHBondContact O-NE2 3.01Å; W195-H197 PolarHBondContact O-CD2 3.02Å; H197-I200 HydrophobicContact CB-CD1 3.55Å; H197-I200 HydrophobicContact CB-CG1 3.82Å; H197-R208 WeakPolarHBondContact CE1-CD 3.33Å; H197-R208 WeakPolarHBondContact ND1-CD 3.31Å; H197-R208 PolarHBondContact ND1-NH1 3.01Å; H197-L220 HydrophobicContact CB-CD1 4.32Å; H197-V221 PolarHBondContact N-O 3.07Å; H197-I285 WeakPolarHBondContact CE1-CG2 3.34Å; H197-I285 CovalentContact NE2-O 1.77Å; H197-I285 PolarHBondContact NE2-O 2.87Å; H197-V287 HydrophobicContact CB-CG2 4.22Å; H197-V287 VanDerWaalsContact CD2-CG2 3.42Å; H197-V287 WeakPolarHBondContact CD2-CG2 3.32Å; H197-V287 PolarHBondContact NE2-N 2.97Å; H197-F290 AromaticContact CE1-CD2 3.17Å; H197-F290 WeakPolarHBondContact CE1-CD2 3.32Å; H197-F290 AromaticContact CE1-CE2 3.21Å; H197-F290 WeakPolarHBondContact CE1-CE2 3.41Å
198	H	92.8	Very high	93.6	Very high	85 Å²	85	53.8 Å²	53.8	39%	0.394	26%	0.256	S	S	.	.			trans	53.8	-140.8	178.6	-64.3	53.6	0	0	0	110.8	Y196 I200 R222 Y223	Y196-H198 AromaticContact CD1-CE1 3.59Å; Y196-H198 AromaticContact CD1-ND1 3.42Å; Y196-H198 WeakPolarHBondContact CD1-ND1 3.44Å; Y196-H198 HydrophobicContact CE1-CB 4.31Å; Y196-H198 AromaticContact CE1-CE1 3.67Å; Y196-H198 AromaticContact CE1-CG 3.68Å; Y196-H198 AromaticContact CE1-ND1 3.45Å; Y196-H198 WeakPolarHBondContact CE1-ND1 3.4Å; Y196-H198 PolarHBondContact O-N 3.1Å; Y196-H198 VanDerWaalsContact O-N 3.15Å; Y196-H198 PolarHBondContact O-ND1 3.49Å; H198-I200 PolarHBondContact O-N 3.49Å; H198-R222 CarbonylContact O-C 3.53Å; H198-R222 WeakPolarHBondContact O-CA 3.39Å; H198-Y223 PolarHBondContact O-N 3.4Å
199	T	93.8	Very high	94.2	Very high	63 Å²	63	51.4 Å²	51.4	39%	0.387	24%	0.243	S	C	.	.	S	Bend	trans	-89	90.2	178.3	-55	0	0	0	0	111.7	Y223 K225	T199-Y223 WeakPolarHBondContact CA-O 3.4Å; T199-K225 HydrophobicContact CG2-CD 3.88Å; T199-K225 HydrophobicContact CG2-CG 3.83Å; T199-K225 VanDerWaalsContact OG1-CE 3.31Å; T199-K225 WeakPolarHBondContact OG1-CE 3.44Å
200	I	93.8	Very high	94.5	Very high	16 Å²	16	53.1 Å²	53.1	8%	0.082	26%	0.259	C	S	.	.			trans	-115.3	149.1	165.4	59.4	162.5	0	0	0	111.9	H197 H198 E204 A205 L220 R222	H197-I200 HydrophobicContact CB-CD1 3.55Å; H197-I200 HydrophobicContact CB-CG1 3.82Å; H198-I200 PolarHBondContact O-N 3.49Å; I200-E204 WeakPolarHBondContact CA-OE2 3.48Å; I200-E204 HydrophobicContact CB-CB 4.06Å; I200-E204 HydrophobicContact CD1-CB 4.4Å; I200-A205 HydrophobicContact CD1-CB 4.03Å; I200-L220 HydrophobicContact CD1-CD1 4.13Å; I200-R222 HydrophobicContact CG1-CB 3.73Å; I200-R222 HydrophobicContact CG1-CG 4.44Å; I200-R222 PolarHBondContact O-NH1 3.29Å
201	R	94.1	Very high	94.5	Very high	159 Å²	159	56.5 Å²	56.5	60%	0.6	28%	0.283	S	S	*	.			trans	-72.5	169.7	178	-64.6	-179.9	166.6	-177	-6.2	111.4	Y203 E204 A205	R201-Y203 HydrophobicContact CB-CD1 4.08Å; R201-Y203 HydrophobicContact CB-CE1 3.81Å; R201-Y203 HydrophobicContact CG-CE1 4.34Å; R201-E204 HydrophobicContact CB-CG 4.21Å; R201-E204 WeakPolarHBondContact CB-OE2 3.43Å; R201-E204 PolarHBondContact N-OE2 3.39Å; R201-E204 PolarHBondContact O-N 2.62Å; R201-A205 PolarHBondContact O-N 2.74Å
202	R	95.8	Very high	94.2	Very high	140 Å²	140	56.8 Å²	56.8	53%	0.528	28%	0.284	S	S	.	.	H	α-helix	trans	-60.6	-52.8	-178.6	-171.6	-174.5	158.1	152.5	3.2	112	E204 A205 E206 H242	R202-E204 PolarHBondContact O-N 3.13Å; R202-A205 WeakPolarHBondContact O-CB 3.48Å; R202-A205 PolarHBondContact O-N 3.48Å; R202-E206 HydrophobicContact CG-CG 4.42Å; R202-E206 IonicContact CZ-OE1 2.7Å; R202-E206 IonicContact NE-OE1 2.83Å; R202-E206 PolarHBondContact NE-OE1 3.26Å; R202-E206 IonicContact NE-OE2 3.49Å; R202-E206 IonicContact NH2-OE1 2.78Å; R202-E206 PolarHBondContact NH2-OE1 3.48Å; R202-E206 WeakPolarHBondContact O-CG 3.4Å; R202-E206 PolarHBondContact O-N 2.97Å; R202-H242 WeakPolarHBondContact CG-NE2 3.5Å; R202-H242 VanDerWaalsContact CZ-CD2 3.48Å; R202-H242 PolarHBondContact NE-CD2 2.99Å; R202-H242 PolarHBondContact NE-NE2 3.35Å
203	Y	95.7	Very high	94.2	Very high	133 Å²	133	54.9 Å²	54.9	52%	0.522	29%	0.287	S	S	.	.	H	α-helix	trans	-62.1	-29.3	-179.9	72.4	-97.3	0	0	0	113.2	R201 E206 S207	R201-Y203 HydrophobicContact CB-CD1 4.08Å; R201-Y203 HydrophobicContact CB-CE1 3.81Å; R201-Y203 HydrophobicContact CG-CE1 4.34Å; Y203-E206 WeakPolarHBondContact CA-OE2 3.49Å; Y203-E206 PolarHBondContact N-OE2 2.89Å; Y203-S207 VanDerWaalsContact O-CB 3.24Å; Y203-S207 WeakPolarHBondContact O-CB 3.36Å; Y203-S207 PolarHBondContact O-N 3.48Å
204	E	95.8	Very high	94.1	Very high	59 Å²	59	55.4 Å²	55.4	28%	0.276	29%	0.29	S	S	.	.	H	α-helix	trans	-69.6	-40.2	175.9	-61.4	-179.9	114.5	0	0	110.7	I200 R201 R202 S207 R208	I200-E204 WeakPolarHBondContact CA-OE2 3.48Å; I200-E204 HydrophobicContact CB-CB 4.06Å; I200-E204 HydrophobicContact CD1-CB 4.4Å; R201-E204 HydrophobicContact CB-CG 4.21Å; R201-E204 WeakPolarHBondContact CB-OE2 3.43Å; R201-E204 PolarHBondContact N-OE2 3.39Å; R201-E204 PolarHBondContact O-N 2.62Å; R202-E204 PolarHBondContact O-N 3.13Å; E204-S207 PolarHBondContact O-N 3.21Å; E204-R208 WeakPolarHBondContact O-CB 3.3Å; E204-R208 WeakPolarHBondContact O-CG 3.4Å; E204-R208 PolarHBondContact O-N 2.89Å
205	A	96.4	Very high	94.1	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-66	-43.5	173.5	0	0	0	0	0	112.1	I200 R201 R202 S207 R208 L209 L220	I200-A205 HydrophobicContact CD1-CB 4.03Å; R201-A205 PolarHBondContact O-N 2.74Å; R202-A205 WeakPolarHBondContact O-CB 3.48Å; R202-A205 PolarHBondContact O-N 3.48Å; A205-S207 VanDerWaalsContact C-N 3.33Å; A205-S207 PolarHBondContact O-N 2.97Å; A205-R208 PolarHBondContact O-N 3.38Å; A205-L209 WeakPolarHBondContact O-CG 3.46Å; A205-L209 PolarHBondContact O-N 3.25Å; A205-L220 HydrophobicContact CB-CD1 3.91Å; A205-L220 HydrophobicContact CB-CD2 4.31Å
206	E	97.1	Very high	94.1	Very high	49 Å²	49	60.1 Å²	60.1	23%	0.229	31%	0.309	C	S	.	.	H	α-helix	trans	-61	-42	176.1	-66.5	167.6	142	0	0	111	R202 Y203 L209 A210 P240 H242	R202-E206 HydrophobicContact CG-CG 4.42Å; R202-E206 IonicContact CZ-OE1 2.7Å; R202-E206 IonicContact NE-OE1 2.83Å; R202-E206 PolarHBondContact NE-OE1 3.26Å; R202-E206 IonicContact NE-OE2 3.49Å; R202-E206 IonicContact NH2-OE1 2.78Å; R202-E206 PolarHBondContact NH2-OE1 3.48Å; R202-E206 WeakPolarHBondContact O-CG 3.4Å; R202-E206 PolarHBondContact O-N 2.97Å; Y203-E206 WeakPolarHBondContact CA-OE2 3.49Å; Y203-E206 PolarHBondContact N-OE2 2.89Å; E206-L209 PolarHBondContact O-N 3.39Å; E206-A210 WeakPolarHBondContact O-CB 3.42Å; E206-A210 PolarHBondContact O-N 3.35Å; E206-P240 HydrophobicContact CB-CB 4.44Å; E206-P240 HydrophobicContact CB-CG 4.12Å; E206-P240 HydrophobicContact CG-CB 3.94Å; E206-P240 HydrophobicContact CG-CG 3.77Å; E206-H242 WeakPolarHBondContact CG-NE2 3.17Å; E206-H242 IonicContact OE1-NE2 3.25Å; E206-H242 PolarHBondContact OE1-NE2 3.26Å
207	S	95.6	Very high	94	Very high	78 Å²	78	59.4 Å²	59.4	55%	0.545	31%	0.306	S	S	.	.	H	α-helix	trans	-65.5	-39.8	175.5	-173.9	0	0	0	0	113.3	Y203 E204 A205 A210 S211	Y203-S207 VanDerWaalsContact O-CB 3.24Å; Y203-S207 WeakPolarHBondContact O-CB 3.36Å; Y203-S207 PolarHBondContact O-N 3.48Å; E204-S207 PolarHBondContact O-N 3.21Å; A205-S207 VanDerWaalsContact C-N 3.33Å; A205-S207 PolarHBondContact O-N 2.97Å; S207-A210 PolarHBondContact O-N 2.97Å; S207-S211 PolarHBondContact O-N 3.39Å; S207-S211 PolarHBondContact O-OG 3.38Å
208	R	96.5	Very high	94	Very high	35 Å²	35	59.1 Å²	59.1	13%	0.132	31%	0.305	C	S	.	.	H	α-helix	trans	-70.4	-29.9	177.9	-70	178.1	-171.3	-148.8	-6.3	113.4	H197 E204 A205 S211 L220 I285 F290	H197-R208 WeakPolarHBondContact CE1-CD 3.33Å; H197-R208 WeakPolarHBondContact ND1-CD 3.31Å; H197-R208 PolarHBondContact ND1-NH1 3.01Å; E204-R208 WeakPolarHBondContact O-CB 3.3Å; E204-R208 WeakPolarHBondContact O-CG 3.4Å; E204-R208 PolarHBondContact O-N 2.89Å; A205-R208 PolarHBondContact O-N 3.38Å; R208-S211 WeakPolarHBondContact CA-OG 3.41Å; R208-S211 PolarHBondContact O-OG 2.9Å; R208-L220 HydrophobicContact CB-CD2 4.04Å; R208-I285 HydrophobicContact CB-CG2 4.47Å; R208-F290 HydrophobicContact CB-CD2 4.48Å; R208-F290 HydrophobicContact CB-CE1 4.15Å; R208-F290 HydrophobicContact CB-CE2 4Å; R208-F290 HydrophobicContact CB-CZ 3.81Å; R208-F290 HydrophobicContact CG-CD1 3.74Å; R208-F290 HydrophobicContact CG-CD2 3.96Å; R208-F290 HydrophobicContact CG-CE1 3.71Å; R208-F290 HydrophobicContact CG-CE2 3.94Å; R208-F290 HydrophobicContact CG-CG 3.86Å; R208-F290 HydrophobicContact CG-CZ 3.8Å; R208-F290 VanDerWaalsContact CZ-CB 3.49Å
209	L	95.9	Very high	94.3	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-71.1	-42.6	169.9	-70.6	165.4	0	0	0	110.9	A205 E206 S211 E212 N214 A218 L220 P240 I285	A205-L209 WeakPolarHBondContact O-CG 3.46Å; A205-L209 PolarHBondContact O-N 3.25Å; E206-L209 PolarHBondContact O-N 3.39Å; L209-S211 PolarHBondContact O-N 2.76Å; L209-E212 PolarHBondContact O-N 2.72Å; L209-N214 VanDerWaalsContact C-OD1 3.25Å; L209-N214 PolarHBondContact O-N 2.84Å; L209-N214 PolarHBondContact O-OD1 3.19Å; L209-A218 HydrophobicContact CD2-CB 4.19Å; L209-A218 WeakPolarHBondContact CD2-O 3.39Å; L209-L220 HydrophobicContact CG-CD2 4.38Å; L209-P240 HydrophobicContact CD1-CB 3.82Å; L209-I285 HydrophobicContact CD2-CG1 3.88Å
210	A	94.4	Very high	94.5	Very high	50 Å²	50	52 Å²	52	41%	0.413	27%	0.267	S	S	.	.	H	α-helix	trans	-64.8	-37.6	179.1	0	0	0	0	0	113.3	E206 S207 E212 G213 N214	E206-A210 WeakPolarHBondContact O-CB 3.42Å; E206-A210 PolarHBondContact O-N 3.35Å; S207-A210 PolarHBondContact O-N 2.97Å; A210-E212 PolarHBondContact O-N 2.88Å; A210-G213 PolarHBondContact O-N 2.98Å; A210-N214 WeakPolarHBondContact CA-OD1 3.44Å; A210-N214 PolarHBondContact N-OD1 3.01Å
211	S	91.1	Very high	94.6	Very high	76 Å²	76	51.3 Å²	51.3	53%	0.531	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-19	176.3	50.5	0	0	0	0	114.3	S207 R208 L209 G213 F290	S207-S211 PolarHBondContact O-N 3.39Å; S207-S211 PolarHBondContact O-OG 3.38Å; R208-S211 WeakPolarHBondContact CA-OG 3.41Å; R208-S211 PolarHBondContact O-OG 2.9Å; L209-S211 PolarHBondContact O-N 2.76Å; S211-G213 VanDerWaalsContact C-N 3.34Å; S211-F290 WeakPolarHBondContact OG-CE1 3.31Å; S211-F290 WeakPolarHBondContact OG-CZ 3.5Å
212	E	84.6	Confident	94.8	Very high	46 Å²	46	44.3 Å²	44.3	22%	0.215	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	18.3	176.4	-70.3	-82.8	174.6	0	0	111.7	L209 A210 K283 I285 N289	L209-E212 PolarHBondContact O-N 2.72Å; A210-E212 PolarHBondContact O-N 2.88Å; E212-K283 VanDerWaalsContact OE2-CE 3.31Å; E212-K283 WeakPolarHBondContact OE2-CE 3.45Å; E212-K283 IonicContact OE2-NZ 2.82Å; E212-K283 PolarHBondContact OE2-NZ 3.21Å; E212-I285 HydrophobicContact CB-CD1 3.76Å; E212-I285 HydrophobicContact CG-CD1 3.78Å; E212-I285 HydrophobicContact CG-CG2 4.36Å; E212-N289 PolarHBondContact OE1-ND2 3.03Å
213	G	90.7	Very high	94.7	Very high	53 Å²	53	40.3 Å²	40.3	55%	0.546	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	80	15.7	173.4	0	0	0	0	0	115.2	A210 S211 Q215	A210-G213 PolarHBondContact O-N 2.98Å; S211-G213 VanDerWaalsContact C-N 3.34Å; G213-Q215 PolarHBondContact O-N 3.04Å; G213-Q215 VanDerWaalsContact O-N 3.16Å
214	N	90.7	Very high	94.5	Very high	30 Å²	30	38.1 Å²	38.1	16%	0.16	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	40	-177.1	-86.7	-12.6	0	0	0	113.7	L209 A210 D216 T235 N238	L209-N214 VanDerWaalsContact C-OD1 3.25Å; L209-N214 PolarHBondContact O-N 2.84Å; L209-N214 PolarHBondContact O-OD1 3.19Å; A210-N214 WeakPolarHBondContact CA-OD1 3.44Å; A210-N214 PolarHBondContact N-OD1 3.01Å; N214-D216 PolarHBondContact O-N 3.32Å; N214-T235 HydrophobicContact CB-CG2 3.88Å; N214-T235 WeakPolarHBondContact O-CG2 3.46Å; N214-N238 WeakPolarHBondContact CB-OD1 3.2Å; N214-N238 PolarHBondContact ND2-O 3.31Å; N214-N238 VanDerWaalsContact ND2-O 3.16Å; N214-N238 PolarHBondContact O-OD1 3.45Å
215	Q	93.4	Very high	94	Very high	100 Å²	100	42 Å²	42	47%	0.467	23%	0.229	S	C	.	.			trans	-61.5	131.1	175.9	-66.3	173.1	-13.3	0	0	110.3	G213 G217 A218	G213-Q215 PolarHBondContact O-N 3.04Å; G213-Q215 VanDerWaalsContact O-N 3.16Å; Q215-G217 PolarHBondContact O-N 2.88Å; Q215-A218 HydrophobicContact CB-CB 4.42Å; Q215-A218 WeakPolarHBondContact O-CB 3.41Å; Q215-A218 PolarHBondContact O-N 3.4Å
216	D	94.9	Very high	93.3	Very high	69 Å²	69	49.4 Å²	49.4	37%	0.369	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	136.2	176.7	-96.3	45.7	0	0	0	110.7	N214 A218 S236 Q237 N238	N214-D216 PolarHBondContact O-N 3.32Å; D216-A218 VanDerWaalsContact C-N 3.26Å; D216-A218 PolarHBondContact O-N 3.04Å; D216-S236 WeakPolarHBondContact OD2-CA 3.46Å; D216-Q237 WeakPolarHBondContact OD1-CA 3.41Å; D216-Q237 PolarHBondContact OD1-N 3.34Å; D216-Q237 PolarHBondContact OD2-N 2.71Å; D216-N238 PolarHBondContact OD1-N 3.21Å
217	G	95.1	Very high	92.6	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.4	-1	-172.3	0	0	0	0	0	114.8	Q215 T235 K280 Q282 K283	Q215-G217 PolarHBondContact O-N 2.88Å; G217-T235 PolarHBondContact N-O 2.87Å; G217-K280 WeakPolarHBondContact CA-O 3.43Å; G217-Q282 PolarHBondContact O-N 3.13Å; G217-K283 PolarHBondContact O-N 3.42Å
218	A	96.6	Very high	92.1	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	132	169.2	0	0	0	0	0	111	L209 Q215 D216 L234 T235 K283 I285	L209-A218 HydrophobicContact CD2-CB 4.19Å; L209-A218 WeakPolarHBondContact CD2-O 3.39Å; Q215-A218 HydrophobicContact CB-CB 4.42Å; Q215-A218 WeakPolarHBondContact O-CB 3.41Å; Q215-A218 PolarHBondContact O-N 3.4Å; D216-A218 VanDerWaalsContact C-N 3.26Å; D216-A218 PolarHBondContact O-N 3.04Å; A218-L234 CarbonylContact O-C 3.51Å; A218-L234 WeakPolarHBondContact O-CA 3.39Å; A218-T235 PolarHBondContact O-N 3.06Å; A218-K283 CarbonylContact C-O 3.35Å; A218-K283 VanDerWaalsContact CA-O 3.27Å; A218-K283 WeakPolarHBondContact CA-O 3.49Å; A218-K283 HydrophobicContact CB-CB 4.48Å; A218-I285 HydrophobicContact CB-CD1 3.89Å; A218-I285 HydrophobicContact CB-CG1 4.42Å
219	F	97.9	Very high	91.7	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	158.8	-172.6	81.3	-82.6	0	0	0	115.6	W195 L232 S233 L234 I267 H271 L281 K283 P284 I285	W195-F219 HydrophobicContact CB-CD2 4.42Å; W195-F219 HydrophobicContact CB-CE2 3.73Å; W195-F219 HydrophobicContact CB-CZ 4.12Å; W195-F219 AromaticContact CD1-CZ 3.97Å; W195-F219 HydrophobicContact CD2-CE2 4.11Å; W195-F219 AromaticContact CG-CE2 3.72Å; W195-F219 HydrophobicContact CG-CE2 3.72Å; W195-F219 HydrophobicContact CG-CZ 4.01Å; F219-L232 HydrophobicContact CB-CD1 4.1Å; F219-L232 HydrophobicContact CD2-CD1 3.87Å; F219-L232 HydrophobicContact CG-CD1 4.37Å; F219-S233 CarbonylContact C-O 3.6Å; F219-S233 VanDerWaalsContact CA-O 3.22Å; F219-S233 WeakPolarHBondContact CA-O 3.48Å; F219-L234 HydrophobicContact CB-CB 4.5Å; F219-L234 HydrophobicContact CB-CD1 4.1Å; F219-I267 HydrophobicContact CE2-CD1 4.41Å; F219-I267 HydrophobicContact CE2-CG2 3.82Å; F219-I267 HydrophobicContact CZ-CG2 3.97Å; F219-H271 AromaticContact CE1-CE1 3.66Å; F219-H271 AromaticContact CE1-NE2 3.41Å; F219-H271 WeakPolarHBondContact CE1-NE2 3.45Å; F219-H271 AromaticContact CZ-CE1 3.48Å; F219-H271 VanDerWaalsContact CZ-CE1 3.48Å; F219-H271 WeakPolarHBondContact CZ-CE1 3.44Å; F219-H271 AromaticContact CZ-NE2 3.67Å; F219-L281 HydrophobicContact CB-CD2 3.83Å; F219-L281 HydrophobicContact CD1-CB 3.82Å; F219-L281 HydrophobicContact CD1-CD1 4.41Å; F219-L281 HydrophobicContact CD1-CD2 4.15Å; F219-L281 HydrophobicContact CD1-CG 4.33Å; F219-L281 HydrophobicContact CD2-CD1 4.07Å; F219-L281 HydrophobicContact CD2-CD2 4.33Å; F219-L281 HydrophobicContact CE1-CB 3.93Å; F219-L281 HydrophobicContact CE1-CD1 4.41Å; F219-L281 HydrophobicContact CE2-CD1 4.08Å; F219-L281 HydrophobicContact CG-CB 4.34Å; F219-L281 HydrophobicContact CG-CD1 4.25Å; F219-L281 HydrophobicContact CG-CD2 3.84Å; F219-L281 HydrophobicContact CG-CG 4.35Å; F219-L281 HydrophobicContact CZ-CD1 4.26Å; F219-K283 WeakPolarHBondContact CD1-O 3.36Å; F219-K283 PolarHBondContact N-O 3.43Å; F219-P284 HydrophobicContact CE1-CB 3.82Å; F219-P284 HydrophobicContact CE1-CG 4.5Å; F219-P284 HydrophobicContact CZ-CB 3.81Å; F219-I285 PolarHBondContact O-N 2.71Å
220	L	97.8	Very high	91.7	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	157.6	166.8	63.4	88.5	0	0	0	110.9	W195 H197 I200 A205 R208 L209 R222 S233 I285	W195-L220 WeakPolarHBondContact O-CA 3.4Å; H197-L220 HydrophobicContact CB-CD1 4.32Å; I200-L220 HydrophobicContact CD1-CD1 4.13Å; A205-L220 HydrophobicContact CB-CD1 3.91Å; A205-L220 HydrophobicContact CB-CD2 4.31Å; R208-L220 HydrophobicContact CB-CD2 4.04Å; L209-L220 HydrophobicContact CG-CD2 4.38Å; L220-R222 HydrophobicContact CD1-CB 4.31Å; L220-R222 HydrophobicContact CD1-CG 4.49Å; L220-S233 PolarHBondContact N-O 3.01Å; L220-S233 PolarHBondContact O-N 3.38Å; L220-I285 HydrophobicContact CB-CB 4.44Å
221	V	97.5	Very high	91.8	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	137.8	171.8	-177.3	0	0	0	0	109.3	W195 Y196 H197 Y230 V231 L232 I245 I267	W195-V221 HydrophobicContact CE3-CB 3.77Å; W195-V221 HydrophobicContact CE3-CG2 3.57Å; W195-V221 HydrophobicContact CZ3-CB 3.83Å; W195-V221 HydrophobicContact CZ3-CG1 4.46Å; W195-V221 HydrophobicContact CZ3-CG2 3.62Å; W195-V221 PolarHBondContact O-N 2.91Å; Y196-V221 CarbonylContact C-O 3.58Å; Y196-V221 WeakPolarHBondContact CA-O 3.5Å; Y196-V221 HydrophobicContact CD2-CB 4.42Å; Y196-V221 HydrophobicContact CD2-CG1 4.32Å; H197-V221 PolarHBondContact N-O 3.07Å; V221-Y230 HydrophobicContact CG1-CD1 4.12Å; V221-V231 WeakPolarHBondContact CA-O 3.31Å; V221-L232 HydrophobicContact CG2-CD1 4.2Å; V221-I245 HydrophobicContact CG1-CD1 4.18Å; V221-I267 HydrophobicContact CG2-CD1 3.61Å; V221-I267 HydrophobicContact CG2-CG1 4.11Å
222	R	96.6	Very high	92.1	Very high	13 Å²	13	49.3 Å²	49.3	5%	0.049	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	149.5	178.3	63.9	-164.4	178.5	81.1	3.3	111.4	H198 I200 L220 Y230 V231 S233	H198-R222 CarbonylContact O-C 3.53Å; H198-R222 WeakPolarHBondContact O-CA 3.39Å; I200-R222 HydrophobicContact CG1-CB 3.73Å; I200-R222 HydrophobicContact CG1-CG 4.44Å; I200-R222 PolarHBondContact O-NH1 3.29Å; L220-R222 HydrophobicContact CD1-CB 4.31Å; L220-R222 HydrophobicContact CD1-CG 4.49Å; R222-Y230 CarbonylContact O-C 3.59Å; R222-Y230 WeakPolarHBondContact O-CA 3.28Å; R222-V231 HydrophobicContact CG-CB 4.06Å; R222-V231 PolarHBondContact N-O 3.39Å; R222-V231 PolarHBondContact O-N 2.84Å; R222-S233 PolarHBondContact NE-OG 2.87Å
223	Y	95	Very high	92.8	Very high	55 Å²	55	47.1 Å²	47.1	22%	0.216	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	128.5	176.7	-175.1	-107.1	0	0	0	111.3	Y196 H198 T199 K225 R228 T229 Y230	Y196-Y223 WeakPolarHBondContact OH-CB 3.39Å; H198-Y223 PolarHBondContact O-N 3.4Å; T199-Y223 WeakPolarHBondContact CA-O 3.4Å; Y223-K225 HydrophobicContact CD1-CG 4.1Å; Y223-K225 HydrophobicContact CE1-CG 4.05Å; Y223-R228 VanDerWaalsContact CE2-O 3.25Å; Y223-R228 WeakPolarHBondContact CE2-O 3.34Å; Y223-R228 VanDerWaalsContact OH-CA 3.31Å; Y223-R228 WeakPolarHBondContact OH-CA 3.4Å; Y223-R228 WeakPolarHBondContact OH-CB 3.43Å; Y223-R228 PolarHBondContact OH-O 3.18Å; Y223-T229 WeakPolarHBondContact CD2-O 3.25Å; Y223-Y230 AromaticContact CD2-CD1 3.98Å; Y223-Y230 HydrophobicContact CD2-CD1 3.98Å; Y223-Y230 AromaticContact CD2-CD2 3.9Å; Y223-Y230 HydrophobicContact CD2-CD2 3.9Å; Y223-Y230 AromaticContact CD2-CE1 3.86Å; Y223-Y230 HydrophobicContact CD2-CE1 3.86Å; Y223-Y230 AromaticContact CD2-CE2 3.77Å; Y223-Y230 HydrophobicContact CD2-CE2 3.77Å; Y223-Y230 HydrophobicContact CD2-CG 4.01Å; Y223-Y230 AromaticContact CD2-CZ 3.77Å; Y223-Y230 HydrophobicContact CE2-CD2 4.26Å; Y223-Y230 AromaticContact CE2-CE2 3.98Å; Y223-Y230 HydrophobicContact CE2-CE2 3.98Å; Y223-Y230 HydrophobicContact CG-CE1 4.47Å
224	R	90.8	Very high	93.1	Very high	87 Å²	87	44.6 Å²	44.6	33%	0.328	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	111.5	-179.4	-167.7	166.6	71.7	176.6	2.3	109.2	E226 D227 R228 T229 V231	R224-E226 VanDerWaalsContact C-N 3.35Å; R224-E226 WeakPolarHBondContact CG-OE2 3.46Å; R224-D227 WeakPolarHBondContact CG-OD1 3.33Å; R224-D227 IonicContact CZ-OD1 3.59Å; R224-D227 IonicContact CZ-OD2 3.61Å; R224-D227 IonicContact NE-OD1 3.35Å; R224-D227 PolarHBondContact NE-OD1 3.35Å; R224-D227 IonicContact NE-OD2 3.41Å; R224-D227 IonicContact NH2-OD1 2.66Å; R224-D227 IonicContact NH2-OD2 2.67Å; R224-D227 PolarHBondContact NH2-OD2 3.41Å; R224-R228 CarbonylContact O-C 3.58Å; R224-R228 VanDerWaalsContact O-CA 3.27Å; R224-R228 WeakPolarHBondContact O-CA 3.32Å; R224-R228 PolarHBondContact O-N 2.64Å; R224-T229 PolarHBondContact N-O 3.19Å; R224-T229 PolarHBondContact O-N 3.38Å; R224-V231 HydrophobicContact CB-CG2 4.38Å
225	K	84.9	Confident	93.4	Very high	141 Å²	141	43.2 Å²	43.2	61%	0.613	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73	-29.1	-172.5	-77.6	-176.8	178.4	170	0	112.9	T199 Y223 D227	T199-K225 HydrophobicContact CG2-CD 3.88Å; T199-K225 HydrophobicContact CG2-CG 3.83Å; T199-K225 VanDerWaalsContact OG1-CE 3.31Å; T199-K225 WeakPolarHBondContact OG1-CE 3.44Å; Y223-K225 HydrophobicContact CD1-CG 4.1Å; Y223-K225 HydrophobicContact CE1-CG 4.05Å; K225-D227 VanDerWaalsContact C-N 3.28Å; K225-D227 PolarHBondContact O-N 2.88Å
226	E	81.7	Confident	93.5	Very high	155 Å²	155	38.5 Å²	38.5	72%	0.724	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-35.7	-174.1	-63.2	84.9	166.9	0	0	112.4	R224	R224-E226 VanDerWaalsContact C-N 3.35Å; R224-E226 WeakPolarHBondContact CG-OE2 3.46Å
227	D	83.8	Confident	93.5	Very high	46 Å²	46	42.4 Å²	42.4	25%	0.246	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.6	10.3	-179.9	74.9	-34.8	0	0	0	113.5	R224 K225 T229 R244	R224-D227 WeakPolarHBondContact CG-OD1 3.33Å; R224-D227 IonicContact CZ-OD1 3.59Å; R224-D227 IonicContact CZ-OD2 3.61Å; R224-D227 IonicContact NE-OD1 3.35Å; R224-D227 PolarHBondContact NE-OD1 3.35Å; R224-D227 IonicContact NE-OD2 3.41Å; R224-D227 IonicContact NH2-OD1 2.66Å; R224-D227 IonicContact NH2-OD2 2.67Å; R224-D227 PolarHBondContact NH2-OD2 3.41Å; K225-D227 VanDerWaalsContact C-N 3.28Å; K225-D227 PolarHBondContact O-N 2.88Å; D227-T229 PolarHBondContact O-N 3.35Å; D227-T229 PolarHBondContact OD1-N 2.89Å; D227-T229 PolarHBondContact OD1-OG1 3.33Å; D227-T229 WeakPolarHBondContact OD2-CG2 3.29Å; D227-T229 PolarHBondContact OD2-OG1 2.89Å; D227-R244 IonicContact OD2-CZ 3.71Å; D227-R244 VanDerWaalsContact OD2-CZ 3.28Å; D227-R244 IonicContact OD2-NE 2.74Å; D227-R244 PolarHBondContact OD2-NE 3Å; D227-R244 VanDerWaalsContact OD2-NE 3.08Å; D227-R244 IonicContact OD2-NH2 3.21Å; D227-R244 PolarHBondContact OD2-NH2 3.46Å
228	R	83.6	Confident	93.3	Very high	195 Å²	195	47.4 Å²	47.4	74%	0.736	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.5	20	179.1	-54.9	-177.1	-176.9	-163.6	-1.4	115.7	Y223 R224	Y223-R228 VanDerWaalsContact CE2-O 3.25Å; Y223-R228 WeakPolarHBondContact CE2-O 3.34Å; Y223-R228 VanDerWaalsContact OH-CA 3.31Å; Y223-R228 WeakPolarHBondContact OH-CA 3.4Å; Y223-R228 WeakPolarHBondContact OH-CB 3.43Å; Y223-R228 PolarHBondContact OH-O 3.18Å; R224-R228 CarbonylContact O-C 3.58Å; R224-R228 VanDerWaalsContact O-CA 3.27Å; R224-R228 WeakPolarHBondContact O-CA 3.32Å; R224-R228 PolarHBondContact O-N 2.64Å
229	T	89	Confident	93.2	Very high	15 Å²	15	52.8 Å²	52.8	9%	0.092	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	162.9	180	62.2	0	0	0	0	113.3	Y223 R224 D227 R244	Y223-T229 WeakPolarHBondContact CD2-O 3.25Å; R224-T229 PolarHBondContact N-O 3.19Å; R224-T229 PolarHBondContact O-N 3.38Å; D227-T229 PolarHBondContact O-N 3.35Å; D227-T229 PolarHBondContact OD1-N 2.89Å; D227-T229 PolarHBondContact OD1-OG1 3.33Å; D227-T229 WeakPolarHBondContact OD2-CG2 3.29Å; D227-T229 PolarHBondContact OD2-OG1 2.89Å; T229-R244 HydrophobicContact CG2-CG 4.46Å
230	Y	95.9	Very high	93.1	Very high	26 Å²	26	54.3 Å²	54.3	10%	0.102	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	157.8	166.9	-68	-100.8	0	0	0	109.5	H190 Y196 V221 R222 Y223 I245 W252 I263	H190-Y230 AromaticContact CD2-CE1 3.98Å; H190-Y230 AromaticContact NE2-CE1 3.86Å; H190-Y230 AromaticContact NE2-CZ 3.65Å; H190-Y230 PolarHBondContact NE2-OH 3.06Å; H190-Y230 VanDerWaalsContact NE2-OH 3.09Å; Y196-Y230 HydrophobicContact CD2-CE1 4.45Å; Y196-Y230 AromaticContact CE2-CD1 3.88Å; Y196-Y230 HydrophobicContact CE2-CD1 3.88Å; Y196-Y230 AromaticContact CE2-CE1 3.59Å; Y196-Y230 HydrophobicContact CE2-CE1 3.59Å; Y196-Y230 AromaticContact CZ-CE1 3.98Å; V221-Y230 HydrophobicContact CG1-CD1 4.12Å; R222-Y230 CarbonylContact O-C 3.59Å; R222-Y230 WeakPolarHBondContact O-CA 3.28Å; Y223-Y230 AromaticContact CD2-CD1 3.98Å; Y223-Y230 HydrophobicContact CD2-CD1 3.98Å; Y223-Y230 AromaticContact CD2-CD2 3.9Å; Y223-Y230 HydrophobicContact CD2-CD2 3.9Å; Y223-Y230 AromaticContact CD2-CE1 3.86Å; Y223-Y230 HydrophobicContact CD2-CE1 3.86Å; Y223-Y230 AromaticContact CD2-CE2 3.77Å; Y223-Y230 HydrophobicContact CD2-CE2 3.77Å; Y223-Y230 HydrophobicContact CD2-CG 4.01Å; Y223-Y230 AromaticContact CD2-CZ 3.77Å; Y223-Y230 HydrophobicContact CE2-CD2 4.26Å; Y223-Y230 AromaticContact CE2-CE2 3.98Å; Y223-Y230 HydrophobicContact CE2-CE2 3.98Å; Y223-Y230 HydrophobicContact CG-CE1 4.47Å; Y230-I245 PolarHBondContact N-O 3.15Å; Y230-I245 PolarHBondContact O-N 2.85Å; Y230-W252 HydrophobicContact CD2-CE3 4.33Å; Y230-W252 HydrophobicContact CD2-CH2 4.17Å; Y230-W252 AromaticContact CD2-CZ3 3.65Å; Y230-W252 HydrophobicContact CD2-CZ3 3.65Å; Y230-W252 AromaticContact CE2-CH2 3.78Å; Y230-W252 HydrophobicContact CE2-CH2 3.78Å; Y230-W252 AromaticContact CE2-CZ3 3.77Å; Y230-W252 HydrophobicContact CE2-CZ3 3.77Å; Y230-I263 HydrophobicContact CD1-CD1 3.83Å; Y230-I263 HydrophobicContact CD2-CD1 3.5Å; Y230-I263 VanDerWaalsContact CD2-CD1 3.5Å; Y230-I263 HydrophobicContact CE1-CD1 3.84Å; Y230-I263 HydrophobicContact CE2-CD1 3.51Å; Y230-I263 HydrophobicContact CG-CD1 3.65Å
231	V	97	Very high	93	Very high	5 Å²	5	56.5 Å²	56.5	3%	0.03	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	118.1	177.1	-177.4	0	0	0	0	109.1	V221 R222 R224 H242 Y243	V221-V231 WeakPolarHBondContact CA-O 3.31Å; R222-V231 HydrophobicContact CG-CB 4.06Å; R222-V231 PolarHBondContact N-O 3.39Å; R222-V231 PolarHBondContact O-N 2.84Å; R224-V231 HydrophobicContact CB-CG2 4.38Å; V231-H242 HydrophobicContact CG1-CB 3.91Å; V231-Y243 CarbonylContact C-O 3.54Å; V231-Y243 WeakPolarHBondContact CA-O 3.49Å
232	L	97.6	Very high	93	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	123	165	170.3	62	0	0	0	108	F219 V221 H242 Y243 I245 I267 L277 L281	F219-L232 HydrophobicContact CB-CD1 4.1Å; F219-L232 HydrophobicContact CD2-CD1 3.87Å; F219-L232 HydrophobicContact CG-CD1 4.37Å; V221-L232 HydrophobicContact CG2-CD1 4.2Å; L232-H242 CarbonylContact O-C 3.6Å; L232-H242 WeakPolarHBondContact O-CA 3.27Å; L232-Y243 PolarHBondContact N-O 2.82Å; L232-Y243 PolarHBondContact O-N 2.98Å; L232-I245 HydrophobicContact CB-CD1 3.99Å; L232-I245 HydrophobicContact CB-CG1 4.33Å; L232-I267 HydrophobicContact CD1-CD1 4.06Å; L232-L277 HydrophobicContact CD2-CD1 3.97Å; L232-L277 HydrophobicContact CD2-CD2 3.87Å; L232-L281 HydrophobicContact CD1-CD1 4.47Å; L232-L281 HydrophobicContact CD1-CD2 4.06Å; L232-L281 HydrophobicContact CD2-CD2 4.22Å
233	S	97.8	Very high	93	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	120.4	174.6	-51.8	0	0	0	0	107.5	F219 L220 R222 K241 H242	F219-S233 CarbonylContact C-O 3.6Å; F219-S233 VanDerWaalsContact CA-O 3.22Å; F219-S233 WeakPolarHBondContact CA-O 3.48Å; L220-S233 PolarHBondContact N-O 3.01Å; L220-S233 PolarHBondContact O-N 3.38Å; R222-S233 PolarHBondContact NE-OG 2.87Å; S233-K241 WeakPolarHBondContact CA-O 3.5Å; S233-H242 VanDerWaalsContact CB-ND1 3.33Å; S233-H242 WeakPolarHBondContact CB-ND1 3.31Å; S233-H242 PolarHBondContact OG-ND1 3.28Å
234	L	97.1	Very high	93	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	129.8	-166.2	166.7	62.4	0	0	0	109	A218 F219 K241 Y243 L277 L281	A218-L234 CarbonylContact O-C 3.51Å; A218-L234 WeakPolarHBondContact O-CA 3.39Å; F219-L234 HydrophobicContact CB-CB 4.5Å; F219-L234 HydrophobicContact CB-CD1 4.1Å; L234-K241 PolarHBondContact N-O 3.25Å; L234-K241 WeakPolarHBondContact O-CA 3.31Å; L234-K241 WeakPolarHBondContact O-CB 3.34Å; L234-K241 PolarHBondContact O-N 3.12Å; L234-Y243 HydrophobicContact CD2-CE2 4.17Å; L234-L277 HydrophobicContact CD2-CB 4.14Å; L234-L277 HydrophobicContact CD2-CD1 4.07Å; L234-L277 HydrophobicContact CD2-CD2 4.48Å; L234-L277 HydrophobicContact CD2-CG 4.47Å; L234-L281 HydrophobicContact CD1-CD2 3.78Å; L234-L281 HydrophobicContact CD2-CD2 4.05Å; L234-L281 HydrophobicContact CG-CD2 4.38Å
235	T	97.6	Very high	93.2	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	131.4	170.8	-62	0	0	0	0	111	N214 G217 A218 E239	N214-T235 HydrophobicContact CB-CG2 3.88Å; N214-T235 WeakPolarHBondContact O-CG2 3.46Å; G217-T235 PolarHBondContact N-O 2.87Å; A218-T235 PolarHBondContact O-N 3.06Å; T235-E239 WeakPolarHBondContact CA-O 3.4Å
236	S	95.7	Very high	93.2	Very high	2 Å²	2	54 Å²	54	1%	0.014	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	136.5	173.5	-177	0	0	0	0	110	D216 N238 E239 K241 L278	D216-S236 WeakPolarHBondContact OD2-CA 3.46Å; S236-N238 VanDerWaalsContact C-N 3.27Å; S236-N238 PolarHBondContact O-N 2.79Å; S236-E239 PolarHBondContact N-O 2.98Å; S236-E239 PolarHBondContact O-N 2.79Å; S236-E239 VanDerWaalsContact O-O 3.07Å; S236-K241 VanDerWaalsContact O-CE 3.26Å; S236-K241 WeakPolarHBondContact O-CE 3.25Å; S236-L278 WeakPolarHBondContact OG-CB 3.45Å
237	Q	93.6	Very high	93.3	Very high	151 Å²	151	51.9 Å²	51.9	71%	0.706	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	43.4	-169.4	-56.6	177.3	-0.8	0	0	111.9	D216 E239	D216-Q237 WeakPolarHBondContact OD1-CA 3.41Å; D216-Q237 PolarHBondContact OD1-N 3.34Å; D216-Q237 PolarHBondContact OD2-N 2.71Å; Q237-E239 PolarHBondContact O-N 3.03Å; Q237-E239 VanDerWaalsContact O-N 3.1Å
238	N	91	Very high	92.7	Very high	104 Å²	104	52.4 Å²	52.4	56%	0.556	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.2	9.7	-177.1	-166.1	42.6	0	0	0	115.1	N214 D216 S236	N214-N238 WeakPolarHBondContact CB-OD1 3.2Å; N214-N238 PolarHBondContact ND2-O 3.31Å; N214-N238 VanDerWaalsContact ND2-O 3.16Å; N214-N238 PolarHBondContact O-OD1 3.45Å; D216-N238 PolarHBondContact OD1-N 3.21Å; S236-N238 VanDerWaalsContact C-N 3.27Å; S236-N238 PolarHBondContact O-N 2.79Å
239	E	94.7	Very high	91.8	Very high	114 Å²	114	47 Å²	47	53%	0.533	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	140.7	178.2	-76.7	-167.7	163.8	0	0	112.9	T235 S236 Q237 K241	T235-E239 WeakPolarHBondContact CA-O 3.4Å; S236-E239 PolarHBondContact N-O 2.98Å; S236-E239 PolarHBondContact O-N 2.79Å; S236-E239 VanDerWaalsContact O-O 3.07Å; Q237-E239 PolarHBondContact O-N 3.03Å; Q237-E239 VanDerWaalsContact O-N 3.1Å; E239-K241 IonicContact OE2-NZ 2.67Å; E239-K241 PolarHBondContact OE2-NZ 3.15Å
240	P	96.3	Very high	90.9	Very high	32 Å²	32	50 Å²	50	21%	0.208	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	130.8	174.2	30.7	-34.6	0	0	0	112	E206 L209	E206-P240 HydrophobicContact CB-CB 4.44Å; E206-P240 HydrophobicContact CB-CG 4.12Å; E206-P240 HydrophobicContact CG-CB 3.94Å; E206-P240 HydrophobicContact CG-CG 3.77Å; L209-P240 HydrophobicContact CD1-CB 3.82Å
241	K	96.4	Very high	89.9	Confident	45 Å²	45	52.1 Å²	52.1	20%	0.196	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	151.3	177.5	-44.2	-63.1	177.7	178.4	0	108.9	S233 L234 S236 E239 Y243 L278	S233-K241 WeakPolarHBondContact CA-O 3.5Å; L234-K241 PolarHBondContact N-O 3.25Å; L234-K241 WeakPolarHBondContact O-CA 3.31Å; L234-K241 WeakPolarHBondContact O-CB 3.34Å; L234-K241 PolarHBondContact O-N 3.12Å; S236-K241 VanDerWaalsContact O-CE 3.26Å; S236-K241 WeakPolarHBondContact O-CE 3.25Å; E239-K241 IonicContact OE2-NZ 2.67Å; E239-K241 PolarHBondContact OE2-NZ 3.15Å; K241-Y243 HydrophobicContact CB-CE2 4.02Å; K241-L278 HydrophobicContact CD-CD1 4.06Å; K241-L278 HydrophobicContact CG-CD1 3.9Å
242	H	96.5	Very high	89.6	Confident	48 Å²	48	53 Å²	53	22%	0.222	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	121.3	-176.5	-56.4	-73.6	0	0	0	111.9	R202 E206 V231 L232 S233	R202-H242 WeakPolarHBondContact CG-NE2 3.5Å; R202-H242 VanDerWaalsContact CZ-CD2 3.48Å; R202-H242 PolarHBondContact NE-CD2 2.99Å; R202-H242 PolarHBondContact NE-NE2 3.35Å; E206-H242 WeakPolarHBondContact CG-NE2 3.17Å; E206-H242 IonicContact OE1-NE2 3.25Å; E206-H242 PolarHBondContact OE1-NE2 3.26Å; V231-H242 HydrophobicContact CG1-CB 3.91Å; L232-H242 CarbonylContact O-C 3.6Å; L232-H242 WeakPolarHBondContact O-CA 3.27Å; S233-H242 VanDerWaalsContact CB-ND1 3.33Å; S233-H242 WeakPolarHBondContact CB-ND1 3.31Å; S233-H242 PolarHBondContact OG-ND1 3.28Å
243	Y	96.6	Very high	89.2	Confident	43 Å²	43	53.1 Å²	53.1	17%	0.169	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	122.3	178.7	-60.7	-94	0	0	0	108.9	V231 L232 L234 K241 I245 I254 L277 L278	V231-Y243 CarbonylContact C-O 3.54Å; V231-Y243 WeakPolarHBondContact CA-O 3.49Å; L232-Y243 PolarHBondContact N-O 2.82Å; L232-Y243 PolarHBondContact O-N 2.98Å; L234-Y243 HydrophobicContact CD2-CE2 4.17Å; K241-Y243 HydrophobicContact CB-CE2 4.02Å; Y243-I245 PolarHBondContact O-N 3.35Å; Y243-I254 HydrophobicContact CD1-CD1 4.43Å; Y243-L277 HydrophobicContact CD1-CD2 3.67Å; Y243-L277 HydrophobicContact CD2-CD2 3.59Å; Y243-L277 HydrophobicContact CE1-CD2 3.75Å; Y243-L277 HydrophobicContact CE2-CD2 3.68Å; Y243-L277 HydrophobicContact CG-CD2 3.59Å; Y243-L278 WeakPolarHBondContact OH-CG 3.27Å; Y243-L278 PolarHBondContact OH-N 3.3Å
244	R	94.7	Very high	88.9	Confident	85 Å²	85	53.3 Å²	53.3	32%	0.321	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	126.9	173.4	-165.7	-178.1	-172.8	-151.4	3.5	108.3	D227 T229 E246 I254 E255	D227-R244 IonicContact OD2-CZ 3.71Å; D227-R244 VanDerWaalsContact OD2-CZ 3.28Å; D227-R244 IonicContact OD2-NE 2.74Å; D227-R244 PolarHBondContact OD2-NE 3Å; D227-R244 VanDerWaalsContact OD2-NE 3.08Å; D227-R244 IonicContact OD2-NH2 3.21Å; D227-R244 PolarHBondContact OD2-NH2 3.46Å; T229-R244 HydrophobicContact CG2-CG 4.46Å; R244-E246 WeakPolarHBondContact CD-OE1 3.35Å; R244-E246 HydrophobicContact CG-CG 4.07Å; R244-E246 IonicContact CZ-OE1 3.69Å; R244-E246 IonicContact NE-OE1 3.27Å; R244-E246 IonicContact NH1-OE1 3.11Å; R244-E246 PolarHBondContact NH1-OE1 3.44Å; R244-I254 WeakPolarHBondContact O-CA 3.45Å; R244-E255 PolarHBondContact O-N 3.5Å
245	I	94.8	Very high	88.3	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	114.1	169.6	-61.3	165.9	0	0	0	106.7	V221 Y230 L232 Y243 W252 S253 I254 L266	V221-I245 HydrophobicContact CG1-CD1 4.18Å; Y230-I245 PolarHBondContact N-O 3.15Å; Y230-I245 PolarHBondContact O-N 2.85Å; L232-I245 HydrophobicContact CB-CD1 3.99Å; L232-I245 HydrophobicContact CB-CG1 4.33Å; Y243-I245 PolarHBondContact O-N 3.35Å; I245-W252 HydrophobicContact CG2-CB 4.23Å; I245-W252 HydrophobicContact CG2-CE3 4.07Å; I245-S253 CarbonylContact C-O 3.59Å; I245-S253 VanDerWaalsContact CA-O 3.28Å; I245-S253 WeakPolarHBondContact CA-O 3.42Å; I245-I254 HydrophobicContact CG1-CG2 4.19Å; I245-L266 HydrophobicContact CD1-CD2 4.04Å; I245-L266 HydrophobicContact CG1-CD1 4.35Å; I245-L266 HydrophobicContact CG1-CD2 4.38Å; I245-L266 HydrophobicContact CG2-CD1 3.81Å
246	E	85.9	Confident	87.2	Confident	67 Å²	67	63.7 Å²	63.7	31%	0.313	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	144.4	-179.1	-56.9	-167.2	156.2	0	0	110.8	R244 W252 S253	R244-E246 WeakPolarHBondContact CD-OE1 3.35Å; R244-E246 HydrophobicContact CG-CG 4.07Å; R244-E246 IonicContact CZ-OE1 3.69Å; R244-E246 IonicContact NE-OE1 3.27Å; R244-E246 IonicContact NH1-OE1 3.11Å; R244-E246 PolarHBondContact NH1-OE1 3.44Å; E246-W252 WeakPolarHBondContact O-CA 3.43Å; E246-S253 PolarHBondContact N-O 3.28Å; E246-S253 PolarHBondContact O-N 3.4Å; E246-S253 VanDerWaalsContact O-N 3.1Å
247	E	84.4	Confident	86.4	Confident	112 Å²	112	64.4 Å²	64.4	52%	0.523	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	126.9	168.4	-163.4	-174.2	158.7	0	0	109.4	S250 R251 W252	E247-S250 WeakPolarHBondContact OE1-CA 3.12Å; E247-S250 PolarHBondContact OE1-N 3.24Å; E247-R251 WeakPolarHBondContact CA-O 3.45Å; E247-W252 HydrophobicContact CB-CE3 3.99Å; E247-W252 HydrophobicContact CB-CH2 3.89Å; E247-W252 HydrophobicContact CB-CZ3 3.59Å; E247-W252 HydrophobicContact CG-CD2 4.45Å; E247-W252 HydrophobicContact CG-CE3 4.26Å; E247-W252 HydrophobicContact CG-CH2 3.81Å; E247-W252 HydrophobicContact CG-CZ2 4.02Å; E247-W252 HydrophobicContact CG-CZ3 3.96Å; E247-W252 WeakPolarHBondContact OE2-CH2 3.49Å
248	Y	70.1	Confident	85.8	Confident	57 Å²	57	61.6 Å²	61.6	22%	0.224	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	111.2	168.1	-168	-107.7	0	0	0	108.4	R251 Y259 H987 V1134 L1135 S1138	Y248-R251 PolarHBondContact N-O 3.25Å; Y248-R251 WeakPolarHBondContact O-CB 3.46Å; Y248-R251 PolarHBondContact O-N 2.96Å; Y248-Y259 HydrophobicContact CD1-CE1 4.28Å; Y248-Y259 HydrophobicContact CG-CE1 4.27Å; Y248-H987 PolarHBondContact OH-NE2 3.26Å; Y248-V1134 HydrophobicContact CE1-CG1 3.99Å; Y248-L1135 HydrophobicContact CD1-CD2 3.63Å; Y248-L1135 HydrophobicContact CE1-CD2 3.79Å; Y248-S1138 WeakPolarHBondContact OH-CB 3.33Å; Y248-S1138 PolarHBondContact OH-OG 3.2Å
249	L	65.4	Low	85.3	Confident	82 Å²	82	58.8 Å²	58.8	43%	0.429	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	59	47.3	175.1	-50.7	165.9	0	0	0	114	R251 L991 V1134	L249-R251 PolarHBondContact O-N 2.88Å; L249-L991 HydrophobicContact CD1-CD2 3.22Å; L249-L991 HydrophobicContact CD2-CD2 3.7Å; L249-L991 HydrophobicContact CG-CD2 4.08Å; L249-V1134 HydrophobicContact CD1-CG1 3.31Å
250	S	69.7	Low	84.8	Confident	77 Å²	77	54 Å²	54	54%	0.538	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	13.1	-173.5	-40.8	0	0	0	0	115.1	E247	E247-S250 WeakPolarHBondContact OE1-CA 3.12Å; E247-S250 PolarHBondContact OE1-N 3.24Å
251	R	75.9	Confident	84	Confident	70 Å²	70	55.6 Å²	55.6	26%	0.264	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	151.5	171.2	-62.6	-177.7	77.6	101.9	1.5	110.1	E247 Y248 L249 Y259 F260 E261	E247-R251 WeakPolarHBondContact CA-O 3.45Å; Y248-R251 PolarHBondContact N-O 3.25Å; Y248-R251 WeakPolarHBondContact O-CB 3.46Å; Y248-R251 PolarHBondContact O-N 2.96Å; L249-R251 PolarHBondContact O-N 2.88Å; R251-Y259 HydrophobicContact CB-CD1 4.45Å; R251-Y259 PolarHBondContact NE-O 3.37Å; R251-Y259 PolarHBondContact NH2-O 3.04Å; R251-F260 CarbonylContact C-O 3.53Å; R251-F260 WeakPolarHBondContact CA-O 3.28Å; R251-F260 WeakPolarHBondContact CB-O 3.49Å; R251-E261 IonicContact CZ-OE1 2.78Å; R251-E261 VanDerWaalsContact NH1-CG 3.31Å; R251-E261 IonicContact NH1-OE1 3.62Å; R251-E261 PolarHBondContact NH1-OE1 3.21Å; R251-E261 IonicContact NH2-OE1 3.33Å
252	W	90.2	Very high	83.6	Confident	24 Å²	24	53.6 Å²	53.6	9%	0.091	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	140.8	-172.9	-54.9	89.8	0	0	0	110.9	Y230 I245 E246 E247 Y259 F260 I263 L266	Y230-W252 HydrophobicContact CD2-CE3 4.33Å; Y230-W252 HydrophobicContact CD2-CH2 4.17Å; Y230-W252 AromaticContact CD2-CZ3 3.65Å; Y230-W252 HydrophobicContact CD2-CZ3 3.65Å; Y230-W252 AromaticContact CE2-CH2 3.78Å; Y230-W252 HydrophobicContact CE2-CH2 3.78Å; Y230-W252 AromaticContact CE2-CZ3 3.77Å; Y230-W252 HydrophobicContact CE2-CZ3 3.77Å; I245-W252 HydrophobicContact CG2-CB 4.23Å; I245-W252 HydrophobicContact CG2-CE3 4.07Å; E246-W252 WeakPolarHBondContact O-CA 3.43Å; E247-W252 HydrophobicContact CB-CE3 3.99Å; E247-W252 HydrophobicContact CB-CH2 3.89Å; E247-W252 HydrophobicContact CB-CZ3 3.59Å; E247-W252 HydrophobicContact CG-CD2 4.45Å; E247-W252 HydrophobicContact CG-CE3 4.26Å; E247-W252 HydrophobicContact CG-CH2 3.81Å; E247-W252 HydrophobicContact CG-CZ2 4.02Å; E247-W252 HydrophobicContact CG-CZ3 3.96Å; E247-W252 WeakPolarHBondContact OE2-CH2 3.49Å; W252-Y259 CarbonylContact O-C 3.53Å; W252-Y259 WeakPolarHBondContact O-CA 3.13Å; W252-F260 PolarHBondContact N-O 2.84Å; W252-F260 WeakPolarHBondContact O-CD2 3.46Å; W252-F260 PolarHBondContact O-N 3.08Å; W252-I263 HydrophobicContact CB-CG1 4.28Å; W252-I263 HydrophobicContact CD2-CD1 3.95Å; W252-I263 HydrophobicContact CD2-CG1 3.57Å; W252-I263 HydrophobicContact CE3-CD1 3.91Å; W252-I263 HydrophobicContact CE3-CG1 3.99Å; W252-I263 HydrophobicContact CG-CG1 3.67Å; W252-I263 HydrophobicContact CH2-CD1 4.45Å; W252-I263 HydrophobicContact CZ2-CD1 4.47Å; W252-I263 HydrophobicContact CZ3-CD1 4.15Å; W252-L266 HydrophobicContact CB-CD1 3.99Å
253	S	89	Confident	83.5	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.014	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	155.1	173.4	-161.5	0	0	0	0	111.1	I245 E246 G257 Q258	I245-S253 CarbonylContact C-O 3.59Å; I245-S253 VanDerWaalsContact CA-O 3.28Å; I245-S253 WeakPolarHBondContact CA-O 3.42Å; E246-S253 PolarHBondContact N-O 3.28Å; E246-S253 PolarHBondContact O-N 3.4Å; E246-S253 VanDerWaalsContact O-N 3.1Å; S253-G257 WeakPolarHBondContact OG-CA 3.46Å; S253-G257 PolarHBondContact OG-O 3.5Å; S253-Q258 VanDerWaalsContact CB-O 3.3Å; S253-Q258 WeakPolarHBondContact CB-O 3.35Å; S253-Q258 PolarHBondContact OG-O 3.06Å
254	I	92.1	Very high	83.4	Confident	4 Å²	4	49.3 Å²	49.3	2%	0.021	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	158.9	159.7	66.8	175.5	0	0	0	109.4	Y243 R244 I245 G256 G257 Y270 L277	Y243-I254 HydrophobicContact CD1-CD1 4.43Å; R244-I254 WeakPolarHBondContact O-CA 3.45Å; I245-I254 HydrophobicContact CG1-CG2 4.19Å; I254-G256 PolarHBondContact O-N 2.93Å; I254-G257 PolarHBondContact O-N 2.89Å; I254-Y270 HydrophobicContact CD1-CE1 4.23Å; I254-Y270 HydrophobicContact CD1-CE2 4.25Å; I254-Y270 VanDerWaalsContact CD1-OH 3.27Å; I254-Y270 WeakPolarHBondContact CD1-OH 3.19Å; I254-Y270 HydrophobicContact CG1-CE2 4.39Å; I254-Y270 WeakPolarHBondContact CG1-OH 3.18Å; I254-Y270 HydrophobicContact CG2-CE2 4.14Å; I254-L277 HydrophobicContact CD1-CD2 3.76Å; I254-L277 HydrophobicContact CD1-CG 4.29Å
255	E	82.8	Confident	83.2	Confident	149 Å²	149	47.8 Å²	47.8	70%	0.696	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.7	112	177.1	-169.6	171.5	179.8	0	0	111.9	R244	R244-E255 PolarHBondContact O-N 3.5Å
256	G	75.2	Confident	83.2	Confident	69 Å²	69	47.8 Å²	47.8	71%	0.711	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.2	-6.1	-177.7	0	0	0	0	0	117.1	I254	I254-G256 PolarHBondContact O-N 2.93Å
257	G	78.9	Confident	83.6	Confident	17 Å²	17	44.7 Å²	44.7	18%	0.175	24%	0.235	C	C	.	.	S	Bend	trans	-80.8	-167.1	-173.6	0	0	0	0	0	116.5	S253 I254 Y259	S253-G257 WeakPolarHBondContact OG-CA 3.46Å; S253-G257 PolarHBondContact OG-O 3.5Å; I254-G257 PolarHBondContact O-N 2.89Å; G257-Y259 WeakPolarHBondContact O-CE2 3.4Å
258	Q	81.5	Confident	84.1	Confident	93 Å²	93	39.7 Å²	39.7	44%	0.435	21%	0.212	S	C	.	.			trans	-85.5	160.2	169.5	68.6	154.9	76.5	0	0	112.1	S253 F260 H269	S253-Q258 VanDerWaalsContact CB-O 3.3Å; S253-Q258 WeakPolarHBondContact CB-O 3.35Å; S253-Q258 PolarHBondContact OG-O 3.06Å; Q258-F260 HydrophobicContact CG-CE1 4.11Å; Q258-F260 HydrophobicContact CG-CE2 3.76Å; Q258-F260 HydrophobicContact CG-CZ 3.43Å; Q258-F260 VanDerWaalsContact CG-CZ 3.43Å; Q258-F260 VanDerWaalsContact NE2-CZ 3.32Å; Q258-F260 WeakPolarHBondContact O-CD2 3.45Å; Q258-F260 WeakPolarHBondContact O-CE2 3.19Å; Q258-H269 PolarHBondContact OE1-CE1 3.01Å; Q258-H269 VanDerWaalsContact OE1-CE1 3.23Å
259	Y	80.9	Confident	85.1	Confident	45 Å²	45	38 Å²	38	18%	0.176	21%	0.206	C	C	.	.			trans	-108.6	120.5	-169.6	-69	-103.2	0	0	0	112.4	Y248 R251 W252 G257 L1135	Y248-Y259 HydrophobicContact CD1-CE1 4.28Å; Y248-Y259 HydrophobicContact CG-CE1 4.27Å; R251-Y259 HydrophobicContact CB-CD1 4.45Å; R251-Y259 PolarHBondContact NE-O 3.37Å; R251-Y259 PolarHBondContact NH2-O 3.04Å; W252-Y259 CarbonylContact O-C 3.53Å; W252-Y259 WeakPolarHBondContact O-CA 3.13Å; G257-Y259 WeakPolarHBondContact O-CE2 3.4Å; Y259-L1135 HydrophobicContact CD1-CD2 4.11Å; Y259-L1135 HydrophobicContact CD2-CD1 3.29Å; Y259-L1135 HydrophobicContact CD2-CD2 3.81Å; Y259-L1135 HydrophobicContact CD2-CG 4.19Å; Y259-L1135 HydrophobicContact CE1-CD2 3.77Å; Y259-L1135 HydrophobicContact CE2-CD1 3.64Å; Y259-L1135 HydrophobicContact CE2-CD2 3.46Å; Y259-L1135 VanDerWaalsContact CE2-CD2 3.46Å; Y259-L1135 HydrophobicContact CE2-CG 4.17Å; Y259-L1135 HydrophobicContact CG-CD1 3.88Å; Y259-L1135 HydrophobicContact CG-CD2 4.13Å; Y259-L1135 VanDerWaalsContact CZ-CD2 3.42Å
260	F	83.6	Confident	86.5	Confident	13 Å²	13	34.1 Å²	34.1	6%	0.057	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-100.8	157.2	-178.4	-54.8	-86.5	0	0	0	111.3	R251 W252 Q258 T262 E265 L266 H269 Y270	R251-F260 CarbonylContact C-O 3.53Å; R251-F260 WeakPolarHBondContact CA-O 3.28Å; R251-F260 WeakPolarHBondContact CB-O 3.49Å; W252-F260 PolarHBondContact N-O 2.84Å; W252-F260 WeakPolarHBondContact O-CD2 3.46Å; W252-F260 PolarHBondContact O-N 3.08Å; Q258-F260 HydrophobicContact CG-CE1 4.11Å; Q258-F260 HydrophobicContact CG-CE2 3.76Å; Q258-F260 HydrophobicContact CG-CZ 3.43Å; Q258-F260 VanDerWaalsContact CG-CZ 3.43Å; Q258-F260 VanDerWaalsContact NE2-CZ 3.32Å; Q258-F260 WeakPolarHBondContact O-CD2 3.45Å; Q258-F260 WeakPolarHBondContact O-CE2 3.19Å; F260-T262 VanDerWaalsContact C-N 3.32Å; F260-E265 HydrophobicContact CB-CB 4.08Å; F260-E265 HydrophobicContact CD1-CB 4.1Å; F260-E265 HydrophobicContact CG-CB 4.47Å; F260-L266 HydrophobicContact CB-CB 4.09Å; F260-L266 HydrophobicContact CD2-CB 3.48Å; F260-L266 VanDerWaalsContact CD2-CB 3.48Å; F260-L266 HydrophobicContact CD2-CD1 3.88Å; F260-L266 HydrophobicContact CD2-CG 3.65Å; F260-L266 HydrophobicContact CE2-CB 4.01Å; F260-L266 HydrophobicContact CE2-CD1 4.31Å; F260-L266 HydrophobicContact CE2-CG 3.83Å; F260-L266 HydrophobicContact CG-CB 3.78Å; F260-L266 HydrophobicContact CG-CG 4.45Å; F260-H269 HydrophobicContact CD1-CB 4.38Å; F260-H269 HydrophobicContact CE1-CB 3.33Å; F260-H269 AromaticContact CE1-CG 3.53Å; F260-H269 AromaticContact CE1-ND1 3.72Å; F260-H269 HydrophobicContact CZ-CB 3.57Å; F260-H269 AromaticContact CZ-CD2 3.61Å; F260-H269 AromaticContact CZ-CG 3.41Å; F260-H269 VanDerWaalsContact CZ-CG 3.41Å; F260-H269 AromaticContact CZ-ND1 3.73Å; F260-Y270 HydrophobicContact CE2-CE2 4.05Å; F260-Y270 HydrophobicContact CZ-CE2 4.36Å
261	E	79.7	Confident	87.7	Confident	66 Å²	66	31 Å²	31	31%	0.308	16%	0.163	S	C	.	.	S	Bend	trans	-80.8	-21.3	178.9	-59.6	-174.6	179.3	0	0	111.6	F183 R251 E265	F183-E261 HydrophobicContact CD2-CB 4.48Å; F183-E261 HydrophobicContact CE2-CB 4.19Å; R251-E261 IonicContact CZ-OE1 2.78Å; R251-E261 VanDerWaalsContact NH1-CG 3.31Å; R251-E261 IonicContact NH1-OE1 3.62Å; R251-E261 PolarHBondContact NH1-OE1 3.21Å; R251-E261 IonicContact NH2-OE1 3.33Å; E261-E265 WeakPolarHBondContact CB-OE2 3.02Å; E261-E265 PolarHBondContact N-OE2 2.85Å; E261-E265 VanDerWaalsContact N-OE2 3.08Å
262	T	88.3	Confident	88.4	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.012	16%	0.155	C	C	.	.	S	Bend	trans	-142.1	156.9	-176.7	68.4	0	0	0	0	111.3	I186 K187 F260 M264 E265 L266	I186-T262 HydrophobicContact CB-CG2 4.4Å; I186-T262 HydrophobicContact CG2-CG2 3.95Å; K187-T262 HydrophobicContact CB-CG2 4.15Å; F260-T262 VanDerWaalsContact C-N 3.32Å; T262-M264 PolarHBondContact O-N 2.9Å; T262-E265 PolarHBondContact N-OE2 2.87Å; T262-E265 PolarHBondContact O-N 3.4Å; T262-E265 WeakPolarHBondContact OG1-CB 3.39Å; T262-E265 VanDerWaalsContact OG1-CG 3.28Å; T262-E265 WeakPolarHBondContact OG1-CG 3.46Å; T262-E265 PolarHBondContact OG1-N 2.85Å; T262-E265 VanDerWaalsContact OG1-N 3.08Å; T262-E265 PolarHBondContact OG1-OE2 3.25Å; T262-L266 PolarHBondContact O-N 3.06Å
263	I	94	Very high	88.3	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-68	-29.4	173.4	-60.8	-178.8	0	0	0	110.6	H190 W195 Y230 W252 E265 L266 I267	H190-I263 HydrophobicContact CB-CB 4.11Å; H190-I263 HydrophobicContact CB-CG2 4.2Å; W195-I263 HydrophobicContact CH2-CG2 4.14Å; W195-I263 HydrophobicContact CZ3-CG2 4.3Å; Y230-I263 HydrophobicContact CD1-CD1 3.83Å; Y230-I263 HydrophobicContact CD2-CD1 3.5Å; Y230-I263 VanDerWaalsContact CD2-CD1 3.5Å; Y230-I263 HydrophobicContact CE1-CD1 3.84Å; Y230-I263 HydrophobicContact CE2-CD1 3.51Å; Y230-I263 HydrophobicContact CG-CD1 3.65Å; W252-I263 HydrophobicContact CB-CG1 4.28Å; W252-I263 HydrophobicContact CD2-CD1 3.95Å; W252-I263 HydrophobicContact CD2-CG1 3.57Å; W252-I263 HydrophobicContact CE3-CD1 3.91Å; W252-I263 HydrophobicContact CE3-CG1 3.99Å; W252-I263 HydrophobicContact CG-CG1 3.67Å; W252-I263 HydrophobicContact CH2-CD1 4.45Å; W252-I263 HydrophobicContact CZ2-CD1 4.47Å; W252-I263 HydrophobicContact CZ3-CD1 4.15Å; I263-E265 PolarHBondContact O-N 3.35Å; I263-L266 PolarHBondContact O-N 3.33Å; I263-I267 HydrophobicContact CG2-CG1 4.31Å; I263-I267 WeakPolarHBondContact O-CG1 3.26Å; I263-I267 PolarHBondContact O-N 3.08Å
264	M	94.1	Very high	88.4	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-56.4	-47.9	170.8	-74.9	-60.1	-56.7	0	0	112.5	L143 I186 L189 H190 Q193 W195 T262 I267 D268	L143-M264 HydrophobicContact CB-CE 4.4Å; L143-M264 HydrophobicContact CD1-CB 3.99Å; L143-M264 HydrophobicContact CD1-CE 4.33Å; I186-M264 HydrophobicContact CG2-CB 3.66Å; I186-M264 HydrophobicContact CG2-CG 4.1Å; I186-M264 WeakPolarHBondContact O-CG 3.34Å; L189-M264 HydrophobicContact CB-CG 4Å; L189-M264 HydrophobicContact CB-SD 4.37Å; L189-M264 HydrophobicContact CD2-CE 4.08Å; L189-M264 HydrophobicContact CD2-CG 4.33Å; L189-M264 HydrophobicContact CD2-SD 4.29Å; L189-M264 HydrophobicContact CG-CG 4.36Å; L189-M264 HydrophobicContact CG-SD 4.18Å; H190-M264 HydrophobicContact CB-CG 4.23Å; H190-M264 HydrophobicContact CB-SD 4.16Å; Q193-M264 HydrophobicContact CG-CE 4.2Å; Q193-M264 HydrophobicContact CG-SD 3.45Å; Q193-M264 WeakPolarHBondContact CG-SD 3.46Å; W195-M264 HydrophobicContact CH2-SD 4.26Å; W195-M264 HydrophobicContact CZ2-SD 3.79Å; T262-M264 PolarHBondContact O-N 2.9Å; M264-I267 PolarHBondContact O-N 3.26Å; M264-D268 VanDerWaalsContact O-CB 3.32Å; M264-D268 WeakPolarHBondContact O-CB 3.46Å; M264-D268 PolarHBondContact O-N 2.73Å
265	E	91.2	Very high	88.1	Confident	53 Å²	53	39.9 Å²	39.9	25%	0.248	21%	0.205	C	C	.	.	H	α-helix	trans	-69.6	-33.6	178.8	-73.5	174	143.6	0	0	113.3	F260 E261 T262 I263 H269	F260-E265 HydrophobicContact CB-CB 4.08Å; F260-E265 HydrophobicContact CD1-CB 4.1Å; F260-E265 HydrophobicContact CG-CB 4.47Å; E261-E265 WeakPolarHBondContact CB-OE2 3.02Å; E261-E265 PolarHBondContact N-OE2 2.85Å; E261-E265 VanDerWaalsContact N-OE2 3.08Å; T262-E265 PolarHBondContact N-OE2 2.87Å; T262-E265 PolarHBondContact O-N 3.4Å; T262-E265 WeakPolarHBondContact OG1-CB 3.39Å; T262-E265 VanDerWaalsContact OG1-CG 3.28Å; T262-E265 WeakPolarHBondContact OG1-CG 3.46Å; T262-E265 PolarHBondContact OG1-N 2.85Å; T262-E265 VanDerWaalsContact OG1-N 3.08Å; T262-E265 PolarHBondContact OG1-OE2 3.25Å; I263-E265 PolarHBondContact O-N 3.35Å; E265-H269 WeakPolarHBondContact O-CB 3.23Å; E265-H269 PolarHBondContact O-N 3.08Å
266	L	93.9	Very high	88.2	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-60.4	-50	173	-177.1	154.4	0	0	0	110.2	I245 W252 F260 T262 I263 Y270	I245-L266 HydrophobicContact CD1-CD2 4.04Å; I245-L266 HydrophobicContact CG1-CD1 4.35Å; I245-L266 HydrophobicContact CG1-CD2 4.38Å; I245-L266 HydrophobicContact CG2-CD1 3.81Å; W252-L266 HydrophobicContact CB-CD1 3.99Å; F260-L266 HydrophobicContact CB-CB 4.09Å; F260-L266 HydrophobicContact CD2-CB 3.48Å; F260-L266 VanDerWaalsContact CD2-CB 3.48Å; F260-L266 HydrophobicContact CD2-CD1 3.88Å; F260-L266 HydrophobicContact CD2-CG 3.65Å; F260-L266 HydrophobicContact CE2-CB 4.01Å; F260-L266 HydrophobicContact CE2-CD1 4.31Å; F260-L266 HydrophobicContact CE2-CG 3.83Å; F260-L266 HydrophobicContact CG-CB 3.78Å; F260-L266 HydrophobicContact CG-CG 4.45Å; T262-L266 PolarHBondContact O-N 3.06Å; I263-L266 PolarHBondContact O-N 3.33Å; L266-Y270 HydrophobicContact CD2-CD2 3.83Å; L266-Y270 HydrophobicContact CD2-CE2 4.1Å; L266-Y270 HydrophobicContact CG-CD2 4.1Å; L266-Y270 HydrophobicContact CG-CE2 4.03Å; L266-Y270 WeakPolarHBondContact O-CD2 3.36Å; L266-Y270 PolarHBondContact O-N 2.93Å
267	I	95.7	Very high	89.1	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-69.7	-37.8	179.6	-65.1	-62.9	0	0	0	111.5	W195 F219 V221 L232 I263 M264 Y270 H271 L281	W195-I267 HydrophobicContact CD2-CG2 4.44Å; W195-I267 HydrophobicContact CH2-CB 4.13Å; W195-I267 HydrophobicContact CH2-CG1 3.73Å; W195-I267 HydrophobicContact CH2-CG2 4.36Å; W195-I267 HydrophobicContact CZ2-CB 3.97Å; W195-I267 HydrophobicContact CZ2-CG1 4.06Å; W195-I267 HydrophobicContact CZ2-CG2 3.82Å; W195-I267 HydrophobicContact CZ3-CG1 4.02Å; F219-I267 HydrophobicContact CE2-CD1 4.41Å; F219-I267 HydrophobicContact CE2-CG2 3.82Å; F219-I267 HydrophobicContact CZ-CG2 3.97Å; V221-I267 HydrophobicContact CG2-CD1 3.61Å; V221-I267 HydrophobicContact CG2-CG1 4.11Å; L232-I267 HydrophobicContact CD1-CD1 4.06Å; I263-I267 HydrophobicContact CG2-CG1 4.31Å; I263-I267 WeakPolarHBondContact O-CG1 3.26Å; I263-I267 PolarHBondContact O-N 3.08Å; M264-I267 PolarHBondContact O-N 3.26Å; I267-Y270 PolarHBondContact O-N 3.17Å; I267-H271 PolarHBondContact O-N 3.43Å; I267-H271 PolarHBondContact O-ND1 3Å; I267-L281 HydrophobicContact CD1-CD1 3.83Å; I267-L281 HydrophobicContact CG2-CD1 3.98Å
268	D	93.3	Very high	89.8	Confident	7 Å²	7	36.7 Å²	36.7	4%	0.037	19%	0.187	C	C	.	.	H	α-helix	trans	-56.3	-53.5	172.8	-174.7	67.8	0	0	0	111.2	K53 L143 Q144 M264 Y270 H271 F272	K53-D268 WeakPolarHBondContact CD-OD2 3.27Å; K53-D268 IonicContact NZ-OD2 2.72Å; K53-D268 PolarHBondContact NZ-OD2 3.43Å; L143-D268 VanDerWaalsContact CA-OD1 3.3Å; L143-D268 WeakPolarHBondContact CA-OD1 3.39Å; L143-D268 HydrophobicContact CB-CB 4.41Å; L143-D268 HydrophobicContact CD2-CB 3.86Å; L143-D268 WeakPolarHBondContact CD2-OD2 3.36Å; Q144-D268 PolarHBondContact N-OD1 2.94Å; M264-D268 VanDerWaalsContact O-CB 3.32Å; M264-D268 WeakPolarHBondContact O-CB 3.46Å; M264-D268 PolarHBondContact O-N 2.73Å; D268-Y270 VanDerWaalsContact C-N 3.32Å; D268-Y270 PolarHBondContact O-N 2.82Å; D268-H271 PolarHBondContact O-N 3.39Å; D268-F272 WeakPolarHBondContact O-CD2 3.26Å
269	H	91.5	Very high	90.4	Very high	23 Å²	23	33.2 Å²	33.2	11%	0.106	17%	0.172	C	C	.	.	H	α-helix	trans	-55	-44.7	177.8	168.5	110.9	0	0	0	112.8	Q258 F260 E265 H271 F272 R273 D275	Q258-H269 PolarHBondContact OE1-CE1 3.01Å; Q258-H269 VanDerWaalsContact OE1-CE1 3.23Å; F260-H269 HydrophobicContact CD1-CB 4.38Å; F260-H269 HydrophobicContact CE1-CB 3.33Å; F260-H269 AromaticContact CE1-CG 3.53Å; F260-H269 AromaticContact CE1-ND1 3.72Å; F260-H269 HydrophobicContact CZ-CB 3.57Å; F260-H269 AromaticContact CZ-CD2 3.61Å; F260-H269 AromaticContact CZ-CG 3.41Å; F260-H269 VanDerWaalsContact CZ-CG 3.41Å; F260-H269 AromaticContact CZ-ND1 3.73Å; E265-H269 WeakPolarHBondContact O-CB 3.23Å; E265-H269 PolarHBondContact O-N 3.08Å; H269-H271 PolarHBondContact O-N 3.2Å; H269-F272 PolarHBondContact O-N 2.94Å; H269-R273 PolarHBondContact O-N 3.27Å; H269-D275 IonicContact CE1-OD2 2.7Å; H269-D275 IonicContact NE2-OD2 2.69Å
270	Y	95.1	Very high	91.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-73.7	-6.6	-175.7	-75.9	-59	0	0	0	114.6	I254 F260 L266 I267 D268 R273 Q274 D275 L277 L281	I254-Y270 HydrophobicContact CD1-CE1 4.23Å; I254-Y270 HydrophobicContact CD1-CE2 4.25Å; I254-Y270 VanDerWaalsContact CD1-OH 3.27Å; I254-Y270 WeakPolarHBondContact CD1-OH 3.19Å; I254-Y270 HydrophobicContact CG1-CE2 4.39Å; I254-Y270 WeakPolarHBondContact CG1-OH 3.18Å; I254-Y270 HydrophobicContact CG2-CE2 4.14Å; F260-Y270 HydrophobicContact CE2-CE2 4.05Å; F260-Y270 HydrophobicContact CZ-CE2 4.36Å; L266-Y270 HydrophobicContact CD2-CD2 3.83Å; L266-Y270 HydrophobicContact CD2-CE2 4.1Å; L266-Y270 HydrophobicContact CG-CD2 4.1Å; L266-Y270 HydrophobicContact CG-CE2 4.03Å; L266-Y270 WeakPolarHBondContact O-CD2 3.36Å; L266-Y270 PolarHBondContact O-N 2.93Å; I267-Y270 PolarHBondContact O-N 3.17Å; D268-Y270 VanDerWaalsContact C-N 3.32Å; D268-Y270 PolarHBondContact O-N 2.82Å; Y270-R273 CarbonylContact C-O 3.57Å; Y270-R273 WeakPolarHBondContact CA-O 3.41Å; Y270-Q274 WeakPolarHBondContact CD1-O 3.33Å; Y270-Q274 WeakPolarHBondContact CE1-O 3.43Å; Y270-D275 HydrophobicContact CE1-CB 3.98Å; Y270-D275 WeakPolarHBondContact CE1-O 3.37Å; Y270-D275 PolarHBondContact OH-O 3.18Å; Y270-L277 HydrophobicContact CD1-CD1 3.39Å; Y270-L277 HydrophobicContact CD1-CG 3.72Å; Y270-L277 HydrophobicContact CD2-CD1 4.29Å; Y270-L277 HydrophobicContact CE1-CD1 4.11Å; Y270-L277 HydrophobicContact CE1-CG 3.94Å; Y270-L277 HydrophobicContact CG-CD1 3.53Å; Y270-L277 HydrophobicContact CG-CG 4.25Å; Y270-L281 PolarHBondContact O-N 3.07Å
271	H	94.2	Very high	91.7	Very high	10 Å²	10	33.3 Å²	33.3	5%	0.046	17%	0.174	C	C	.	.	H	α-helix	trans	-76.7	-28.4	162.8	-72.4	79.3	0	0	0	112.7	T55 Q144 F219 I267 D268 H269 L281	T55-H271 HydrophobicContact CG2-CB 4.16Å; Q144-H271 HydrophobicContact CG-CB 4.06Å; F219-H271 AromaticContact CE1-CE1 3.66Å; F219-H271 AromaticContact CE1-NE2 3.41Å; F219-H271 WeakPolarHBondContact CE1-NE2 3.45Å; F219-H271 AromaticContact CZ-CE1 3.48Å; F219-H271 VanDerWaalsContact CZ-CE1 3.48Å; F219-H271 WeakPolarHBondContact CZ-CE1 3.44Å; F219-H271 AromaticContact CZ-NE2 3.67Å; I267-H271 PolarHBondContact O-N 3.43Å; I267-H271 PolarHBondContact O-ND1 3Å; D268-H271 PolarHBondContact O-N 3.39Å; H269-H271 PolarHBondContact O-N 3.2Å; H271-L281 WeakPolarHBondContact CA-O 3.27Å; H271-L281 PolarHBondContact CD2-O 2.86Å
272	F	91.1	Very high	92.3	Very high	23 Å²	23	36 Å²	36	10%	0.101	19%	0.186	C	C	.	.	H	α-helix	trans	-92.9	-36	-178.6	-64.6	-82.2	0	0	0	113	K53 I54 T55 V79 D268 H269 K280	K53-F272 HydrophobicContact CB-CZ 4Å; K53-F272 HydrophobicContact CD-CE2 4.46Å; I54-F272 WeakPolarHBondContact O-CE1 3.29Å; T55-F272 HydrophobicContact CG2-CD1 4.23Å; T55-F272 HydrophobicContact CG2-CE1 4.03Å; T55-F272 HydrophobicContact CG2-CZ 4.34Å; V79-F272 HydrophobicContact CB-CB 4.46Å; V79-F272 HydrophobicContact CG1-CB 3.88Å; V79-F272 HydrophobicContact CG2-CB 3.93Å; V79-F272 HydrophobicContact CG2-CD1 4.03Å; V79-F272 HydrophobicContact CG2-CG 4.31Å; D268-F272 WeakPolarHBondContact O-CD2 3.26Å; H269-F272 PolarHBondContact O-N 2.94Å; F272-K280 WeakPolarHBondContact O-CE 3.38Å
273	R	89.2	Confident	92.5	Very high	94 Å²	94	38.8 Å²	38.8	36%	0.355	20%	0.198	S	C	.	.			trans	-128.5	152.8	-171.1	-60.6	-177.7	61.5	90.7	14.2	110.6	V79 H269 Y270 D275	V79-R273 VanDerWaalsContact CG1-CD 3.47Å; V79-R273 HydrophobicContact CG1-CG 3.49Å; V79-R273 VanDerWaalsContact CG1-CG 3.49Å; H269-R273 PolarHBondContact O-N 3.27Å; Y270-R273 CarbonylContact C-O 3.57Å; Y270-R273 WeakPolarHBondContact CA-O 3.41Å; R273-D275 HydrophobicContact CB-CB 4.48Å; R273-D275 IonicContact CZ-OD1 3.55Å; R273-D275 IonicContact CZ-OD2 2.7Å; R273-D275 VanDerWaalsContact NE-CG 3.32Å; R273-D275 IonicContact NE-OD1 3.21Å; R273-D275 PolarHBondContact NE-OD1 3.38Å; R273-D275 IonicContact NE-OD2 2.68Å; R273-D275 PolarHBondContact NE-OD2 3.36Å; R273-D275 VanDerWaalsContact NH2-CG 3.35Å; R273-D275 IonicContact NH2-OD1 3.58Å; R273-D275 PolarHBondContact NH2-OD1 2.82Å; R273-D275 IonicContact NH2-OD2 3.52Å; R273-D275 PolarHBondContact NH2-OD2 2.84Å
274	Q	89.4	Confident	92.5	Very high	114 Å²	114	41.3 Å²	41.3	53%	0.533	22%	0.215	S	C	.	.			trans	-91.4	-42.9	176.3	73.1	-171.5	11.6	0	0	112.1	Y270 G276 L277	Y270-Q274 WeakPolarHBondContact CD1-O 3.33Å; Y270-Q274 WeakPolarHBondContact CE1-O 3.43Å; Q274-G276 VanDerWaalsContact C-N 3.29Å; Q274-G276 PolarHBondContact O-N 2.92Å; Q274-L277 VanDerWaalsContact O-CB 3.29Å; Q274-L277 WeakPolarHBondContact O-CB 3.48Å; Q274-L277 WeakPolarHBondContact O-CG 3.47Å; Q274-L277 PolarHBondContact O-N 2.97Å
275	D	85.7	Confident	92.6	Very high	56 Å²	56	41.2 Å²	41.2	30%	0.299	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	30	53.6	168.3	-66.5	24.2	0	0	0	116.3	H269 Y270 R273	H269-D275 IonicContact CE1-OD2 2.7Å; H269-D275 IonicContact NE2-OD2 2.69Å; Y270-D275 HydrophobicContact CE1-CB 3.98Å; Y270-D275 WeakPolarHBondContact CE1-O 3.37Å; Y270-D275 PolarHBondContact OH-O 3.18Å; R273-D275 HydrophobicContact CB-CB 4.48Å; R273-D275 IonicContact CZ-OD1 3.55Å; R273-D275 IonicContact CZ-OD2 2.7Å; R273-D275 VanDerWaalsContact NE-CG 3.32Å; R273-D275 IonicContact NE-OD1 3.21Å; R273-D275 PolarHBondContact NE-OD1 3.38Å; R273-D275 IonicContact NE-OD2 2.68Å; R273-D275 PolarHBondContact NE-OD2 3.36Å; R273-D275 VanDerWaalsContact NH2-CG 3.35Å; R273-D275 IonicContact NH2-OD1 3.58Å; R273-D275 PolarHBondContact NH2-OD1 2.82Å; R273-D275 IonicContact NH2-OD2 3.52Å; R273-D275 PolarHBondContact NH2-OD2 2.84Å
276	G	86.8	Confident	92.7	Very high	61 Å²	61	40.1 Å²	40.1	63%	0.629	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	115.1	-22.3	179.9	0	0	0	0	0	114.8	Q274	Q274-G276 VanDerWaalsContact C-N 3.29Å; Q274-G276 PolarHBondContact O-N 2.92Å
277	L	93.1	Very high	92.4	Very high	9 Å²	9	42.5 Å²	42.5	5%	0.047	23%	0.226	C	C	.	.	S	Bend	trans	-80.2	154.1	172.3	-53	-177.3	0	0	0	111.8	L232 L234 Y243 I254 Y270 Q274 C279 L281	L232-L277 HydrophobicContact CD2-CD1 3.97Å; L232-L277 HydrophobicContact CD2-CD2 3.87Å; L234-L277 HydrophobicContact CD2-CB 4.14Å; L234-L277 HydrophobicContact CD2-CD1 4.07Å; L234-L277 HydrophobicContact CD2-CD2 4.48Å; L234-L277 HydrophobicContact CD2-CG 4.47Å; Y243-L277 HydrophobicContact CD1-CD2 3.67Å; Y243-L277 HydrophobicContact CD2-CD2 3.59Å; Y243-L277 HydrophobicContact CE1-CD2 3.75Å; Y243-L277 HydrophobicContact CE2-CD2 3.68Å; Y243-L277 HydrophobicContact CG-CD2 3.59Å; I254-L277 HydrophobicContact CD1-CD2 3.76Å; I254-L277 HydrophobicContact CD1-CG 4.29Å; Y270-L277 HydrophobicContact CD1-CD1 3.39Å; Y270-L277 HydrophobicContact CD1-CG 3.72Å; Y270-L277 HydrophobicContact CD2-CD1 4.29Å; Y270-L277 HydrophobicContact CE1-CD1 4.11Å; Y270-L277 HydrophobicContact CE1-CG 3.94Å; Y270-L277 HydrophobicContact CG-CD1 3.53Å; Y270-L277 HydrophobicContact CG-CG 4.25Å; Q274-L277 VanDerWaalsContact O-CB 3.29Å; Q274-L277 WeakPolarHBondContact O-CB 3.48Å; Q274-L277 WeakPolarHBondContact O-CG 3.47Å; Q274-L277 PolarHBondContact O-N 2.97Å; L277-C279 VanDerWaalsContact C-N 3.33Å; L277-C279 VanDerWaalsContact CB-O 3.26Å; L277-C279 WeakPolarHBondContact CB-O 3.33Å; L277-L281 HydrophobicContact CD1-CD2 4.09Å; L277-L281 HydrophobicContact CD1-CG 4.4Å
278	L	93.7	Very high	91.4	Very high	99 Å²	99	47 Å²	47	52%	0.518	26%	0.257	S	S	.	.	S	Bend	trans	-74	-22.2	176.5	-76.4	162.4	0	0	0	113.3	S236 K241 Y243	S236-L278 WeakPolarHBondContact OG-CB 3.45Å; K241-L278 HydrophobicContact CD-CD1 4.06Å; K241-L278 HydrophobicContact CG-CD1 3.9Å; Y243-L278 WeakPolarHBondContact OH-CG 3.27Å; Y243-L278 PolarHBondContact OH-N 3.3Å
279	C	94.2	Very high	90.6	Very high	19 Å²	19	50.7 Å²	50.7	13%	0.128	28%	0.278	C	S	.	.	S	Bend	trans	-151.3	168.8	169.1	67.3	0	0	0	0	110	L277	L277-C279 VanDerWaalsContact C-N 3.33Å; L277-C279 VanDerWaalsContact CB-O 3.26Å; L277-C279 WeakPolarHBondContact CB-O 3.33Å
280	K	94.8	Very high	89.4	Confident	57 Å²	57	51.8 Å²	51.8	25%	0.248	28%	0.282	C	S	.	.			trans	-65.1	158.7	168.8	-57.8	179.3	-176.5	-179.1	0	110.9	E57 G217 F272	E57-K280 IonicContact OE1-NZ 3.74Å; E57-K280 PolarHBondContact OE1-NZ 2.96Å; E57-K280 IonicContact OE2-NZ 2.75Å; G217-K280 WeakPolarHBondContact CA-O 3.43Å; F272-K280 WeakPolarHBondContact O-CE 3.38Å
281	L	96.2	Very high	87.2	Confident	3 Å²	3	58 Å²	58	2%	0.016	32%	0.32	C	S	.	.			trans	-73	137.5	161.7	-52.1	-175	0	0	0	109.6	F219 L232 L234 I267 Y270 H271 L277	F219-L281 HydrophobicContact CB-CD2 3.83Å; F219-L281 HydrophobicContact CD1-CB 3.82Å; F219-L281 HydrophobicContact CD1-CD1 4.41Å; F219-L281 HydrophobicContact CD1-CD2 4.15Å; F219-L281 HydrophobicContact CD1-CG 4.33Å; F219-L281 HydrophobicContact CD2-CD1 4.07Å; F219-L281 HydrophobicContact CD2-CD2 4.33Å; F219-L281 HydrophobicContact CE1-CB 3.93Å; F219-L281 HydrophobicContact CE1-CD1 4.41Å; F219-L281 HydrophobicContact CE2-CD1 4.08Å; F219-L281 HydrophobicContact CG-CB 4.34Å; F219-L281 HydrophobicContact CG-CD1 4.25Å; F219-L281 HydrophobicContact CG-CD2 3.84Å; F219-L281 HydrophobicContact CG-CG 4.35Å; F219-L281 HydrophobicContact CZ-CD1 4.26Å; L232-L281 HydrophobicContact CD1-CD1 4.47Å; L232-L281 HydrophobicContact CD1-CD2 4.06Å; L232-L281 HydrophobicContact CD2-CD2 4.22Å; L234-L281 HydrophobicContact CD1-CD2 3.78Å; L234-L281 HydrophobicContact CD2-CD2 4.05Å; L234-L281 HydrophobicContact CG-CD2 4.38Å; I267-L281 HydrophobicContact CD1-CD1 3.83Å; I267-L281 HydrophobicContact CG2-CD1 3.98Å; Y270-L281 PolarHBondContact O-N 3.07Å; H271-L281 WeakPolarHBondContact CA-O 3.27Å; H271-L281 PolarHBondContact CD2-O 2.86Å; L277-L281 HydrophobicContact CD1-CD2 4.09Å; L277-L281 HydrophobicContact CD1-CG 4.4Å
282	Q	93.1	Very high	84.3	Confident	123 Å²	123	62 Å²	62	58%	0.575	35%	0.348	S	S	*	.			trans	-134	-50.2	-179.6	-62.1	-172.4	3.1	0	0	112.2	G217	G217-Q282 PolarHBondContact O-N 3.13Å
283	K	92.3	Very high	81.2	Confident	60 Å²	60	66.4 Å²	66.4	26%	0.261	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	106.7	-172.3	-177.9	-179.4	171	-171.2	0	111.1	E212 G217 A218 F219 I285	E212-K283 VanDerWaalsContact OE2-CE 3.31Å; E212-K283 WeakPolarHBondContact OE2-CE 3.45Å; E212-K283 IonicContact OE2-NZ 2.82Å; E212-K283 PolarHBondContact OE2-NZ 3.21Å; G217-K283 PolarHBondContact O-N 3.42Å; A218-K283 CarbonylContact C-O 3.35Å; A218-K283 VanDerWaalsContact CA-O 3.27Å; A218-K283 WeakPolarHBondContact CA-O 3.49Å; A218-K283 HydrophobicContact CB-CB 4.48Å; F219-K283 WeakPolarHBondContact CD1-O 3.36Å; F219-K283 PolarHBondContact N-O 3.43Å; K283-I285 HydrophobicContact CG-CD1 4.42Å; K283-I285 PolarHBondContact O-N 2.74Å
284	P	95.1	Very high	78.2	Confident	54 Å²	54	69.8 Å²	69.8	35%	0.351	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	127.8	171.8	27.2	-32.5	0	0	0	110	W195 F219 P286	W195-P284 HydrophobicContact CB-CB 3.83Å; W195-P284 HydrophobicContact CG-CB 4.31Å; F219-P284 HydrophobicContact CE1-CB 3.82Å; F219-P284 HydrophobicContact CE1-CG 4.5Å; F219-P284 HydrophobicContact CZ-CB 3.81Å; P284-P286 WeakPolarHBondContact O-CD 3.49Å
285	I	95.9	Very high	75.1	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-81.3	117	170.5	-58	-40.1	0	0	0	108.3	H197 R208 L209 E212 A218 F219 L220 K283 F290	H197-I285 WeakPolarHBondContact CE1-CG2 3.34Å; H197-I285 CovalentContact NE2-O 1.77Å; H197-I285 PolarHBondContact NE2-O 2.87Å; R208-I285 HydrophobicContact CB-CG2 4.47Å; L209-I285 HydrophobicContact CD2-CG1 3.88Å; E212-I285 HydrophobicContact CB-CD1 3.76Å; E212-I285 HydrophobicContact CG-CD1 3.78Å; E212-I285 HydrophobicContact CG-CG2 4.36Å; A218-I285 HydrophobicContact CB-CD1 3.89Å; A218-I285 HydrophobicContact CB-CG1 4.42Å; F219-I285 PolarHBondContact O-N 2.71Å; L220-I285 HydrophobicContact CB-CB 4.44Å; K283-I285 HydrophobicContact CG-CD1 4.42Å; K283-I285 PolarHBondContact O-N 2.74Å; I285-F290 HydrophobicContact CG2-CE2 3.63Å; I285-F290 HydrophobicContact CG2-CZ 4.21Å
286	P	92.9	Very high	72.2	Confident	29 Å²	29	70.2 Å²	70.2	19%	0.188	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-84.7	139.5	-172.1	34.4	-35.9	0	0	0	112.6	P194 P284 S288 N289 F290	P194-P286 HydrophobicContact CB-CB 4.03Å; P194-P286 CarbonylContact O-C 3.05Å; P194-P286 VanDerWaalsContact O-CA 3.29Å; P194-P286 WeakPolarHBondContact O-CA 3.23Å; P284-P286 WeakPolarHBondContact O-CD 3.49Å; P286-S288 PolarHBondContact O-N 3.4Å; P286-N289 HydrophobicContact CG-CB 4.46Å; P286-N289 PolarHBondContact O-N 3.04Å; P286-F290 WeakPolarHBondContact O-CD2 3.38Å
287	V	86.9	Confident	69.1	Low	51 Å²	51	73.9 Å²	73.9	31%	0.309	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-57.5	-31.6	174.7	169.9	0	0	0	0	112.7	P194 Y196 H197 N289 F290	P194-V287 WeakPolarHBondContact O-CG2 3.16Å; P194-V287 PolarHBondContact O-N 2.84Å; Y196-V287 WeakPolarHBondContact O-CG2 3.42Å; H197-V287 HydrophobicContact CB-CG2 4.22Å; H197-V287 VanDerWaalsContact CD2-CG2 3.42Å; H197-V287 WeakPolarHBondContact CD2-CG2 3.32Å; H197-V287 PolarHBondContact NE2-N 2.97Å; V287-N289 PolarHBondContact O-N 2.79Å; V287-N289 VanDerWaalsContact O-N 3.11Å; V287-F290 PolarHBondContact O-N 3.13Å
288	S	75.9	Confident	65.8	Low	94 Å²	94	76.3 Å²	76.3	66%	0.657	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-57.2	-25.5	-179.6	52.9	0	0	0	0	114.2	P286 F290	P286-S288 PolarHBondContact O-N 3.4Å; S288-F290 PolarHBondContact O-N 3.08Å
289	N	75.2	Confident	62.5	Low	86 Å²	86	75.7 Å²	75.7	46%	0.46	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-76	-6.9	178.9	-64.9	11.4	0	0	0	112.1	E212 P286 V287	E212-N289 PolarHBondContact OE1-ND2 3.03Å; P286-N289 HydrophobicContact CG-CB 4.46Å; P286-N289 PolarHBondContact O-N 3.04Å; V287-N289 PolarHBondContact O-N 2.79Å; V287-N289 VanDerWaalsContact O-N 3.11Å
290	F	66.4	Low	59.1	Low	46 Å²	46	81.5 Å²	81.5	20%	0.202	52%	0.515	C	S	.	.			trans	-135.8	74.3	-171.4	-50.9	-76.1	0	0	0	112	H197 R208 S211 I285 P286 V287 S288	H197-F290 AromaticContact CE1-CD2 3.17Å; H197-F290 WeakPolarHBondContact CE1-CD2 3.32Å; H197-F290 AromaticContact CE1-CE2 3.21Å; H197-F290 WeakPolarHBondContact CE1-CE2 3.41Å; R208-F290 HydrophobicContact CB-CD2 4.48Å; R208-F290 HydrophobicContact CB-CE1 4.15Å; R208-F290 HydrophobicContact CB-CE2 4Å; R208-F290 HydrophobicContact CB-CZ 3.81Å; R208-F290 HydrophobicContact CG-CD1 3.74Å; R208-F290 HydrophobicContact CG-CD2 3.96Å; R208-F290 HydrophobicContact CG-CE1 3.71Å; R208-F290 HydrophobicContact CG-CE2 3.94Å; R208-F290 HydrophobicContact CG-CG 3.86Å; R208-F290 HydrophobicContact CG-CZ 3.8Å; R208-F290 VanDerWaalsContact CZ-CB 3.49Å; S211-F290 WeakPolarHBondContact OG-CE1 3.31Å; S211-F290 WeakPolarHBondContact OG-CZ 3.5Å; I285-F290 HydrophobicContact CG2-CE2 3.63Å; I285-F290 HydrophobicContact CG2-CZ 4.21Å; P286-F290 WeakPolarHBondContact O-CD2 3.38Å; V287-F290 PolarHBondContact O-N 3.13Å; S288-F290 PolarHBondContact O-N 3.08Å
291	T	49.6	Very low	55.7	Low	130 Å²	130	83.6 Å²	83.6	80%	0.798	54%	0.538	S	S	*	.			trans	-60.1	137.8	169.7	46.1	0	0	0	0	110.8	S293	T291-S293 PolarHBondContact O-N 3.16Å; T291-S293 VanDerWaalsContact O-N 3.17Å
292	C	32.9	Very low	52.3	Low	94 Å²	94	92.6 Å²	92.6	64%	0.635	58%	0.577	S	S	*	*			trans	-78.1	105.9	-176.6	-162.7	0	0	0	0	110.3	F294	C292-F294 PolarHBondContact O-N 3.46Å
293	S	25.2	Very low	49	Very low	115 Å²	115	92.8 Å²	92.8	80%	0.804	58%	0.58	S	S	*	*			trans	-74.6	65.7	177.6	41.4	0	0	0	0	112	T291 S295	T291-S293 PolarHBondContact O-N 3.16Å; T291-S293 VanDerWaalsContact O-N 3.17Å; S293-S295 PolarHBondContact O-N 3.39Å
294	F	26.1	Very low	45.7	Very low	165 Å²	165	95.5 Å²	95.5	72%	0.724	60%	0.602	S	S	*	*			trans	-69.1	102.4	172.1	-118.8	-86.2	0	0	0	110.1	C292 G296	C292-F294 PolarHBondContact O-N 3.46Å; F294-G296 PolarHBondContact O-N 2.97Å
295	S	24.9	Very low	42.3	Very low	133 Å²	133	97 Å²	97	93%	0.93	61%	0.61	S	S	*	*			trans	-74.3	55.2	168.9	44.7	0	0	0	0	111.4	S293	S293-S295 PolarHBondContact O-N 3.39Å
296	G	24.9	Very low	39	Very low	47 Å²	47	104.4 Å²	104.4	49%	0.485	65%	0.648	S	S	.	*	S	Bend	trans	-132.9	123.4	175.4	0	0	0	0	0	109.9	F294 G298	F294-G296 PolarHBondContact O-N 2.97Å; G296-G298 PolarHBondContact O-N 2.71Å
297	S	23	Very low	35.8	Very low	138 Å²	138	109.6 Å²	109.6	97%	0.965	67%	0.674	S	S	*	*	S	Bend	trans	-71.7	90.8	-174.5	53.7	0	0	0	0	112.4
298	G	23.5	Very low	32.8	Very low	59 Å²	59	112.2 Å²	112.2	61%	0.608	69%	0.687	S	S	*	*	S	Bend	trans	-164.5	117.9	172.5	0	0	0	0	0	109.6	G296 I300	G296-G298 PolarHBondContact O-N 2.71Å; G298-I300 PolarHBondContact O-N 3.46Å
299	G	23.1	Very low	30.5	Very low	86 Å²	86	113.6 Å²	113.6	89%	0.887	68%	0.681	S	S	*	*			trans	-59.8	130.8	-161	0	0	0	0	0	115.5
300	I	23	Very low	28	Very low	141 Å²	141	118.7 Å²	118.7	72%	0.723	70%	0.699	S	S	*	*			trans	-101.5	105.9	169.7	-57.6	175.7	0	0	0	108.5	G298	G298-I300 PolarHBondContact O-N 3.46Å
301	S	24.6	Very low	26	Very low	102 Å²	102	120.6 Å²	120.6	71%	0.713	71%	0.71	S	S	*	*			trans	-73.1	149	164.8	-65.3	0	0	0	0	110.2	I303	S301-I303 PolarHBondContact O-N 2.73Å
302	K	24.7	Very low	24.6	Very low	192 Å²	192	119.6 Å²	119.6	84%	0.835	71%	0.706	S	S	*	*			trans	-58.4	119.8	172.7	-72.4	-179.7	176	179.6	0	110.2	T304	K302-T304 HydrophobicContact CB-CG2 4.3Å
303	I	23	Very low	24.2	Very low	126 Å²	126	121.9 Å²	121.9	65%	0.646	71%	0.711	S	S	*	*			trans	-86	110.3	164.8	-59.7	176.9	0	0	0	107.2	S301	S301-I303 PolarHBondContact O-N 2.73Å
304	T	22.7	Very low	24.1	Very low	118 Å²	118	123.4 Å²	123.4	72%	0.724	71%	0.708	S	S	*	*			trans	-137.5	41.4	179.5	53.6	0	0	0	0	111.5	K302	K302-T304 HydrophobicContact CB-CG2 4.3Å
305	T	23.7	Very low	24	Very low	86 Å²	86	120 Å²	120	53%	0.528	71%	0.705	S	S	.	*	S	Bend	trans	-146.2	152	176.8	30.8	0	0	0	0	109.6
306	I	27.2	Very low	24	Very low	155 Å²	155	120.1 Å²	120.1	80%	0.795	70%	0.695	S	S	*	*	S	Bend	trans	-80.2	-19.8	-176.2	-72.1	171.9	0	0	0	111.9	D308 F309	I306-D308 VanDerWaalsContact C-N 3.29Å; I306-D308 PolarHBondContact O-N 3.01Å; I306-F309 PolarHBondContact O-N 3.18Å
307	D	25.6	Very low	24	Very low	137 Å²	137	126.8 Å²	126.8	73%	0.733	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-16.4	-168	-54	-82.9	0	0	0	115.9	F309	D307-F309 VanDerWaalsContact C-N 3.32Å; D307-F309 PolarHBondContact O-N 3.49Å
308	D	24.3	Very low	24	Very low	106 Å²	106	127.7 Å²	127.7	57%	0.567	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-10.2	-179.2	-75.9	-44.4	0	0	0	113.9	I306 K310	I306-D308 VanDerWaalsContact C-N 3.29Å; I306-D308 PolarHBondContact O-N 3.01Å; D308-K310 PolarHBondContact O-N 2.83Å
309	F	26.7	Very low	24.3	Very low	124 Å²	124	133.5 Å²	133.5	54%	0.544	72%	0.716	S	S	.	*			trans	-77.4	55.2	177.5	-93.3	-80.1	0	0	0	113.6	L192 I306 D307 I311	L192-F309 HydrophobicContact CD2-CB 4.37Å; L192-F309 HydrophobicContact CD2-CD1 3.57Å; L192-F309 HydrophobicContact CD2-CD2 3.86Å; L192-F309 HydrophobicContact CD2-CE1 3.69Å; L192-F309 HydrophobicContact CD2-CE2 3.96Å; L192-F309 HydrophobicContact CD2-CG 3.66Å; L192-F309 HydrophobicContact CD2-CZ 3.88Å; I306-F309 PolarHBondContact O-N 3.18Å; D307-F309 VanDerWaalsContact C-N 3.32Å; D307-F309 PolarHBondContact O-N 3.49Å; F309-I311 VanDerWaalsContact C-N 3.3Å; F309-I311 PolarHBondContact O-N 3.15Å
310	K	23.1	Very low	24.3	Very low	193 Å²	193	138.3 Å²	138.3	84%	0.839	72%	0.716	S	S	*	*			trans	-68.3	91.4	158	-111.9	-179.5	-179.5	172.7	0	108.8	D308 P312	D308-K310 PolarHBondContact O-N 2.83Å; K310-P312 VanDerWaalsContact O-CD 3.32Å; K310-P312 WeakPolarHBondContact O-CD 3.06Å; K310-P312 VanDerWaalsContact O-N 3.12Å
311	I	24.1	Very low	24.3	Very low	85 Å²	85	142.7 Å²	142.7	44%	0.436	73%	0.725	S	S	.	*			trans	-51.6	119	172.5	-60.7	175.8	0	0	0	108.1	D188 F309 I313	D188-I311 HydrophobicContact CB-CD1 4.4Å; F309-I311 VanDerWaalsContact C-N 3.3Å; F309-I311 PolarHBondContact O-N 3.15Å; I311-I313 VanDerWaalsContact C-N 3.34Å; I311-I313 PolarHBondContact O-N 3.46Å
312	P	21.2	Very low	24.4	Very low	110 Å²	110	146 Å²	146	71%	0.714	73%	0.726	S	S	*	*			trans	-71.2	96.5	172.5	28.9	-31.9	0	0	0	107.6	K310 I314	K310-P312 VanDerWaalsContact O-CD 3.32Å; K310-P312 WeakPolarHBondContact O-CD 3.06Å; K310-P312 VanDerWaalsContact O-N 3.12Å; P312-I314 PolarHBondContact O-N 2.83Å; P312-I314 VanDerWaalsContact O-N 3.07Å
313	I	23.6	Very low	24.4	Very low	142 Å²	142	142.7 Å²	142.7	73%	0.728	72%	0.724	S	S	*	*			trans	-53.5	118.1	166	-58.9	175	0	0	0	106.2	I311 S315	I311-I313 VanDerWaalsContact C-N 3.34Å; I311-I313 PolarHBondContact O-N 3.46Å; I313-S315 PolarHBondContact O-N 2.75Å
314	I	24.3	Very low	24.6	Very low	146 Å²	146	145 Å²	145	75%	0.749	73%	0.732	S	S	*	*			trans	-74.5	74.5	176.3	-56.2	179.8	0	0	0	107.8	P312 D316	P312-I314 PolarHBondContact O-N 2.83Å; P312-I314 VanDerWaalsContact O-N 3.07Å; I314-D316 HydrophobicContact CG2-CB 4.45Å; I314-D316 PolarHBondContact O-N 3.48Å
315	S	23.2	Very low	24.7	Very low	93 Å²	93	145.6 Å²	145.6	65%	0.65	74%	0.736	S	S	*	*			trans	-86.8	64.4	170.9	62.9	0	0	0	0	109.2	I313 K317	I313-S315 PolarHBondContact O-N 2.75Å; S315-K317 PolarHBondContact O-N 3.48Å
316	D	25.1	Very low	24.6	Very low	137 Å²	137	149.9 Å²	149.9	73%	0.733	75%	0.752	S	S	*	*			trans	-68.4	77.4	170.6	-90.3	-29.7	0	0	0	109.8	I314	I314-D316 HydrophobicContact CG2-CB 4.45Å; I314-D316 PolarHBondContact O-N 3.48Å
317	K	23.6	Very low	24.7	Very low	187 Å²	187	148.8 Å²	148.8	81%	0.813	75%	0.753	S	S	*	*			trans	-104.6	122.9	158.7	-73.4	-163.5	172.7	-166.9	0	108.2	S315	S315-K317 PolarHBondContact O-N 3.48Å
318	N	25	Very low	24.7	Very low	156 Å²	156	146.7 Å²	146.7	83%	0.834	75%	0.749	S	S	*	*			trans	68.5	78	169.7	-53.9	-16.5	0	0	0	116.8
319	Q	27.8	Very low	25	Very low	182 Å²	182	148.8 Å²	148.8	85%	0.85	76%	0.76	S	S	*	*			trans	-117.3	131.1	135.5	-71.1	-161.3	-0	0	0	109.8	Y321	Q319-Y321 PolarHBondContact O-N 2.91Å
320	Q	24.2	Very low	25.1	Very low	187 Å²	187	149.2 Å²	149.2	87%	0.874	77%	0.768	S	S	*	*			trans	-80.1	110.9	-176.6	-70.4	178.8	-32.2	0	0	110.6	K322	Q320-K322 PolarHBondContact O-N 3.13Å; Q320-K322 VanDerWaalsContact O-N 3.14Å
321	Y	23.6	Very low	25.3	Very low	233 Å²	233	152.6 Å²	152.6	91%	0.914	78%	0.776	S	S	*	*			trans	-71.8	104	160.1	-100.5	-93.7	0	0	0	109.4	Q319	Q319-Y321 PolarHBondContact O-N 2.91Å
322	K	25.5	Very low	25.4	Very low	171 Å²	171	156.5 Å²	156.5	74%	0.743	80%	0.798	S	S	*	*			trans	-101.6	112	173.4	-163.2	-178.6	-173.4	-174	0	108.2	Q320 Q324	Q320-K322 PolarHBondContact O-N 3.13Å; Q320-K322 VanDerWaalsContact O-N 3.14Å; K322-Q324 PolarHBondContact O-N 2.82Å
323	P	25.3	Very low	25.7	Very low	122 Å²	122	154.8 Å²	154.8	79%	0.792	80%	0.799	S	S	*	*			trans	-74.4	127.7	-179.5	29.5	-33	0	0	0	110.2
324	Q	27.3	Very low	26	Very low	176 Å²	176	152.4 Å²	152.4	82%	0.822	80%	0.795	S	S	*	*			trans	-135.4	120.8	159.9	-72.4	-163.6	-80.8	0	0	109.7	K322	K322-Q324 PolarHBondContact O-N 2.82Å
325	T	24.1	Very low	26.3	Very low	130 Å²	130	153.6 Å²	153.6	80%	0.798	80%	0.798	S	S	*	*			trans	-104.8	146.4	170.1	40.4	0	0	0	0	109.3
326	M	22.8	Very low	26.7	Very low	176 Å²	176	154.7 Å²	154.7	87%	0.867	81%	0.805	S	S	*	*			trans	68	151.4	175.4	-33.7	-168.2	80.1	0	0	114.3
327	T	29.2	Very low	26.7	Very low	131 Å²	131	156 Å²	156	80%	0.804	81%	0.811	S	S	*	*			cis	-129	172.5	7.2	42.5	0	0	0	0	112.2
328	S	24.6	Very low	27.3	Very low	94 Å²	94	151.7 Å²	151.7	66%	0.657	80%	0.803	S	S	*	*			trans	-77.2	149.4	-176.7	52.1	0	0	0	0	115.7
329	N	31.3	Very low	27.4	Very low	149 Å²	149	149 Å²	149	80%	0.797	80%	0.796	S	S	*	*			trans	-150.8	106	135.9	-95	-40.9	0	0	0	108.2
330	N	29.4	Very low	27.4	Very low	134 Å²	134	147 Å²	147	72%	0.717	79%	0.791	S	S	*	*				67.3	77.4	92	-82.3	-13.9	0	0	0	114.5
331	W	26.6	Very low	27.7	Very low	263 Å²	263	144.9 Å²	144.9	100%	0.996	79%	0.785	S	S	*	*			trans	-126.3	110.3	143.9	-106.8	59.5	0	0	0	107.4
332	N	26.2	Very low	27.9	Very low	168 Å²	168	137.9 Å²	137.9	90%	0.898	77%	0.77	S	S	*	*			trans	-151	115.3	174.4	-145	9	0	0	0	108.5
333	G	28.1	Very low	28	Very low	73 Å²	73	137.3 Å²	137.3	75%	0.753	77%	0.774	S	S	*	*			trans	-110.4	125.2	175.1	0	0	0	0	0	109.9
334	S	28.7	Very low	28.7	Very low	92 Å²	92	137 Å²	137	64%	0.643	77%	0.772	S	S	*	*			trans	-62.4	162.2	164	46.8	0	0	0	0	110.2
335	H	31.1	Very low	28.7	Very low	171 Å²	171	134.9 Å²	134.9	79%	0.792	77%	0.77	S	S	*	*			cis	-144.8	168.8	28.3	-61.8	-105.6	0	0	0	109.3
336	S	31.5	Very low	28.9	Very low	117 Å²	117	135 Å²	135	82%	0.818	77%	0.771	S	S	*	*			cis	-154.2	154.2	2.2	18.3	0	0	0	0	110.8
337	L	24.4	Very low	29.1	Very low	164 Å²	164	130.1 Å²	130.1	86%	0.859	77%	0.766	S	S	*	*			trans	-109.3	-177.7	176.4	-92.4	170.1	0	0	0	109.8
338	P	36.5	Very low	29.2	Very low	97 Å²	97	130.9 Å²	130.9	63%	0.63	77%	0.77	S	S	*	*			cis	-137	-174.8	-12.7	31.3	-9.9	0	0	0	115.3
339	S	26.9	Very low	29.2	Very low	99 Å²	99	133.6 Å²	133.6	69%	0.692	78%	0.777	S	S	*	*			trans	76.3	154.1	140.9	73.4	0	0	0	0	119.7
340	L	29	Very low	29.5	Very low	141 Å²	141	130.6 Å²	130.6	74%	0.738	77%	0.766	S	S	*	*			cis	-137.5	161.6	6.5	-110.1	118.8	0	0	0	112.1
341	N	29	Very low	29.5	Very low	141 Å²	141	132.9 Å²	132.9	75%	0.754	77%	0.77	S	S	*	*			trans	5.8	155.2	139.7	-64.3	15	0	0	0	121
342	S	28.1	Very low	29.4	Very low	87 Å²	87	127.2 Å²	127.2	61%	0.608	76%	0.759	S	S	*	*			cis	177.1	158.6	-10.2	55.3	0	0	0	0	111.5
343	I	28.6	Very low	29.6	Very low	158 Å²	158	125.8 Å²	125.8	81%	0.81	75%	0.75	S	S	*	*			trans	73	136	158.8	-64.2	158.6	0	0	0	117.5
344	P	38.9	Very low	29.6	Very low	116 Å²	116	128.7 Å²	128.7	75%	0.753	75%	0.749	S	S	*	*			trans	-102.2	165.6	177.1	39.7	-35.7	0	0	0	114.2
345	V	28.2	Very low	29.6	Very low	131 Å²	131	130 Å²	130	79%	0.794	75%	0.752	S	S	*	*			trans	-164.5	131	153.6	123	0	0	0	0	114.7
346	T	27.5	Very low	29.5	Very low	133 Å²	133	129.4 Å²	129.4	82%	0.816	76%	0.755	S	S	*	*			trans	45.3	137.5	157	64.7	0	0	0	0	125.3
347	G	26.5	Very low	29.4	Very low	74 Å²	74	129.4 Å²	129.4	76%	0.763	75%	0.751	S	S	*	*			trans	107.4	141.5	148.3	0	0	0	0	0	115.7
348	V	31.3	Very low	29.7	Very low	147 Å²	147	127.8 Å²	127.8	89%	0.891	74%	0.743	S	S	*	*			cis	-146.9	157.4	-5.2	175.9	0	0	0	0	108.4
349	N	25.4	Very low	29.4	Very low	150 Å²	150	129.8 Å²	129.8	80%	0.802	75%	0.747	S	S	*	*			trans	-123.9	163.7	179.2	-146.3	13.6	0	0	0	108.1
350	P	38	Very low	29.4	Very low	86 Å²	86	134 Å²	134	56%	0.558	76%	0.755	S	S	*	*			cis	-140.6	-144.2	5.8	44.9	-23.6	0	0	0	114.4
351	F	28.5	Very low	29.5	Very low	183 Å²	183	132 Å²	132	80%	0.803	75%	0.754	S	S	*	*			trans	81.2	114.9	-178.5	-57.9	-79.4	0	0	0	114.6
352	N	24.8	Very low	29.4	Very low	144 Å²	144	132.3 Å²	132.3	77%	0.77	75%	0.753	S	S	*	*			cis	91.6	144.8	33.9	-164.8	23.2	0	0	0	113.8
353	I	30.4	Very low	29.6	Very low	137 Å²	137	135 Å²	135	70%	0.703	77%	0.766	S	S	*	*			trans	104.2	105.4	176.2	-57.6	168.2	0	0	0	116.8
354	N	28.8	Very low	29.6	Very low	135 Å²	135	132 Å²	132	72%	0.722	76%	0.759	S	S	*	*			trans	42.7	113.5	140.3	-57.7	-0.5	0	0	0	122.8
355	T	27.7	Very low	29.4	Very low	118 Å²	118	134.7 Å²	134.7	72%	0.724	77%	0.767	S	S	*	*				17.1	120.3	125.3	57.8	0	0	0	0	119.7
356	N	28.6	Very low	29.7	Very low	159 Å²	159	131.7 Å²	131.7	85%	0.85	76%	0.763	S	S	*	*				-170.8	161.7	109.3	-98.7	-21.1	0	0	0	114.1
357	T	31.2	Very low	30.1	Very low	118 Å²	118	131.6 Å²	131.6	72%	0.724	76%	0.761	S	S	*	*			trans	-85.5	169.8	169.3	51.1	0	0	0	0	110.4
358	N	30.2	Very low	30.5	Very low	130 Å²	130	134.3 Å²	134.3	70%	0.695	76%	0.758	S	S	*	*			cis	-155.3	136.2	17.7	-125.3	-16	0	0	0	112.9
359	I	29.4	Very low	30.6	Very low	138 Å²	138	133.1 Å²	133.1	71%	0.708	75%	0.747	S	S	*	*			trans	21.9	129.8	134.1	-55.3	173.1	0	0	0	121.3
360	Q	28	Very low	31	Very low	187 Å²	187	131.6 Å²	131.6	87%	0.874	74%	0.744	S	S	*	*			trans	-139.2	160.5	132.2	-75.6	-154.8	9.3	0	0	108.1
361	S	30.6	Very low	30.8	Very low	101 Å²	101	134.1 Å²	134.1	71%	0.706	75%	0.751	S	S	*	*			cis	-143.6	164.4	7.7	53.3	0	0	0	0	111.5
362	I	27.3	Very low	31	Very low	146 Å²	146	130.8 Å²	130.8	75%	0.749	75%	0.746	S	S	*	*			trans	-130	145.6	178.6	-63.4	170.1	0	0	0	110.1
363	V	31.8	Very low	31.3	Very low	145 Å²	145	129 Å²	129	88%	0.879	74%	0.744	S	S	*	*			trans	-131.1	139.2	163.4	-179	0	0	0	0	107.8
364	S	29.4	Very low	31.3	Very low	93 Å²	93	131.5 Å²	131.5	65%	0.65	75%	0.75	S	S	*	*			trans	-153.5	140.9	-163.8	55.7	0	0	0	0	113.7
365	N	33.8	Very low	31.2	Very low	173 Å²	173	130.9 Å²	130.9	93%	0.925	75%	0.752	S	S	*	*			trans	-144.9	120.1	169.3	-86.6	-33.4	0	0	0	108.7
366	G	33.6	Very low	31.4	Very low	68 Å²	68	132.9 Å²	132.9	70%	0.701	76%	0.756	S	S	*	*			cis	-161.2	-127.7	-10.8	0	0	0	0	0	106.4
367	V	37.6	Very low	31.4	Very low	131 Å²	131	130.8 Å²	130.8	79%	0.794	75%	0.749	S	S	*	*			cis	-165.7	136	-13.1	173.4	0	0	0	0	103.1
368	N	34.9	Very low	31.2	Very low	131 Å²	131	131.3 Å²	131.3	70%	0.701	75%	0.752	S	S	*	*			cis	-159.9	-170.5	-14.5	-105.4	31.5	0	0	0	104.5
369	D	33.5	Very low	31.2	Very low	122 Å²	122	132.6 Å²	132.6	65%	0.652	76%	0.756	S	S	*	*			cis	-164.1	157.8	-1.4	-122.2	-42.2	0	0	0	106.9
370	T	31.8	Very low	31.2	Very low	119 Å²	119	131.4 Å²	131.4	73%	0.73	76%	0.755	S	S	*	*			cis	-124	-104	-17.5	-39.1	0	0	0	0	108.1
371	I	34.2	Very low	31.3	Very low	139 Å²	139	127.9 Å²	127.9	71%	0.713	75%	0.747	S	S	*	*			cis	-146	149.5	-22.8	-151.1	165.6	0	0	0	109.6
372	T	33.4	Very low	31.2	Very low	112 Å²	112	129 Å²	129	69%	0.687	75%	0.749	S	S	*	*			trans	22.8	111.9	169.5	52.8	0	0	0	0	120.3
373	S	30.2	Very low	31.4	Very low	106 Å²	106	129.6 Å²	129.6	74%	0.741	75%	0.753	S	S	*	*				79	144.8	75.5	-75.4	0	0	0	0	115.3
374	K	31.9	Very low	31.1	Very low	190 Å²	190	127.8 Å²	127.8	83%	0.826	75%	0.746	S	S	*	*			cis	-156.9	158.8	12.7	-129.5	165	-170	176.5	0	112.1
375	T	25.5	Very low	31	Very low	123 Å²	123	128.2 Å²	128.2	76%	0.755	75%	0.749	S	S	*	*			trans	-112.4	139.5	172	-49.5	0	0	0	0	110.8
376	I	32.9	Very low	30.9	Very low	160 Å²	160	126.9 Å²	126.9	82%	0.821	75%	0.747	S	S	*	*			trans	-139.5	142	157.2	-63.5	-174.4	0	0	0	108.7
377	T	28.4	Very low	30.6	Very low	115 Å²	115	129.9 Å²	129.9	71%	0.706	75%	0.753	S	S	*	*			trans	-115.5	133.5	178.2	-57.1	0	0	0	0	110.1
378	T	27.5	Very low	30.3	Very low	128 Å²	128	128.5 Å²	128.5	79%	0.785	76%	0.755	S	S	*	*			trans	175.4	166.7	136.8	25.2	0	0	0	0	112.9
379	M	28.4	Very low	29.9	Very low	157 Å²	157	128.5 Å²	128.5	77%	0.773	76%	0.76	S	S	*	*			trans	80.8	94	165.3	-63.3	-56.3	176.7	0	0	120.8
380	T	29.9	Very low	29.7	Very low	113 Å²	113	129 Å²	129	69%	0.693	77%	0.768	S	S	*	*				75.7	134.7	128	46.8	0	0	0	0	123.8
381	T	30.8	Very low	29.5	Very low	114 Å²	114	129.1 Å²	129.1	70%	0.699	77%	0.768	S	S	*	*			trans	62.3	111.9	151.3	49.5	0	0	0	0	118.1
382	T	27.9	Very low	29.4	Very low	123 Å²	123	130.1 Å²	130.1	76%	0.755	77%	0.773	S	S	*	*				54.6	136.4	78.5	67.4	0	0	0	0	113.2
383	I	31.7	Very low	29.2	Very low	160 Å²	160	129.9 Å²	129.9	82%	0.821	77%	0.772	S	S	*	*			cis	-145.7	156.4	41.6	-67.1	165.7	0	0	0	110.9
384	S	25.5	Very low	29.2	Very low	106 Å²	106	130 Å²	130	74%	0.741	77%	0.768	S	S	*	*			trans	-101.2	131.4	164.9	-56.9	0	0	0	0	112.1
385	S	27.4	Very low	29.1	Very low	103 Å²	103	126.6 Å²	126.6	72%	0.72	76%	0.763	S	S	*	*			trans	25.8	122.6	152.1	59.9	0	0	0	0	120.8
386	T	31.1	Very low	29.4	Very low	144 Å²	144	125.8 Å²	125.8	88%	0.883	76%	0.759	S	S	*	*				-163.3	161.2	122.1	7.4	0	0	0	0	114.3
387	T	28.3	Very low	29.3	Very low	132 Å²	132	124.1 Å²	124.1	81%	0.81	76%	0.756	S	S	*	*			trans	-54.7	146.9	179.9	47.9	0	0	0	0	117.2
388	A	30.7	Very low	29.6	Very low	102 Å²	102	123.3 Å²	123.3	84%	0.843	76%	0.755	S	S	*	*				-167.2	143.4	121.4	0	0	0	0	0	112.7
389	T	26.6	Very low	29.8	Very low	130 Å²	130	123.2 Å²	123.2	80%	0.798	76%	0.755	S	S	*	*			trans	-92.4	143.6	170.3	-42.3	0	0	0	0	110.1
390	T	30.6	Very low	30	Very low	134 Å²	134	123 Å²	123	82%	0.822	76%	0.755	S	S	*	*			trans	-168.3	135.7	140.1	-73.9	0	0	0	0	109.8
391	T	27.6	Very low	30.1	Very low	120 Å²	120	124.3 Å²	124.3	74%	0.736	76%	0.758	S	S	*	*			trans	-80.7	149.4	173.1	-25	0	0	0	0	110.8
392	I	31.8	Very low	30.1	Very low	160 Å²	160	125.1 Å²	125.1	82%	0.821	76%	0.758	S	S	*	*			trans	-171.8	138.5	135.9	-101.2	154.6	0	0	0	113.1
393	T	29.5	Very low	30.3	Very low	108 Å²	108	125 Å²	125	66%	0.663	76%	0.757	S	S	*	*			trans	-53.9	167.6	165	41.6	0	0	0	0	113.8
394	T	29.8	Very low	30.6	Very low	108 Å²	108	122.4 Å²	122.4	66%	0.663	75%	0.75	S	S	*	*			cis	-175.9	162	13.6	10.7	0	0	0	0	109.4
395	T	29.6	Very low	30.7	Very low	118 Å²	118	122.8 Å²	122.8	72%	0.724	75%	0.749	S	S	*	*			trans	64.1	151.9	145	56.4	0	0	0	0	119.6
396	T	31.4	Very low	30.8	Very low	107 Å²	107	125.2 Å²	125.2	66%	0.656	75%	0.753	S	S	*	*			cis	-168.5	161.6	-2.4	19.2	0	0	0	0	112.2
397	T	31.8	Very low	30.7	Very low	125 Å²	125	124 Å²	124	77%	0.767	75%	0.745	S	S	*	*			trans	65	154.7	146.7	47.7	0	0	0	0	119.6
398	S	33	Very low	30.8	Very low	98 Å²	98	123.7 Å²	123.7	69%	0.685	74%	0.743	S	S	*	*			cis	-172.8	160.8	-0.3	36.9	0	0	0	0	109.4
399	T	32.2	Very low	30.7	Very low	126 Å²	126	126.3 Å²	126.3	77%	0.773	74%	0.743	S	S	*	*			cis	-162.9	-137.9	-18.3	34.4	0	0	0	0	105.8
400	I	33.4	Very low	31.5	Very low	151 Å²	151	124.9 Å²	124.9	77%	0.774	74%	0.736	S	S	*	*			trans	66.1	108.8	176.2	-48.9	175	0	0	0	114.2
401	N	31.6	Very low	31.5	Very low	142 Å²	142	125.1 Å²	125.1	76%	0.759	73%	0.731	S	S	*	*			cis	-163	176.4	-7	-121.9	6.6	0	0	0	108
402	N	30.6	Very low	31.7	Very low	130 Å²	130	129.5 Å²	129.5	70%	0.695	73%	0.734	S	S	*	*			cis	-145.8	-169.5	8.2	-160.9	9	0	0	0	110.2
403	T	31.5	Very low	31.7	Very low	122 Å²	122	127.8 Å²	127.8	75%	0.748	72%	0.722	S	S	*	*			trans	-124.9	-163.8	-177.3	59.8	0	0	0	0	113.3
404	P	38	Very low	31.8	Very low	104 Å²	104	128.1 Å²	128.1	68%	0.675	72%	0.72	S	S	*	*				-137.9	-168.6	-98.8	43.9	-24.2	0	0	0	117.5
405	T	29.2	Very low	31.7	Very low	115 Å²	115	129.7 Å²	129.7	71%	0.706	72%	0.724	S	S	*	*			trans	78.1	119	152.4	43.6	0	0	0	0	124.1
406	L	28.1	Very low	31.8	Very low	154 Å²	154	131.5 Å²	131.5	81%	0.806	73%	0.727	S	S	*	*			trans	90.5	136.9	131.5	-76.6	165.5	0	0	0	124.7
407	T	28.7	Very low	31.5	Very low	117 Å²	117	130.5 Å²	130.5	72%	0.718	73%	0.725	S	S	*	*			trans	81.9	116.1	154.2	43.3	0	0	0	0	124.1
408	T	31.7	Very low	31.3	Very low	127 Å²	127	133.5 Å²	133.5	78%	0.779	73%	0.727	S	S	*	*			trans	62.7	101.7	140.4	55.7	0	0	0	0	123.5
409	N	28.3	Very low	31	Very low	157 Å²	157	134.5 Å²	134.5	84%	0.84	73%	0.725	S	S	*	*				28.1	158.9	111.3	-104.2	-7.7	0	0	0	121.7
410	P	42.7	Very low	30.9	Very low	99 Å²	99	135.4 Å²	135.4	64%	0.643	73%	0.725	S	S	*	*			cis	-146.4	-165.2	2.8	29.6	-2	0	0	0	116.9
411	I	31.8	Very low	30.7	Very low	139 Å²	139	138.2 Å²	138.2	71%	0.713	73%	0.726	S	S	*	*			trans	95.8	111	151.8	-59.9	-176.5	0	0	0	120.8
412	R	31	Very low	31.1	Very low	212 Å²	212	136.3 Å²	136.3	80%	0.8	72%	0.722	S	S	*	*			trans	53.3	150.4	146	-66.2	174.1	176.2	-117	8.8	119.1
413	Q	31.4	Very low	31.1	Very low	124 Å²	124	136.8 Å²	136.8	58%	0.579	72%	0.724	S	S	*	*			cis	-161.2	-174.3	-9.2	-117.2	172.5	-77.5	0	0	105.9
414	D	31.4	Very low	30.9	Very low	116 Å²	116	136.8 Å²	136.8	62%	0.62	72%	0.724	S	S	*	*			cis	-159	-178.3	8.7	-130.6	-12.1	0	0	0	107.6
415	L	28.5	Very low	30.2	Very low	141 Å²	141	137.5 Å²	137.5	74%	0.738	73%	0.727	S	S	*	*			cis	-156.1	-154.5	1.6	-143	171.1	0	0	0	106.7
416	I	31	Very low	30	Very low	156 Å²	156	139.6 Å²	139.6	80%	0.8	73%	0.73	S	S	*	*			trans	74.5	169.5	165.1	-68.5	174.1	0	0	0	114.9
417	S	26.3	Very low	29.8	Very low	86 Å²	86	138.7 Å²	138.7	60%	0.601	73%	0.725	S	S	*	*			trans	-130.6	166.6	-163.4	58	0	0	0	0	111.3
418	F	27	Very low	29.7	Very low	187 Å²	187	140 Å²	140	82%	0.82	73%	0.727	S	S	*	*			cis	-131.8	142.4	20.3	-92.5	-96.7	0	0	0	114.3
419	N	26.1	Very low	29.4	Very low	119 Å²	119	138.3 Å²	138.3	64%	0.636	72%	0.72	S	S	*	*			trans	-108.2	153.3	151.9	-83.4	3.1	0	0	0	107.2
420	D	30.2	Very low	29.2	Very low	145 Å²	145	137.5 Å²	137.5	78%	0.775	72%	0.716	S	S	*	*			cis	75.4	146.6	41.2	-151.8	43.9	0	0	0	113.2
421	W	30.8	Very low	28.4	Very low	210 Å²	210	140.3 Å²	140.3	80%	0.795	72%	0.721	S	S	*	*			trans	133.4	156	159.8	-81.5	13	0	0	0	118
422	P	40	Very low	28.2	Very low	102 Å²	102	140.1 Å²	140.1	66%	0.662	72%	0.721	S	S	*	*			cis	-132.8	-152.7	-30.4	38.8	-18.9	0	0	0	109.4
423	N	29	Very low	28.6	Very low	140 Å²	140	135 Å²	135	75%	0.749	72%	0.715	S	S	*	*			cis	-163.6	171.5	-6.4	-136.5	-14.1	0	0	0	106.5
424	V	27.1	Very low	28.4	Very low	122 Å²	122	134 Å²	134	74%	0.739	72%	0.722	S	S	*	*			cis	-142.3	155.3	-1.2	-157.6	0	0	0	0	107
425	T	23.9	Very low	28.2	Very low	120 Å²	120	134.9 Å²	134.9	74%	0.736	73%	0.727	S	S	*	*			trans	-139	127.4	-175.2	-51.9	0	0	0	0	113.7
426	M	25.3	Very low	28.2	Very low	158 Å²	158	135.3 Å²	135.3	78%	0.778	73%	0.725	S	S	*	*			trans	62.4	171.4	156.5	-74.7	-178.3	61	0	0	120
427	L	24.4	Very low	28.1	Very low	135 Å²	135	133.9 Å²	133.9	71%	0.707	72%	0.717	S	S	*	*			cis	-177.7	169.4	-42.6	-144.5	172.6	0	0	0	107.2
428	L	25.4	Very low	28.3	Very low	146 Å²	146	136.5 Å²	136.5	76%	0.764	72%	0.724	S	S	*	*			trans	90.1	142.4	165.7	-55.9	166.6	0	0	0	117.3
429	S	25.2	Very low	28.3	Very low	90 Å²	90	133.4 Å²	133.4	63%	0.629	72%	0.72	S	S	*	*			cis	-169.4	152.7	-11.5	51.5	0	0	0	0	115.2
430	N	25	Very low	28.5	Very low	140 Å²	140	133.6 Å²	133.6	75%	0.749	73%	0.726	S	S	*	*			trans	79.1	116.5	143.4	-71.3	-5.2	0	0	0	125.4
431	Q	26.4	Very low	28.4	Very low	159 Å²	159	132.6 Å²	132.6	74%	0.743	73%	0.725	S	S	*	*				91.7	127.5	126.7	-75.5	-168.4	7.7	0	0	125.2
432	N	27.7	Very low	28.8	Very low	134 Å²	134	128.1 Å²	128.1	72%	0.717	72%	0.723	S	S	*	*			trans	74	160	142.4	-64.9	-13.4	0	0	0	120.4
433	P	37.5	Very low	28.5	Very low	105 Å²	105	128.6 Å²	128.6	68%	0.682	72%	0.724	S	S	*	*				-141	175.8	-58.6	40.4	-23.2	0	0	0	115.5
434	S	28.9	Very low	28.6	Very low	102 Å²	102	128.7 Å²	128.7	71%	0.713	73%	0.73	S	S	*	*			trans	54.7	125.8	149.3	57.7	0	0	0	0	123.6
435	N	27.3	Very low	28.7	Very low	136 Å²	136	126.4 Å²	126.4	73%	0.727	73%	0.731	S	S	*	*				22.7	145.1	119.9	-71.2	40.4	0	0	0	120
436	E	28	Very low	28.8	Very low	149 Å²	149	126.1 Å²	126.1	70%	0.696	73%	0.734	S	S	*	*			cis	-171.1	178.9	10.6	-128.6	174.4	128.3	0	0	114.4
437	I	29.6	Very low	29	Very low	126 Å²	126	126.5 Å²	126.5	65%	0.646	74%	0.738	S	S	*	*			trans	83.6	110.6	141.4	-81.3	165.1	0	0	0	122.3
438	I	29.4	Very low	29.1	Very low	142 Å²	142	127.1 Å²	127.1	73%	0.728	74%	0.74	S	S	*	*				64.7	136.2	129.9	-59.1	179.8	0	0	0	119.1
439	T	27.4	Very low	29.8	Very low	122 Å²	122	126.1 Å²	126.1	75%	0.748	74%	0.742	S	S	*	*			cis	-116.8	-137.2	19	-25.2	0	0	0	0	112.2
440	T	30.2	Very low	29.9	Very low	123 Å²	123	124.6 Å²	124.6	76%	0.755	74%	0.741	S	S	*	*			cis	-154.3	162.7	7.2	-30.3	0	0	0	0	111.2
441	T	29	Very low	29.9	Very low	124 Å²	124	124 Å²	124	76%	0.761	74%	0.743	S	S	*	*			trans	-143.6	173.2	-179.7	52.8	0	0	0	0	109.5
442	P	38.9	Very low	30	Very low	116 Å²	116	123.2 Å²	123.2	75%	0.753	74%	0.744	S	S	*	*			cis	-127.8	-164	20.6	29.1	-1.6	0	0	0	112.8
443	T	32.1	Very low	30	Very low	112 Å²	112	122.1 Å²	122.1	69%	0.687	74%	0.742	S	S	*	*			cis	-157.6	156.2	28.6	35.9	0	0	0	0	112.6
444	T	32.2	Very low	29.4	Very low	141 Å²	141	123.5 Å²	123.5	87%	0.865	75%	0.749	S	S	*	*			trans	47.3	138.7	149.6	56.9	0	0	0	0	120.9
445	G	29.1	Very low	29.4	Very low	75 Å²	75	126.1 Å²	126.1	77%	0.773	75%	0.753	S	S	*	*			cis	-178.5	-169	7.7	0	0	0	0	0	112.3
446	S	24.9	Very low	29.2	Very low	114 Å²	114	125.6 Å²	125.6	80%	0.797	76%	0.755	S	S	*	*			trans	-82.8	159	-176.6	-172.9	0	0	0	0	113.4
447	I	31.2	Very low	29.2	Very low	165 Å²	165	124.1 Å²	124.1	85%	0.846	76%	0.756	S	S	*	*			trans	167.8	151.9	138	-87.3	155.9	0	0	0	111.4
448	I	26	Very low	29.1	Very low	149 Å²	149	124.4 Å²	124.4	76%	0.764	76%	0.759	S	S	*	*			trans	-126.8	-162.5	177.2	-18.3	176.9	0	0	0	108.1
449	P	40.2	Very low	28.9	Very low	124 Å²	124	125.7 Å²	125.7	81%	0.805	76%	0.762	S	S	*	*				-96.4	-171	-76.8	40.6	-27.7	0	0	0	113.4
450	G	26	Very low	29	Very low	59 Å²	59	128.6 Å²	128.6	61%	0.608	77%	0.767	S	S	*	*			trans	154	92.1	161.6	0	0	0	0	0	113.7
451	T	25.4	Very low	28.7	Very low	127 Å²	127	127.5 Å²	127.5	78%	0.779	77%	0.77	S	S	*	*				79	146.7	82.6	55.9	0	0	0	0	115.7
452	N	29	Very low	28.7	Very low	143 Å²	143	127.1 Å²	127.1	77%	0.765	77%	0.771	S	S	*	*			trans	77.9	137.6	175.1	-56.9	-13.1	0	0	0	116.4
453	T	26.8	Very low	28.2	Very low	111 Å²	111	127.9 Å²	127.9	68%	0.681	77%	0.769	S	S	*	*			cis	178.8	151.1	-34.4	18.8	0	0	0	0	107
454	T	25.5	Very low	28	Very low	134 Å²	134	132.3 Å²	132.3	82%	0.822	78%	0.779	S	S	*	*			trans	60.7	138.1	168.8	52.1	0	0	0	0	115.5
455	I	29.3	Very low	27.8	Very low	157 Å²	157	132.7 Å²	132.7	81%	0.805	77%	0.774	S	S	*	*				-141.4	145.4	53.8	-78.6	163.3	0	0	0	111.5
456	T	23.7	Very low	27.7	Very low	124 Å²	124	136.8 Å²	136.8	76%	0.761	78%	0.778	S	S	*	*			trans	-96.4	138.9	166	50	0	0	0	0	110.9
457	T	27.7	Very low	27.9	Very low	118 Å²	118	142 Å²	142	72%	0.724	78%	0.781	S	S	*	*			trans	-175.9	147.5	135.8	24.3	0	0	0	0	113.5
458	N	28.2	Very low	27.7	Very low	132 Å²	132	145 Å²	145	71%	0.706	78%	0.783	S	S	*	*			trans	52.7	121.6	140.1	-59.6	11.4	0	0	0	119.5
459	E	24.9	Very low	27.9	Very low	170 Å²	170	143.3 Å²	143.3	79%	0.794	78%	0.782	S	S	*	*				81.4	149.1	64.4	-81.1	-157.7	140.7	0	0	115.2
460	Q	28.2	Very low	27.3	Very low	183 Å²	183	145 Å²	145	86%	0.855	78%	0.784	S	S	*	*			trans	72.7	90.3	-176.6	-52.7	-170.1	2.9	0	0	113.6
461	A	24.5	Very low	27.5	Very low	99 Å²	99	146.8 Å²	146.8	82%	0.818	79%	0.787	S	S	*	*				76.3	106.2	55.3	0	0	0	0	0	114.2
462	C	28.2	Very low	27.5	Very low	117 Å²	117	148.9 Å²	148.9	79%	0.791	79%	0.788	S	S	*	*			trans	-152.8	133	155.1	-123.7	0	0	0	0	111.5
463	N	29.4	Very low	27.3	Very low	131 Å²	131	147.9 Å²	147.9	70%	0.701	79%	0.787	S	S	*	*			trans	62.5	91.9	153.5	-60.9	-18.6	0	0	0	122.3
464	F	27.4	Very low	27.2	Very low	205 Å²	205	148.8 Å²	148.8	90%	0.899	79%	0.787	S	S	*	*				79.9	144.4	122.6	-89.6	-85.7	0	0	0	121.2
465	I	27.9	Very low	27.2	Very low	149 Å²	149	151.9 Å²	151.9	76%	0.764	79%	0.789	S	S	*	*			trans	-120.1	142.3	-161.3	-67.3	166.8	0	0	0	109.4	R467	I465-R467 HydrophobicContact CG2-CB 4.15Å
466	N	26.5	Very low	27.3	Very low	161 Å²	161	149.1 Å²	149.1	86%	0.861	78%	0.78	S	S	*	*			trans	-122.2	95.4	166.2	-148.3	-5.6	0	0	0	109.1
467	R	29.4	Very low	28.1	Very low	225 Å²	225	147.9 Å²	147.9	85%	0.849	77%	0.774	S	S	*	*			trans	-159.7	136.8	175.4	-117.5	179.6	-172.5	179.7	3.2	111.7	I465	I465-R467 HydrophobicContact CG2-CB 4.15Å
468	Y	28.6	Very low	28	Very low	227 Å²	227	151.2 Å²	151.2	89%	0.89	78%	0.779	S	S	*	*			trans	-80.5	137.2	-179.4	-76.5	-99.8	0	0	0	113.3
469	P	28.8	Very low	27.9	Very low	113 Å²	113	150.2 Å²	150.2	73%	0.734	78%	0.778	S	S	*	*			trans	-118.3	172	147.8	38.2	-28.8	0	0	0	111.7
470	N	28.3	Very low	27.9	Very low	159 Å²	159	147.7 Å²	147.7	85%	0.85	77%	0.774	S	S	*	*			trans	-85.6	121	-176	-73.4	-21.1	0	0	0	114.2
471	S	29.1	Very low	27.9	Very low	98 Å²	98	145.8 Å²	145.8	69%	0.685	77%	0.769	S	S	*	*			trans	30.8	130.7	140.4	65.4	0	0	0	0	122.3
472	Q	25.5	Very low	28	Very low	170 Å²	170	148 Å²	148	79%	0.794	77%	0.767	S	S	*	*				168.5	177.2	105.1	-90.7	-157.5	14.2	0	0	113.9
473	T	24.9	Very low	28	Very low	122 Å²	122	147.7 Å²	147.7	75%	0.748	77%	0.766	S	S	*	*			trans	85.5	149.2	162.3	75.7	0	0	0	0	118
474	I	26	Very low	28	Very low	130 Å²	130	146.1 Å²	146.1	67%	0.667	77%	0.766	S	S	*	*			cis	-164.5	156.1	-9.2	-115.6	167.8	0	0	0	111.1	T476	I474-T476 HydrophobicContact CG2-CG2 3.91Å
475	F	25.8	Very low	28.2	Very low	199 Å²	199	142.1 Å²	142.1	87%	0.873	76%	0.763	S	S	*	*			trans	-171.4	107	146.8	-105.4	-85.6	0	0	0	106.9
476	T	30.2	Very low	28.3	Very low	99 Å²	99	138.6 Å²	138.6	61%	0.607	76%	0.763	S	S	*	*				76.9	157.2	64	60.3	0	0	0	0	115.6	I474	I474-T476 HydrophobicContact CG2-CG2 3.91Å
477	P	40.3	Very low	28.5	Very low	99 Å²	99	140.1 Å²	140.1	64%	0.643	77%	0.765	S	S	*	*			cis	-145.3	-178.7	-36.7	37.4	-18.5	0	0	0	117.3
478	F	26	Very low	28.3	Very low	188 Å²	188	135.3 Å²	135.3	83%	0.825	76%	0.761	S	S	*	*			trans	108.5	132.8	142.2	-82.8	-49.3	0	0	0	125.6
479	T	25.3	Very low	28.8	Very low	111 Å²	111	129.3 Å²	129.3	68%	0.681	75%	0.75	S	S	*	*			trans	70.8	111.8	146.2	47.6	0	0	0	0	124.9
480	T	25.8	Very low	28.6	Very low	117 Å²	117	131 Å²	131	72%	0.718	75%	0.752	S	S	*	*			trans	56.4	123.2	134.5	60.5	0	0	0	0	120.4
481	N	28.3	Very low	28.6	Very low	142 Å²	142	131.6 Å²	131.6	76%	0.759	75%	0.747	S	S	*	*				-168.8	165.4	69.3	-108.6	-31.3	0	0	0	116.6
482	L	26.2	Very low	28.5	Very low	145 Å²	145	134.6 Å²	134.6	76%	0.759	75%	0.752	S	S	*	*			trans	8.2	147	164.3	-83.4	72.1	0	0	0	124.5
483	S	28.3	Very low	28.4	Very low	112 Å²	112	132 Å²	132	78%	0.783	75%	0.748	S	S	*	*			trans	73.3	142.3	144.8	65.5	0	0	0	0	120.2
484	S	29.9	Very low	28.4	Very low	98 Å²	98	133.5 Å²	133.5	69%	0.685	75%	0.751	S	S	*	*			cis	-168.9	143	-17.1	46.7	0	0	0	0	111.6
485	S	31.7	Very low	28.4	Very low	120 Å²	120	131.9 Å²	131.9	84%	0.839	75%	0.752	S	S	*	*			trans	49.5	135.6	158.1	57	0	0	0	0	119.7
486	G	29.3	Very low	28.5	Very low	75 Å²	75	130.8 Å²	130.8	77%	0.773	75%	0.749	S	S	*	*			cis	162.1	170.9	5.1	0	0	0	0	0	108.5
487	Q	29.9	Very low	28.4	Very low	194 Å²	194	132.9 Å²	132.9	91%	0.907	76%	0.756	S	S	*	*			cis	-154.4	136.6	-4.1	-149.7	175.2	10.7	0	0	109
488	T	26.2	Very low	27.6	Very low	124 Å²	124	133.4 Å²	133.4	76%	0.761	76%	0.758	S	S	*	*			trans	-103	-147.5	165.1	51.1	0	0	0	0	106.3
489	P	38.4	Very low	27.6	Very low	100 Å²	100	129.9 Å²	129.9	65%	0.649	75%	0.752	S	S	*	*			cis	-142.3	-164.4	-10.1	25.4	2.5	0	0	0	115.1
490	L	25.7	Very low	27.7	Very low	149 Å²	149	130.6 Å²	130.6	78%	0.78	75%	0.752	S	S	*	*			trans	90.3	144	156.1	-51.3	-177.1	0	0	0	116.9
491	K	28.6	Very low	27.6	Very low	171 Å²	171	131.2 Å²	131.2	74%	0.743	75%	0.75	S	S	*	*			cis	-144.3	131.5	20.6	-151.8	172.6	-176	-179.3	0	115.6
492	M	26.4	Very low	27.6	Very low	161 Å²	161	130.4 Å²	130.4	79%	0.793	75%	0.746	S	S	*	*			trans	62.4	108.8	146.5	-77.7	167.6	147.2	0	0	123.5
493	T	24.3	Very low	27.6	Very low	115 Å²	115	133.3 Å²	133.3	71%	0.706	75%	0.747	S	S	*	*			trans	-53.9	174.9	133.5	48.1	0	0	0	0	113.3
494	N	24.2	Very low	27.4	Very low	155 Å²	155	135.1 Å²	135.1	83%	0.829	75%	0.747	S	S	*	*			cis	-161.2	-174.6	-9.9	-109	3.7	0	0	0	109
495	S	26.6	Very low	27.3	Very low	96 Å²	96	138 Å²	138	67%	0.671	75%	0.753	S	S	*	*			trans	-93.3	164.4	-179.2	54.3	0	0	0	0	116.9
496	H	26.8	Very low	27	Very low	175 Å²	175	136.6 Å²	136.6	81%	0.81	74%	0.743	S	S	*	*			trans	82.9	117.1	162.4	-67.4	-32	0	0	0	121.4
497	N	28	Very low	26.7	Very low	143 Å²	143	138.2 Å²	138.2	77%	0.765	74%	0.743	S	S	*	*				175.6	143.8	123.4	-85.8	-9.8	0	0	0	107.2
498	T	24.8	Very low	26.6	Very low	111 Å²	111	135.6 Å²	135.6	68%	0.681	74%	0.735	S	S	*	*			cis	65.5	131.4	44.9	70.7	0	0	0	0	112.8
499	T	25.9	Very low	26.6	Very low	114 Å²	114	138.8 Å²	138.8	70%	0.699	73%	0.733	S	S	*	*			cis	-164.7	168.3	-0.8	3.8	0	0	0	0	111.4
500	N	25.9	Very low	25.9	Very low	126 Å²	126	141.6 Å²	141.6	67%	0.674	74%	0.735	S	S	*	*			trans	80.9	130.6	143.2	-74.1	1.3	0	0	0	123.8
501	N	25.5	Very low	26	Very low	129 Å²	129	140.3 Å²	140.3	69%	0.69	73%	0.728	S	S	*	*			trans	76.4	147.2	138	-62.1	-7.1	0	0	0	119.1
502	N	26.8	Very low	25.8	Very low	126 Å²	126	139.9 Å²	139.9	67%	0.674	73%	0.729	S	S	*	*			cis	-157.1	158.3	5.7	-132.6	-21.1	0	0	0	113.7
503	R	26.8	Very low	25.8	Very low	206 Å²	206	137.3 Å²	137.3	78%	0.777	72%	0.722	S	S	*	*			trans	53.9	115.9	151.8	-71.6	-172.2	174.3	-170.6	-3.6	120.2
504	L	23.4	Very low	25.9	Very low	150 Å²	150	136.4 Å²	136.4	79%	0.785	72%	0.72	S	S	*	*				68.9	123.6	92.8	-72.9	172	0	0	0	116.3
505	I	27.8	Very low	26.1	Very low	159 Å²	159	134.2 Å²	134.2	82%	0.815	71%	0.713	S	S	*	*				175.1	148.4	124.9	-92.1	159.4	0	0	0	112.2
506	S	26	Very low	26.1	Very low	89 Å²	89	135.3 Å²	135.3	62%	0.622	72%	0.716	S	S	*	*			trans	1.6	130.1	170.1	63.5	0	0	0	0	121.1
507	S	23.8	Very low	26.1	Very low	110 Å²	110	135.4 Å²	135.4	77%	0.769	71%	0.714	S	S	*	*				83	157.1	63.6	-56	0	0	0	0	115.7
508	N	26.9	Very low	26.1	Very low	138 Å²	138	134.3 Å²	134.3	74%	0.738	71%	0.712	S	S	*	*			trans	82.4	147.2	174.7	-64	-29.9	0	0	0	117.7
509	R	25.4	Very low	26.1	Very low	191 Å²	191	133.7 Å²	133.7	72%	0.721	71%	0.708	S	S	*	*			cis	-176	150.2	-32.9	-129.8	174.8	176.4	-175.8	0.1	109.3
510	F	24.6	Very low	26.1	Very low	159 Å²	159	134 Å²	134	70%	0.697	71%	0.71	S	S	*	*			trans	64	168.3	153.4	-72.5	-45.2	0	0	0	117.3
511	I	26.7	Very low	26.1	Very low	122 Å²	122	133.2 Å²	133.2	63%	0.626	71%	0.71	S	S	*	*			cis	-149.3	142.2	3.4	-134.9	152.2	0	0	0	111
512	Q	25.8	Very low	26.1	Very low	163 Å²	163	132.7 Å²	132.7	76%	0.762	71%	0.712	S	S	*	*			trans	59.6	159.6	151.3	-67.3	174.2	-30.4	0	0	120.8
513	T	26.1	Very low	26.1	Very low	106 Å²	106	133.2 Å²	133.2	65%	0.65	72%	0.72	S	S	*	*			cis	-163	164.2	-17.7	27.6	0	0	0	0	110.9
514	S	25.9	Very low	26.2	Very low	96 Å²	96	130 Å²	130	67%	0.671	72%	0.723	S	S	*	*			trans	67.3	148.4	137.5	60.9	0	0	0	0	120.6
515	T	28.1	Very low	26.9	Very low	110 Å²	110	128.2 Å²	128.2	68%	0.675	72%	0.72	S	S	*	*			cis	-172.6	136.8	-9.2	26.2	0	0	0	0	109.8
516	T	28	Very low	27.5	Very low	119 Å²	119	126 Å²	126	73%	0.73	72%	0.717	S	S	*	*			trans	61.4	165.3	140.1	68.3	0	0	0	0	119.5
517	K	26.6	Very low	27.8	Very low	176 Å²	176	128 Å²	128	77%	0.765	73%	0.725	S	S	*	*			cis	-168.4	160.4	-9.4	-120.1	176.9	172.8	-176.7	0	109
518	V	26.6	Very low	27.9	Very low	121 Å²	121	130.8 Å²	130.8	73%	0.733	73%	0.725	S	S	*	*			trans	69	155	138.6	162.9	0	0	0	0	120.4
519	T	26	Very low	28.1	Very low	97 Å²	97	129.4 Å²	129.4	60%	0.595	73%	0.727	S	S	*	*			cis	-173.9	137.4	-36.6	-68.1	0	0	0	0	108.5
520	T	25.8	Very low	28.2	Very low	122 Å²	122	125.1 Å²	125.1	75%	0.748	73%	0.726	S	S	*	*			trans	56.8	179	161.5	62.5	0	0	0	0	118.1
521	T	25.3	Very low	28.4	Very low	109 Å²	109	125.6 Å²	125.6	67%	0.669	73%	0.732	S	S	*	*			cis	-158.3	151.9	13.6	-18.8	0	0	0	0	113.9
522	T	25.2	Very low	28.2	Very low	117 Å²	117	126.5 Å²	126.5	72%	0.718	74%	0.744	S	S	*	*			trans	44.4	130.2	148.3	50.8	0	0	0	0	123
523	T	27.9	Very low	28.3	Very low	138 Å²	138	124.7 Å²	124.7	85%	0.847	74%	0.744	S	S	*	*				-170.9	174.2	102.5	21.4	0	0	0	0	111.5
524	T	28.1	Very low	28.8	Very low	138 Å²	138	125 Å²	125	85%	0.847	75%	0.748	S	S	*	*			trans	-125.1	-145.7	-166.3	51.5	0	0	0	0	113.7
525	P	38.4	Very low	28.9	Very low	112 Å²	112	125.4 Å²	125.4	73%	0.727	75%	0.751	S	S	*	*			trans	-117	-148.5	-131.1	41.4	-18.7	0	0	0	111.1
526	P	40.3	Very low	28.9	Very low	114 Å²	114	127 Å²	127	74%	0.74	76%	0.755	S	S	*	*			cis	-133.1	-140.7	-11.1	43.7	-24.3	0	0	0	112.4
527	V	32.7	Very low	29	Very low	131 Å²	131	126.3 Å²	126.3	79%	0.794	76%	0.755	S	S	*	*			trans	112	138	167.3	175.8	0	0	0	0	113.6
528	E	26.4	Very low	29.1	Very low	167 Å²	167	123.4 Å²	123.4	78%	0.78	76%	0.757	S	S	*	*			cis	170.6	153.4	-38.7	173.1	174.8	-108.9	0	0	106.7
529	S	29.3	Very low	29	Very low	109 Å²	109	124.6 Å²	124.6	76%	0.762	76%	0.759	S	S	*	*			trans	69.7	156.2	169.8	92.3	0	0	0	0	116.5
530	S	28.3	Very low	28.9	Very low	101 Å²	101	129.2 Å²	129.2	71%	0.706	77%	0.772	S	S	*	*			cis	-163.2	163.9	-19.4	40.8	0	0	0	0	112.7
531	M	28	Very low	28.9	Very low	169 Å²	169	129 Å²	129	83%	0.833	77%	0.77	S	S	*	*			trans	60	103.6	151	-75.1	174.2	168.4	0	0	120.8
532	T	23.3	Very low	29	Very low	142 Å²	142	131.8 Å²	131.8	87%	0.871	78%	0.781	S	S	*	*			trans	-131.5	97.2	145.8	43.8	0	0	0	0	110.8
533	T	28.5	Very low	29	Very low	125 Å²	125	130.7 Å²	130.7	77%	0.767	78%	0.783	S	S	*	*			trans	-151.5	165.5	173.5	59.2	0	0	0	0	109.7
534	P	37.1	Very low	28.9	Very low	112 Å²	112	132.5 Å²	132.5	73%	0.727	79%	0.785	S	S	*	*				-137.5	-163.5	-58.9	41.5	-25.6	0	0	0	112.4
535	S	26.9	Very low	28.8	Very low	104 Å²	104	132.3 Å²	132.3	73%	0.727	78%	0.778	S	S	*	*			trans	82.4	154.7	161.8	89.8	0	0	0	0	117
536	N	27.6	Very low	28.3	Very low	144 Å²	144	135 Å²	135	77%	0.77	78%	0.784	S	S	*	*			cis	-155.3	165.9	5.1	-143.9	-14	0	0	0	114.2
537	S	29.9	Very low	27.6	Very low	105 Å²	105	133 Å²	133	73%	0.734	78%	0.784	S	S	*	*			trans	65.9	148.8	165.3	72.5	0	0	0	0	118.7
538	S	30.1	Very low	27.4	Very low	114 Å²	114	132.1 Å²	132.1	80%	0.797	78%	0.784	S	S	*	*			cis	-159.1	164.8	-13.6	40	0	0	0	0	111.1
539	N	24.4	Very low	27.5	Very low	147 Å²	147	131 Å²	131	79%	0.786	79%	0.788	S	S	*	*			trans	-112.8	174	-171.9	-82.7	-35.1	0	0	0	114.5
540	F	23.5	Very low	27.4	Very low	194 Å²	194	133.6 Å²	133.6	85%	0.851	79%	0.793	S	S	*	*			trans	69.3	121	168.2	-67.8	-81.3	0	0	0	115.9
541	T	26.3	Very low	27.4	Very low	118 Å²	118	136.5 Å²	136.5	72%	0.724	80%	0.799	S	S	*	*			cis	-157.1	144	47.6	40.5	0	0	0	0	113.4
542	N	27.1	Very low	27.4	Very low	167 Å²	167	132.9 Å²	132.9	89%	0.893	79%	0.788	S	S	*	*			trans	-176.6	146	135.1	-102.8	-35.6	0	0	0	111.8
543	A	23.9	Very low	27.6	Very low	93 Å²	93	134.5 Å²	134.5	77%	0.769	79%	0.786	S	S	*	*			trans	-153.9	112.5	173.1	0	0	0	0	0	111.5
544	M	26.2	Very low	27.8	Very low	177 Å²	177	134.5 Å²	134.5	87%	0.872	78%	0.779	S	S	*	*			trans	-167.1	148.5	152.3	-114	-167.7	171.6	0	0	113.3
545	L	27.5	Very low	27.5	Very low	133 Å²	133	132.7 Å²	132.7	70%	0.696	77%	0.773	S	S	*	*			trans	50.8	83.8	157.3	-90.2	60.2	0	0	0	120.4
546	I	26.3	Very low	27.8	Very low	168 Å²	168	132.9 Å²	132.9	86%	0.862	77%	0.765	S	S	*	*				41	124	108.5	-54.5	163.3	0	0	0	118
547	G	25.5	Very low	28.1	Very low	72 Å²	72	131.5 Å²	131.5	74%	0.742	75%	0.753	S	S	*	*			trans	142.2	61.7	132.3	0	0	0	0	0	121.6
548	S	29.5	Very low	28.5	Very low	114 Å²	114	130.8 Å²	130.8	80%	0.797	74%	0.74	S	S	*	*			trans	-167.2	119	155.1	57.4	0	0	0	0	114.2
549	T	27.5	Very low	28.8	Very low	142 Å²	142	133.1 Å²	133.1	87%	0.871	73%	0.732	S	S	*	*			trans	-142.9	78.5	171.6	52.4	0	0	0	0	112.2
550	L	27.3	Very low	29.3	Very low	164 Å²	164	132.1 Å²	132.1	86%	0.859	72%	0.722	S	S	*	*			trans	-155.3	33.6	167.6	-120.2	163.1	0	0	0	113.2
551	I	28.6	Very low	30.2	Very low	163 Å²	163	127 Å²	127	84%	0.836	70%	0.703	S	S	*	*			trans	-134.5	74.8	175.9	-46.8	176.8	0	0	0	111.1
552	P	27.9	Very low	30.9	Very low	92 Å²	92	125.7 Å²	125.7	60%	0.597	69%	0.692	S	S	*	*	S	Bend	trans	-142.1	13	156.7	39.5	-23.7	0	0	0	116.4
553	Q	29	Very low	31.4	Very low	176 Å²	176	122 Å²	122	82%	0.822	67%	0.669	S	S	*	*	S	Bend	trans	-98.1	-32.9	178.3	-76.3	-169.6	-17.5	0	0	115.2
554	M	30.7	Very low	32.2	Very low	126 Å²	126	121.1 Å²	121.1	62%	0.621	65%	0.654	S	S	*	*	H	α-helix	trans	-69.6	-39.8	176.9	-75.1	-102	51.9	0	0	113	L556 F557 D558	M554-L556 PolarHBondContact O-N 3.38Å; M554-F557 HydrophobicContact CE-CB 4.48Å; M554-F557 PolarHBondContact O-N 2.95Å; M554-D558 PolarHBondContact O-N 2.9Å
555	A	32.5	Very low	32.8	Very low	73 Å²	73	116 Å²	116	60%	0.603	63%	0.633	S	S	*	*	H	α-helix	trans	-65.5	-13.3	-173.9	0	0	0	0	0	115.3
556	L	31.9	Very low	33.3	Very low	109 Å²	109	115.5 Å²	115.5	57%	0.571	63%	0.625	S	S	*	*	H	α-helix	trans	-84.9	-37.8	171.5	-76.2	166.8	0	0	0	111.8	M554 R559 E560	M554-L556 PolarHBondContact O-N 3.38Å; L556-R559 WeakPolarHBondContact O-CB 3.13Å; L556-R559 PolarHBondContact O-N 3.16Å; L556-E560 PolarHBondContact O-N 3.08Å
557	F	34.9	Very low	33.8	Very low	115 Å²	115	114.2 Å²	114.2	50%	0.504	62%	0.619	S	S	.	*	H	α-helix	trans	-70.4	-41.7	-177.4	-156.1	-109.6	0	0	0	111.9	M554 R559 E560 I561	M554-F557 HydrophobicContact CE-CB 4.48Å; M554-F557 PolarHBondContact O-N 2.95Å; F557-R559 PolarHBondContact O-N 3.19Å; F557-E560 PolarHBondContact O-N 2.88Å; F557-I561 HydrophobicContact CD1-CD1 3.88Å; F557-I561 HydrophobicContact CE1-CD1 3.77Å; F557-I561 PolarHBondContact O-N 2.59Å; F557-I561 VanDerWaalsContact O-N 3.15Å
558	D	37.3	Very low	34.2	Very low	89 Å²	89	117.2 Å²	117.2	48%	0.476	62%	0.616	S	S	.	*	H	α-helix	trans	-58.7	-29.9	172.6	-74.2	-40.4	0	0	0	112.5	M554 N562	M554-D558 PolarHBondContact O-N 2.9Å; D558-N562 WeakPolarHBondContact O-CB 3.38Å; D558-N562 PolarHBondContact O-N 2.97Å; D558-N562 VanDerWaalsContact O-N 3.13Å; D558-N562 PolarHBondContact O-ND2 3.07Å
559	R	36.3	Very low	34.3	Very low	164 Å²	164	117.3 Å²	117.3	62%	0.619	61%	0.607	S	S	*	*	H	α-helix	trans	-71	-42.6	178.6	-162.1	179	71.9	148.8	3.7	111.4	L556 F557 N562 E563	L556-R559 WeakPolarHBondContact O-CB 3.13Å; L556-R559 PolarHBondContact O-N 3.16Å; F557-R559 PolarHBondContact O-N 3.19Å; R559-N562 PolarHBondContact O-N 3.41Å; R559-E563 WeakPolarHBondContact O-CG 3.45Å; R559-E563 PolarHBondContact O-N 2.9Å
560	E	35.1	Very low	34.5	Very low	125 Å²	125	113.2 Å²	113.2	58%	0.584	59%	0.593	S	S	*	*	H	α-helix	trans	-69.8	-40.8	-179.5	-65.3	-174.1	152.7	0	0	111.9	L556 F557 N562 E563 V564	L556-E560 PolarHBondContact O-N 3.08Å; F557-E560 PolarHBondContact O-N 2.88Å; E560-N562 VanDerWaalsContact C-N 3.31Å; E560-N562 PolarHBondContact O-N 3.03Å; E560-E563 PolarHBondContact O-N 3.5Å; E560-V564 WeakPolarHBondContact O-CB 3.15Å; E560-V564 WeakPolarHBondContact O-CG2 3.43Å; E560-V564 PolarHBondContact O-N 2.87Å
561	I	42.9	Very low	34.5	Very low	88 Å²	88	114.4 Å²	114.4	45%	0.451	59%	0.594	S	S	.	*	H	α-helix	trans	-62.1	-38.9	173.2	-66.9	177.3	0	0	0	111.2	F557 T565	F557-I561 HydrophobicContact CD1-CD1 3.88Å; F557-I561 HydrophobicContact CE1-CD1 3.77Å; F557-I561 PolarHBondContact O-N 2.59Å; F557-I561 VanDerWaalsContact O-N 3.15Å; I561-T565 VanDerWaalsContact O-CB 3.29Å; I561-T565 WeakPolarHBondContact O-CB 3.39Å; I561-T565 PolarHBondContact O-N 2.75Å; I561-T565 PolarHBondContact O-OG1 2.95Å
562	N	40.5	Very low	34.4	Very low	90 Å²	90	113.8 Å²	113.8	48%	0.481	60%	0.598	S	S	.	*	H	α-helix	trans	-67.7	-41.2	175.4	-87.9	-77.6	0	0	0	113	D558 R559 E560 T565 K566	D558-N562 WeakPolarHBondContact O-CB 3.38Å; D558-N562 PolarHBondContact O-N 2.97Å; D558-N562 VanDerWaalsContact O-N 3.13Å; D558-N562 PolarHBondContact O-ND2 3.07Å; R559-N562 PolarHBondContact O-N 3.41Å; E560-N562 VanDerWaalsContact C-N 3.31Å; E560-N562 PolarHBondContact O-N 3.03Å; N562-T565 PolarHBondContact O-N 3.47Å; N562-K566 VanDerWaalsContact O-CG 3.25Å; N562-K566 WeakPolarHBondContact O-CG 3.21Å; N562-K566 PolarHBondContact O-N 3.09Å
563	E	38.6	Very low	34.5	Very low	89 Å²	89	116.2 Å²	116.2	42%	0.416	61%	0.611	S	S	.	*	H	α-helix	trans	-64.8	-43.1	175.4	-69.4	-53.2	117.6	0	0	112	R559 E560 T565 K566 L567	R559-E563 WeakPolarHBondContact O-CG 3.45Å; R559-E563 PolarHBondContact O-N 2.9Å; E560-E563 PolarHBondContact O-N 3.5Å; E563-T565 VanDerWaalsContact C-N 3.31Å; E563-T565 PolarHBondContact O-N 2.93Å; E563-K566 PolarHBondContact O-N 3.22Å; E563-K566 IonicContact OE1-NZ 3.4Å; E563-K566 PolarHBondContact OE1-NZ 3.12Å; E563-L567 WeakPolarHBondContact O-CB 3.18Å; E563-L567 WeakPolarHBondContact O-CG 3.28Å; E563-L567 PolarHBondContact O-N 3.16Å
564	V	39.4	Very low	34.3	Very low	75 Å²	75	112.8 Å²	112.8	46%	0.455	61%	0.607	S	S	.	*	H	α-helix	trans	-61.4	-39.3	174.2	170.4	0	0	0	0	111.5	E560 L567 M568	E560-V564 WeakPolarHBondContact O-CB 3.15Å; E560-V564 WeakPolarHBondContact O-CG2 3.43Å; E560-V564 PolarHBondContact O-N 2.87Å; V564-L567 PolarHBondContact O-N 3.22Å; V564-M568 HydrophobicContact CG1-CE 3.45Å; V564-M568 VanDerWaalsContact CG1-CE 3.45Å; V564-M568 PolarHBondContact O-N 3.02Å; V564-M568 VanDerWaalsContact O-N 3.13Å
565	T	40.6	Very low	34.2	Very low	69 Å²	69	113.7 Å²	113.7	42%	0.423	62%	0.619	S	S	.	*	H	α-helix	trans	-70.8	-35.6	178.4	-57.6	0	0	0	0	112.6	I561 N562 E563 N569	I561-T565 VanDerWaalsContact O-CB 3.29Å; I561-T565 WeakPolarHBondContact O-CB 3.39Å; I561-T565 PolarHBondContact O-N 2.75Å; I561-T565 PolarHBondContact O-OG1 2.95Å; N562-T565 PolarHBondContact O-N 3.47Å; E563-T565 VanDerWaalsContact C-N 3.31Å; E563-T565 PolarHBondContact O-N 2.93Å; T565-N569 PolarHBondContact O-N 3.46Å; T565-N569 PolarHBondContact O-ND2 3.47Å
566	K	38	Very low	33.8	Very low	122 Å²	122	114.3 Å²	114.3	53%	0.53	62%	0.619	S	S	.	*	H	α-helix	trans	-65.1	-47.8	171.6	-72.2	167.6	-169	173.4	0	111.3	N562 E563 M568 N569 G570	N562-K566 VanDerWaalsContact O-CG 3.25Å; N562-K566 WeakPolarHBondContact O-CG 3.21Å; N562-K566 PolarHBondContact O-N 3.09Å; E563-K566 PolarHBondContact O-N 3.22Å; E563-K566 IonicContact OE1-NZ 3.4Å; E563-K566 PolarHBondContact OE1-NZ 3.12Å; K566-M568 PolarHBondContact O-N 2.77Å; K566-N569 CarbonylContact O-C 3.59Å; K566-N569 PolarHBondContact O-N 3.06Å; K566-G570 PolarHBondContact O-N 3.38Å
567	L	35.8	Very low	33.6	Very low	142 Å²	142	115.2 Å²	115.2	74%	0.743	63%	0.63	S	S	*	*	H	α-helix	trans	-58.2	-34.5	178.4	-76.7	165.2	0	0	0	112.3	E563 V564	E563-L567 WeakPolarHBondContact O-CB 3.18Å; E563-L567 WeakPolarHBondContact O-CG 3.28Å; E563-L567 PolarHBondContact O-N 3.16Å; V564-L567 PolarHBondContact O-N 3.22Å
568	M	34.1	Very low	33.2	Very low	135 Å²	135	115.8 Å²	115.8	67%	0.665	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-5.6	176	-73.3	-162	-102	0	0	115.6	V564 K566	V564-M568 HydrophobicContact CG1-CE 3.45Å; V564-M568 VanDerWaalsContact CG1-CE 3.45Å; V564-M568 PolarHBondContact O-N 3.02Å; V564-M568 VanDerWaalsContact O-N 3.13Å; K566-M568 PolarHBondContact O-N 2.77Å
569	N	32.2	Very low	32.7	Very low	116 Å²	116	118 Å²	118	62%	0.62	65%	0.648	S	S	*	*	S	Bend	trans	-132.5	20.5	-176.9	-69.8	-83.8	0	0	0	114.5	T565 K566	T565-N569 PolarHBondContact O-N 3.46Å; T565-N569 PolarHBondContact O-ND2 3.47Å; K566-N569 CarbonylContact O-C 3.59Å; K566-N569 PolarHBondContact O-N 3.06Å
570	G	30.4	Very low	32.4	Very low	56 Å²	56	118.5 Å²	118.5	58%	0.577	66%	0.657	S	S	*	*			trans	-149.4	72.6	-168.6	0	0	0	0	0	117.9	K566	K566-G570 PolarHBondContact O-N 3.38Å
571	Q	28.4	Very low	31.8	Very low	189 Å²	189	119.1 Å²	119.1	88%	0.883	67%	0.665	S	S	*	*			trans	-139.3	90.7	150.6	-84.4	-157.3	-9.9	0	0	112.3
572	T	26.6	Very low	31.2	Very low	149 Å²	149	121.1 Å²	121.1	91%	0.914	68%	0.681	S	S	*	*				177.3	97.6	129.8	23.8	0	0	0	0	109.8
573	T	28.5	Very low	30.5	Very low	143 Å²	143	122.4 Å²	122.4	88%	0.877	69%	0.692	S	S	*	*			trans	-123.7	128.1	161.3	47	0	0	0	0	108.5
574	S	25.6	Very low	29.9	Very low	104 Å²	104	126.6 Å²	126.6	73%	0.727	71%	0.714	S	S	*	*			trans	-75.2	139.7	-174.6	50.6	0	0	0	0	113
575	V	28.1	Very low	29.5	Very low	146 Å²	146	127.1 Å²	127.1	89%	0.885	72%	0.721	S	S	*	*			trans	-97.6	146.8	148	-178.2	0	0	0	0	107.2
576	S	24.2	Very low	28.8	Very low	86 Å²	86	130.7 Å²	130.7	60%	0.601	74%	0.737	S	S	*	*			trans	-142.2	170.1	-174.5	-68.8	0	0	0	0	111.3
577	T	27.9	Very low	28.4	Very low	128 Å²	128	131.7 Å²	131.7	79%	0.785	75%	0.749	S	S	*	*			trans	76.3	135.4	-170.3	74.9	0	0	0	0	113.5
578	N	27	Very low	27.9	Very low	127 Å²	127	131 Å²	131	68%	0.679	75%	0.746	S	S	*	*			cis	-153.5	146.9	6.5	-122.2	-7.6	0	0	0	114
579	I	25.7	Very low	27.6	Very low	136 Å²	136	131.7 Å²	131.7	70%	0.697	75%	0.752	S	S	*	*			trans	65	120.4	145.9	-62.3	163.7	0	0	0	116.2
580	H	30	Very low	27.3	Very low	174 Å²	174	131.6 Å²	131.6	81%	0.806	76%	0.756	S	S	*	*				-157.1	176.8	63.3	-147	68.8	0	0	0	113.5
581	N	24	Very low	27.1	Very low	138 Å²	138	138.1 Å²	138.1	74%	0.738	77%	0.768	S	S	*	*			trans	-97.8	148.9	-167.7	-60.4	-49	0	0	0	115.8
582	T	29	Very low	26.9	Very low	130 Å²	130	136 Å²	136	80%	0.798	76%	0.763	S	S	*	*			trans	-164.6	105.9	131.3	13.9	0	0	0	0	115.8
583	T	26.6	Very low	27	Very low	116 Å²	116	133.5 Å²	133.5	71%	0.712	75%	0.751	S	S	*	*			trans	49.9	138.1	130	58.3	0	0	0	0	125.1
584	M	26.6	Very low	26.8	Very low	178 Å²	178	138.1 Å²	138.1	88%	0.877	75%	0.753	S	S	*	*			trans	75.4	148	151.5	-60.1	-106.2	106.3	0	0	117.2
585	S	29.4	Very low	26.9	Very low	86 Å²	86	140.7 Å²	140.7	60%	0.601	76%	0.764	S	S	*	*			cis	-163.5	160.9	-10.3	172.9	0	0	0	0	110.4
586	N	26.3	Very low	26.9	Very low	143 Å²	143	136.9 Å²	136.9	77%	0.765	75%	0.754	S	S	*	*			trans	-3.9	154.2	159.6	-52.5	-23.1	0	0	0	119.5
587	N	29.4	Very low	26.9	Very low	144 Å²	144	139.1 Å²	139.1	77%	0.77	77%	0.768	S	S	*	*			cis	-165.9	-178.3	37.5	-149.1	-16.2	0	0	0	114
588	N	25.7	Very low	26.8	Very low	128 Å²	128	141 Å²	141	68%	0.684	77%	0.773	S	S	*	*			trans	-90.9	143.5	-172.9	-52.6	-86.6	0	0	0	115
589	N	28.2	Very low	26.8	Very low	148 Å²	148	144.2 Å²	144.2	79%	0.791	78%	0.78	S	S	*	*				164.5	120.7	109.9	-89.3	-33	0	0	0	117
590	V	26.2	Very low	27	Very low	115 Å²	115	143.5 Å²	143.5	70%	0.697	79%	0.785	S	S	*	*				56.3	122.8	123.5	-176.5	0	0	0	0	122.1
591	K	25.6	Very low	27	Very low	192 Å²	192	142 Å²	142	84%	0.835	78%	0.781	S	S	*	*			trans	86.3	96.6	151.9	-81.8	171.4	-175.1	-179.5	0	122.8
592	D	25.1	Very low	27.4	Very low	146 Å²	146	144 Å²	144	78%	0.781	78%	0.778	S	S	*	*				106.2	132.8	107.2	-140.5	-11.4	0	0	0	121.7
593	S	27.6	Very low	27.5	Very low	96 Å²	96	142.4 Å²	142.4	67%	0.671	76%	0.764	S	S	*	*			trans	67.7	113.9	160.3	74.2	0	0	0	0	122.7
594	R	25.2	Very low	28.1	Very low	240 Å²	240	142.4 Å²	142.4	91%	0.906	76%	0.76	S	S	*	*			trans	60.6	97.7	145.3	-60.2	-179.6	-179.3	173.8	1.7	121.4
595	V	27	Very low	28.8	Very low	158 Å²	158	141.6 Å²	141.6	96%	0.958	75%	0.754	S	S	*	*				-146.1	150	124.2	-177.9	0	0	0	0	108.7
596	G	27.5	Very low	29.2	Very low	66 Å²	66	140.5 Å²	140.5	68%	0.68	75%	0.745	S	S	*	*			trans	107.5	15.5	141	0	0	0	0	0	121.8	L598	G596-L598 PolarHBondContact O-N 2.67Å; G596-L598 VanDerWaalsContact O-N 3.08Å
597	C	25.6	Very low	29.9	Very low	133 Å²	133	139.5 Å²	139.5	90%	0.899	74%	0.739	S	S	*	*			trans	-72.7	101	169.7	-76.7	0	0	0	0	111.9	K599	C597-K599 PolarHBondContact O-N 3.4Å
598	L	25.6	Very low	30.8	Very low	168 Å²	168	136.6 Å²	136.6	88%	0.88	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-62.7	127.2	163.4	-73.4	167.3	0	0	0	109.6	G596	G596-L598 PolarHBondContact O-N 2.67Å; G596-L598 VanDerWaalsContact O-N 3.08Å
599	K	27.1	Very low	31.8	Very low	194 Å²	194	134.3 Å²	134.3	84%	0.843	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-78.1	129	172.6	-71.1	-177.8	178.6	179.2	0	109.7	C597	C597-K599 PolarHBondContact O-N 3.4Å
600	P	30.3	Very low	32.4	Very low	121 Å²	121	130.1 Å²	130.1	79%	0.786	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-67.9	138.6	162.3	29.5	-32.7	0	0	0	109.8
601	I	28.9	Very low	33.5	Very low	143 Å²	143	128.6 Å²	128.6	73%	0.733	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-73.5	134.6	177.9	-62.3	171.6	0	0	0	109	L603	I601-L603 PolarHBondContact O-N 3.34Å
602	R	33.1	Very low	34.7	Very low	179 Å²	179	125.8 Å²	125.8	68%	0.675	68%	0.676	S	S	*	*			trans	-75.5	110.6	176.5	-77.9	-173.2	173.5	-176.5	-1	110.1	E171	E171-R602 IonicContact OE1-CZ 2.74Å; E171-R602 IonicContact OE1-NH1 2.67Å; E171-R602 PolarHBondContact OE1-NH1 3.44Å; E171-R602 IonicContact OE1-NH2 3.29Å; E171-R602 PolarHBondContact OE1-NH2 3.4Å; E171-R602 IonicContact OE2-NH2 2.72Å
603	L	31	Very low	35.7	Very low	97 Å²	97	120.3 Å²	120.3	51%	0.508	65%	0.651	S	S	.	*			trans	-94.5	17.7	175	-83.1	165.8	0	0	0	113.6	I601	I601-L603 PolarHBondContact O-N 3.34Å
604	N	39.2	Very low	36.7	Very low	115 Å²	115	120.7 Å²	120.7	62%	0.615	64%	0.641	S	S	*	*	H	α-helix	trans	-80.7	-21.7	-167.8	-68.5	20.8	0	0	0	114.7	T608	N604-T608 PolarHBondContact O-N 3.33Å; N604-T608 PolarHBondContact O-OG1 2.78Å
605	E	40.5	Very low	38.2	Very low	161 Å²	161	111.4 Å²	111.4	75%	0.752	62%	0.615	S	S	*	*	H	α-helix	trans	-72.7	-48.6	-175.7	-66.3	-177.9	171.9	0	0	113.2	L607 T608 T609	E605-L607 VanDerWaalsContact C-N 3.35Å; E605-L607 PolarHBondContact O-N 2.96Å; E605-T608 PolarHBondContact O-N 3.41Å; E605-T608 VanDerWaalsContact O-N 3.12Å; E605-T609 PolarHBondContact O-N 3.42Å; E605-T609 PolarHBondContact O-OG1 2.82Å
606	P	38.9	Very low	39.4	Very low	63 Å²	63	110.1 Å²	110.1	41%	0.409	60%	0.599	S	S	.	*	H	α-helix	trans	-58.6	-41.7	-178.5	-26.3	35.7	0	0	0	113.8	T608 T609 M610	P606-T608 PolarHBondContact O-N 3.07Å; P606-T609 PolarHBondContact O-N 3.16Å; P606-M610 WeakPolarHBondContact O-CB 3.45Å; P606-M610 PolarHBondContact O-N 2.99Å
607	L	40.5	Very low	40.5	Very low	122 Å²	122	108.2 Å²	108.2	64%	0.639	57%	0.574	S	S	*	*	H	α-helix	trans	-63.5	-39.3	177.4	-84.6	148	0	0	0	112.4	E605 M610 S611	E605-L607 VanDerWaalsContact C-N 3.35Å; E605-L607 PolarHBondContact O-N 2.96Å; L607-M610 PolarHBondContact O-N 2.81Å; L607-S611 WeakPolarHBondContact O-CB 3.33Å; L607-S611 PolarHBondContact O-N 3.25Å
608	T	47.6	Very low	41.8	Very low	83 Å²	83	107.2 Å²	107.2	51%	0.509	56%	0.56	S	S	.	*	H	α-helix	trans	-67.6	-39.7	178.3	-54.2	0	0	0	0	111	N604 E605 P606 K612	N604-T608 PolarHBondContact O-N 3.33Å; N604-T608 PolarHBondContact O-OG1 2.78Å; E605-T608 PolarHBondContact O-N 3.41Å; E605-T608 VanDerWaalsContact O-N 3.12Å; P606-T608 PolarHBondContact O-N 3.07Å; T608-K612 PolarHBondContact O-N 3.2Å
609	T	46.9	Very low	43.3	Very low	80 Å²	80	104.5 Å²	104.5	49%	0.491	55%	0.546	S	S	.	.	H	α-helix	trans	-67	-43.9	174.8	-57.4	0	0	0	0	111.8	E605 P606 S611 K612 A613	E605-T609 PolarHBondContact O-N 3.42Å; E605-T609 PolarHBondContact O-OG1 2.82Å; P606-T609 PolarHBondContact O-N 3.16Å; T609-S611 PolarHBondContact O-N 3.06Å; T609-K612 PolarHBondContact O-N 3Å; T609-A613 PolarHBondContact O-N 3.35Å; T609-A613 VanDerWaalsContact O-N 3.08Å
610	M	41.6	Very low	44.5	Very low	60 Å²	60	97.2 Å²	97.2	30%	0.296	52%	0.522	S	S	.	.	H	α-helix	trans	-60.1	-44.7	177	-131.1	176.3	-68.9	0	0	111.7	P606 L607 K612 A613 F614 M657 I661	P606-M610 WeakPolarHBondContact O-CB 3.45Å; P606-M610 PolarHBondContact O-N 2.99Å; L607-M610 PolarHBondContact O-N 2.81Å; M610-K612 VanDerWaalsContact C-N 3.26Å; M610-K612 PolarHBondContact O-N 3.1Å; M610-A613 PolarHBondContact O-N 3.06Å; M610-F614 HydrophobicContact CG-CE2 4.05Å; M610-F614 WeakPolarHBondContact O-CD2 3.42Å; M610-F614 PolarHBondContact O-N 2.97Å; M610-F614 VanDerWaalsContact O-N 3.07Å; M610-M657 HydrophobicContact CG-CE 4.36Å; M610-M657 HydrophobicContact CG-SD 4.35Å; M610-I661 HydrophobicContact CE-CD1 3.87Å; M610-I661 HydrophobicContact CE-CG1 4.16Å; M610-I661 HydrophobicContact SD-CD1 4.28Å
611	S	48.5	Very low	45.6	Very low	84 Å²	84	94.9 Å²	94.9	59%	0.587	50%	0.502	S	S	*	.	H	α-helix	trans	-63.7	-28.4	178.1	-173.3	0	0	0	0	113.6	L607 T609 A615	L607-S611 WeakPolarHBondContact O-CB 3.33Å; L607-S611 PolarHBondContact O-N 3.25Å; T609-S611 PolarHBondContact O-N 3.06Å; S611-A615 PolarHBondContact O-N 2.78Å
612	K	50.4	Low	47	Very low	132 Å²	132	90.8 Å²	90.8	57%	0.574	49%	0.49	S	S	*	.	H	α-helix	trans	-72.6	-47	172	-73.8	-178.8	175.1	-174.6	0	111.4	T608 T609 M610 F614 A615 E616	T608-K612 PolarHBondContact O-N 3.2Å; T609-K612 PolarHBondContact O-N 3Å; M610-K612 VanDerWaalsContact C-N 3.26Å; M610-K612 PolarHBondContact O-N 3.1Å; K612-F614 VanDerWaalsContact C-N 3.31Å; K612-F614 PolarHBondContact O-N 3.35Å; K612-A615 PolarHBondContact O-N 2.89Å; K612-A615 VanDerWaalsContact O-N 3.07Å; K612-E616 WeakPolarHBondContact O-CG 3.32Å; K612-E616 PolarHBondContact O-N 3.41Å
613	A	45.9	Very low	48.1	Very low	31 Å²	31	88.4 Å²	88.4	26%	0.256	49%	0.486	S	S	.	.	H	α-helix	trans	-58.7	-40.2	179.8	0	0	0	0	0	112.7	T609 M610 E616 V617 M657	T609-A613 PolarHBondContact O-N 3.35Å; T609-A613 VanDerWaalsContact O-N 3.08Å; M610-A613 PolarHBondContact O-N 3.06Å; A613-E616 PolarHBondContact O-N 3.39Å; A613-V617 WeakPolarHBondContact O-CG2 3.37Å; A613-V617 PolarHBondContact O-N 2.92Å; A613-V617 VanDerWaalsContact O-N 3.1Å; A613-M657 HydrophobicContact CB-CE 4.28Å
614	F	49.7	Very low	49.1	Very low	105 Å²	105	86.1 Å²	86.1	46%	0.461	48%	0.476	S	S	.	.	H	α-helix	trans	-63.4	-44.5	173.1	-76.6	-66.2	0	0	0	112.5	M610 K612 E616 V617 D618 M657	M610-F614 HydrophobicContact CG-CE2 4.05Å; M610-F614 WeakPolarHBondContact O-CD2 3.42Å; M610-F614 PolarHBondContact O-N 2.97Å; M610-F614 VanDerWaalsContact O-N 3.07Å; K612-F614 VanDerWaalsContact C-N 3.31Å; K612-F614 PolarHBondContact O-N 3.35Å; F614-E616 VanDerWaalsContact C-N 3.3Å; F614-E616 PolarHBondContact O-N 3.22Å; F614-V617 PolarHBondContact O-N 2.86Å; F614-D618 PolarHBondContact O-N 2.92Å; F614-M657 HydrophobicContact CD1-CE 4.21Å; F614-M657 HydrophobicContact CD2-CE 4.15Å; F614-M657 HydrophobicContact CE1-CE 3.83Å; F614-M657 HydrophobicContact CE2-CE 3.75Å; F614-M657 HydrophobicContact CE2-SD 4.35Å; F614-M657 HydrophobicContact CG-CE 4.36Å; F614-M657 HydrophobicContact CZ-CE 3.58Å; F614-M657 HydrophobicContact CZ-SD 3.98Å
615	A	56	Low	49.7	Very low	44 Å²	44	84.2 Å²	84.2	36%	0.364	47%	0.468	S	S	.	.	H	α-helix	trans	-65.8	-30.2	177.9	0	0	0	0	0	113.2	S611 K612 N619	S611-A615 PolarHBondContact O-N 2.78Å; K612-A615 PolarHBondContact O-N 2.89Å; K612-A615 VanDerWaalsContact O-N 3.07Å; A615-N619 WeakPolarHBondContact O-CB 3.36Å; A615-N619 PolarHBondContact O-N 3.33Å; A615-N619 PolarHBondContact O-ND2 2.89Å
616	E	52.9	Low	50.4	Low	131 Å²	131	79.8 Å²	79.8	61%	0.612	46%	0.455	S	S	*	.	H	α-helix	trans	-69.7	-40.4	172.8	-73.6	168.3	-168.1	0	0	111.6	K612 A613 F614 N619 A620	K612-E616 WeakPolarHBondContact O-CG 3.32Å; K612-E616 PolarHBondContact O-N 3.41Å; A613-E616 PolarHBondContact O-N 3.39Å; F614-E616 VanDerWaalsContact C-N 3.3Å; F614-E616 PolarHBondContact O-N 3.22Å; E616-N619 PolarHBondContact O-N 3.49Å; E616-A620 WeakPolarHBondContact O-CB 3.41Å; E616-A620 PolarHBondContact O-N 3.43Å
617	V	50.9	Low	51.1	Low	26 Å²	26	82.4 Å²	82.4	16%	0.158	47%	0.466	C	S	.	.	H	α-helix	trans	-65.1	-45.4	174.1	170.8	0	0	0	0	112	A613 F614 N619 A620 I621 T653	A613-V617 WeakPolarHBondContact O-CG2 3.37Å; A613-V617 PolarHBondContact O-N 2.92Å; A613-V617 VanDerWaalsContact O-N 3.1Å; F614-V617 PolarHBondContact O-N 2.86Å; V617-N619 VanDerWaalsContact C-N 3.32Å; V617-N619 PolarHBondContact O-N 2.89Å; V617-A620 PolarHBondContact O-N 3.16Å; V617-I621 HydrophobicContact CG1-CD1 3.76Å; V617-I621 HydrophobicContact CG1-CG1 4.4Å; V617-I621 WeakPolarHBondContact O-CG1 3.35Å; V617-I621 PolarHBondContact O-N 3.1Å; V617-T653 HydrophobicContact CG2-CG2 4.05Å
618	D	52.1	Low	51.5	Low	113 Å²	113	79.6 Å²	79.6	60%	0.604	46%	0.46	S	S	*	.	H	α-helix	trans	-59.2	-42.7	177	-79.4	-21	0	0	0	111.7	F614 I621 A622	F614-D618 PolarHBondContact O-N 2.92Å; D618-I621 PolarHBondContact O-N 3.48Å; D618-A622 WeakPolarHBondContact O-CB 3.47Å; D618-A622 PolarHBondContact O-N 2.84Å
619	N	57.5	Low	51.6	Low	110 Å²	110	84 Å²	84	59%	0.588	47%	0.473	S	S	*	.	H	α-helix	trans	-66.3	-39.4	175.9	-79.2	-54.3	0	0	0	112.5	A615 E616 V617 A622 Q623	A615-N619 WeakPolarHBondContact O-CB 3.36Å; A615-N619 PolarHBondContact O-N 3.33Å; A615-N619 PolarHBondContact O-ND2 2.89Å; E616-N619 PolarHBondContact O-N 3.49Å; V617-N619 VanDerWaalsContact C-N 3.32Å; V617-N619 PolarHBondContact O-N 2.89Å; N619-A622 PolarHBondContact O-N 3.27Å; N619-Q623 PolarHBondContact O-N 3.38Å
620	A	52.1	Low	51.4	Low	42 Å²	42	84.4 Å²	84.4	35%	0.347	48%	0.479	S	S	.	.	H	α-helix	trans	-64.1	-44	176.2	0	0	0	0	0	111.7	E616 V617 Q623 V624	E616-A620 WeakPolarHBondContact O-CB 3.41Å; E616-A620 PolarHBondContact O-N 3.43Å; V617-A620 PolarHBondContact O-N 3.16Å; A620-Q623 PolarHBondContact O-N 3.47Å; A620-V624 WeakPolarHBondContact O-CG2 3.25Å; A620-V624 PolarHBondContact O-N 3.5Å
621	I	54.4	Low	51.3	Low	71 Å²	71	86 Å²	86	36%	0.364	50%	0.496	S	S	.	.	H	α-helix	trans	-62.3	-45.3	174.8	-67.4	169.3	0	0	0	110.2	V617 D618 Q623 V624 V625	V617-I621 HydrophobicContact CG1-CD1 3.76Å; V617-I621 HydrophobicContact CG1-CG1 4.4Å; V617-I621 WeakPolarHBondContact O-CG1 3.35Å; V617-I621 PolarHBondContact O-N 3.1Å; D618-I621 PolarHBondContact O-N 3.48Å; I621-Q623 PolarHBondContact O-N 3.45Å; I621-V624 PolarHBondContact O-N 3.43Å; I621-V625 HydrophobicContact CG2-CG2 4.41Å; I621-V625 WeakPolarHBondContact O-CG2 3.38Å; I621-V625 PolarHBondContact O-N 3.06Å
622	A	58.2	Low	50.8	Low	57 Å²	57	87.5 Å²	87.5	47%	0.471	50%	0.503	S	S	.	.	H	α-helix	trans	-60	-40.9	178	0	0	0	0	0	112.8	D618 N619 S626	D618-A622 WeakPolarHBondContact O-CB 3.47Å; D618-A622 PolarHBondContact O-N 2.84Å; N619-A622 PolarHBondContact O-N 3.27Å; A622-S626 VanDerWaalsContact O-CB 3.32Å; A622-S626 WeakPolarHBondContact O-CB 3.42Å; A622-S626 PolarHBondContact O-N 3.01Å
623	Q	55.3	Low	50.1	Low	130 Å²	130	86.4 Å²	86.4	61%	0.607	51%	0.513	S	S	*	.	H	α-helix	trans	-67.9	-43.4	174.9	-76.1	-160.5	-7.5	0	0	112.9	N619 A620 I621 V625 S626 N627	N619-Q623 PolarHBondContact O-N 3.38Å; A620-Q623 PolarHBondContact O-N 3.47Å; I621-Q623 PolarHBondContact O-N 3.45Å; Q623-V625 VanDerWaalsContact C-N 3.3Å; Q623-V625 PolarHBondContact O-N 3.29Å; Q623-S626 PolarHBondContact O-N 3.38Å; Q623-N627 WeakPolarHBondContact O-CB 3.46Å; Q623-N627 VanDerWaalsContact O-CG 3.22Å; Q623-N627 PolarHBondContact O-N 3.43Å; Q623-N627 PolarHBondContact O-ND2 2.79Å
624	V	51.2	Low	49.6	Very low	49 Å²	49	91.9 Å²	91.9	30%	0.297	54%	0.543	S	S	.	.	H	α-helix	trans	-60.5	-41.3	177.1	170.7	0	0	0	0	111	A620 I621 A628 I642 I646	A620-V624 WeakPolarHBondContact O-CG2 3.25Å; A620-V624 PolarHBondContact O-N 3.5Å; I621-V624 PolarHBondContact O-N 3.43Å; V624-A628 WeakPolarHBondContact O-CB 3.36Å; V624-A628 PolarHBondContact O-N 2.8Å; V624-A628 VanDerWaalsContact O-N 3.17Å; V624-I642 HydrophobicContact CG1-CG2 3.78Å; V624-I646 HydrophobicContact CG1-CD1 4.21Å; V624-I646 HydrophobicContact CG1-CG1 4.47Å
625	V	52.9	Low	48.9	Very low	74 Å²	74	94.1 Å²	94.1	45%	0.448	56%	0.56	S	S	.	*	H	α-helix	trans	-66.3	-46.7	174.6	172.7	0	0	0	0	111.5	I621 Q623 N627 A628 F629	I621-V625 HydrophobicContact CG2-CG2 4.41Å; I621-V625 WeakPolarHBondContact O-CG2 3.38Å; I621-V625 PolarHBondContact O-N 3.06Å; Q623-V625 VanDerWaalsContact C-N 3.3Å; Q623-V625 PolarHBondContact O-N 3.29Å; V625-N627 VanDerWaalsContact C-N 3.34Å; V625-N627 PolarHBondContact O-N 2.93Å; V625-A628 PolarHBondContact O-N 3.18Å; V625-A628 VanDerWaalsContact O-N 3.16Å; V625-F629 HydrophobicContact CG1-CD2 4.15Å; V625-F629 HydrophobicContact CG1-CE2 4.18Å; V625-F629 WeakPolarHBondContact O-CD2 3.38Å; V625-F629 PolarHBondContact O-N 2.72Å
626	S	55.4	Low	47.9	Very low	68 Å²	68	103.6 Å²	103.6	48%	0.476	59%	0.586	S	S	.	*	H	α-helix	trans	-58.8	-43.8	178.9	-170.4	0	0	0	0	112.4	A622 Q623 A628 F629 S630	A622-S626 VanDerWaalsContact O-CB 3.32Å; A622-S626 WeakPolarHBondContact O-CB 3.42Å; A622-S626 PolarHBondContact O-N 3.01Å; Q623-S626 PolarHBondContact O-N 3.38Å; S626-A628 VanDerWaalsContact C-N 3.32Å; S626-A628 PolarHBondContact O-N 2.9Å; S626-F629 PolarHBondContact O-N 3.04Å; S626-S630 PolarHBondContact O-N 3.36Å; S626-S630 PolarHBondContact O-OG 3.09Å
627	N	52.8	Low	46.9	Very low	118 Å²	118	106.5 Å²	106.5	63%	0.631	60%	0.6	S	S	*	*	H	α-helix	trans	-66.4	-33	178.1	-68.9	-18.7	0	0	0	112.3	Q623 V625 F629	Q623-N627 WeakPolarHBondContact O-CB 3.46Å; Q623-N627 VanDerWaalsContact O-CG 3.22Å; Q623-N627 PolarHBondContact O-N 3.43Å; Q623-N627 PolarHBondContact O-ND2 2.79Å; V625-N627 VanDerWaalsContact C-N 3.34Å; V625-N627 PolarHBondContact O-N 2.93Å; N627-F629 VanDerWaalsContact C-N 3.28Å; N627-F629 PolarHBondContact O-N 3.49Å
628	A	50.1	Low	46.2	Very low	63 Å²	63	109.4 Å²	109.4	52%	0.521	62%	0.621	S	S	.	*	H	α-helix	trans	-69.3	-20.1	178.4	0	0	0	0	0	114.3	V624 V625 S626	V624-A628 WeakPolarHBondContact O-CB 3.36Å; V624-A628 PolarHBondContact O-N 2.8Å; V624-A628 VanDerWaalsContact O-N 3.17Å; V625-A628 PolarHBondContact O-N 3.18Å; V625-A628 VanDerWaalsContact O-N 3.16Å; S626-A628 VanDerWaalsContact C-N 3.32Å; S626-A628 PolarHBondContact O-N 2.9Å
629	F	48	Very low	45.8	Very low	177 Å²	177	110.3 Å²	110.3	78%	0.776	62%	0.624	S	S	*	*	H	α-helix	trans	-106	-2	-178.6	-76.5	-72.8	0	0	0	114.9	V625 S626 N627	V625-F629 HydrophobicContact CG1-CD2 4.15Å; V625-F629 HydrophobicContact CG1-CE2 4.18Å; V625-F629 WeakPolarHBondContact O-CD2 3.38Å; V625-F629 PolarHBondContact O-N 2.72Å; S626-F629 PolarHBondContact O-N 3.04Å; N627-F629 VanDerWaalsContact C-N 3.28Å; N627-F629 PolarHBondContact O-N 3.49Å
630	S	43.3	Very low	45.2	Very low	88 Å²	88	109.6 Å²	109.6	62%	0.615	63%	0.628	S	S	*	*	S	Bend	trans	-98.6	14.2	-168.2	-62.9	0	0	0	0	115.7	S626	S626-S630 PolarHBondContact O-N 3.36Å; S626-S630 PolarHBondContact O-OG 3.09Å
631	S	40.3	Very low	44.8	Very low	93 Å²	93	111.4 Å²	111.4	65%	0.65	64%	0.636	S	S	*	*			trans	-129.7	114.8	-179.4	-172.1	0	0	0	0	113
632	P	37	Very low	44.7	Very low	115 Å²	115	111.4 Å²	111.4	75%	0.747	64%	0.636	S	S	*	*			trans	-78.8	129.2	171.9	31.2	-31.5	0	0	0	111.2
633	S	35.2	Very low	44.3	Very low	110 Å²	110	112.6 Å²	112.6	77%	0.769	64%	0.638	S	S	*	*			trans	71.6	104.4	178.2	75.9	0	0	0	0	117.5
634	T	36	Very low	44.1	Very low	146 Å²	146	109.8 Å²	109.8	90%	0.896	63%	0.632	S	S	*	*			trans	-170.1	178.3	130.4	16.5	0	0	0	0	110.4
635	N	36.4	Very low	44.3	Very low	152 Å²	152	111.1 Å²	111.1	81%	0.813	64%	0.641	S	S	*	*			trans	-73	150.2	-160.8	-111.8	-36.6	0	0	0	116.1	Q637	N635-Q637 VanDerWaalsContact C-N 3.34Å; N635-Q637 PolarHBondContact O-N 2.8Å
636	R	33	Very low	44.4	Very low	243 Å²	243	110.4 Å²	110.4	92%	0.917	63%	0.634	S	S	*	*	S	Bend	trans	-72.8	74.3	173.4	-72.3	-175.4	172.8	-170.6	-1.4	112.4
637	Q	33.8	Very low	44.6	Very low	192 Å²	192	111 Å²	111	90%	0.897	64%	0.635	S	S	*	*			trans	-153.8	34.5	172.8	-125.8	170.1	31.5	0	0	116.6	N635	N635-Q637 VanDerWaalsContact C-N 3.34Å; N635-Q637 PolarHBondContact O-N 2.8Å
638	S	35	Very low	45.1	Very low	87 Å²	87	109.1 Å²	109.1	61%	0.608	63%	0.628	S	S	*	*			trans	-148.1	35.5	-175.5	56.5	0	0	0	0	116.2	P641	S638-P641 VanDerWaalsContact O-CD 3.25Å; S638-P641 WeakPolarHBondContact O-CD 3.28Å
639	I	44	Very low	45.5	Very low	131 Å²	131	108.8 Å²	108.8	67%	0.672	62%	0.619	S	S	*	*			trans	-77.6	-24.2	-179.6	-63	176.6	0	0	0	113.1	P641 I642	I639-P641 VanDerWaalsContact C-CD 3.43Å; I639-I642 PolarHBondContact O-N 3.37Å; I639-I642 VanDerWaalsContact O-N 3.13Å
640	S	44.5	Very low	45.9	Very low	96 Å²	96	104.5 Å²	104.5	67%	0.671	60%	0.604	S	S	*	*	H	α-helix	trans	-48.8	-43.7	-176.2	-177.4	0	0	0	0	116.3	I642 T643 S644	S640-I642 VanDerWaalsContact C-N 3.3Å; S640-I642 PolarHBondContact O-N 2.79Å; S640-T643 PolarHBondContact O-OG1 3.28Å; S640-S644 PolarHBondContact O-N 3.15Å
641	P	45	Very low	46.8	Very low	79 Å²	79	104 Å²	104	51%	0.513	60%	0.597	S	S	.	*	H	α-helix	trans	-65	-32.4	-178.4	-21	34.7	0	0	0	113.1	S638 I639 S644 T645	S638-P641 VanDerWaalsContact O-CD 3.25Å; S638-P641 WeakPolarHBondContact O-CD 3.28Å; I639-P641 VanDerWaalsContact C-CD 3.43Å; P641-S644 WeakPolarHBondContact O-CB 3.43Å; P641-S644 PolarHBondContact O-N 3.07Å; P641-T645 PolarHBondContact O-N 3Å; P641-T645 PolarHBondContact O-OG1 3.17Å
642	I	51.2	Low	47.8	Very low	71 Å²	71	103.3 Å²	103.3	36%	0.364	59%	0.589	S	S	.	*	H	α-helix	trans	-72.6	-45.7	-174	-58.8	176	0	0	0	110.5	V624 I639 S640 S644 T645 I646	V624-I642 HydrophobicContact CG1-CG2 3.78Å; I639-I642 PolarHBondContact O-N 3.37Å; I639-I642 VanDerWaalsContact O-N 3.13Å; S640-I642 VanDerWaalsContact C-N 3.3Å; S640-I642 PolarHBondContact O-N 2.79Å; I642-S644 VanDerWaalsContact C-N 3.32Å; I642-S644 PolarHBondContact O-N 3.32Å; I642-T645 PolarHBondContact O-N 3.14Å; I642-I646 HydrophobicContact CG2-CD1 3.9Å; I642-I646 WeakPolarHBondContact O-CG1 3.5Å; I642-I646 PolarHBondContact O-N 3.44Å
643	T	50.8	Low	48.8	Very low	82 Å²	82	99.5 Å²	99.5	50%	0.503	56%	0.564	S	S	.	*	H	α-helix	trans	-64.5	-36.1	173.7	27.7	0	0	0	0	112.1	S640 T647	S640-T643 PolarHBondContact O-OG1 3.28Å; T643-T647 VanDerWaalsContact O-CB 3.3Å; T643-T647 WeakPolarHBondContact O-CB 3.4Å; T643-T647 PolarHBondContact O-N 2.98Å; T643-T647 PolarHBondContact O-OG1 3.46Å
644	S	49.7	Very low	49.8	Very low	71 Å²	71	98.1 Å²	98.1	50%	0.497	55%	0.55	S	S	.	*	H	α-helix	trans	-57.7	-55.8	171.6	179.2	0	0	0	0	111.2	S640 P641 I642 I646 T647 T648	S640-S644 PolarHBondContact O-N 3.15Å; P641-S644 WeakPolarHBondContact O-CB 3.43Å; P641-S644 PolarHBondContact O-N 3.07Å; I642-S644 VanDerWaalsContact C-N 3.32Å; I642-S644 PolarHBondContact O-N 3.32Å; S644-I646 PolarHBondContact O-N 3.43Å; S644-T647 PolarHBondContact O-N 2.94Å; S644-T647 VanDerWaalsContact O-N 3.16Å; S644-T648 PolarHBondContact O-N 2.65Å; S644-T648 PolarHBondContact O-OG1 3.08Å
645	T	55.6	Low	51	Low	78 Å²	78	94.9 Å²	94.9	48%	0.479	53%	0.531	S	S	.	.	H	α-helix	trans	-59.1	-45.5	-179	-55.7	0	0	0	0	112.8	P641 I642 T647 T648 V649	P641-T645 PolarHBondContact O-N 3Å; P641-T645 PolarHBondContact O-OG1 3.17Å; I642-T645 PolarHBondContact O-N 3.14Å; T645-T647 VanDerWaalsContact C-N 3.34Å; T645-T647 PolarHBondContact O-N 2.94Å; T645-T648 PolarHBondContact O-N 3.46Å; T645-V649 WeakPolarHBondContact O-CG2 3.15Å; T645-V649 PolarHBondContact O-N 3.43Å
646	I	54.5	Low	51.9	Low	58 Å²	58	90.9 Å²	90.9	30%	0.297	51%	0.512	S	S	.	.	H	α-helix	trans	-62.4	-42.2	177.7	-67.9	169.3	0	0	0	110.8	V624 I642 S644 V649 I650	V624-I646 HydrophobicContact CG1-CD1 4.21Å; V624-I646 HydrophobicContact CG1-CG1 4.47Å; I642-I646 HydrophobicContact CG2-CD1 3.9Å; I642-I646 WeakPolarHBondContact O-CG1 3.5Å; I642-I646 PolarHBondContact O-N 3.44Å; S644-I646 PolarHBondContact O-N 3.43Å; I646-V649 PolarHBondContact O-N 3.3Å; I646-I650 HydrophobicContact CG2-CD1 3.74Å; I646-I650 HydrophobicContact CG2-CG1 4.44Å; I646-I650 WeakPolarHBondContact O-CG1 3.42Å; I646-I650 PolarHBondContact O-N 3.09Å
647	T	60.2	Low	52.7	Low	82 Å²	82	81.1 Å²	81.1	50%	0.503	48%	0.477	S	S	.	.	H	α-helix	trans	-64.1	-41.8	178	-55	0	0	0	0	111.6	T643 S644 T645 T651	T643-T647 VanDerWaalsContact O-CB 3.3Å; T643-T647 WeakPolarHBondContact O-CB 3.4Å; T643-T647 PolarHBondContact O-N 2.98Å; T643-T647 PolarHBondContact O-OG1 3.46Å; S644-T647 PolarHBondContact O-N 2.94Å; S644-T647 VanDerWaalsContact O-N 3.16Å; T645-T647 VanDerWaalsContact C-N 3.34Å; T645-T647 PolarHBondContact O-N 2.94Å; T647-T651 VanDerWaalsContact O-CB 3.31Å; T647-T651 WeakPolarHBondContact O-CB 3.31Å; T647-T651 PolarHBondContact O-N 2.91Å; T647-T651 PolarHBondContact O-OG1 2.89Å
648	T	63.7	Low	53.8	Low	78 Å²	78	76.1 Å²	76.1	48%	0.479	46%	0.459	S	S	.	.	H	α-helix	trans	-61.2	-49.7	173.9	-56.9	0	0	0	0	111.5	S644 T645 I650 T651 T652	S644-T648 PolarHBondContact O-N 2.65Å; S644-T648 PolarHBondContact O-OG1 3.08Å; T645-T648 PolarHBondContact O-N 3.46Å; T648-I650 PolarHBondContact O-N 3.25Å; T648-T651 PolarHBondContact O-N 3.49Å; T648-T652 WeakPolarHBondContact O-CB 3.31Å; T648-T652 PolarHBondContact O-N 3.11Å; T648-T652 PolarHBondContact O-OG1 2.7Å; T648-T652 VanDerWaalsContact O-OG1 3.1Å
649	V	57.5	Low	54.9	Low	55 Å²	55	76 Å²	76	33%	0.333	46%	0.455	S	S	.	.	H	α-helix	trans	-58.4	-47.2	179.7	170.3	0	0	0	0	111.4	T645 I646 T653	T645-V649 WeakPolarHBondContact O-CG2 3.15Å; T645-V649 PolarHBondContact O-N 3.43Å; I646-V649 PolarHBondContact O-N 3.3Å; V649-T653 WeakPolarHBondContact O-CB 3.37Å; V649-T653 PolarHBondContact O-N 2.78Å; V649-T653 PolarHBondContact O-OG1 3.13Å
650	I	58.1	Low	54.9	Low	88 Å²	88	75.5 Å²	75.5	45%	0.451	45%	0.451	S	S	.	.	H	α-helix	trans	-61.1	-48.3	177.2	-67.8	169.8	0	0	0	110.3	I646 T648 T652 T653 T654	I646-I650 HydrophobicContact CG2-CD1 3.74Å; I646-I650 HydrophobicContact CG2-CG1 4.44Å; I646-I650 WeakPolarHBondContact O-CG1 3.42Å; I646-I650 PolarHBondContact O-N 3.09Å; T648-I650 PolarHBondContact O-N 3.25Å; I650-T652 PolarHBondContact O-N 2.83Å; I650-T653 PolarHBondContact O-N 2.67Å; I650-T654 WeakPolarHBondContact O-CB 3.47Å; I650-T654 PolarHBondContact O-N 2.89Å; I650-T654 PolarHBondContact O-OG1 2.99Å
651	T	61.3	Low	55	Low	77 Å²	77	73.9 Å²	73.9	47%	0.472	44%	0.435	S	S	.	.	H	α-helix	trans	-61.8	-48.6	-177.7	-53.7	0	0	0	0	111.4	T647 T648 T654 T655	T647-T651 VanDerWaalsContact O-CB 3.31Å; T647-T651 WeakPolarHBondContact O-CB 3.31Å; T647-T651 PolarHBondContact O-N 2.91Å; T647-T651 PolarHBondContact O-OG1 2.89Å; T648-T651 PolarHBondContact O-N 3.49Å; T651-T654 PolarHBondContact O-N 2.93Å; T651-T655 PolarHBondContact O-N 3.02Å; T651-T655 PolarHBondContact O-OG1 2.99Å
652	T	61.1	Low	55	Low	78 Å²	78	72.3 Å²	72.3	48%	0.479	43%	0.429	S	S	.	.	H	α-helix	trans	-61.6	-45.7	179.2	-59.7	0	0	0	0	111.4	T648 I650 T654 T655 V656	T648-T652 WeakPolarHBondContact O-CB 3.31Å; T648-T652 PolarHBondContact O-N 3.11Å; T648-T652 PolarHBondContact O-OG1 2.7Å; T648-T652 VanDerWaalsContact O-OG1 3.1Å; I650-T652 PolarHBondContact O-N 2.83Å; T652-T654 PolarHBondContact O-N 2.71Å; T652-T655 PolarHBondContact O-N 2.98Å; T652-V656 WeakPolarHBondContact O-CG2 3.34Å; T652-V656 PolarHBondContact O-N 3.18Å
653	T	58.3	Low	54.4	Low	36 Å²	36	72.3 Å²	72.3	22%	0.221	43%	0.433	C	S	.	.	H	α-helix	trans	-64	-41.9	177.8	-59.2	0	0	0	0	111.8	V617 V649 I650 T655 V656 M657	V617-T653 HydrophobicContact CG2-CG2 4.05Å; V649-T653 WeakPolarHBondContact O-CB 3.37Å; V649-T653 PolarHBondContact O-N 2.78Å; V649-T653 PolarHBondContact O-OG1 3.13Å; I650-T653 PolarHBondContact O-N 2.67Å; T653-T655 PolarHBondContact O-N 3.36Å; T653-V656 PolarHBondContact O-N 3.09Å; T653-M657 HydrophobicContact CG2-CE 3.86Å; T653-M657 WeakPolarHBondContact O-CG 3.44Å; T653-M657 PolarHBondContact O-N 3.02Å
654	T	56.7	Low	53.9	Low	80 Å²	80	71.1 Å²	71.1	49%	0.491	43%	0.428	S	S	.	.	H	α-helix	trans	-62.3	-41.1	174.5	-58.1	0	0	0	0	111.8	I650 T651 T652 T658	I650-T654 WeakPolarHBondContact O-CB 3.47Å; I650-T654 PolarHBondContact O-N 2.89Å; I650-T654 PolarHBondContact O-OG1 2.99Å; T651-T654 PolarHBondContact O-N 2.93Å; T652-T654 PolarHBondContact O-N 2.71Å; T654-T658 WeakPolarHBondContact O-CB 3.39Å; T654-T658 PolarHBondContact O-N 2.87Å; T654-T658 PolarHBondContact O-OG1 3.25Å
655	T	60.1	Low	53.4	Low	79 Å²	79	71.7 Å²	71.7	49%	0.485	43%	0.425	S	S	.	.	H	α-helix	trans	-62.5	-44.9	174.8	-57.9	0	0	0	0	111.5	T651 T652 T653 T658 T659	T651-T655 PolarHBondContact O-N 3.02Å; T651-T655 PolarHBondContact O-OG1 2.99Å; T652-T655 PolarHBondContact O-N 2.98Å; T653-T655 PolarHBondContact O-N 3.36Å; T655-T658 PolarHBondContact O-N 3.08Å; T655-T659 HydrophobicContact CG2-CG2 4.47Å; T655-T659 WeakPolarHBondContact O-CG2 3.47Å; T655-T659 PolarHBondContact O-N 3.22Å; T655-T659 PolarHBondContact O-OG1 3.42Å
656	V	55.7	Low	52.6	Low	68 Å²	68	71.7 Å²	71.7	41%	0.412	42%	0.422	S	S	.	.	H	α-helix	trans	-65.3	-41.5	179.1	171.5	0	0	0	0	112.2	T652 T653 T658 T659 M660	T652-V656 WeakPolarHBondContact O-CG2 3.34Å; T652-V656 PolarHBondContact O-N 3.18Å; T653-V656 PolarHBondContact O-N 3.09Å; V656-T658 VanDerWaalsContact C-N 3.34Å; V656-T658 PolarHBondContact O-N 3.32Å; V656-T659 PolarHBondContact O-N 3Å; V656-T659 PolarHBondContact O-OG1 3.24Å; V656-M660 HydrophobicContact CG1-CE 4.26Å; V656-M660 HydrophobicContact CG1-SD 4.45Å; V656-M660 WeakPolarHBondContact O-CG 3.44Å; V656-M660 PolarHBondContact O-N 3.16Å
657	M	50.5	Low	51.7	Low	37 Å²	37	74.4 Å²	74.4	18%	0.182	44%	0.437	C	S	.	.	H	α-helix	trans	-61.1	-44.8	172.1	-70.5	-169.6	-171.4	0	0	111.2	M610 A613 F614 T653 T659 M660 I661	M610-M657 HydrophobicContact CG-CE 4.36Å; M610-M657 HydrophobicContact CG-SD 4.35Å; A613-M657 HydrophobicContact CB-CE 4.28Å; F614-M657 HydrophobicContact CD1-CE 4.21Å; F614-M657 HydrophobicContact CD2-CE 4.15Å; F614-M657 HydrophobicContact CE1-CE 3.83Å; F614-M657 HydrophobicContact CE2-CE 3.75Å; F614-M657 HydrophobicContact CE2-SD 4.35Å; F614-M657 HydrophobicContact CG-CE 4.36Å; F614-M657 HydrophobicContact CZ-CE 3.58Å; F614-M657 HydrophobicContact CZ-SD 3.98Å; T653-M657 HydrophobicContact CG2-CE 3.86Å; T653-M657 WeakPolarHBondContact O-CG 3.44Å; T653-M657 PolarHBondContact O-N 3.02Å; M657-T659 PolarHBondContact O-N 2.96Å; M657-M660 PolarHBondContact O-N 3.21Å; M657-I661 HydrophobicContact CB-CD1 4.27Å; M657-I661 VanDerWaalsContact O-CB 3.28Å; M657-I661 WeakPolarHBondContact O-CB 3.37Å; M657-I661 WeakPolarHBondContact O-CD1 3.4Å; M657-I661 WeakPolarHBondContact O-CG1 3.46Å; M657-I661 PolarHBondContact O-N 3.42Å
658	T	56.2	Low	50.5	Low	87 Å²	87	76.2 Å²	76.2	53%	0.534	44%	0.443	S	S	.	.	H	α-helix	trans	-61.3	-42.9	-180	-53.5	0	0	0	0	111.7	T654 T655 V656 A662	T654-T658 WeakPolarHBondContact O-CB 3.39Å; T654-T658 PolarHBondContact O-N 2.87Å; T654-T658 PolarHBondContact O-OG1 3.25Å; T655-T658 PolarHBondContact O-N 3.08Å; V656-T658 VanDerWaalsContact C-N 3.34Å; V656-T658 PolarHBondContact O-N 3.32Å; T658-A662 WeakPolarHBondContact O-CB 3.43Å; T658-A662 PolarHBondContact O-N 3.39Å
659	T	57.2	Low	49.1	Very low	86 Å²	86	79.3 Å²	79.3	53%	0.528	45%	0.45	S	S	.	.	H	α-helix	trans	-76.2	-23.3	-179.7	55.7	0	0	0	0	114	T655 V656 M657 P663	T655-T659 HydrophobicContact CG2-CG2 4.47Å; T655-T659 WeakPolarHBondContact O-CG2 3.47Å; T655-T659 PolarHBondContact O-N 3.22Å; T655-T659 PolarHBondContact O-OG1 3.42Å; V656-T659 PolarHBondContact O-N 3Å; V656-T659 PolarHBondContact O-OG1 3.24Å; M657-T659 PolarHBondContact O-N 2.96Å; T659-P663 WeakPolarHBondContact O-CD 3.43Å; T659-P663 WeakPolarHBondContact O-CG 3.45Å
660	M	45.9	Very low	47.8	Very low	119 Å²	119	83.3 Å²	83.3	59%	0.586	47%	0.469	S	S	*	.	H	α-helix	trans	-82.9	-32.4	171.1	-71	-167.3	175.4	0	0	113.3	V656 M657 S664	V656-M660 HydrophobicContact CG1-CE 4.26Å; V656-M660 HydrophobicContact CG1-SD 4.45Å; V656-M660 WeakPolarHBondContact O-CG 3.44Å; V656-M660 PolarHBondContact O-N 3.16Å; M657-M660 PolarHBondContact O-N 3.21Å; M660-S664 PolarHBondContact O-OG 3.17Å
661	I	46.3	Very low	46.4	Very low	62 Å²	62	83.2 Å²	83.2	32%	0.318	48%	0.477	S	S	.	.	H	α-helix	trans	-80.9	-39.9	-177.4	-67.6	168	0	0	0	111.7	M610 M657 S664 I665	M610-I661 HydrophobicContact CE-CD1 3.87Å; M610-I661 HydrophobicContact CE-CG1 4.16Å; M610-I661 HydrophobicContact SD-CD1 4.28Å; M657-I661 HydrophobicContact CB-CD1 4.27Å; M657-I661 VanDerWaalsContact O-CB 3.28Å; M657-I661 WeakPolarHBondContact O-CB 3.37Å; M657-I661 WeakPolarHBondContact O-CD1 3.4Å; M657-I661 WeakPolarHBondContact O-CG1 3.46Å; M657-I661 PolarHBondContact O-N 3.42Å; I661-S664 WeakPolarHBondContact O-CB 3.4Å; I661-S664 PolarHBondContact O-N 3.44Å; I661-I665 HydrophobicContact CG2-CD1 3.59Å; I661-I665 HydrophobicContact CG2-CG1 4.07Å; I661-I665 PolarHBondContact O-N 3.35Å
662	A	43.8	Very low	44.9	Very low	47 Å²	47	85.1 Å²	85.1	39%	0.388	49%	0.493	S	S	.	.	H	α-helix	trans	-57.7	-48.3	-176.9	0	0	0	0	0	114.1	T658 S664 I665 D666	T658-A662 WeakPolarHBondContact O-CB 3.43Å; T658-A662 PolarHBondContact O-N 3.39Å; A662-S664 PolarHBondContact O-N 3.41Å; A662-I665 PolarHBondContact O-N 3.16Å; A662-D666 PolarHBondContact O-N 2.92Å; A662-D666 VanDerWaalsContact O-N 3.13Å
663	P	40.2	Very low	43.3	Very low	71 Å²	71	87.4 Å²	87.4	46%	0.461	51%	0.51	S	S	.	.	H	α-helix	trans	-63.6	-28.5	176	-20.7	33.7	0	0	0	113	T659 N667	T659-P663 WeakPolarHBondContact O-CD 3.43Å; T659-P663 WeakPolarHBondContact O-CG 3.45Å; P663-N667 WeakPolarHBondContact O-CB 3.32Å; P663-N667 PolarHBondContact O-N 3.31Å; P663-N667 VanDerWaalsContact O-N 3.13Å; P663-N667 PolarHBondContact O-ND2 3.26Å
664	S	38.7	Very low	41.9	Very low	57 Å²	57	92.2 Å²	92.2	40%	0.399	53%	0.534	S	S	.	.	H	α-helix	trans	-72.9	-35.4	178.7	-57.2	0	0	0	0	111.8	M660 I661 A662 L668	M660-S664 PolarHBondContact O-OG 3.17Å; I661-S664 WeakPolarHBondContact O-CB 3.4Å; I661-S664 PolarHBondContact O-N 3.44Å; A662-S664 PolarHBondContact O-N 3.41Å; S664-L668 PolarHBondContact O-N 3.39Å
665	I	40.3	Very low	40.5	Very low	82 Å²	82	96.2 Å²	96.2	42%	0.421	55%	0.552	S	S	.	*	H	α-helix	trans	-73.2	-39.4	176.2	-69.5	177.5	0	0	0	111.6	I661 A662 L668 K669	I661-I665 HydrophobicContact CG2-CD1 3.59Å; I661-I665 HydrophobicContact CG2-CG1 4.07Å; I661-I665 PolarHBondContact O-N 3.35Å; A662-I665 PolarHBondContact O-N 3.16Å; I665-L668 WeakPolarHBondContact O-CB 3.49Å; I665-L668 PolarHBondContact O-N 3.34Å; I665-K669 PolarHBondContact O-N 3.37Å
666	D	37.9	Very low	39.1	Very low	78 Å²	78	98.1 Å²	98.1	42%	0.417	56%	0.563	S	S	.	*	H	α-helix	trans	-77.4	-25.8	-179.8	-71.1	-27	0	0	0	113.3	A662 L668 K669 N670	A662-D666 PolarHBondContact O-N 2.92Å; A662-D666 VanDerWaalsContact O-N 3.13Å; D666-L668 VanDerWaalsContact C-N 3.32Å; D666-K669 PolarHBondContact O-N 3.47Å; D666-K669 IonicContact OD1-NZ 2.78Å; D666-K669 PolarHBondContact OD1-NZ 3.21Å; D666-N670 PolarHBondContact O-N 3.46Å; D666-N670 PolarHBondContact O-ND2 3.19Å
667	N	36.9	Very low	37.8	Very low	115 Å²	115	102.8 Å²	102.8	62%	0.615	58%	0.58	S	S	*	*	H	α-helix	trans	-66.3	-32.7	166.3	-83.8	-69.9	0	0	0	112.4	P663 K669 N670	P663-N667 WeakPolarHBondContact O-CB 3.32Å; P663-N667 PolarHBondContact O-N 3.31Å; P663-N667 VanDerWaalsContact O-N 3.13Å; P663-N667 PolarHBondContact O-ND2 3.26Å; N667-K669 PolarHBondContact O-N 3.35Å; N667-N670 PolarHBondContact O-N 3.1Å
668	L	34.3	Very low	36.6	Very low	120 Å²	120	109 Å²	109	63%	0.628	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-12.4	172.4	-78.5	165.7	0	0	0	113.9	S664 I665 D666	S664-L668 PolarHBondContact O-N 3.39Å; I665-L668 WeakPolarHBondContact O-CB 3.49Å; I665-L668 PolarHBondContact O-N 3.34Å; D666-L668 VanDerWaalsContact C-N 3.32Å
669	K	35.1	Very low	35.3	Very low	143 Å²	143	111.6 Å²	111.6	62%	0.622	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-17.5	173.8	-65.1	174	-165.5	153.6	0	113.9	I665 D666 N667	I665-K669 PolarHBondContact O-N 3.37Å; D666-K669 PolarHBondContact O-N 3.47Å; D666-K669 IonicContact OD1-NZ 2.78Å; D666-K669 PolarHBondContact OD1-NZ 3.21Å; N667-K669 PolarHBondContact O-N 3.35Å
670	N	29.7	Very low	33.9	Very low	140 Å²	140	115.4 Å²	115.4	75%	0.749	63%	0.628	S	S	*	*	S	Bend	trans	-114.6	25.7	-168.9	-80.7	-42.4	0	0	0	114.3	D666 N667	D666-N670 PolarHBondContact O-N 3.46Å; D666-N670 PolarHBondContact O-ND2 3.19Å; N667-N670 PolarHBondContact O-N 3.1Å
671	S	27.8	Very low	33.1	Very low	86 Å²	86	115.9 Å²	115.9	60%	0.601	63%	0.633	S	S	*	*	S	Bend	trans	-130.1	34.6	-173.6	76.1	0	0	0	0	116.3
672	S	29.4	Very low	32.2	Very low	116 Å²	116	120.7 Å²	120.7	81%	0.811	65%	0.653	S	S	*	*			trans	-153.7	77	166.6	55.7	0	0	0	0	115.2
673	C	28.2	Very low	31.3	Very low	126 Å²	126	122.5 Å²	122.5	85%	0.851	66%	0.662	S	S	*	*			trans	-109.1	145.9	156.7	-57.5	0	0	0	0	107.2
674	I	29.4	Very low	30.7	Very low	138 Å²	138	125 Å²	125	71%	0.708	67%	0.672	S	S	*	*			cis	-140.6	136.7	13.6	-63.8	168.6	0	0	0	108.9
675	N	27.8	Very low	30.1	Very low	163 Å²	163	129.4 Å²	129.4	87%	0.872	69%	0.686	S	S	*	*			trans	-150.9	72.6	130.3	-144.9	5.7	0	0	0	111.1
676	T	29.5	Very low	29.4	Very low	119 Å²	119	131.1 Å²	131.1	73%	0.73	70%	0.7	S	S	*	*			trans	-76.4	132.7	177.2	46.4	0	0	0	0	111.4
677	H	28.2	Very low	28.9	Very low	166 Å²	166	132.7 Å²	132.7	77%	0.769	71%	0.713	S	S	*	*			trans	-125.2	140.3	153.6	-123.8	-81.4	0	0	0	109.1
678	F	26.4	Very low	28.4	Very low	168 Å²	168	132.6 Å²	132.6	74%	0.737	72%	0.716	S	S	*	*	S	Bend	trans	71.3	83.4	179.6	-71.6	-87.1	0	0	0	118.5
679	I	28.4	Very low	28.1	Very low	142 Å²	142	133.4 Å²	133.4	73%	0.728	72%	0.722	S	S	*	*				61.1	109.1	119.8	-67.6	169.2	0	0	0	117.1
680	H	28.2	Very low	27.9	Very low	166 Å²	166	133.3 Å²	133.3	77%	0.769	73%	0.728	S	S	*	*				61.7	134.3	88.6	-118.5	-128.4	0	0	0	113.9
681	N	29.4	Very low	27.9	Very low	129 Å²	129	132.8 Å²	132.8	69%	0.69	73%	0.73	S	S	*	*			cis	-157.7	163.4	13.3	-159.6	15.4	0	0	0	113.6
682	Q	25.5	Very low	28	Very low	162 Å²	162	137.2 Å²	137.2	76%	0.757	74%	0.743	S	S	*	*			trans	-98.2	174.6	162.7	-82.5	-174.1	-3.5	0	0	109.5
683	C	26.1	Very low	27.8	Very low	85 Å²	85	138.7 Å²	138.7	57%	0.574	74%	0.742	S	S	*	*			cis	-161.4	158.6	-6.4	-124.3	0	0	0	0	110.2
684	N	27	Very low	28	Very low	123 Å²	123	141.9 Å²	141.9	66%	0.658	74%	0.744	S	S	*	*			trans	60.8	174.6	149.5	-52.5	-6.1	0	0	0	118.5
685	H	27.3	Very low	28	Very low	151 Å²	151	142.9 Å²	142.9	70%	0.699	75%	0.745	S	S	*	*			cis	-149.1	147.4	12.1	-111.9	-64.1	0	0	0	113.1
686	T	25	Very low	27.9	Very low	117 Å²	117	140.9 Å²	140.9	72%	0.718	73%	0.734	S	S	*	*			trans	64.3	161.8	152	52.5	0	0	0	0	118.8
687	T	28.4	Very low	27.8	Very low	112 Å²	112	140.7 Å²	140.7	69%	0.687	73%	0.729	S	S	*	*			cis	-156.8	142.1	26.5	-6.1	0	0	0	0	114
688	T	26.1	Very low	27.7	Very low	112 Å²	112	139.1 Å²	139.1	69%	0.687	73%	0.726	S	S	*	*			trans	56.6	125.4	139.9	55.5	0	0	0	0	125.4
689	N	26.6	Very low	27.6	Very low	138 Å²	138	136.2 Å²	136.2	74%	0.738	72%	0.722	S	S	*	*				108.7	146.9	119.1	-78.1	16.7	0	0	0	123.7
690	N	30.6	Very low	27.6	Very low	141 Å²	141	135.8 Å²	135.8	75%	0.754	72%	0.722	S	S	*	*			trans	71.9	137.1	170.3	-55.5	-11.5	0	0	0	116.2
691	T	31.1	Very low	27.4	Very low	129 Å²	129	134.1 Å²	134.1	79%	0.791	72%	0.717	S	S	*	*			cis	-161.5	157.3	-11.5	18.7	0	0	0	0	105.1
692	M	29.6	Very low	27.2	Very low	178 Å²	178	134.7 Å²	134.7	88%	0.877	72%	0.718	S	S	*	*			cis	-167.7	155.2	39.9	-154.1	169.6	-169	0	0	109.3
693	D	24.9	Very low	27.2	Very low	147 Å²	147	132.8 Å²	132.8	79%	0.786	71%	0.713	S	S	*	*			trans	-93	155.4	178.8	-60.3	-79.5	0	0	0	114.1
694	H	32.1	Very low	27.3	Very low	193 Å²	193	136.2 Å²	136.2	89%	0.894	72%	0.719	S	S	*	*				-173.1	165.9	122.5	-102.1	-61.5	0	0	0	114.9
695	H	30.2	Very low	27.2	Very low	160 Å²	160	141.2 Å²	141.2	74%	0.741	73%	0.728	S	S	*	*			trans	-80.4	158.1	-161.9	-96.6	-57.9	0	0	0	117.7
696	N	26	Very low	26.9	Very low	120 Å²	120	140.3 Å²	140.3	64%	0.642	73%	0.727	S	S	*	*				26.6	151.1	123.4	-66	55.4	0	0	0	120.2
697	D	27.6	Very low	26.8	Very low	116 Å²	116	141.6 Å²	141.6	62%	0.62	74%	0.735	S	S	*	*			cis	-165.7	168.5	14	-124.7	-28.9	0	0	0	112.9
698	N	24.8	Very low	26.5	Very low	132 Å²	132	142.3 Å²	142.3	71%	0.706	73%	0.733	S	S	*	*			trans	30.3	149.4	139.2	-71.1	-38.3	0	0	0	123.4
699	V	25.5	Very low	26.3	Very low	107 Å²	107	143.8 Å²	143.8	65%	0.648	74%	0.737	S	S	*	*			cis	-175.5	159.2	-10.4	75.9	0	0	0	0	111
700	N	26.8	Very low	26.1	Very low	134 Å²	134	145.1 Å²	145.1	72%	0.717	74%	0.736	S	S	*	*			trans	66.6	168.6	157.5	-75.7	-15.2	0	0	0	119.8
701	I	25.6	Very low	25.8	Very low	131 Å²	131	144.7 Å²	144.7	67%	0.672	73%	0.73	S	S	*	*			cis	-148.3	146.4	0.4	-133.2	156.5	0	0	0	115.2
702	I	25	Very low	25.4	Very low	140 Å²	140	147.6 Å²	147.6	72%	0.718	73%	0.732	S	S	*	*			trans	20.8	127.4	146.6	-59.1	167.9	0	0	0	121.7
703	D	25.3	Very low	25	Very low	122 Å²	122	146 Å²	146	65%	0.652	73%	0.725	S	S	*	*				-168.7	155.8	126.8	-117.7	19.7	0	0	0	110.2
704	K	27.2	Very low	25.2	Very low	158 Å²	158	144 Å²	144	69%	0.687	72%	0.72	S	S	*	*			cis	-153.6	-177.6	-18.2	-131.6	175.1	-157.4	77.9	0	105.1
705	R	24.8	Very low	24.8	Very low	227 Å²	227	140.3 Å²	140.3	86%	0.857	71%	0.712	S	S	*	*			cis	-152.6	-164.6	13.3	-153.2	177.6	-175	170.9	2.1	108.6
706	I	21.3	Very low	24.6	Very low	132 Å²	132	141.6 Å²	141.6	68%	0.677	72%	0.718	S	S	*	*			trans	-135.6	148.8	-178.4	-65.5	161.9	0	0	0	110	I708	I706-I708 HydrophobicContact CG2-CD1 4.08Å; I706-I708 HydrophobicContact CG2-CG1 3.8Å
707	T	23.5	Very low	24.6	Very low	145 Å²	145	141.5 Å²	141.5	89%	0.89	72%	0.722	S	S	*	*			trans	-141.6	145.1	150.3	-55.9	0	0	0	0	110
708	I	21.6	Very low	24.5	Very low	126 Å²	126	144.1 Å²	144.1	65%	0.646	74%	0.735	S	S	*	*			trans	-133.5	140	-177.4	-54.3	165.5	0	0	0	108.2	I706	I706-I708 HydrophobicContact CG2-CD1 4.08Å; I706-I708 HydrophobicContact CG2-CG1 3.8Å
709	N	21.3	Very low	24.5	Very low	143 Å²	143	145.7 Å²	145.7	77%	0.765	74%	0.738	S	S	*	*			trans	151.9	155.1	133.6	-86.8	-60.2	0	0	0	115
710	K	22.9	Very low	24.6	Very low	166 Å²	166	149.8 Å²	149.8	72%	0.722	75%	0.747	S	S	*	*			trans	69.5	142.4	162.6	-70.6	167.6	166.1	-82.1	0	116.1
711	E	23.8	Very low	24.9	Very low	132 Å²	132	148.7 Å²	148.7	62%	0.617	75%	0.747	S	S	*	*			cis	-158.5	166.2	-4.7	-130.4	157.1	-157.9	0	0	113.8
712	F	23.4	Very low	25	Very low	191 Å²	191	148.1 Å²	148.1	84%	0.838	75%	0.752	S	S	*	*			trans	63.3	135.4	162.1	-83.7	-80.8	0	0	0	123.7
713	I	22	Very low	25.3	Very low	143 Å²	143	148.5 Å²	148.5	73%	0.733	75%	0.754	S	S	*	*			trans	-90.9	159.4	157.3	-16.2	172.4	0	0	0	105.6
714	P	28.7	Very low	25.5	Very low	106 Å²	106	150.1 Å²	150.1	69%	0.688	76%	0.762	S	S	*	*				-152.7	170.8	50.2	43.5	-21.7	0	0	0	118.8
715	T	23.8	Very low	25.5	Very low	116 Å²	116	147.2 Å²	147.2	71%	0.712	75%	0.754	S	S	*	*			trans	33	117.9	146.8	56.5	0	0	0	0	120.8
716	Q	26.3	Very low	25.7	Very low	187 Å²	187	141.8 Å²	141.8	87%	0.874	75%	0.746	S	S	*	*				-152.4	139.2	128	-123	152.1	101.3	0	0	114.9
717	T	25.6	Very low	25.9	Very low	118 Å²	118	141.2 Å²	141.2	72%	0.724	75%	0.751	S	S	*	*			trans	-25.9	119	167	-42.9	0	0	0	0	115.7	H719	T717-H719 PolarHBondContact O-N 3.37Å; T717-H719 VanDerWaalsContact O-N 3.16Å
718	L	25.1	Very low	26.1	Very low	170 Å²	170	144.3 Å²	144.3	89%	0.89	75%	0.747	S	S	*	*			trans	-76.3	101.5	167	-97	173.7	0	0	0	110.2
719	H	24.6	Very low	26.2	Very low	165 Å²	165	146.8 Å²	146.8	76%	0.764	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-59	143.5	170.1	-99	-102.1	0	0	0	112.1	T717	T717-H719 PolarHBondContact O-N 3.37Å; T717-H719 VanDerWaalsContact O-N 3.16Å
720	F	27.7	Very low	26.6	Very low	193 Å²	193	145.9 Å²	145.9	85%	0.846	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-64.2	144.2	156.9	-71.8	-89.6	0	0	0	109.8
721	P	32.4	Very low	26.8	Very low	111 Å²	111	142.5 Å²	142.5	72%	0.721	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-64	140.8	177.9	27.2	-34.5	0	0	0	110.8	I723	P721-I723 PolarHBondContact O-N 2.8Å
722	P	28.1	Very low	26.8	Very low	119 Å²	119	143.6 Å²	143.6	77%	0.773	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-70.3	128.1	-176.1	28	-34.2	0	0	0	111.4	L724	P722-L724 PolarHBondContact O-N 2.82Å
723	I	30.8	Very low	26.9	Very low	149 Å²	149	140.7 Å²	140.7	76%	0.764	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-66.8	118.3	161.7	-63.7	175.7	0	0	0	106.9	P721 D725	P721-I723 PolarHBondContact O-N 2.8Å; I723-D725 PolarHBondContact O-N 3.21Å
724	L	29.7	Very low	27.1	Very low	156 Å²	156	138.3 Å²	138.3	82%	0.817	75%	0.749	S	S	*	*			trans	-71.6	92.6	179.5	-106.6	161.6	0	0	0	110.4	P722 T726	P722-L724 PolarHBondContact O-N 2.82Å; L724-T726 PolarHBondContact O-N 3.09Å
725	D	28.3	Very low	26.9	Very low	96 Å²	96	142.1 Å²	142.1	51%	0.513	76%	0.758	S	S	.	*			trans	-52.5	121	168	-94.9	-19.8	0	0	0	110.1	I723 K1088	I723-D725 PolarHBondContact O-N 3.21Å; D725-K1088 WeakPolarHBondContact OD2-CD 3.42Å; D725-K1088 WeakPolarHBondContact OD2-CE 3.45Å; D725-K1088 IonicContact OD2-NZ 3.82Å; D725-K1088 PolarHBondContact OD2-NZ 2.92Å
726	T	28.1	Very low	27.1	Very low	114 Å²	114	145.5 Å²	145.5	70%	0.699	77%	0.766	S	S	*	*			trans	-113.6	109.5	157.4	33.9	0	0	0	0	107.3	L724 W728	L724-T726 PolarHBondContact O-N 3.09Å; T726-W728 PolarHBondContact O-N 2.93Å
727	P	25.3	Very low	27.2	Very low	120 Å²	120	145.4 Å²	145.4	78%	0.779	77%	0.765	S	S	*	*			trans	-64.8	132	170.4	28.7	-32.3	0	0	0	107.9
728	W	29.3	Very low	27.2	Very low	210 Å²	210	144.3 Å²	144.3	80%	0.795	77%	0.768	S	S	*	*			trans	-131	104.3	169	-138.7	76.2	0	0	0	109.1	T726 E730	T726-W728 PolarHBondContact O-N 2.93Å; W728-E730 PolarHBondContact O-N 3.21Å
729	E	24	Very low	27.3	Very low	177 Å²	177	145.9 Å²	145.9	83%	0.827	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-66.5	120.6	164.7	-62.4	172.9	142.4	0	0	107.1
730	E	28.9	Very low	27.5	Very low	125 Å²	125	143.3 Å²	143.3	58%	0.584	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-68.8	124.1	159.8	-74	-179.4	125.4	0	0	106.8	W728 D732 R1082	W728-E730 PolarHBondContact O-N 3.21Å; E730-D732 PolarHBondContact O-N 3.39Å; E730-R1082 IonicContact OE2-CZ 3.08Å; E730-R1082 IonicContact OE2-NH1 2.7Å; E730-R1082 IonicContact OE2-NH2 3.67Å; E730-R1082 PolarHBondContact OE2-NH2 3.16Å
731	P	26.3	Very low	27.6	Very low	95 Å²	95	140.8 Å²	140.8	62%	0.617	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-63.7	135	177.5	26.5	-33.9	0	0	0	109.9	C733	P731-C733 PolarHBondContact O-N 3.48Å; P731-C733 VanDerWaalsContact O-N 3.1Å
732	D	25	Very low	27.4	Very low	155 Å²	155	139.8 Å²	139.8	83%	0.829	77%	0.768	S	S	*	*			trans	-65.9	110.8	-178.8	-92.8	-46.6	0	0	0	111.3	E730 S734	E730-D732 PolarHBondContact O-N 3.39Å; D732-S734 PolarHBondContact O-N 3.38Å; D732-S734 VanDerWaalsContact O-N 3.11Å
733	C	24.3	Very low	27.4	Very low	129 Å²	129	139.3 Å²	139.3	87%	0.872	77%	0.767	S	S	*	*			trans	-83.5	63.4	164.9	-68.8	0	0	0	0	110.3	P731	P731-C733 PolarHBondContact O-N 3.48Å; P731-C733 VanDerWaalsContact O-N 3.1Å
734	S	27.2	Very low	27.3	Very low	93 Å²	93	137.8 Å²	137.8	65%	0.65	77%	0.77	S	S	*	*			trans	-89.6	94.5	166.9	54.6	0	0	0	0	110	D732 E736	D732-S734 PolarHBondContact O-N 3.38Å; D732-S734 VanDerWaalsContact O-N 3.11Å; S734-E736 PolarHBondContact O-N 2.94Å
735	E	24.8	Very low	27.2	Very low	186 Å²	186	134.4 Å²	134.4	87%	0.869	77%	0.772	S	S	*	*			trans	-70.2	114.2	154.3	-69.6	179.2	127.8	0	0	107.6
736	E	28.2	Very low	27.2	Very low	188 Å²	188	133.2 Å²	133.2	88%	0.879	78%	0.783	S	S	*	*			trans	-140.4	153.2	158.8	-157.6	155.6	-122.1	0	0	111.4	S734	S734-E736 PolarHBondContact O-N 2.94Å
737	H	28.2	Very low	27.3	Very low	184 Å²	184	132.5 Å²	132.5	85%	0.852	78%	0.783	S	S	*	*			trans	-70.2	143.5	-157.8	-77.9	-99	0	0	0	114.6
738	A	24.7	Very low	27.5	Very low	96 Å²	96	136.6 Å²	136.6	79%	0.793	79%	0.789	S	S	*	*			trans	-68.4	135.9	156	0	0	0	0	0	110.6
739	Q	28.1	Very low	27.5	Very low	203 Å²	203	129.6 Å²	129.6	95%	0.949	78%	0.781	S	S	*	*			trans	-141.3	151.6	150.5	-112	-179.2	17.1	0	0	110.1
740	S	27.2	Very low	27.9	Very low	110 Å²	110	127.5 Å²	127.5	77%	0.769	79%	0.787	S	S	*	*			trans	-123.2	136.9	-163.4	48.8	0	0	0	0	112.8
741	T	29.9	Very low	27.9	Very low	140 Å²	140	125 Å²	125	86%	0.859	80%	0.795	S	S	*	*			trans	-171.1	139.3	157.8	28.5	0	0	0	0	106.4
742	S	29.7	Very low	28.1	Very low	91 Å²	91	127 Å²	127	64%	0.636	81%	0.809	S	S	*	*			cis	162.8	131.1	-13.7	44.1	0	0	0	0	105.5
743	S	27.9	Very low	28.5	Very low	109 Å²	109	123.7 Å²	123.7	76%	0.762	80%	0.803	S	S	*	*			trans	43	143.8	143.7	59.2	0	0	0	0	122.3
744	S	27.6	Very low	28.9	Very low	117 Å²	117	123.4 Å²	123.4	82%	0.818	80%	0.802	S	S	*	*			cis	-178.5	159.1	-4	44.3	0	0	0	0	111.5
745	G	28.6	Very low	29.1	Very low	84 Å²	84	123.2 Å²	123.2	87%	0.866	82%	0.815	S	S	*	*			trans	89.8	152.6	163.6	0	0	0	0	0	116.4
746	G	27.4	Very low	29.5	Very low	72 Å²	72	117.5 Å²	117.5	74%	0.742	81%	0.806	S	S	*	*			cis	169.1	165.7	-9.4	0	0	0	0	0	114.8
747	S	30.5	Very low	29.7	Very low	99 Å²	99	114.6 Å²	114.6	69%	0.692	81%	0.807	S	S	*	*			trans	78.9	133.4	163.2	-79.6	0	0	0	0	122.5
748	F	30.2	Very low	30	Very low	206 Å²	206	110.9 Å²	110.9	90%	0.904	80%	0.801	S	S	*	*			trans	51.9	138.9	155.8	-48.4	-56.9	0	0	0	120.8
749	G	28.9	Very low	30.5	Very low	62 Å²	62	111 Å²	111	64%	0.639	80%	0.797	S	S	*	*			cis	170	172	-6	0	0	0	0	0	114
750	S	32.5	Very low	30.8	Very low	134 Å²	134	107 Å²	107	94%	0.937	79%	0.791	S	S	*	*			trans	57.4	129.8	164.2	57.9	0	0	0	0	121.4
751	G	29.4	Very low	31.1	Very low	73 Å²	73	108.4 Å²	108.4	75%	0.753	79%	0.794	S	S	*	*			trans	150.3	103.7	152.3	0	0	0	0	0	118.2
752	C	29.6	Very low	31.2	Very low	137 Å²	137	104.8 Å²	104.8	93%	0.926	79%	0.785	S	S	*	*			trans	22.7	147	138.5	-52.8	0	0	0	0	122.5
753	A	32.5	Very low	31.4	Very low	85 Å²	85	105.7 Å²	105.7	70%	0.702	80%	0.798	S	S	*	*			cis	-171.2	158.8	-11.9	0	0	0	0	0	112.6
754	S	33	Very low	31.6	Very low	122 Å²	122	104.2 Å²	104.2	85%	0.853	80%	0.801	S	S	*	*			trans	54.6	123.8	145.6	60.4	0	0	0	0	123.8
755	G	33.1	Very low	31.8	Very low	89 Å²	89	104 Å²	104	92%	0.918	80%	0.799	S	S	*	*			trans	116.1	123.1	144.7	0	0	0	0	0	116.7
756	G	31.6	Very low	31.8	Very low	66 Å²	66	106.3 Å²	106.3	68%	0.68	80%	0.8	S	S	*	*			cis	165.9	147.9	-11.2	0	0	0	0	0	113.6
757	S	33.8	Very low	31.9	Very low	127 Å²	127	106.8 Å²	106.8	89%	0.888	81%	0.805	S	S	*	*			trans	70.7	150.9	169.2	-42.3	0	0	0	0	116.7
758	S	34.3	Very low	31.9	Very low	106 Å²	106	109.5 Å²	109.5	74%	0.741	81%	0.812	S	S	*	*			cis	179.5	152.7	-13.1	46.4	0	0	0	0	109.7
759	S	34.1	Very low	32	Very low	100 Å²	100	105.3 Å²	105.3	70%	0.699	81%	0.808	S	S	*	*			cis	-179.3	134.2	-20.9	50.3	0	0	0	0	111.4
760	S	34.1	Very low	31.9	Very low	118 Å²	118	105.5 Å²	105.5	83%	0.825	81%	0.81	S	S	*	*			trans	63.4	168.6	175.3	75	0	0	0	0	116
761	V	34.1	Very low	31.8	Very low	139 Å²	139	107.8 Å²	107.8	84%	0.842	81%	0.811	S	S	*	*			cis	-135.9	160.3	5.3	-177.7	0	0	0	0	106.9
762	G	32.2	Very low	32	Very low	65 Å²	65	110.6 Å²	110.6	67%	0.67	81%	0.814	S	S	*	*			cis	-140.7	-157.1	2.4	0	0	0	0	0	110.7
763	A	33.1	Very low	32.3	Very low	109 Å²	109	109 Å²	109	90%	0.901	80%	0.802	S	S	*	*			cis	79.8	110.9	15.2	0	0	0	0	0	115.7
764	G	32	Very low	32.2	Very low	79 Å²	79	110.7 Å²	110.7	81%	0.814	80%	0.803	S	S	*	*			cis	-171.7	-160.9	-3	0	0	0	0	0	109.4
765	S	33.6	Very low	31.9	Very low	112 Å²	112	111.5 Å²	111.5	78%	0.783	80%	0.798	S	S	*	*			cis	-170.8	131.9	-21.7	-177.7	0	0	0	0	108.8
766	C	27.4	Very low	31.7	Very low	132 Å²	132	112.8 Å²	112.8	89%	0.892	79%	0.788	S	S	*	*			trans	26.1	126.9	155.3	-53.2	0	0	0	0	122.6
767	G	30.6	Very low	31.6	Very low	82 Å²	82	116 Å²	116	85%	0.845	79%	0.79	S	S	*	*			trans	-162.7	141.7	158.6	0	0	0	0	0	110.7
768	N	30.8	Very low	31.5	Very low	157 Å²	157	116.5 Å²	116.5	84%	0.84	78%	0.781	S	S	*	*			trans	-145.1	156.1	-164.7	-165.9	12.8	0	0	0	113.8
769	S	32.3	Very low	31.3	Very low	118 Å²	118	116.3 Å²	116.3	83%	0.825	78%	0.78	S	S	*	*			trans	63	154.6	180	73.3	0	0	0	0	116.3
770	G	26.9	Very low	31.2	Very low	66 Å²	66	116.6 Å²	116.6	68%	0.68	78%	0.777	S	S	*	*			cis	170.4	163.2	-8	0	0	0	0	0	112.5
771	L	29.5	Very low	30.8	Very low	182 Å²	182	119.8 Å²	119.8	95%	0.953	78%	0.777	S	S	*	*			trans	74.7	154	175.5	-53.5	174	0	0	0	118.4
772	T	33.4	Very low	30.7	Very low	132 Å²	132	120.4 Å²	120.4	81%	0.81	77%	0.774	S	S	*	*			trans	-113.2	179.9	177.5	57.9	0	0	0	0	109
773	P	35.8	Very low	30.4	Very low	104 Å²	104	120.3 Å²	120.3	68%	0.675	77%	0.772	S	S	*	*			cis	-142.8	-158.4	12.1	33.8	-7.2	0	0	0	115.9
774	T	29.6	Very low	30.2	Very low	119 Å²	119	123 Å²	123	73%	0.73	77%	0.771	S	S	*	*			trans	87.3	114.9	157.6	58.2	0	0	0	0	123.4
775	N	28.3	Very low	30	Very low	140 Å²	140	126.5 Å²	126.5	75%	0.749	77%	0.772	S	S	*	*				57.2	104.4	126.1	-66.1	9.6	0	0	0	124.8
776	T	29.1	Very low	30.2	Very low	115 Å²	115	125.2 Å²	125.2	71%	0.706	76%	0.761	S	S	*	*				43.4	135.3	117.7	62.1	0	0	0	0	123.4
777	N	29.7	Very low	30.2	Very low	135 Å²	135	128.2 Å²	128.2	72%	0.722	76%	0.759	S	S	*	*				-163.1	131.1	125.3	-94.9	-22.7	0	0	0	109.8
778	I	29.7	Very low	30.1	Very low	137 Å²	137	131.9 Å²	131.9	70%	0.703	76%	0.758	S	S	*	*				68.2	127	84.8	-65.9	-178	0	0	0	110.7
779	S	31.3	Very low	30.5	Very low	102 Å²	102	129.7 Å²	129.7	71%	0.713	75%	0.753	S	S	*	*			cis	-151.7	165.1	46.2	-26.5	0	0	0	0	110.8
780	T	31.1	Very low	30	Very low	105 Å²	105	132.1 Å²	132.1	64%	0.644	76%	0.756	S	S	*	*			cis	-168.4	-173.7	-12.4	15.6	0	0	0	0	108.4
781	F	27.3	Very low	30.1	Very low	186 Å²	186	136.4 Å²	136.4	82%	0.816	76%	0.761	S	S	*	*			trans	77.7	141.3	165.1	-59.1	-90.9	0	0	0	117.9
782	I	30.2	Very low	29.8	Very low	152 Å²	152	132.9 Å²	132.9	78%	0.779	75%	0.752	S	S	*	*			cis	-154	137.6	-30.7	-162	171.1	0	0	0	111
783	G	27	Very low	30	Very low	62 Å²	62	131.7 Å²	131.7	64%	0.639	75%	0.746	S	S	*	*			trans	67.8	136	152.6	0	0	0	0	0	119.9
784	N	29.3	Very low	29.5	Very low	165 Å²	165	132.5 Å²	132.5	88%	0.882	75%	0.749	S	S	*	*			cis	-150.1	162.1	-3.8	-95.7	-18.1	0	0	0	110.7
785	N	27.1	Very low	29.4	Very low	153 Å²	153	134.7 Å²	134.7	82%	0.818	76%	0.756	S	S	*	*			trans	-146.8	-172.8	172.2	-133.5	-6.6	0	0	0	105.5
786	P	38.6	Very low	29.3	Very low	85 Å²	85	133.7 Å²	133.7	55%	0.552	76%	0.755	S	S	*	*			cis	-126.5	-165.5	-6.4	39.9	-18.8	0	0	0	112.2
787	F	27.8	Very low	29.1	Very low	196 Å²	196	139.6 Å²	139.6	86%	0.86	76%	0.764	S	S	*	*				-162.5	168.8	82.1	-109.3	-78.2	0	0	0	113.6
788	L	27.7	Very low	28.9	Very low	159 Å²	159	143.7 Å²	143.7	83%	0.832	77%	0.77	S	S	*	*			trans	-108.7	160.5	-165.9	-70.1	165.5	0	0	0	114.6
789	P	38.6	Very low	28.7	Very low	111 Å²	111	143 Å²	143	72%	0.721	77%	0.772	S	S	*	*			trans	-100.6	166.1	175.5	39.6	-35.1	0	0	0	113.8
790	L	22.6	Very low	28.6	Very low	169 Å²	169	142.7 Å²	142.7	89%	0.885	77%	0.77	S	S	*	*			trans	-175.7	172.4	148.5	-108.7	166	0	0	0	113.6
791	I	28.4	Very low	28.4	Very low	156 Å²	156	142.6 Å²	142.6	80%	0.8	77%	0.773	S	S	*	*			trans	85.9	140.6	168.5	-49	-172.8	0	0	0	118.1
792	S	24.1	Very low	28.4	Very low	107 Å²	107	142 Å²	142	75%	0.748	78%	0.778	S	S	*	*			trans	-144.7	178.5	175.3	-65.6	0	0	0	0	106.7
793	P	37.1	Very low	28.4	Very low	108 Å²	108	141.6 Å²	141.6	70%	0.701	78%	0.777	S	S	*	*			cis	-147.1	-173.8	17.7	40	-16.3	0	0	0	117.6
794	T	25.6	Very low	28.5	Very low	120 Å²	120	146.5 Å²	146.5	74%	0.736	79%	0.789	S	S	*	*			trans	41	123.7	150	51.9	0	0	0	0	122.5
795	L	26.8	Very low	28.5	Very low	166 Å²	166	142.8 Å²	142.8	87%	0.869	78%	0.776	S	S	*	*				-175.2	164.8	105.2	-103.1	152.4	0	0	0	114.4
796	T	25.2	Very low	28.7	Very low	119 Å²	119	142.8 Å²	142.8	73%	0.73	78%	0.776	S	S	*	*			trans	-75.7	156.2	-174.1	55.2	0	0	0	0	115.3
797	R	26.5	Very low	28.3	Very low	238 Å²	238	147.4 Å²	147.4	90%	0.898	79%	0.789	S	S	*	*				178.6	149.7	103.3	-156.9	166.9	-139.2	-125.2	5.7	115.3
798	R	25.3	Very low	28.2	Very low	221 Å²	221	144.2 Å²	144.2	83%	0.834	78%	0.781	S	S	*	*			trans	-46.8	163.7	163.6	-63.4	176.8	-178.1	179	-0.7	115.2
799	T	25.9	Very low	28.2	Very low	124 Å²	124	144.5 Å²	144.5	76%	0.761	78%	0.78	S	S	*	*			cis	-161.5	-153	-10.5	30.8	0	0	0	0	106.2
800	S	28.6	Very low	27.7	Very low	94 Å²	94	144.1 Å²	144.1	66%	0.657	77%	0.772	S	S	*	*			cis	-164.2	129.2	10.9	-20	0	0	0	0	109
801	S	25.7	Very low	27.8	Very low	103 Å²	103	145.8 Å²	145.8	72%	0.72	77%	0.772	S	S	*	*				81.4	114.5	88.9	75.4	0	0	0	0	117.8
802	L	28.9	Very low	27.8	Very low	173 Å²	173	144.2 Å²	144.2	91%	0.906	76%	0.764	S	S	*	*			trans	-168.2	88.1	155.3	-107.8	156	0	0	0	107.6
803	N	29.2	Very low	27.7	Very low	144 Å²	144	146 Å²	146	77%	0.77	77%	0.765	S	S	*	*				58.6	108	83.3	-83.5	8.6	0	0	0	116.6
804	N	29.9	Very low	27.2	Very low	166 Å²	166	150.3 Å²	150.3	89%	0.888	77%	0.773	S	S	*	*				-148	167.3	122.9	-145.6	-19	0	0	0	110
805	S	28.7	Very low	27.1	Very low	86 Å²	86	149.6 Å²	149.6	60%	0.601	77%	0.769	S	S	*	*			trans	-115.5	176.9	-142.9	-59.2	0	0	0	0	117.7
806	N	31.4	Very low	27	Very low	153 Å²	153	147.8 Å²	147.8	82%	0.818	76%	0.76	S	S	*	*			trans	91.5	136.6	171.8	-50.4	-26.9	0	0	0	115.1
807	H	30.1	Very low	27.1	Very low	182 Å²	182	149.5 Å²	149.5	84%	0.843	76%	0.764	S	S	*	*			cis	-136.8	163.2	8.3	-145.6	-82.1	0	0	0	112.9
808	L	25.7	Very low	27.1	Very low	130 Å²	130	145 Å²	145	68%	0.681	76%	0.758	S	S	*	*			trans	-98.3	139.5	-172.3	-171.4	79.6	0	0	0	112.9
809	M	28.4	Very low	27.2	Very low	164 Å²	164	142.4 Å²	142.4	81%	0.808	76%	0.761	S	S	*	*				-168.2	122.5	126.1	-136.3	59.9	175.8	0	0	116
810	N	28.4	Very low	27.3	Very low	103 Å²	103	145.2 Å²	145.2	55%	0.551	77%	0.766	S	S	*	*			trans	-8.8	133.2	164.8	-54.7	-9.7	0	0	0	121.8	I812	N810-I812 HydrophobicContact CB-CG1 4.21Å
811	K	24	Very low	27.3	Very low	204 Å²	204	147.1 Å²	147.1	89%	0.887	77%	0.773	S	S	*	*			trans	-86.3	147.3	130.1	-74.9	-176.8	176.1	-178.9	0	108.9
812	I	27.8	Very low	27.4	Very low	123 Å²	123	149.4 Å²	149.4	63%	0.631	78%	0.777	S	S	*	*			trans	-131.7	117.1	162.4	-62.1	179	0	0	0	107.6	N810 F814	N810-I812 HydrophobicContact CB-CG1 4.21Å; I812-F814 HydrophobicContact CG2-CD2 3.73Å; I812-F814 HydrophobicContact CG2-CE2 4.04Å
813	N	23.3	Very low	27.4	Very low	146 Å²	146	147 Å²	147	78%	0.781	77%	0.773	S	S	*	*			trans	-97.8	145.5	158	-73.8	4.3	0	0	0	107.3
814	F	25.5	Very low	27.1	Very low	198 Å²	198	145.3 Å²	145.3	87%	0.868	77%	0.773	S	S	*	*			trans	-126.7	140.6	157.7	-100.4	-82.7	0	0	0	108.7	I812	I812-F814 HydrophobicContact CG2-CD2 3.73Å; I812-F814 HydrophobicContact CG2-CE2 4.04Å
815	T	22.9	Very low	27.1	Very low	104 Å²	104	144.5 Å²	144.5	64%	0.638	77%	0.774	S	S	*	*			trans	-107.2	171.7	174	49	0	0	0	0	109.7
816	D	25	Very low	27	Very low	129 Å²	129	146 Å²	146	69%	0.69	78%	0.78	S	S	*	*			trans	72.4	137.1	162.2	-41.6	-53.3	0	0	0	115.6
817	N	27.9	Very low	26.9	Very low	154 Å²	154	145.8 Å²	145.8	82%	0.824	78%	0.784	S	S	*	*			cis	-140.4	158.4	32.4	-78.3	-92.4	0	0	0	114.1
818	N	26.3	Very low	26.6	Very low	144 Å²	144	142.9 Å²	142.9	77%	0.77	78%	0.779	S	S	*	*			trans	-79	154.7	159	-54.3	-47.1	0	0	0	110.1
819	N	28.6	Very low	26.9	Very low	167 Å²	167	142.4 Å²	142.4	89%	0.893	78%	0.782	S	S	*	*				-172	152.2	118.1	-98.7	-11.2	0	0	0	112.4
820	E	27	Very low	26.9	Very low	183 Å²	183	140.9 Å²	140.9	86%	0.855	78%	0.777	S	S	*	*			trans	-98.8	161.3	-177.9	-63.3	-175.4	132.8	0	0	113.1
821	T	29.4	Very low	27	Very low	133 Å²	133	142.7 Å²	142.7	82%	0.816	79%	0.787	S	S	*	*			trans	17.7	104.5	150.8	-37.6	0	0	0	0	120.1
822	L	27.3	Very low	27.3	Very low	152 Å²	152	140 Å²	140	80%	0.796	78%	0.782	S	S	*	*	S	Bend	trans	17.2	117.9	141.2	-163.7	69.7	0	0	0	120.9
823	C	28.1	Very low	27.4	Very low	123 Å²	123	138.3 Å²	138.3	83%	0.831	78%	0.781	S	S	*	*			trans	63.5	130.7	150.8	-69.5	0	0	0	0	120.9
824	S	24.2	Very low	27.8	Very low	108 Å²	108	138 Å²	138	76%	0.755	78%	0.779	S	S	*	*			trans	-107.7	149.5	-177.8	49.6	0	0	0	0	113.3
825	T	30	Very low	28.1	Very low	148 Å²	148	134.8 Å²	134.8	91%	0.908	77%	0.771	S	S	*	*			trans	-152.3	147.6	135.9	-31.1	0	0	0	0	109.9
826	T	25.3	Very low	28.4	Very low	119 Å²	119	136.8 Å²	136.8	73%	0.73	78%	0.778	S	S	*	*			trans	-108.2	141.8	-170	-20.1	0	0	0	0	112
827	T	29.4	Very low	28.8	Very low	147 Å²	147	137.1 Å²	137.1	90%	0.902	79%	0.785	S	S	*	*			trans	-171.1	160.8	131.3	13.9	0	0	0	0	111.7
828	T	24.9	Very low	28.8	Very low	122 Å²	122	136.6 Å²	136.6	75%	0.748	79%	0.787	S	S	*	*			trans	-125.3	149.5	-165.6	-14.9	0	0	0	0	111.4
829	T	30.3	Very low	29	Very low	119 Å²	119	132.9 Å²	132.9	73%	0.73	78%	0.783	S	S	*	*				176.8	144.5	123.1	25.9	0	0	0	0	114.1
830	N	28.6	Very low	29	Very low	132 Å²	132	132.9 Å²	132.9	71%	0.706	78%	0.782	S	S	*	*			trans	58	125.6	141.8	-61.9	5	0	0	0	119.9
831	N	30.9	Very low	29.1	Very low	142 Å²	142	132 Å²	132	76%	0.759	78%	0.782	S	S	*	*			cis	-171	144.4	28.8	-100.2	-16.3	0	0	0	114.1
832	N	30	Very low	29.1	Very low	147 Å²	147	128.2 Å²	128.2	79%	0.786	77%	0.77	S	S	*	*			trans	-20.3	158.6	141	-83.8	-8.2	0	0	0	118.1
833	S	31.1	Very low	29.3	Very low	87 Å²	87	127.4 Å²	127.4	61%	0.608	77%	0.774	S	S	*	*			cis	-167.2	179.7	13.4	-115.6	0	0	0	0	112.9
834	N	31	Very low	29.1	Very low	141 Å²	141	129.2 Å²	129.2	75%	0.754	77%	0.771	S	S	*	*			trans	89.2	142.4	159.6	-58.3	-25.3	0	0	0	118.9
835	N	32.3	Very low	29.2	Very low	130 Å²	130	133.1 Å²	133.1	70%	0.695	78%	0.778	S	S	*	*			cis	-167.3	150.6	-31.2	-123.1	-5.1	0	0	0	111.6
836	N	29.8	Very low	29.1	Very low	145 Å²	145	130.1 Å²	130.1	78%	0.775	76%	0.76	S	S	*	*			trans	63.8	155.2	167	-59.9	-19.6	0	0	0	116.8
837	T	33.3	Very low	29.6	Very low	137 Å²	137	132 Å²	132	84%	0.84	76%	0.76	S	S	*	*			cis	-138.1	153	17.6	-45.6	0	0	0	0	112
838	V	27.6	Very low	29.6	Very low	143 Å²	143	127.8 Å²	127.8	87%	0.867	74%	0.737	S	S	*	*			trans	-87.3	141.3	-179.7	175.9	0	0	0	0	112.1
839	G	30.8	Very low	30	Very low	66 Å²	66	127.8 Å²	127.8	68%	0.68	73%	0.732	S	S	*	*			trans	-149.4	130.9	170.1	0	0	0	0	0	112.1
840	N	27.4	Very low	30.3	Very low	166 Å²	166	128 Å²	128	89%	0.888	72%	0.719	S	S	*	*			trans	-59.2	132.7	-174.4	-87.2	-18.1	0	0	0	114.1
841	I	29.4	Very low	30.8	Very low	165 Å²	165	124.5 Å²	124.5	85%	0.846	71%	0.705	S	S	*	*			trans	-134.7	129.4	153.6	-56.9	-178.2	0	0	0	107.8
842	G	29	Very low	31.1	Very low	54 Å²	54	120.2 Å²	120.2	56%	0.557	69%	0.69	S	S	*	*			trans	-77	168.8	177.9	0	0	0	0	0	113.3	M844	G842-M844 PolarHBondContact O-N 3.32Å
843	P	32.1	Very low	31.5	Very low	135 Å²	135	117.7 Å²	117.7	88%	0.877	67%	0.67	S	S	*	*			trans	-69.2	101.2	-177.1	28.6	-34.6	0	0	0	111.7	E845	P843-E845 PolarHBondContact O-N 2.9Å; P843-E845 VanDerWaalsContact O-N 3.16Å
844	M	24.2	Very low	31.9	Very low	160 Å²	160	113.8 Å²	113.8	79%	0.788	64%	0.642	S	S	*	*			trans	-76.8	94.2	170.4	-176.4	169.8	65.4	0	0	109.6	G842 T846	G842-M844 PolarHBondContact O-N 3.32Å; M844-T846 WeakPolarHBondContact O-CG2 3.38Å; M844-T846 PolarHBondContact O-N 3.31Å; M844-T846 VanDerWaalsContact O-N 3.09Å
845	E	25.2	Very low	32.5	Very low	190 Å²	190	110.7 Å²	110.7	89%	0.888	63%	0.626	S	S	*	*			trans	-60	112.9	172.5	-88.8	-162.5	133.2	0	0	110.4	P843	P843-E845 PolarHBondContact O-N 2.9Å; P843-E845 VanDerWaalsContact O-N 3.16Å
846	T	29.4	Very low	33	Very low	86 Å²	86	108.6 Å²	108.6	53%	0.528	63%	0.627	S	S	.	*			trans	-83.6	149.8	-172.9	62	0	0	0	0	112.5	M844 S848	M844-T846 WeakPolarHBondContact O-CG2 3.38Å; M844-T846 PolarHBondContact O-N 3.31Å; M844-T846 VanDerWaalsContact O-N 3.09Å; T846-S848 PolarHBondContact O-N 3.01Å; T846-S848 PolarHBondContact O-OG 3.42Å; T846-S848 PolarHBondContact OG1-OG 3.45Å
847	Q	34.2	Very low	34.2	Very low	157 Å²	157	104.6 Å²	104.6	73%	0.734	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-3.9	178.8	-58.5	-179	10.1	0	0	114.1	N849 R850	Q847-N849 PolarHBondContact O-N 3.5Å; Q847-R850 PolarHBondContact O-N 3.34Å
848	S	30.8	Very low	35.4	Very low	60 Å²	60	100.1 Å²	100.1	42%	0.42	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-49.8	-47.7	-178.2	56.3	0	0	0	0	113.5	T846 R850 S851 A852	T846-S848 PolarHBondContact O-N 3.01Å; T846-S848 PolarHBondContact O-OG 3.42Å; T846-S848 PolarHBondContact OG1-OG 3.45Å; S848-R850 PolarHBondContact O-N 2.88Å; S848-R850 VanDerWaalsContact O-N 3.13Å; S848-S851 PolarHBondContact O-N 2.81Å; S848-S851 PolarHBondContact O-OG 3.25Å; S848-A852 PolarHBondContact O-N 3.42Å
849	N	32.7	Very low	36.8	Very low	122 Å²	122	95 Å²	95	65%	0.652	55%	0.548	S	S	*	.	H	α-helix	trans	-60	-24.9	-176.5	-90.8	-25.5	0	0	0	114.3	Q847 S851	Q847-N849 PolarHBondContact O-N 3.5Å; N849-S851 VanDerWaalsContact C-N 3.27Å; N849-S851 PolarHBondContact O-N 3.05Å
850	R	37.5	Very low	38.2	Very low	122 Å²	122	96.8 Å²	96.8	46%	0.46	54%	0.539	S	S	.	.	H	α-helix	trans	-68.3	-26.9	174.9	-80.1	-176.9	166.3	-176.1	-7.8	113	Q847 S848 W853 E885	Q847-R850 PolarHBondContact O-N 3.34Å; S848-R850 PolarHBondContact O-N 2.88Å; S848-R850 VanDerWaalsContact O-N 3.13Å; R850-W853 VanDerWaalsContact O-CD1 3.3Å; R850-W853 PolarHBondContact O-NE1 2.89Å; R850-E885 IonicContact CZ-OE1 3.54Å; R850-E885 IonicContact NE-OE1 2.75Å; R850-E885 IonicContact NH2-OE1 3.48Å; R850-E885 PolarHBondContact NH2-OE1 2.94Å
851	S	39.3	Very low	39.9	Very low	59 Å²	59	93 Å²	93	41%	0.413	52%	0.519	S	S	.	.	H	α-helix	trans	-89.2	-33.8	-179.7	74.1	0	0	0	0	113	S848 N849 N855	S848-S851 PolarHBondContact O-N 2.81Å; S848-S851 PolarHBondContact O-OG 3.25Å; N849-S851 VanDerWaalsContact C-N 3.27Å; N849-S851 PolarHBondContact O-N 3.05Å; S851-N855 WeakPolarHBondContact O-CB 3.43Å; S851-N855 PolarHBondContact O-N 3.46Å; S851-N855 PolarHBondContact O-ND2 3.04Å
852	A	36.2	Very low	41.6	Very low	52 Å²	52	85.9 Å²	85.9	43%	0.43	49%	0.485	S	S	.	.	H	α-helix	trans	-59.3	-53.5	-175	0	0	0	0	0	112.3	S848 A854 N855 A856	S848-A852 PolarHBondContact O-N 3.42Å; A852-A854 PolarHBondContact O-N 3.28Å; A852-N855 PolarHBondContact O-N 3.01Å; A852-A856 WeakPolarHBondContact O-CB 3.49Å; A852-A856 PolarHBondContact O-N 2.95Å
853	W	37.9	Very low	43.8	Very low	95 Å²	95	83.7 Å²	83.7	36%	0.36	46%	0.46	S	S	.	.	H	α-helix	trans	-65.9	-41.8	-176.8	80.3	-70	0	0	0	113.4	R850 N855 A856 I857 L961 P963	R850-W853 VanDerWaalsContact O-CD1 3.3Å; R850-W853 PolarHBondContact O-NE1 2.89Å; W853-N855 PolarHBondContact O-N 2.99Å; W853-A856 PolarHBondContact O-N 3.18Å; W853-I857 HydrophobicContact CE3-CD1 3.81Å; W853-I857 HydrophobicContact CZ3-CD1 4.47Å; W853-I857 WeakPolarHBondContact O-CG1 3.44Å; W853-I857 PolarHBondContact O-N 3.09Å; W853-L961 HydrophobicContact CH2-CD2 4.31Å; W853-L961 HydrophobicContact CZ2-CD2 4.36Å; W853-P963 HydrophobicContact CH2-CB 3.99Å; W853-P963 HydrophobicContact CH2-CG 3.73Å; W853-P963 HydrophobicContact CZ2-CB 3.29Å; W853-P963 HydrophobicContact CZ2-CG 3.44Å; W853-P963 VanDerWaalsContact CZ2-CG 3.44Å
854	A	41.1	Very low	45.9	Very low	4 Å²	4	81.6 Å²	81.6	3%	0.033	44%	0.438	C	S	.	.	H	α-helix	trans	-73.8	-12.4	-178.9	0	0	0	0	0	114.1	A852 P963 L964	A852-A854 PolarHBondContact O-N 3.28Å; A854-P963 HydrophobicContact CB-CG 4.32Å; A854-L964 HydrophobicContact CB-CD1 4.45Å; A854-L964 HydrophobicContact CB-CD2 3.78Å; A854-L964 HydrophobicContact CB-CG 4.02Å
855	N	42.2	Very low	48.6	Very low	77 Å²	77	77 Å²	77	41%	0.412	42%	0.416	S	S	.	.	H	α-helix	trans	-93.2	-15.6	171.2	-70.4	-38.4	0	0	0	113.1	S851 A852 W853 R1016	S851-N855 WeakPolarHBondContact O-CB 3.43Å; S851-N855 PolarHBondContact O-N 3.46Å; S851-N855 PolarHBondContact O-ND2 3.04Å; A852-N855 PolarHBondContact O-N 3.01Å; W853-N855 PolarHBondContact O-N 2.99Å; N855-R1016 PolarHBondContact ND2-NH2 3.45Å; N855-R1016 PolarHBondContact OD1-NE 3.43Å; N855-R1016 PolarHBondContact OD1-NH2 2.84Å; N855-R1016 VanDerWaalsContact OD1-NH2 3.1Å
856	A	43.3	Very low	51.3	Low	86 Å²	86	68.8 Å²	68.8	71%	0.711	38%	0.377	S	S	*	.	H	α-helix	trans	-104.9	-7.2	-171.4	0	0	0	0	0	114.8	A852 W853	A852-A856 WeakPolarHBondContact O-CB 3.49Å; A852-A856 PolarHBondContact O-N 2.95Å; W853-A856 PolarHBondContact O-N 3.18Å
857	I	54.5	Low	53.7	Low	60 Å²	60	69 Å²	69	31%	0.308	38%	0.375	S	S	.	.	S	Bend	trans	-108.8	130.2	-176.1	-61.3	174.4	0	0	0	109.4	W853 N861 A862	W853-I857 HydrophobicContact CE3-CD1 3.81Å; W853-I857 HydrophobicContact CZ3-CD1 4.47Å; W853-I857 WeakPolarHBondContact O-CG1 3.44Å; W853-I857 PolarHBondContact O-N 3.09Å; I857-N861 HydrophobicContact CG2-CB 3.66Å; I857-A862 HydrophobicContact CG2-CB 3.88Å
858	S	57.8	Low	55.8	Low	43 Å²	43	67.1 Å²	67.1	30%	0.301	37%	0.366	S	S	.	.			trans	-67.5	156.1	175.4	62.5	0	0	0	0	112.1	E860 N861 A862	S858-E860 PolarHBondContact O-N 3.19Å; S858-N861 PolarHBondContact O-N 2.98Å; S858-N861 WeakPolarHBondContact OG-CB 3.32Å; S858-N861 PolarHBondContact OG-N 3.44Å; S858-N861 PolarHBondContact OG-OD1 3.04Å; S858-A862 WeakPolarHBondContact O-CB 3.47Å; S858-A862 PolarHBondContact O-N 3.17Å
859	P	57.7	Low	57.9	Low	35 Å²	35	65.9 Å²	65.9	23%	0.227	36%	0.355	C	S	.	.	H	α-helix	trans	-55.5	-31.9	175.9	-27.2	37	0	0	0	114.2	Q863 F1018	P859-Q863 PolarHBondContact O-N 3.44Å; P859-F1018 HydrophobicContact CB-CB 4.27Å; P859-F1018 HydrophobicContact CB-CD1 4.03Å; P859-F1018 HydrophobicContact CB-CG 4.26Å; P859-F1018 WeakPolarHBondContact O-CE1 3.11Å
860	E	59.9	Low	59.5	Low	105 Å²	105	62.7 Å²	62.7	49%	0.491	34%	0.341	S	S	.	.	H	α-helix	trans	-66.5	-56.3	174	-69.2	59.3	-125.5	0	0	110.9	S858 A862 Q863 Q864 R941	S858-E860 PolarHBondContact O-N 3.19Å; E860-A862 PolarHBondContact O-N 2.7Å; E860-Q863 PolarHBondContact O-N 3.39Å; E860-Q864 PolarHBondContact O-N 3.18Å; E860-R941 IonicContact OE1-NH2 3.63Å; E860-R941 PolarHBondContact OE1-NH2 3.4Å
861	N	64.4	Low	60.7	Low	87 Å²	87	63.5 Å²	63.5	47%	0.465	36%	0.362	S	S	.	.	H	α-helix	trans	-61.7	-31.7	-176.2	-66.5	11.4	0	0	0	111.8	I857 S858	I857-N861 HydrophobicContact CG2-CB 3.66Å; S858-N861 PolarHBondContact O-N 2.98Å; S858-N861 WeakPolarHBondContact OG-CB 3.32Å; S858-N861 PolarHBondContact OG-N 3.44Å; S858-N861 PolarHBondContact OG-OD1 3.04Å
862	A	64.9	Low	61.7	Low	15 Å²	15	63 Å²	63	12%	0.124	36%	0.358	C	S	.	.	H	α-helix	trans	-70.4	-27.8	176.7	0	0	0	0	0	113.6	I857 S858 E860 V1014 T1015	I857-A862 HydrophobicContact CG2-CB 3.88Å; S858-A862 WeakPolarHBondContact O-CB 3.47Å; S858-A862 PolarHBondContact O-N 3.17Å; E860-A862 PolarHBondContact O-N 2.7Å; A862-V1014 HydrophobicContact CB-CG1 3.77Å; A862-T1015 HydrophobicContact CB-CG2 4.49Å
863	Q	75.2	Confident	63.4	Low	8 Å²	8	66.9 Å²	66.9	4%	0.037	37%	0.372	C	S	.	.	H	α-helix	trans	-89.2	-33.9	176.5	-176.1	59.8	47.4	0	0	112.3	P859 E860 I865 Y866 D867 E960 F1018	P859-Q863 PolarHBondContact O-N 3.44Å; E860-Q863 PolarHBondContact O-N 3.39Å; Q863-I865 PolarHBondContact O-N 3.23Å; Q863-I865 VanDerWaalsContact O-N 3.14Å; Q863-Y866 PolarHBondContact O-N 2.97Å; Q863-D867 WeakPolarHBondContact CG-OD2 3.48Å; Q863-D867 PolarHBondContact NE2-OD1 3.37Å; Q863-D867 PolarHBondContact O-N 3.4Å; Q863-D867 VanDerWaalsContact O-N 3.16Å; Q863-E960 PolarHBondContact NE2-OE1 3.01Å; Q863-F1018 HydrophobicContact CB-CE1 4.21Å; Q863-F1018 HydrophobicContact CB-CZ 4.38Å
864	Q	75.7	Confident	65.6	Low	90 Å²	90	64.2 Å²	64.2	42%	0.421	36%	0.363	S	S	.	.	H	α-helix	trans	-51.7	-40.8	-174.3	-176.2	173.9	-4.9	0	0	113.2	E860 Y866 D867 E868	E860-Q864 PolarHBondContact O-N 3.18Å; Q864-Y866 PolarHBondContact O-N 3.27Å; Q864-Y866 VanDerWaalsContact O-N 3.16Å; Q864-D867 PolarHBondContact O-N 2.9Å; Q864-D867 VanDerWaalsContact O-N 3.08Å; Q864-E868 HydrophobicContact CG-CG 4.11Å; Q864-E868 WeakPolarHBondContact CG-OE1 3.49Å; Q864-E868 PolarHBondContact NE2-OE1 3.37Å; Q864-E868 WeakPolarHBondContact O-CB 3.44Å; Q864-E868 WeakPolarHBondContact O-CG 3.46Å; Q864-E868 PolarHBondContact O-N 3.21Å
865	I	80.2	Confident	67.9	Low	64 Å²	64	68 Å²	68	33%	0.328	38%	0.382	S	S	.	.	H	α-helix	trans	-57.1	-32.3	178.7	-58.8	174.7	0	0	0	112.4	Q863 V908	Q863-I865 PolarHBondContact O-N 3.23Å; Q863-I865 VanDerWaalsContact O-N 3.14Å; I865-V908 HydrophobicContact CG2-CG1 4.03Å; I865-V908 HydrophobicContact CG2-CG2 4.06Å
866	Y	83.4	Confident	70.2	Confident	18 Å²	18	65 Å²	65	7%	0.071	37%	0.366	C	S	.	.	H	α-helix	trans	-92.7	-21.5	178.3	-53.5	-72	0	0	0	113.4	Q863 Q864 L869 V908 P909 I947 E960 L961	Q863-Y866 PolarHBondContact O-N 2.97Å; Q864-Y866 PolarHBondContact O-N 3.27Å; Q864-Y866 VanDerWaalsContact O-N 3.16Å; Y866-L869 HydrophobicContact CD1-CD1 4.3Å; Y866-V908 HydrophobicContact CD1-CG1 4.01Å; Y866-V908 HydrophobicContact CE1-CG1 3.78Å; Y866-P909 WeakPolarHBondContact CE1-O 3.45Å; Y866-P909 PolarHBondContact OH-O 3.38Å; Y866-P909 VanDerWaalsContact OH-O 3.09Å; Y866-I947 HydrophobicContact CD1-CD1 4.2Å; Y866-I947 HydrophobicContact CE1-CD1 4.39Å; Y866-E960 WeakPolarHBondContact CB-OE1 3.38Å; Y866-E960 HydrophobicContact CD1-CB 4.24Å; Y866-E960 HydrophobicContact CD1-CG 3.8Å; Y866-E960 HydrophobicContact CD2-CB 4.35Å; Y866-E960 HydrophobicContact CD2-CG 4.1Å; Y866-E960 HydrophobicContact CE1-CB 4.07Å; Y866-E960 HydrophobicContact CE1-CG 4.16Å; Y866-E960 HydrophobicContact CE2-CB 4.2Å; Y866-E960 HydrophobicContact CE2-CG 4.44Å; Y866-E960 HydrophobicContact CG-CB 4.36Å; Y866-E960 HydrophobicContact CG-CG 3.76Å; Y866-L961 WeakPolarHBondContact OH-CB 3.4Å; Y866-L961 PolarHBondContact OH-N 3.03Å; Y866-L961 PolarHBondContact OH-O 2.85Å
867	D	78.5	Confident	72.4	Confident	91 Å²	91	64.4 Å²	64.4	49%	0.487	35%	0.351	S	S	.	.	H	α-helix	trans	-80.3	-24.8	174.3	-72.1	-2.9	0	0	0	112.2	Q863 Q864 R945	Q863-D867 WeakPolarHBondContact CG-OD2 3.48Å; Q863-D867 PolarHBondContact NE2-OD1 3.37Å; Q863-D867 PolarHBondContact O-N 3.4Å; Q863-D867 VanDerWaalsContact O-N 3.16Å; Q864-D867 PolarHBondContact O-N 2.9Å; Q864-D867 VanDerWaalsContact O-N 3.08Å; D867-R945 IonicContact OD1-CZ 2.81Å; D867-R945 IonicContact OD1-NH1 3.59Å; D867-R945 PolarHBondContact OD1-NH1 3.2Å; D867-R945 IonicContact OD1-NH2 3.83Å; D867-R945 PolarHBondContact OD1-NH2 2.85Å
868	E	78.5	Confident	74	Confident	117 Å²	117	63.2 Å²	63.2	55%	0.547	35%	0.348	S	S	.	.	S	Bend	trans	-84.8	-6	174.3	-71.1	-178.3	173.4	0	0	114.1	Q864	Q864-E868 HydrophobicContact CG-CG 4.11Å; Q864-E868 WeakPolarHBondContact CG-OE1 3.49Å; Q864-E868 PolarHBondContact NE2-OE1 3.37Å; Q864-E868 WeakPolarHBondContact O-CB 3.44Å; Q864-E868 WeakPolarHBondContact O-CG 3.46Å; Q864-E868 PolarHBondContact O-N 3.21Å
869	L	75.9	Confident	75.5	Confident	33 Å²	33	68.9 Å²	68.9	17%	0.173	37%	0.369	C	S	.	.	S	Bend	trans	-57.1	130.7	174.5	-77.4	173.7	0	0	0	110.3	Y866 Y900 T902 V908 I947	Y866-L869 HydrophobicContact CD1-CD1 4.3Å; L869-Y900 HydrophobicContact CD2-CE1 4.42Å; L869-T902 HydrophobicContact CD2-CG2 3.61Å; L869-V908 HydrophobicContact CD2-CG2 4.05Å; L869-I947 HydrophobicContact CD1-CD1 4.15Å; L869-I947 HydrophobicContact CD1-CG1 4.19Å; L869-I947 HydrophobicContact CD1-CG2 4.09Å
870	P	65.7	Low	77.1	Confident	55 Å²	55	69.3 Å²	69.3	36%	0.357	37%	0.371	S	S	.	.			trans	-61.2	153.6	174.9	27.3	-34.5	0	0	0	110	S872	P870-S872 PolarHBondContact O-N 3.2Å
871	P	62.3	Low	78.7	Confident	140 Å²	140	64.7 Å²	64.7	91%	0.909	35%	0.351	S	S	*	.			trans	-55.7	98.6	176.8	-25.2	35.1	0	0	0	111
872	S	60.9	Low	80.1	Confident	48 Å²	48	64.3 Å²	64.3	34%	0.336	35%	0.351	S	S	.	.			trans	-73.3	148	-167.7	-171.1	0	0	0	0	111.5	P870 F874 L876	P870-S872 PolarHBondContact O-N 3.2Å; S872-F874 PolarHBondContact O-N 2.95Å; S872-L876 WeakPolarHBondContact OG-CD2 3.34Å
873	N	70.7	Confident	81.4	Confident	133 Å²	133	67.5 Å²	67.5	71%	0.711	37%	0.366	S	S	*	.			trans	-56.8	126.7	155	-76	-26.5	0	0	0	108.1	L875	N873-L875 WeakPolarHBondContact CB-O 3.4Å; N873-L875 PolarHBondContact O-N 3.19Å
874	F	85.7	Confident	82.2	Confident	40 Å²	40	72.1 Å²	72.1	18%	0.175	39%	0.386	C	S	.	.	S	Bend	trans	-60	-31	178.6	165.9	-100.4	0	0	0	112.2	S872 L929 A932 R933 A936 L946 G948 V949	S872-F874 PolarHBondContact O-N 2.95Å; F874-L929 HydrophobicContact CE1-CD2 4Å; F874-L929 HydrophobicContact CZ-CD2 4.33Å; F874-A932 HydrophobicContact CE2-CB 4.04Å; F874-A932 HydrophobicContact CZ-CB 3.76Å; F874-R933 HydrophobicContact CD1-CG 3.89Å; F874-R933 HydrophobicContact CD2-CG 4.22Å; F874-R933 HydrophobicContact CE1-CG 3.55Å; F874-R933 HydrophobicContact CE2-CB 4.46Å; F874-R933 HydrophobicContact CE2-CG 3.91Å; F874-R933 HydrophobicContact CG-CG 4.21Å; F874-R933 HydrophobicContact CZ-CB 4.36Å; F874-R933 HydrophobicContact CZ-CG 3.56Å; F874-A936 HydrophobicContact CD2-CB 3.94Å; F874-A936 HydrophobicContact CE2-CB 4.15Å; F874-L946 HydrophobicContact CE2-CD2 4.3Å; F874-G948 CarbonylContact O-C 3.58Å; F874-G948 WeakPolarHBondContact O-CA 3.46Å; F874-V949 HydrophobicContact CE1-CG2 4.34Å; F874-V949 HydrophobicContact CE2-CG2 3.72Å; F874-V949 HydrophobicContact CZ-CB 4.32Å; F874-V949 HydrophobicContact CZ-CG2 3.58Å; F874-V949 PolarHBondContact O-N 3.38Å
875	L	89.8	Confident	83	Confident	84 Å²	84	71.2 Å²	71.2	44%	0.44	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-92.1	124.5	168.5	-62.9	177.9	0	0	0	109.8	N873 L929 V949	N873-L875 WeakPolarHBondContact CB-O 3.4Å; N873-L875 PolarHBondContact O-N 3.19Å; L875-L929 HydrophobicContact CD2-CD2 4.09Å; L875-V949 CarbonylContact C-O 3.5Å; L875-V949 WeakPolarHBondContact CA-O 3.5Å; L875-V949 HydrophobicContact CD2-CB 4.5Å
876	L	89.9	Confident	83.4	Confident	13 Å²	13	75.6 Å²	75.6	7%	0.068	39%	0.394	C	S	.	.			trans	-107.7	136	179.3	-65.9	176.5	0	0	0	110.1	S872 Y900 V949 C950 V958	S872-L876 WeakPolarHBondContact OG-CD2 3.34Å; L876-Y900 HydrophobicContact CD1-CD2 4.49Å; L876-Y900 HydrophobicContact CD1-CE2 4.24Å; L876-Y900 HydrophobicContact CD2-CE2 3.79Å; L876-V949 PolarHBondContact N-O 2.87Å; L876-C950 WeakPolarHBondContact O-CA 3.43Å; L876-C950 PolarHBondContact O-SG 3.37Å; L876-V958 HydrophobicContact CD1-CB 3.98Å; L876-V958 HydrophobicContact CD1-CG1 4.29Å; L876-V958 HydrophobicContact CD1-CG2 3.91Å
877	N	88.9	Confident	83.6	Confident	74 Å²	74	78.2 Å²	78.2	40%	0.396	41%	0.409	S	S	.	.			trans	-69	130.3	171.1	173.3	-36.9	0	0	0	109.4	Q879 T880 E952	N877-Q879 PolarHBondContact O-N 3.19Å; N877-Q879 WeakPolarHBondContact OD1-CB 3.43Å; N877-Q879 WeakPolarHBondContact OD1-CG 3.33Å; N877-Q879 PolarHBondContact OD1-N 3.32Å; N877-T880 HydrophobicContact CB-CG2 4.3Å; N877-T880 WeakPolarHBondContact O-CB 3.27Å; N877-T880 PolarHBondContact O-N 3.06Å; N877-T880 PolarHBondContact O-OG1 3.39Å; N877-E952 VanDerWaalsContact CA-OE1 3.32Å; N877-E952 WeakPolarHBondContact CA-OE1 3.47Å
878	S	88.3	Confident	83.7	Confident	34 Å²	34	75.2 Å²	75.2	24%	0.238	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-58.1	-33.6	-175.1	75.1	0	0	0	0	113.4	T880 V881 E952	S878-T880 PolarHBondContact O-N 3.42Å; S878-T880 VanDerWaalsContact O-N 3.13Å; S878-V881 PolarHBondContact O-N 2.75Å; S878-E952 VanDerWaalsContact CB-OE2 3.26Å; S878-E952 WeakPolarHBondContact CB-OE2 3.32Å; S878-E952 PolarHBondContact N-OE1 3.47Å; S878-E952 PolarHBondContact OG-OE2 3.07Å
879	Q	89.7	Confident	83.3	Confident	162 Å²	162	71.9 Å²	71.9	76%	0.757	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-65.2	-16.8	179.5	-54.5	171.8	-8.4	0	0	112.6	N877 V881	N877-Q879 PolarHBondContact O-N 3.19Å; N877-Q879 WeakPolarHBondContact OD1-CB 3.43Å; N877-Q879 WeakPolarHBondContact OD1-CG 3.33Å; N877-Q879 PolarHBondContact OD1-N 3.32Å; Q879-V881 VanDerWaalsContact C-N 3.31Å
880	T	91.4	Very high	82.8	Confident	44 Å²	44	72.5 Å²	72.5	27%	0.27	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-82.5	-6.2	172.8	67.6	0	0	0	0	113.3	N877 S878 Y900 R901	N877-T880 HydrophobicContact CB-CG2 4.3Å; N877-T880 WeakPolarHBondContact O-CB 3.27Å; N877-T880 PolarHBondContact O-N 3.06Å; N877-T880 PolarHBondContact O-OG1 3.39Å; S878-T880 PolarHBondContact O-N 3.42Å; S878-T880 VanDerWaalsContact O-N 3.13Å; T880-Y900 CarbonylContact O-C 3.6Å; T880-Y900 WeakPolarHBondContact O-CA 3.48Å; T880-Y900 WeakPolarHBondContact OG1-CE2 3.28Å; T880-R901 PolarHBondContact O-N 3.14Å
881	V	92.7	Very high	82.5	Confident	9 Å²	9	74.7 Å²	74.7	6%	0.055	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	98.3	-175.8	-175.8	0	0	0	0	110.1	S878 Q879 L883 L899 Y900 V912 V958	S878-V881 PolarHBondContact O-N 2.75Å; Q879-V881 VanDerWaalsContact C-N 3.31Å; V881-L883 HydrophobicContact CG1-CD2 4.09Å; V881-L883 PolarHBondContact O-N 2.82Å; V881-L899 CarbonylContact C-O 3.55Å; V881-L899 WeakPolarHBondContact CA-O 3.45Å; V881-Y900 HydrophobicContact CG2-CD2 4.02Å; V881-V912 HydrophobicContact CG1-CG2 3.75Å; V881-V958 HydrophobicContact CG1-CG2 4.49Å; V881-V958 HydrophobicContact CG2-CG2 4.07Å
882	T	94.2	Very high	82.4	Confident	78 Å²	78	70 Å²	70	48%	0.479	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	114.7	174.7	-58.3	0	0	0	0	110.1	G898 L899	T882-G898 CarbonylContact O-C 3.59Å; T882-G898 WeakPolarHBondContact O-CA 3.46Å; T882-L899 PolarHBondContact N-O 2.94Å; T882-L899 PolarHBondContact O-N 3.05Å
883	L	92.5	Very high	82.8	Confident	82 Å²	82	67.9 Å²	67.9	43%	0.429	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	145.3	175.3	-52.3	-174.8	0	0	0	111.3	V881 V896 V912 M956	V881-L883 HydrophobicContact CG1-CD2 4.09Å; V881-L883 PolarHBondContact O-N 2.82Å; L883-V896 HydrophobicContact CB-CG2 4.29Å; L883-V896 HydrophobicContact CD2-CG2 3.91Å; L883-V896 HydrophobicContact CG-CG2 4.45Å; L883-V912 HydrophobicContact CD2-CB 3.98Å; L883-V912 HydrophobicContact CD2-CG1 3.85Å; L883-V912 HydrophobicContact CD2-CG2 3.96Å; L883-M956 HydrophobicContact CD1-SD 4.23Å; L883-M956 HydrophobicContact CD2-SD 4.06Å
884	K	92.2	Very high	83.3	Confident	106 Å²	106	65.4 Å²	65.4	46%	0.461	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	-146.5	179.8	-63.8	-164.4	170.9	-170.1	0	110.4	K897 L899	K884-K897 WeakPolarHBondContact CA-O 3.19Å; K884-K897 HydrophobicContact CB-CB 4.37Å; K884-K897 PolarHBondContact N-O 2.97Å; K884-L899 HydrophobicContact CD-CG 4.38Å
885	E	91.7	Very high	83.4	Confident	70 Å²	70	65.2 Å²	65.2	33%	0.327	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	149.1	-169.5	80.6	-80.4	-167.7	0	0	113.3	R850 L887 K897	R850-E885 IonicContact CZ-OE1 3.54Å; R850-E885 IonicContact NE-OE1 2.75Å; R850-E885 IonicContact NH2-OE1 3.48Å; R850-E885 PolarHBondContact NH2-OE1 2.94Å; E885-L887 PolarHBondContact O-N 3.46Å; E885-K897 VanDerWaalsContact CD-CD 3.45Å; E885-K897 PolarHBondContact O-N 3.27Å; E885-K897 WeakPolarHBondContact OE1-CD 3.32Å; E885-K897 IonicContact OE1-NZ 2.77Å; E885-K897 PolarHBondContact OE1-NZ 3.16Å; E885-K897 WeakPolarHBondContact OE2-CD 3.12Å; E885-K897 IonicContact OE2-NZ 3.61Å
886	R	89.6	Confident	83.5	Confident	156 Å²	156	62.3 Å²	62.3	59%	0.589	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.2	131.2	179.7	-174.5	171.9	167.7	-165.5	-11.8	110.9	G888 H894 V896	R886-G888 WeakPolarHBondContact CG-O 3.37Å; R886-G888 PolarHBondContact NE-O 3.31Å; R886-H894 PolarHBondContact NH2-ND1 3.38Å; R886-V896 HydrophobicContact CB-CG1 4.4Å
887	L	87.1	Confident	83.7	Confident	74 Å²	74	64.1 Å²	64.1	39%	0.387	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	-32	175.6	-62.4	174	0	0	0	111.6	E885 V895 K897 A911 L961	E885-L887 PolarHBondContact O-N 3.46Å; L887-V895 HydrophobicContact CB-CG1 4.38Å; L887-V895 HydrophobicContact CD1-CG1 4.38Å; L887-V895 PolarHBondContact N-O 2.85Å; L887-K897 HydrophobicContact CD1-CB 3.97Å; L887-K897 HydrophobicContact CD2-CB 4.2Å; L887-K897 HydrophobicContact CG-CB 4.03Å; L887-A911 HydrophobicContact CD1-CB 4.47Å; L887-L961 HydrophobicContact CD1-CD1 3.58Å
888	G	80	Confident	84	Confident	28 Å²	28	60.6 Å²	60.6	29%	0.289	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.1	-158.9	179	0	0	0	0	0	114.6	R886 V895	R886-G888 WeakPolarHBondContact CG-O 3.37Å; R886-G888 PolarHBondContact NE-O 3.31Å; G888-V895 PolarHBondContact N-O 3.11Å; G888-V895 PolarHBondContact O-N 3.14Å
889	G	70.3	Confident	84.3	Confident	46 Å²	46	60.6 Å²	60.6	47%	0.474	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.9	159.2	172.2	0	0	0	0	0	110.6	G893	G889-G893 WeakPolarHBondContact CA-O 3.4Å
890	G	64.5	Low	84.5	Confident	47 Å²	47	53.3 Å²	53.3	49%	0.485	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	-159.6	-178.3	0	0	0	0	0	112.1	F892 G893 K916	G890-F892 VanDerWaalsContact C-N 3.3Å; G890-F892 PolarHBondContact O-N 2.72Å; G890-G893 PolarHBondContact N-O 2.69Å; G890-G893 PolarHBondContact O-N 2.84Å; G890-K916 PolarHBondContact O-NZ 3.49Å
891	N	60.5	Low	84.6	Confident	101 Å²	101	57.9 Å²	57.9	54%	0.54	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-46	-176.7	-72.5	-19.4	0	0	0	112.5	G893 K916	N891-G893 PolarHBondContact O-N 2.85Å; N891-K916 PolarHBondContact O-NZ 2.6Å
892	F	60.8	Low	84.5	Confident	41 Å²	41	57.7 Å²	57.7	18%	0.18	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-15.7	-173.5	-51.3	-79.4	0	0	0	115.2	G890 Q919 M1026	G890-F892 VanDerWaalsContact C-N 3.3Å; G890-F892 PolarHBondContact O-N 2.72Å; F892-Q919 PolarHBondContact O-OE1 3.09Å; F892-Q919 VanDerWaalsContact O-OE1 3.1Å; F892-M1026 HydrophobicContact CE1-CG 3.78Å; F892-M1026 HydrophobicContact CE1-SD 4.22Å; F892-M1026 HydrophobicContact CZ-CG 3.53Å; F892-M1026 HydrophobicContact CZ-SD 3.72Å
893	G	69.4	Low	84	Confident	4 Å²	4	59.5 Å²	59.5	4%	0.041	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148.5	-158.5	-171.3	0	0	0	0	0	114.6	G889 G890 N891 T914	G889-G893 WeakPolarHBondContact CA-O 3.4Å; G890-G893 PolarHBondContact N-O 2.69Å; G890-G893 PolarHBondContact O-N 2.84Å; N891-G893 PolarHBondContact O-N 2.85Å; G893-T914 WeakPolarHBondContact CA-O 3.24Å
894	H	80.3	Confident	83.7	Confident	80 Å²	80	59.7 Å²	59.7	37%	0.37	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	147	175.1	-62.5	-62.9	0	0	0	110.4	R886 K913 T914	R886-H894 PolarHBondContact NH2-ND1 3.38Å; H894-K913 WeakPolarHBondContact O-CA 3.41Å; H894-T914 PolarHBondContact O-N 3.28Å; H894-T914 PolarHBondContact O-OG1 3.01Å
895	V	88.8	Confident	83.4	Confident	37 Å²	37	56.9 Å²	56.9	22%	0.224	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	119.6	173.8	-174.6	0	0	0	0	107.4	L887 G888 A911 V912 K913	L887-V895 HydrophobicContact CB-CG1 4.38Å; L887-V895 HydrophobicContact CD1-CG1 4.38Å; L887-V895 PolarHBondContact N-O 2.85Å; G888-V895 PolarHBondContact N-O 3.11Å; G888-V895 PolarHBondContact O-N 3.14Å; V895-A911 HydrophobicContact CG1-CB 4.26Å; V895-V912 WeakPolarHBondContact CA-O 3.24Å; V895-K913 HydrophobicContact CG2-CB 4.21Å; V895-K913 HydrophobicContact CG2-CD 4.35Å; V895-K913 HydrophobicContact CG2-CG 4.16Å
896	V	91.6	Very high	83.3	Confident	23 Å²	23	57.4 Å²	57.4	14%	0.139	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	157.2	173.9	-57.1	0	0	0	0	109.3	L883 R886 V912	L883-V896 HydrophobicContact CB-CG2 4.29Å; L883-V896 HydrophobicContact CD2-CG2 3.91Å; L883-V896 HydrophobicContact CG-CG2 4.45Å; R886-V896 HydrophobicContact CB-CG1 4.4Å; V896-V912 HydrophobicContact CG2-CB 3.93Å; V896-V912 PolarHBondContact N-O 3.43Å; V896-V912 PolarHBondContact O-N 2.96Å
897	K	94.1	Very high	83.4	Confident	51 Å²	51	54.4 Å²	54.4	22%	0.222	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	154	164.8	-166.5	-171.2	-172.1	-177.7	0	108.5	K884 E885 L887 V910 L961	K884-K897 WeakPolarHBondContact CA-O 3.19Å; K884-K897 HydrophobicContact CB-CB 4.37Å; K884-K897 PolarHBondContact N-O 2.97Å; E885-K897 VanDerWaalsContact CD-CD 3.45Å; E885-K897 PolarHBondContact O-N 3.27Å; E885-K897 WeakPolarHBondContact OE1-CD 3.32Å; E885-K897 IonicContact OE1-NZ 2.77Å; E885-K897 PolarHBondContact OE1-NZ 3.16Å; E885-K897 WeakPolarHBondContact OE2-CD 3.12Å; E885-K897 IonicContact OE2-NZ 3.61Å; L887-K897 HydrophobicContact CD1-CB 3.97Å; L887-K897 HydrophobicContact CD2-CB 4.2Å; L887-K897 HydrophobicContact CG-CB 4.03Å; K897-V910 CarbonylContact C-O 3.58Å; K897-L961 HydrophobicContact CG-CD1 4.46Å; K897-L961 HydrophobicContact CG-CD2 4.03Å
898	G	94.4	Very high	83.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	176.1	169.3	0	0	0	0	0	112.7	T882 V910	T882-G898 CarbonylContact O-C 3.59Å; T882-G898 WeakPolarHBondContact O-CA 3.46Å; G898-V910 PolarHBondContact N-O 2.97Å; G898-V910 PolarHBondContact O-N 2.93Å
899	L	95.2	Very high	84.3	Confident	33 Å²	33	51 Å²	51	17%	0.173	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	125.2	160.6	-68.3	178.5	0	0	0	108.2	V881 T882 K884 E907 V908 P909	V881-L899 CarbonylContact C-O 3.55Å; V881-L899 WeakPolarHBondContact CA-O 3.45Å; T882-L899 PolarHBondContact N-O 2.94Å; T882-L899 PolarHBondContact O-N 3.05Å; K884-L899 HydrophobicContact CD-CG 4.38Å; L899-E907 WeakPolarHBondContact CD1-OE2 3.25Å; L899-V908 WeakPolarHBondContact CA-O 3.32Å; L899-P909 HydrophobicContact CD2-CB 4.46Å
900	Y	94.1	Very high	85.5	Confident	9 Å²	9	48.8 Å²	48.8	4%	0.035	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	124.5	167.9	169.7	-122.7	0	0	0	109	L869 L876 T880 V881 T902 E907 V908 I947	L869-Y900 HydrophobicContact CD2-CE1 4.42Å; L876-Y900 HydrophobicContact CD1-CD2 4.49Å; L876-Y900 HydrophobicContact CD1-CE2 4.24Å; L876-Y900 HydrophobicContact CD2-CE2 3.79Å; T880-Y900 CarbonylContact O-C 3.6Å; T880-Y900 WeakPolarHBondContact O-CA 3.48Å; T880-Y900 WeakPolarHBondContact OG1-CE2 3.28Å; V881-Y900 HydrophobicContact CG2-CD2 4.02Å; Y900-T902 HydrophobicContact CD1-CG2 4.3Å; Y900-T902 HydrophobicContact CE1-CG2 4Å; Y900-E907 WeakPolarHBondContact O-CA 3.39Å; Y900-V908 PolarHBondContact N-O 2.92Å; Y900-V908 PolarHBondContact O-N 2.91Å; Y900-I947 HydrophobicContact CD1-CG2 4.37Å; Y900-I947 HydrophobicContact CE1-CG2 4.34Å
901	R	93.7	Very high	87	Confident	140 Å²	140	47.1 Å²	47.1	53%	0.528	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	113.4	172.7	-171.5	177.4	-73.2	-175.4	-2.1	109.4	T880 Q906 E907	T880-R901 PolarHBondContact O-N 3.14Å; R901-Q906 WeakPolarHBondContact CA-O 3.37Å; R901-E907 HydrophobicContact CB-CG 4.47Å; R901-E907 HydrophobicContact CG-CG 4.39Å; R901-E907 IonicContact CZ-OE1 3.09Å; R901-E907 VanDerWaalsContact CZ-OE1 3.29Å; R901-E907 IonicContact NE-OE1 2.68Å; R901-E907 PolarHBondContact NE-OE1 3.39Å; R901-E907 VanDerWaalsContact NE-OE1 3.09Å; R901-E907 IonicContact NH2-OE1 2.67Å; R901-E907 PolarHBondContact NH2-OE1 2.96Å
902	T	89.1	Confident	88.5	Confident	6 Å²	6	42.3 Å²	42.3	4%	0.037	23%	0.233	C	C	.	.			trans	-66.3	165.6	179.5	68.1	0	0	0	0	111.9	L869 Y900 S904 G905 Q906 V908	L869-T902 HydrophobicContact CD2-CG2 3.61Å; Y900-T902 HydrophobicContact CD1-CG2 4.3Å; Y900-T902 HydrophobicContact CE1-CG2 4Å; T902-S904 PolarHBondContact O-N 2.89Å; T902-S904 VanDerWaalsContact O-N 3.15Å; T902-S904 PolarHBondContact OG1-N 3.25Å; T902-S904 PolarHBondContact OG1-OG 3.16Å; T902-G905 PolarHBondContact O-N 3.38Å; T902-G905 PolarHBondContact OG1-N 3.08Å; T902-Q906 HydrophobicContact CG2-CB 4.24Å; T902-Q906 PolarHBondContact N-O 2.68Å; T902-Q906 WeakPolarHBondContact OG1-CB 3.32Å; T902-Q906 PolarHBondContact OG1-N 3.39Å; T902-Q906 VanDerWaalsContact OG1-N 3.08Å; T902-Q906 PolarHBondContact OG1-O 3.41Å; T902-V908 HydrophobicContact CG2-CG2 4.05Å
903	P	84.9	Confident	89.7	Confident	115 Å²	115	40.9 Å²	40.9	75%	0.747	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-19.6	169.6	-24.7	35.7	0	0	0	114.4	G905	P903-G905 VanDerWaalsContact C-N 3.32Å
904	S	85.3	Confident	90.4	Very high	87 Å²	87	41.5 Å²	41.5	61%	0.608	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.3	0.7	172.5	53.3	0	0	0	0	113.8	T902 Q906	T902-S904 PolarHBondContact O-N 2.89Å; T902-S904 VanDerWaalsContact O-N 3.15Å; T902-S904 PolarHBondContact OG1-N 3.25Å; T902-S904 PolarHBondContact OG1-OG 3.16Å; S904-Q906 VanDerWaalsContact C-N 3.3Å; S904-Q906 PolarHBondContact O-N 3.34Å
905	G	86.8	Confident	90.1	Very high	47 Å²	47	38.7 Å²	38.7	49%	0.485	22%	0.217	S	C	.	.	S	Bend	trans	80.3	3.7	-179.5	0	0	0	0	0	115	T902 P903	T902-G905 PolarHBondContact O-N 3.38Å; T902-G905 PolarHBondContact OG1-N 3.08Å; P903-G905 VanDerWaalsContact C-N 3.32Å
906	Q	88.8	Confident	89.2	Confident	80 Å²	80	41 Å²	41	37%	0.374	22%	0.224	S	C	.	.			trans	-73.9	136.6	175.5	-177.2	-178.2	-2.4	0	0	110	R901 T902 S904 V908	R901-Q906 WeakPolarHBondContact CA-O 3.37Å; T902-Q906 HydrophobicContact CG2-CB 4.24Å; T902-Q906 PolarHBondContact N-O 2.68Å; T902-Q906 WeakPolarHBondContact OG1-CB 3.32Å; T902-Q906 PolarHBondContact OG1-N 3.39Å; T902-Q906 VanDerWaalsContact OG1-N 3.08Å; T902-Q906 PolarHBondContact OG1-O 3.41Å; S904-Q906 VanDerWaalsContact C-N 3.3Å; S904-Q906 PolarHBondContact O-N 3.34Å; Q906-V908 HydrophobicContact CG-CG2 4.16Å
907	E	91.4	Very high	88.1	Confident	94 Å²	94	44.5 Å²	44.5	44%	0.439	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	120.7	174.1	-61.8	-167.5	162	0	0	110.4	L899 Y900 R901	L899-E907 WeakPolarHBondContact CD1-OE2 3.25Å; Y900-E907 WeakPolarHBondContact O-CA 3.39Å; R901-E907 HydrophobicContact CB-CG 4.47Å; R901-E907 HydrophobicContact CG-CG 4.39Å; R901-E907 IonicContact CZ-OE1 3.09Å; R901-E907 VanDerWaalsContact CZ-OE1 3.29Å; R901-E907 IonicContact NE-OE1 2.68Å; R901-E907 PolarHBondContact NE-OE1 3.39Å; R901-E907 VanDerWaalsContact NE-OE1 3.09Å; R901-E907 IonicContact NH2-OE1 2.67Å; R901-E907 PolarHBondContact NH2-OE1 2.96Å
908	V	92.3	Very high	86.6	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	128.8	-176	171.8	0	0	0	0	109.1	I865 Y866 L869 L899 Y900 T902 Q906 V910	I865-V908 HydrophobicContact CG2-CG1 4.03Å; I865-V908 HydrophobicContact CG2-CG2 4.06Å; Y866-V908 HydrophobicContact CD1-CG1 4.01Å; Y866-V908 HydrophobicContact CE1-CG1 3.78Å; L869-V908 HydrophobicContact CD2-CG2 4.05Å; L899-V908 WeakPolarHBondContact CA-O 3.32Å; Y900-V908 PolarHBondContact N-O 2.92Å; Y900-V908 PolarHBondContact O-N 2.91Å; T902-V908 HydrophobicContact CG2-CG2 4.05Å; Q906-V908 HydrophobicContact CG-CG2 4.16Å; V908-V910 HydrophobicContact CG1-CG1 4.44Å
909	P	94.7	Very high	85	Confident	30 Å²	30	50.7 Å²	50.7	20%	0.195	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	133.1	176.5	29.4	-34.3	0	0	0	110.6	Y866 L899 L961	Y866-P909 WeakPolarHBondContact CE1-O 3.45Å; Y866-P909 PolarHBondContact OH-O 3.38Å; Y866-P909 VanDerWaalsContact OH-O 3.09Å; L899-P909 HydrophobicContact CD2-CB 4.46Å; P909-L961 HydrophobicContact CB-CD2 3.95Å
910	V	95.1	Very high	83.3	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	156.8	-176.9	-67.6	0	0	0	0	111.3	K897 G898 V908 V912 I947 V958 L959	K897-V910 CarbonylContact C-O 3.58Å; G898-V910 PolarHBondContact N-O 2.97Å; G898-V910 PolarHBondContact O-N 2.93Å; V908-V910 HydrophobicContact CG1-CG1 4.44Å; V910-V912 HydrophobicContact CG2-CG2 3.85Å; V910-I947 HydrophobicContact CG1-CD1 3.65Å; V910-V958 HydrophobicContact CB-CG1 3.93Å; V910-V958 HydrophobicContact CG1-CG1 3.88Å; V910-V958 HydrophobicContact CG2-CG1 4.04Å; V910-L959 WeakPolarHBondContact CA-O 3.19Å; V910-L959 WeakPolarHBondContact CB-O 3.37Å
911	A	94.8	Very high	81.6	Confident	11 Å²	11	54.5 Å²	54.5	9%	0.091	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	135	159.5	0	0	0	0	0	108.3	L887 V895 L959 L961	L887-A911 HydrophobicContact CD1-CB 4.47Å; V895-A911 HydrophobicContact CG1-CB 4.26Å; A911-L959 HydrophobicContact CB-CB 4.26Å; A911-L959 PolarHBondContact N-O 2.88Å; A911-L959 WeakPolarHBondContact O-CB 3.42Å; A911-L959 PolarHBondContact O-N 2.79Å; A911-L961 HydrophobicContact CB-CD1 4.12Å
912	V	92.1	Very high	80	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	117.5	179.6	-170.5	0	0	0	0	108.5	V881 L883 V895 V896 V910 M956 L957	V881-V912 HydrophobicContact CG1-CG2 3.75Å; L883-V912 HydrophobicContact CD2-CB 3.98Å; L883-V912 HydrophobicContact CD2-CG1 3.85Å; L883-V912 HydrophobicContact CD2-CG2 3.96Å; V895-V912 WeakPolarHBondContact CA-O 3.24Å; V896-V912 HydrophobicContact CG2-CB 3.93Å; V896-V912 PolarHBondContact N-O 3.43Å; V896-V912 PolarHBondContact O-N 2.96Å; V910-V912 HydrophobicContact CG2-CG2 3.85Å; V912-M956 HydrophobicContact CG1-CB 3.75Å; V912-M956 HydrophobicContact CG1-CG 4.19Å; V912-M956 HydrophobicContact CG1-SD 3.8Å; V912-L957 WeakPolarHBondContact CA-O 3.38Å
913	K	87.9	Confident	78.8	Confident	12 Å²	12	57.2 Å²	57.2	5%	0.052	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	110.2	179.6	178.7	168	172	172	0	109	H894 V895 L957 L959 D1023	H894-K913 WeakPolarHBondContact O-CA 3.41Å; V895-K913 HydrophobicContact CG2-CB 4.21Å; V895-K913 HydrophobicContact CG2-CD 4.35Å; V895-K913 HydrophobicContact CG2-CG 4.16Å; K913-L957 HydrophobicContact CB-CB 4.37Å; K913-L957 PolarHBondContact N-O 3.02Å; K913-L957 PolarHBondContact O-N 2.95Å; K913-L959 HydrophobicContact CB-CD1 3.99Å; K913-D1023 IonicContact NZ-OD1 3.2Å; K913-D1023 PolarHBondContact NZ-OD1 3.08Å; K913-D1023 IonicContact NZ-OD2 3.81Å; K913-D1023 PolarHBondContact NZ-OD2 3.07Å
914	T	82.9	Confident	77.9	Confident	17 Å²	17	53.1 Å²	53.1	10%	0.104	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	130.7	177.4	56.8	0	0	0	0	109.8	G893 H894 M956	G893-T914 WeakPolarHBondContact CA-O 3.24Å; H894-T914 PolarHBondContact O-N 3.28Å; H894-T914 PolarHBondContact O-OG1 3.01Å; T914-M956 HydrophobicContact CG2-CG 4.15Å; T914-M956 HydrophobicContact CG2-SD 4.35Å
915	L	73.7	Confident	77.5	Confident	21 Å²	21	52.3 Å²	52.3	11%	0.11	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	138.5	176.1	-62.5	-178.2	0	0	0	110.5	I928 F955 L957	L915-I928 HydrophobicContact CD1-CD1 4.45Å; L915-I928 HydrophobicContact CD1-CG2 3.74Å; L915-F955 HydrophobicContact CB-CB 4.16Å; L915-F955 HydrophobicContact CD1-CB 4.26Å; L915-F955 HydrophobicContact CG-CB 4.49Å; L915-F955 PolarHBondContact N-O 2.97Å; L915-L957 HydrophobicContact CD2-CD1 4.42Å
916	K	69.3	Low	76.9	Confident	84 Å²	84	60 Å²	60	37%	0.365	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-69.2	138.8	177.1	-68	173	-178.7	164.1	0	110.4	G890 N891 N918 Q919	G890-K916 PolarHBondContact O-NZ 3.49Å; N891-K916 PolarHBondContact O-NZ 2.6Å; K916-N918 PolarHBondContact O-N 3.42Å; K916-N918 VanDerWaalsContact O-N 3.11Å; K916-Q919 PolarHBondContact O-N 3.13Å
917	P	69.1	Low	76.1	Confident	97 Å²	97	61.2 Å²	61.2	63%	0.63	33%	0.328	S	S	*	.	H	α-helix	trans	-50.2	-40.9	-179.8	-30.4	36.1	0	0	0	114.1	Q919 I920 A921	P917-Q919 PolarHBondContact O-N 3.17Å; P917-I920 WeakPolarHBondContact O-CB 3.45Å; P917-I920 PolarHBondContact O-N 2.76Å; P917-A921 PolarHBondContact O-N 3.33Å
918	N	63.7	Low	75.2	Confident	120 Å²	120	57.6 Å²	57.6	64%	0.642	31%	0.312	S	S	*	.	H	α-helix	trans	-62.2	-26.3	179.4	-54.6	39.5	0	0	0	113.4	K916 N922	K916-N918 PolarHBondContact O-N 3.42Å; K916-N918 VanDerWaalsContact O-N 3.11Å; N918-N922 WeakPolarHBondContact O-CB 3.48Å; N918-N922 PolarHBondContact O-N 3.14Å; N918-N922 VanDerWaalsContact O-N 3.1Å; N918-N922 PolarHBondContact O-OD1 3.38Å
919	Q	59.8	Low	74.7	Confident	61 Å²	61	58.2 Å²	58.2	29%	0.285	32%	0.315	S	S	.	.	H	α-helix	trans	-75.5	-36.3	174.1	-65.8	-163.4	-60.1	0	0	111.5	F892 K916 P917 A921 N922 S923	F892-Q919 PolarHBondContact O-OE1 3.09Å; F892-Q919 VanDerWaalsContact O-OE1 3.1Å; K916-Q919 PolarHBondContact O-N 3.13Å; P917-Q919 PolarHBondContact O-N 3.17Å; Q919-A921 VanDerWaalsContact C-N 3.33Å; Q919-N922 PolarHBondContact O-N 3.21Å; Q919-S923 WeakPolarHBondContact O-CB 3.2Å; Q919-S923 PolarHBondContact O-N 2.91Å
920	I	60.2	Low	73.9	Confident	41 Å²	41	59.2 Å²	59.2	21%	0.21	33%	0.326	C	S	.	.	H	α-helix	trans	-64.6	-41.6	175.5	-46.6	169.1	0	0	0	110.1	P917 G924 I928 F955	P917-I920 WeakPolarHBondContact O-CB 3.45Å; P917-I920 PolarHBondContact O-N 2.76Å; I920-G924 VanDerWaalsContact O-CA 3.32Å; I920-G924 WeakPolarHBondContact O-CA 3.45Å; I920-G924 PolarHBondContact O-N 3.07Å; I920-I928 HydrophobicContact CB-CD1 4.38Å; I920-I928 HydrophobicContact CG1-CD1 4.36Å; I920-I928 HydrophobicContact CG2-CD1 4.49Å; I920-F955 HydrophobicContact CD1-CB 3.85Å; I920-F955 HydrophobicContact CD1-CD2 3.86Å; I920-F955 HydrophobicContact CD1-CG 4.1Å; I920-F955 HydrophobicContact CG1-CB 4.46Å
921	A	58.7	Low	72.9	Confident	82 Å²	82	61.8 Å²	61.8	68%	0.678	34%	0.338	S	S	*	.	H	α-helix	trans	-65.2	-41.4	175.5	0	0	0	0	0	113	P917 Q919	P917-A921 PolarHBondContact O-N 3.33Å; Q919-A921 VanDerWaalsContact C-N 3.33Å
922	N	58.7	Low	72.3	Confident	142 Å²	142	61.4 Å²	61.4	76%	0.759	34%	0.335	S	S	*	.	H	α-helix	trans	-81.6	-38.4	-174.5	-70.7	10	0	0	0	114.1	N918 Q919	N918-N922 WeakPolarHBondContact O-CB 3.48Å; N918-N922 PolarHBondContact O-N 3.14Å; N918-N922 VanDerWaalsContact O-N 3.1Å; N918-N922 PolarHBondContact O-OD1 3.38Å; Q919-N922 PolarHBondContact O-N 3.21Å
923	S	63.7	Low	71.9	Confident	60 Å²	60	68 Å²	68	42%	0.42	36%	0.359	S	S	.	.	H	α-helix	trans	-91.6	-18.2	-179.7	-62.8	0	0	0	0	113.2	Q919 E927	Q919-S923 WeakPolarHBondContact O-CB 3.2Å; Q919-S923 PolarHBondContact O-N 2.91Å; S923-E927 WeakPolarHBondContact O-CB 3.49Å; S923-E927 WeakPolarHBondContact O-CG 3.45Å
924	G	67.2	Low	71.5	Confident	30 Å²	30	69.5 Å²	69.5	31%	0.309	37%	0.37	S	S	.	.			trans	74.3	142.6	-174.2	0	0	0	0	0	113.1	I920 R926 E927 I928	I920-G924 VanDerWaalsContact O-CA 3.32Å; I920-G924 WeakPolarHBondContact O-CA 3.45Å; I920-G924 PolarHBondContact O-N 3.07Å; G924-R926 PolarHBondContact O-N 2.95Å; G924-E927 PolarHBondContact O-N 3.47Å; G924-I928 PolarHBondContact O-N 3.41Å
925	E	75.6	Confident	71.5	Confident	70 Å²	70	69.5 Å²	69.5	33%	0.327	37%	0.369	S	S	.	.	H	α-helix	trans	-58.1	-35.7	-175.3	-160.8	-152.4	114.2	0	0	113.4	L929 K951 F955	E925-L929 HydrophobicContact CG-CD1 4.13Å; E925-L929 WeakPolarHBondContact O-CB 3.49Å; E925-L929 WeakPolarHBondContact O-CG 3.36Å; E925-L929 PolarHBondContact O-N 3.19Å; E925-L929 WeakPolarHBondContact OE1-CD1 3.42Å; E925-K951 VanDerWaalsContact CD-CE 3.46Å; E925-K951 WeakPolarHBondContact OE1-CE 3.39Å; E925-K951 IonicContact OE1-NZ 2.65Å; E925-K951 PolarHBondContact OE1-NZ 2.83Å; E925-K951 WeakPolarHBondContact OE2-CE 3.44Å; E925-K951 IonicContact OE2-NZ 3.79Å; E925-K951 PolarHBondContact OE2-NZ 2.95Å; E925-F955 HydrophobicContact CG-CE1 4.29Å; E925-F955 HydrophobicContact CG-CE2 3.99Å; E925-F955 HydrophobicContact CG-CZ 3.42Å; E925-F955 VanDerWaalsContact CG-CZ 3.42Å
926	R	75.3	Confident	72	Confident	208 Å²	208	69.8 Å²	69.8	79%	0.785	37%	0.374	S	S	*	.	H	α-helix	trans	-66.8	-38.8	-178	-69.4	-174.7	-175.6	162.3	4.6	112.7	G924 A930	G924-R926 PolarHBondContact O-N 2.95Å; R926-A930 VanDerWaalsContact O-CB 3.32Å; R926-A930 WeakPolarHBondContact O-CB 3.4Å; R926-A930 PolarHBondContact O-N 3.34Å
927	E	71	Confident	72.7	Confident	105 Å²	105	72.3 Å²	72.3	49%	0.491	39%	0.387	S	S	.	.	H	α-helix	trans	-69.9	-47.3	179.3	-61.6	-160.4	-178.1	0	0	110.5	S923 G924 L929 A930 E931	S923-E927 WeakPolarHBondContact O-CB 3.49Å; S923-E927 WeakPolarHBondContact O-CG 3.45Å; G924-E927 PolarHBondContact O-N 3.47Å; E927-L929 VanDerWaalsContact C-N 3.29Å; E927-L929 PolarHBondContact O-N 3.18Å; E927-A930 PolarHBondContact O-N 3.47Å; E927-E931 PolarHBondContact O-N 3.3Å
928	I	73.5	Confident	73.5	Confident	18 Å²	18	68.2 Å²	68.2	9%	0.092	36%	0.36	C	S	.	.	H	α-helix	trans	-55.9	-44.4	176.9	-63.7	173.6	0	0	0	110.9	L915 I920 G924 A932 F955	L915-I928 HydrophobicContact CD1-CD1 4.45Å; L915-I928 HydrophobicContact CD1-CG2 3.74Å; I920-I928 HydrophobicContact CB-CD1 4.38Å; I920-I928 HydrophobicContact CG1-CD1 4.36Å; I920-I928 HydrophobicContact CG2-CD1 4.49Å; G924-I928 PolarHBondContact O-N 3.41Å; I928-A932 WeakPolarHBondContact O-CB 3.27Å; I928-A932 PolarHBondContact O-N 3.2Å; I928-F955 HydrophobicContact CG2-CD1 4.39Å
929	L	81.8	Confident	74.5	Confident	14 Å²	14	69.3 Å²	69.3	7%	0.073	36%	0.359	C	S	.	.	H	α-helix	trans	-71.2	-27.9	176.7	-70.3	175.8	0	0	0	113.5	F874 L875 E925 E927 R933 V949 F955	F874-L929 HydrophobicContact CE1-CD2 4Å; F874-L929 HydrophobicContact CZ-CD2 4.33Å; L875-L929 HydrophobicContact CD2-CD2 4.09Å; E925-L929 HydrophobicContact CG-CD1 4.13Å; E925-L929 WeakPolarHBondContact O-CB 3.49Å; E925-L929 WeakPolarHBondContact O-CG 3.36Å; E925-L929 PolarHBondContact O-N 3.19Å; E925-L929 WeakPolarHBondContact OE1-CD1 3.42Å; E927-L929 VanDerWaalsContact C-N 3.29Å; E927-L929 PolarHBondContact O-N 3.18Å; L929-R933 WeakPolarHBondContact O-CB 2.82Å; L929-R933 WeakPolarHBondContact O-CD 3.34Å; L929-R933 WeakPolarHBondContact O-CG 3.47Å; L929-R933 PolarHBondContact O-N 3.21Å; L929-V949 HydrophobicContact CD2-CG1 4.13Å; L929-F955 HydrophobicContact CD2-CE1 3.94Å; L929-F955 HydrophobicContact CG-CE1 4.21Å
930	A	77.1	Confident	75.8	Confident	50 Å²	50	68.4 Å²	68.4	41%	0.413	36%	0.355	S	S	.	.	H	α-helix	trans	-75.3	-44.1	175.9	0	0	0	0	0	112.1	R926 E927 R933 T934	R926-A930 VanDerWaalsContact O-CB 3.32Å; R926-A930 WeakPolarHBondContact O-CB 3.4Å; R926-A930 PolarHBondContact O-N 3.34Å; E927-A930 PolarHBondContact O-N 3.47Å; A930-R933 PolarHBondContact O-N 3.01Å; A930-T934 PolarHBondContact O-N 3.01Å; A930-T934 VanDerWaalsContact O-N 3.1Å; A930-T934 PolarHBondContact O-OG1 2.81Å
931	E	73.7	Confident	77.2	Confident	55 Å²	55	71.2 Å²	71.2	26%	0.257	36%	0.363	S	S	.	.	H	α-helix	trans	-61.9	-48.6	172.9	-69.5	-176.3	160.9	0	0	110.4	E927 R933 T934 M935 K1028	E927-E931 PolarHBondContact O-N 3.3Å; E931-R933 VanDerWaalsContact C-N 3.34Å; E931-R933 PolarHBondContact O-N 2.98Å; E931-T934 CarbonylContact O-C 3.59Å; E931-T934 WeakPolarHBondContact O-CA 3.35Å; E931-T934 VanDerWaalsContact O-CB 3.28Å; E931-T934 WeakPolarHBondContact O-CB 3.3Å; E931-T934 PolarHBondContact O-N 2.93Å; E931-M935 WeakPolarHBondContact O-CG 3.31Å; E931-M935 PolarHBondContact O-N 3.31Å; E931-K1028 WeakPolarHBondContact OE1-CE 3.33Å; E931-K1028 VanDerWaalsContact OE1-CG 3.31Å; E931-K1028 WeakPolarHBondContact OE1-CG 3.27Å; E931-K1028 IonicContact OE1-NZ 3.68Å
932	A	82.6	Confident	79	Confident	3 Å²	3	67.7 Å²	67.7	3%	0.025	33%	0.332	C	S	.	.	H	α-helix	trans	-60.9	-37.5	176.5	0	0	0	0	0	113.1	F874 I928 T934 M935 A936 L946 V949 L957	F874-A932 HydrophobicContact CE2-CB 4.04Å; F874-A932 HydrophobicContact CZ-CB 3.76Å; I928-A932 WeakPolarHBondContact O-CB 3.27Å; I928-A932 PolarHBondContact O-N 3.2Å; A932-T934 PolarHBondContact O-N 3.18Å; A932-M935 PolarHBondContact O-N 3.35Å; A932-A936 WeakPolarHBondContact O-CB 3.48Å; A932-A936 PolarHBondContact O-N 2.7Å; A932-L946 HydrophobicContact CB-CD2 3.87Å; A932-L946 WeakPolarHBondContact O-CD2 3.2Å; A932-V949 HydrophobicContact CB-CG2 3.91Å; A932-L957 HydrophobicContact CB-CD2 4.35Å
933	R	84.6	Confident	80.6	Confident	138 Å²	138	61 Å²	61	52%	0.521	30%	0.296	S	S	.	.	H	α-helix	trans	-62.8	-31.8	171.7	-81.8	171.1	-175.1	164.6	2.3	112.9	F874 L929 A930 E931 Q937	F874-R933 HydrophobicContact CD1-CG 3.89Å; F874-R933 HydrophobicContact CD2-CG 4.22Å; F874-R933 HydrophobicContact CE1-CG 3.55Å; F874-R933 HydrophobicContact CE2-CB 4.46Å; F874-R933 HydrophobicContact CE2-CG 3.91Å; F874-R933 HydrophobicContact CG-CG 4.21Å; F874-R933 HydrophobicContact CZ-CB 4.36Å; F874-R933 HydrophobicContact CZ-CG 3.56Å; L929-R933 WeakPolarHBondContact O-CB 2.82Å; L929-R933 WeakPolarHBondContact O-CD 3.34Å; L929-R933 WeakPolarHBondContact O-CG 3.47Å; L929-R933 PolarHBondContact O-N 3.21Å; A930-R933 PolarHBondContact O-N 3.01Å; E931-R933 VanDerWaalsContact C-N 3.34Å; E931-R933 PolarHBondContact O-N 2.98Å; R933-Q937 WeakPolarHBondContact O-CG 3.21Å; R933-Q937 PolarHBondContact O-NE2 3.19Å
934	T	80	Confident	82	Confident	44 Å²	44	58.3 Å²	58.3	27%	0.27	28%	0.278	S	S	.	.	H	α-helix	trans	-72.7	-45.7	174.5	-50.7	0	0	0	0	110.1	A930 E931 A932 A936 Q937 F1001 A1029	A930-T934 PolarHBondContact O-N 3.01Å; A930-T934 VanDerWaalsContact O-N 3.1Å; A930-T934 PolarHBondContact O-OG1 2.81Å; E931-T934 CarbonylContact O-C 3.59Å; E931-T934 WeakPolarHBondContact O-CA 3.35Å; E931-T934 VanDerWaalsContact O-CB 3.28Å; E931-T934 WeakPolarHBondContact O-CB 3.3Å; E931-T934 PolarHBondContact O-N 2.93Å; A932-T934 PolarHBondContact O-N 3.18Å; T934-A936 VanDerWaalsContact C-N 3.3Å; T934-A936 PolarHBondContact O-N 2.82Å; T934-Q937 WeakPolarHBondContact O-CB 3.41Å; T934-Q937 PolarHBondContact O-N 2.89Å; T934-Q937 VanDerWaalsContact O-N 3.09Å; T934-F1001 HydrophobicContact CG2-CD2 4.13Å; T934-F1001 HydrophobicContact CG2-CE2 3.76Å; T934-A1029 HydrophobicContact CG2-CB 4.14Å
935	M	81.5	Confident	83.1	Confident	16 Å²	16	59.1 Å²	59.1	8%	0.079	27%	0.271	C	S	.	.	H	α-helix	trans	-58.1	-38.7	175.4	-65.2	173.1	78.1	0	0	112.8	E931 A932 Q937 L938 L946 F1001 F1024	E931-M935 WeakPolarHBondContact O-CG 3.31Å; E931-M935 PolarHBondContact O-N 3.31Å; A932-M935 PolarHBondContact O-N 3.35Å; M935-Q937 PolarHBondContact O-N 3.49Å; M935-L938 WeakPolarHBondContact O-CB 3.45Å; M935-L938 PolarHBondContact O-N 2.69Å; M935-L946 HydrophobicContact CB-CB 4.42Å; M935-L946 HydrophobicContact CB-CD2 4.13Å; M935-F1001 HydrophobicContact CG-CZ 4.46Å; M935-F1024 HydrophobicContact CB-CE2 3.91Å; M935-F1024 HydrophobicContact CE-CD2 3.65Å; M935-F1024 HydrophobicContact CE-CE2 3.56Å; M935-F1024 HydrophobicContact CE-CG 4.35Å; M935-F1024 HydrophobicContact CE-CZ 4.19Å; M935-F1024 HydrophobicContact CG-CD2 4.02Å; M935-F1024 HydrophobicContact CG-CE2 3.84Å
936	A	85.4	Confident	83.8	Confident	28 Å²	28	56.3 Å²	56.3	23%	0.231	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-15.7	178	0	0	0	0	0	114.5	F874 A932 T934 L946	F874-A936 HydrophobicContact CD2-CB 3.94Å; F874-A936 HydrophobicContact CE2-CB 4.15Å; A932-A936 WeakPolarHBondContact O-CB 3.48Å; A932-A936 PolarHBondContact O-N 2.7Å; T934-A936 VanDerWaalsContact C-N 3.3Å; T934-A936 PolarHBondContact O-N 2.82Å; A936-L946 HydrophobicContact CB-CD2 4.33Å
937	Q	84.2	Confident	84.5	Confident	137 Å²	137	47.5 Å²	47.5	64%	0.64	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-20.6	174.9	-69.4	167	65.4	0	0	112.4	R933 T934 M935 K939	R933-Q937 WeakPolarHBondContact O-CG 3.21Å; R933-Q937 PolarHBondContact O-NE2 3.19Å; T934-Q937 WeakPolarHBondContact O-CB 3.41Å; T934-Q937 PolarHBondContact O-N 2.89Å; T934-Q937 VanDerWaalsContact O-N 3.09Å; M935-Q937 PolarHBondContact O-N 3.49Å; Q937-K939 PolarHBondContact O-N 2.7Å
938	L	84.7	Confident	85.4	Confident	11 Å²	11	42.5 Å²	42.5	6%	0.058	20%	0.203	C	C	.	.			trans	-73.9	113.6	-178.6	-59.9	173.6	0	0	0	110.3	M935 Y995 L996 C999 F1001 F1024	M935-L938 WeakPolarHBondContact O-CB 3.45Å; M935-L938 PolarHBondContact O-N 2.69Å; L938-Y995 HydrophobicContact CB-CE1 4.22Å; L938-Y995 HydrophobicContact CD2-CE1 4.05Å; L938-L996 HydrophobicContact CD1-CD2 3.82Å; L938-L996 HydrophobicContact CD2-CD2 4.07Å; L938-L996 HydrophobicContact CG-CD2 4.44Å; L938-C999 HydrophobicContact CD2-CB 4.13Å; L938-F1001 HydrophobicContact CD1-CD1 3.85Å; L938-F1001 HydrophobicContact CD1-CD2 4.18Å; L938-F1001 HydrophobicContact CD1-CE1 3.69Å; L938-F1001 HydrophobicContact CD1-CE2 4.07Å; L938-F1001 HydrophobicContact CD1-CG 4.07Å; L938-F1001 HydrophobicContact CD1-CZ 3.81Å; L938-F1024 HydrophobicContact CD1-CD2 4.07Å; L938-F1024 HydrophobicContact CD1-CE2 3.81Å
939	K	85.4	Confident	86.2	Confident	143 Å²	143	41.7 Å²	41.7	62%	0.622	20%	0.199	S	C	*	.			trans	-130.9	91.3	-173	-70.7	-179.2	-179.4	-178.4	0	111	Q937 Y995	Q937-K939 PolarHBondContact O-N 2.7Å; K939-Y995 PolarHBondContact N-OH 3.16Å
940	H	87.9	Confident	86.6	Confident	41 Å²	41	41 Å²	41	19%	0.19	20%	0.196	C	C	.	.			trans	-141.3	149.3	173.2	-178.9	-112.9	0	0	0	110.6	H942 I943 L991 G992 Y995	H940-H942 VanDerWaalsContact C-N 3.31Å; H940-H942 AromaticContact CE1-CD2 3.71Å; H940-H942 PolarHBondContact ND1-N 3.36Å; H940-H942 PolarHBondContact O-N 3.33Å; H940-I943 HydrophobicContact CB-CD1 3.97Å; H940-I943 HydrophobicContact CB-CG1 4.12Å; H940-I943 PolarHBondContact O-N 2.94Å; H940-L991 PolarHBondContact CE1-O 3.38Å; H940-G992 WeakPolarHBondContact ND1-CA 3.39Å; H940-Y995 HydrophobicContact CB-CD1 3.65Å; H940-Y995 HydrophobicContact CB-CD2 4.02Å; H940-Y995 HydrophobicContact CB-CE1 3.99Å; H940-Y995 HydrophobicContact CB-CE2 4.34Å; H940-Y995 HydrophobicContact CB-CG 3.66Å; H940-Y995 AromaticContact CG-CG 3.98Å
941	R	89.5	Confident	86.9	Confident	101 Å²	101	43.3 Å²	43.3	38%	0.381	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-34.4	-173.6	76.8	-177.9	-68	177.8	1.7	112.7	E860 I943 F1018 K1020	E860-R941 IonicContact OE1-NH2 3.63Å; E860-R941 PolarHBondContact OE1-NH2 3.4Å; R941-I943 VanDerWaalsContact C-N 3.29Å; R941-I943 PolarHBondContact O-N 3.29Å; R941-F1018 WeakPolarHBondContact O-CE2 3.4Å; R941-K1020 WeakPolarHBondContact O-CE 3.35Å; R941-K1020 WeakPolarHBondContact O-CG 3.4Å; R941-K1020 PolarHBondContact O-NZ 3.11Å
942	H	94.8	Very high	87.1	Confident	8 Å²	8	44.9 Å²	44.9	4%	0.037	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	26.6	179.7	-58.9	-60.5	0	0	0	113.9	H940 Q988 F1018 A1019 K1020 I1021	H940-H942 VanDerWaalsContact C-N 3.31Å; H940-H942 AromaticContact CE1-CD2 3.71Å; H940-H942 PolarHBondContact ND1-N 3.36Å; H940-H942 PolarHBondContact O-N 3.33Å; H942-Q988 VanDerWaalsContact CB-O 3.24Å; H942-Q988 WeakPolarHBondContact CB-O 3.38Å; H942-Q988 VanDerWaalsContact CE1-CD 3.41Å; H942-Q988 WeakPolarHBondContact CE1-CG 3.36Å; H942-Q988 PolarHBondContact CE1-OE1 2.97Å; H942-Q988 PolarHBondContact ND1-OE1 3.19Å; H942-F1018 AromaticContact CE1-CD2 3.8Å; H942-F1018 AromaticContact CE1-CE2 3.74Å; H942-F1018 AromaticContact ND1-CD2 3.7Å; H942-F1018 AromaticContact ND1-CE2 3.52Å; H942-A1019 PolarHBondContact ND1-O 2.7Å; H942-K1020 WeakPolarHBondContact O-CA 3.37Å; H942-I1021 WeakPolarHBondContact O-CG1 3.37Å; H942-I1021 PolarHBondContact O-N 3.43Å
943	I	93.3	Very high	86.5	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-129	142.6	171.9	-57.2	-177.6	0	0	0	107.7	H940 R941 R945 E960 Y995 L996 K1020 F1024	H940-I943 HydrophobicContact CB-CD1 3.97Å; H940-I943 HydrophobicContact CB-CG1 4.12Å; H940-I943 PolarHBondContact O-N 2.94Å; R941-I943 VanDerWaalsContact C-N 3.29Å; R941-I943 PolarHBondContact O-N 3.29Å; I943-R945 PolarHBondContact O-N 3.42Å; I943-E960 VanDerWaalsContact O-OE2 3.11Å; I943-Y995 HydrophobicContact CD1-CD1 3.56Å; I943-Y995 HydrophobicContact CD1-CE1 4.13Å; I943-L996 HydrophobicContact CD1-CD1 4.28Å; I943-L996 HydrophobicContact CD1-CD2 3.66Å; I943-L996 HydrophobicContact CD1-CG 3.73Å; I943-K1020 PolarHBondContact O-NZ 3.1Å; I943-F1024 HydrophobicContact CG2-CD1 4.2Å; I943-F1024 HydrophobicContact CG2-CE1 3.39Å; I943-F1024 HydrophobicContact CG2-CZ 3.67Å
944	V	92.7	Very high	86.1	Confident	5 Å²	5	53.2 Å²	53.2	3%	0.03	25%	0.248	C	C	.	.			trans	-75	107.2	169.3	176.6	0	0	0	0	108	L959 E960 L1012 K1020 I1021 F1024	V944-L959 HydrophobicContact CG1-CB 3.94Å; V944-L959 HydrophobicContact CG1-CD2 4.09Å; V944-E960 WeakPolarHBondContact CA-OE2 3.49Å; V944-E960 HydrophobicContact CG1-CB 4.24Å; V944-E960 WeakPolarHBondContact CG1-O 3.43Å; V944-L1012 HydrophobicContact CG2-CD1 4.29Å; V944-K1020 HydrophobicContact CG2-CB 3.67Å; V944-K1020 HydrophobicContact CG2-CD 4.05Å; V944-I1021 PolarHBondContact N-O 3.4Å; V944-F1024 WeakPolarHBondContact O-CE1 3.45Å; V944-F1024 VanDerWaalsContact O-CZ 3.27Å; V944-F1024 WeakPolarHBondContact O-CZ 3.36Å
945	R	90.4	Very high	86.2	Confident	47 Å²	47	51.7 Å²	51.7	18%	0.177	24%	0.238	C	C	.	.			trans	-72.6	146.1	179.4	-57.9	-178.5	-167.9	152	4.7	111.5	D867 I943 L959 E960	D867-R945 IonicContact OD1-CZ 2.81Å; D867-R945 IonicContact OD1-NH1 3.59Å; D867-R945 PolarHBondContact OD1-NH1 3.2Å; D867-R945 IonicContact OD1-NH2 3.83Å; D867-R945 PolarHBondContact OD1-NH2 2.85Å; I943-R945 PolarHBondContact O-N 3.42Å; R945-L959 WeakPolarHBondContact O-CA 3.46Å; R945-E960 HydrophobicContact CB-CG 4.01Å; R945-E960 PolarHBondContact N-OE2 2.92Å; R945-E960 IonicContact NE-OE1 2.93Å; R945-E960 PolarHBondContact O-N 3.36Å; R945-E960 VanDerWaalsContact O-N 3.15Å
946	L	90.5	Very high	86.5	Confident	10 Å²	10	51.6 Å²	51.6	5%	0.052	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	117.1	163.6	-174.6	70.9	0	0	0	108.8	F874 A932 M935 A936 V949 L957 V958 L959	F874-L946 HydrophobicContact CE2-CD2 4.3Å; A932-L946 HydrophobicContact CB-CD2 3.87Å; A932-L946 WeakPolarHBondContact O-CD2 3.2Å; M935-L946 HydrophobicContact CB-CB 4.42Å; M935-L946 HydrophobicContact CB-CD2 4.13Å; A936-L946 HydrophobicContact CB-CD2 4.33Å; L946-V949 HydrophobicContact CD2-CG2 4.15Å; L946-L957 HydrophobicContact CD1-CB 3.77Å; L946-L957 HydrophobicContact CD1-CD2 4.2Å; L946-L957 HydrophobicContact CD1-CG 4.47Å; L946-V958 WeakPolarHBondContact CD1-O 3.35Å; L946-L959 HydrophobicContact CB-CD2 4.32Å; L946-L959 HydrophobicContact CD1-CD2 3.88Å; L946-L959 HydrophobicContact CD1-CG 4.2Å
947	I	89.8	Confident	86.7	Confident	23 Å²	23	51.1 Å²	51.1	12%	0.118	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	-37.3	178.4	-60.4	168.6	0	0	0	110.1	Y866 L869 Y900 V910 V958	Y866-I947 HydrophobicContact CD1-CD1 4.2Å; Y866-I947 HydrophobicContact CE1-CD1 4.39Å; L869-I947 HydrophobicContact CD1-CD1 4.15Å; L869-I947 HydrophobicContact CD1-CG1 4.19Å; L869-I947 HydrophobicContact CD1-CG2 4.09Å; Y900-I947 HydrophobicContact CD1-CG2 4.37Å; Y900-I947 HydrophobicContact CE1-CG2 4.34Å; V910-I947 HydrophobicContact CG1-CD1 3.65Å; I947-V958 HydrophobicContact CB-CG1 4.34Å; I947-V958 WeakPolarHBondContact CB-O 3.31Å; I947-V958 PolarHBondContact N-O 2.82Å
948	G	90.5	Very high	87.1	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.5	-174.5	175.7	0	0	0	0	0	113.3	F874 V958	F874-G948 CarbonylContact O-C 3.58Å; F874-G948 WeakPolarHBondContact O-CA 3.46Å; G948-V958 PolarHBondContact N-O 2.83Å; G948-V958 PolarHBondContact O-N 2.85Å
949	V	90.2	Very high	87.5	Confident	1 Å²	1	45 Å²	45	1%	0.006	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	129.7	-176	-176.1	0	0	0	0	110.6	F874 L875 L876 L929 A932 L946 F955 M956 L957	F874-V949 HydrophobicContact CE1-CG2 4.34Å; F874-V949 HydrophobicContact CE2-CG2 3.72Å; F874-V949 HydrophobicContact CZ-CB 4.32Å; F874-V949 HydrophobicContact CZ-CG2 3.58Å; F874-V949 PolarHBondContact O-N 3.38Å; L875-V949 CarbonylContact C-O 3.5Å; L875-V949 WeakPolarHBondContact CA-O 3.5Å; L875-V949 HydrophobicContact CD2-CB 4.5Å; L876-V949 PolarHBondContact N-O 2.87Å; L929-V949 HydrophobicContact CD2-CG1 4.13Å; A932-V949 HydrophobicContact CB-CG2 3.91Å; L946-V949 HydrophobicContact CD2-CG2 4.15Å; V949-F955 HydrophobicContact CG1-CD1 4.15Å; V949-F955 HydrophobicContact CG1-CE1 4.25Å; V949-M956 CarbonylContact C-O 3.53Å; V949-M956 WeakPolarHBondContact CA-O 3.37Å; V949-L957 HydrophobicContact CG1-CD2 4.24Å; V949-L957 HydrophobicContact CG2-CD2 3.79Å
950	C	89.8	Confident	87.8	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	138	165	-57.6	0	0	0	0	109.8	L876 F955 M956	L876-C950 WeakPolarHBondContact O-CA 3.43Å; L876-C950 PolarHBondContact O-SG 3.37Å; C950-F955 WeakPolarHBondContact O-CA 3.38Å; C950-M956 HydrophobicContact CB-CB 4.11Å; C950-M956 HydrophobicContact CB-CE 3.76Å; C950-M956 PolarHBondContact N-O 3.06Å; C950-M956 PolarHBondContact O-N 2.96Å
951	K	83.9	Confident	88.1	Confident	99 Å²	99	36.6 Å²	36.6	43%	0.43	17%	0.165	S	C	.	.			trans	-113.8	-0.5	-175	166.2	169.4	178.2	175.1	0	113.8	E925 F955	E925-K951 VanDerWaalsContact CD-CE 3.46Å; E925-K951 WeakPolarHBondContact OE1-CE 3.39Å; E925-K951 IonicContact OE1-NZ 2.65Å; E925-K951 PolarHBondContact OE1-NZ 2.83Å; E925-K951 WeakPolarHBondContact OE2-CE 3.44Å; E925-K951 IonicContact OE2-NZ 3.79Å; E925-K951 PolarHBondContact OE2-NZ 2.95Å; K951-F955 HydrophobicContact CB-CE1 4.46Å; K951-F955 HydrophobicContact CB-CE2 4.22Å; K951-F955 HydrophobicContact CB-CZ 3.97Å; K951-F955 HydrophobicContact CD-CE2 4.47Å; K951-F955 HydrophobicContact CD-CZ 4.06Å; K951-F955 HydrophobicContact CG-CE2 3.8Å; K951-F955 HydrophobicContact CG-CZ 3.7Å
952	E	77.3	Confident	88.3	Confident	88 Å²	88	32.2 Å²	32.2	41%	0.411	15%	0.151	S	C	.	.	S	Bend	trans	-74.7	-135.3	-171.9	-68.2	159.3	-124.5	0	0	112.2	N877 S878 Q954	N877-E952 VanDerWaalsContact CA-OE1 3.32Å; N877-E952 WeakPolarHBondContact CA-OE1 3.47Å; S878-E952 VanDerWaalsContact CB-OE2 3.26Å; S878-E952 WeakPolarHBondContact CB-OE2 3.32Å; S878-E952 PolarHBondContact N-OE1 3.47Å; S878-E952 PolarHBondContact OG-OE2 3.07Å; E952-Q954 PolarHBondContact O-N 3.24Å
953	E	71.1	Confident	88.2	Confident	199 Å²	199	33.4 Å²	33.4	93%	0.93	16%	0.159	S	C	*	.	S	Bend	trans	-55.9	-25	-171.1	-60.8	-174.2	163.1	0	0	114.6
954	Q	75.8	Confident	88.2	Confident	116 Å²	116	35.1 Å²	35.1	54%	0.542	17%	0.168	S	C	.	.	S	Bend	trans	-137.4	144.9	166.1	-62.4	-172.6	6.9	0	0	110.5	E952 M956	E952-Q954 PolarHBondContact O-N 3.24Å; Q954-M956 HydrophobicContact CB-CG 4.49Å; Q954-M956 PolarHBondContact O-N 3.49Å
955	F	82	Confident	88.3	Confident	12 Å²	12	35.8 Å²	35.8	5%	0.053	18%	0.176	C	C	.	.			trans	-71.4	122.7	168.5	-100.8	-102.7	0	0	0	110.3	L915 I920 E925 I928 L929 V949 C950 K951	L915-F955 HydrophobicContact CB-CB 4.16Å; L915-F955 HydrophobicContact CD1-CB 4.26Å; L915-F955 HydrophobicContact CG-CB 4.49Å; L915-F955 PolarHBondContact N-O 2.97Å; I920-F955 HydrophobicContact CD1-CB 3.85Å; I920-F955 HydrophobicContact CD1-CD2 3.86Å; I920-F955 HydrophobicContact CD1-CG 4.1Å; I920-F955 HydrophobicContact CG1-CB 4.46Å; E925-F955 HydrophobicContact CG-CE1 4.29Å; E925-F955 HydrophobicContact CG-CE2 3.99Å; E925-F955 HydrophobicContact CG-CZ 3.42Å; E925-F955 VanDerWaalsContact CG-CZ 3.42Å; I928-F955 HydrophobicContact CG2-CD1 4.39Å; L929-F955 HydrophobicContact CD2-CE1 3.94Å; L929-F955 HydrophobicContact CG-CE1 4.21Å; V949-F955 HydrophobicContact CG1-CD1 4.15Å; V949-F955 HydrophobicContact CG1-CE1 4.25Å; C950-F955 WeakPolarHBondContact O-CA 3.38Å; K951-F955 HydrophobicContact CB-CE1 4.46Å; K951-F955 HydrophobicContact CB-CE2 4.22Å; K951-F955 HydrophobicContact CB-CZ 3.97Å; K951-F955 HydrophobicContact CD-CE2 4.47Å; K951-F955 HydrophobicContact CD-CZ 4.06Å; K951-F955 HydrophobicContact CG-CE2 3.8Å; K951-F955 HydrophobicContact CG-CZ 3.7Å
956	M	88.1	Confident	88.5	Confident	15 Å²	15	35 Å²	35	7%	0.074	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	127.7	-178.3	-53.8	-167.3	-75.4	0	0	111.1	L883 V912 T914 V949 C950 Q954	L883-M956 HydrophobicContact CD1-SD 4.23Å; L883-M956 HydrophobicContact CD2-SD 4.06Å; V912-M956 HydrophobicContact CG1-CB 3.75Å; V912-M956 HydrophobicContact CG1-CG 4.19Å; V912-M956 HydrophobicContact CG1-SD 3.8Å; T914-M956 HydrophobicContact CG2-CG 4.15Å; T914-M956 HydrophobicContact CG2-SD 4.35Å; V949-M956 CarbonylContact C-O 3.53Å; V949-M956 WeakPolarHBondContact CA-O 3.37Å; C950-M956 HydrophobicContact CB-CB 4.11Å; C950-M956 HydrophobicContact CB-CE 3.76Å; C950-M956 PolarHBondContact N-O 3.06Å; C950-M956 PolarHBondContact O-N 2.96Å; Q954-M956 HydrophobicContact CB-CG 4.49Å; Q954-M956 PolarHBondContact O-N 3.49Å
957	L	88.9	Confident	88.9	Confident	18 Å²	18	34.6 Å²	34.6	9%	0.094	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	119.7	168.3	-57.2	-179.1	0	0	0	108.6	V912 K913 L915 A932 L946 V949 L959	V912-L957 WeakPolarHBondContact CA-O 3.38Å; K913-L957 HydrophobicContact CB-CB 4.37Å; K913-L957 PolarHBondContact N-O 3.02Å; K913-L957 PolarHBondContact O-N 2.95Å; L915-L957 HydrophobicContact CD2-CD1 4.42Å; A932-L957 HydrophobicContact CB-CD2 4.35Å; L946-L957 HydrophobicContact CD1-CB 3.77Å; L946-L957 HydrophobicContact CD1-CD2 4.2Å; L946-L957 HydrophobicContact CD1-CG 4.47Å; V949-L957 HydrophobicContact CG1-CD2 4.24Å; V949-L957 HydrophobicContact CG2-CD2 3.79Å; L957-L959 HydrophobicContact CB-CD1 4.39Å
958	V	92.1	Very high	89.2	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	118.9	-179.1	-174.3	0	0	0	0	108.8	L876 V881 V910 L946 I947 G948	L876-V958 HydrophobicContact CD1-CB 3.98Å; L876-V958 HydrophobicContact CD1-CG1 4.29Å; L876-V958 HydrophobicContact CD1-CG2 3.91Å; V881-V958 HydrophobicContact CG1-CG2 4.49Å; V881-V958 HydrophobicContact CG2-CG2 4.07Å; V910-V958 HydrophobicContact CB-CG1 3.93Å; V910-V958 HydrophobicContact CG1-CG1 3.88Å; V910-V958 HydrophobicContact CG2-CG1 4.04Å; L946-V958 WeakPolarHBondContact CD1-O 3.35Å; I947-V958 HydrophobicContact CB-CG1 4.34Å; I947-V958 WeakPolarHBondContact CB-O 3.31Å; I947-V958 PolarHBondContact N-O 2.82Å; G948-V958 PolarHBondContact N-O 2.83Å; G948-V958 PolarHBondContact O-N 2.85Å
959	L	93	Very high	89.5	Confident	18 Å²	18	41.7 Å²	41.7	9%	0.094	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	156.1	-164.6	-65.4	150.8	0	0	0	110.9	V910 A911 K913 V944 R945 L946 L957	V910-L959 WeakPolarHBondContact CA-O 3.19Å; V910-L959 WeakPolarHBondContact CB-O 3.37Å; A911-L959 HydrophobicContact CB-CB 4.26Å; A911-L959 PolarHBondContact N-O 2.88Å; A911-L959 WeakPolarHBondContact O-CB 3.42Å; A911-L959 PolarHBondContact O-N 2.79Å; K913-L959 HydrophobicContact CB-CD1 3.99Å; V944-L959 HydrophobicContact CG1-CB 3.94Å; V944-L959 HydrophobicContact CG1-CD2 4.09Å; R945-L959 WeakPolarHBondContact O-CA 3.46Å; L946-L959 HydrophobicContact CB-CD2 4.32Å; L946-L959 HydrophobicContact CD1-CD2 3.88Å; L946-L959 HydrophobicContact CD1-CG 4.2Å; L957-L959 HydrophobicContact CB-CD1 4.39Å
960	E	92.8	Very high	89.8	Confident	3 Å²	3	43 Å²	43	1%	0.014	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	137.5	168.5	-61.8	175.2	138.2	0	0	110.8	Q863 Y866 I943 V944 R945 K1020	Q863-E960 PolarHBondContact NE2-OE1 3.01Å; Y866-E960 WeakPolarHBondContact CB-OE1 3.38Å; Y866-E960 HydrophobicContact CD1-CB 4.24Å; Y866-E960 HydrophobicContact CD1-CG 3.8Å; Y866-E960 HydrophobicContact CD2-CB 4.35Å; Y866-E960 HydrophobicContact CD2-CG 4.1Å; Y866-E960 HydrophobicContact CE1-CB 4.07Å; Y866-E960 HydrophobicContact CE1-CG 4.16Å; Y866-E960 HydrophobicContact CE2-CB 4.2Å; Y866-E960 HydrophobicContact CE2-CG 4.44Å; Y866-E960 HydrophobicContact CG-CB 4.36Å; Y866-E960 HydrophobicContact CG-CG 3.76Å; I943-E960 VanDerWaalsContact O-OE2 3.11Å; V944-E960 WeakPolarHBondContact CA-OE2 3.49Å; V944-E960 HydrophobicContact CG1-CB 4.24Å; V944-E960 WeakPolarHBondContact CG1-O 3.43Å; R945-E960 HydrophobicContact CB-CG 4.01Å; R945-E960 PolarHBondContact N-OE2 2.92Å; R945-E960 IonicContact NE-OE1 2.93Å; R945-E960 PolarHBondContact O-N 3.36Å; R945-E960 VanDerWaalsContact O-N 3.15Å; E960-K1020 IonicContact OE1-NZ 2.69Å; E960-K1020 WeakPolarHBondContact OE2-CE 3.3Å; E960-K1020 IonicContact OE2-NZ 3.38Å; E960-K1020 PolarHBondContact OE2-NZ 3.43Å
961	L	94.2	Very high	90.2	Very high	5 Å²	5	43 Å²	43	3%	0.026	21%	0.211	C	C	.	.			trans	-84.2	121.2	177.4	-177	65.4	0	0	0	111.5	W853 Y866 L887 K897 P909 A911 P963	W853-L961 HydrophobicContact CH2-CD2 4.31Å; W853-L961 HydrophobicContact CZ2-CD2 4.36Å; Y866-L961 WeakPolarHBondContact OH-CB 3.4Å; Y866-L961 PolarHBondContact OH-N 3.03Å; Y866-L961 PolarHBondContact OH-O 2.85Å; L887-L961 HydrophobicContact CD1-CD1 3.58Å; K897-L961 HydrophobicContact CG-CD1 4.46Å; K897-L961 HydrophobicContact CG-CD2 4.03Å; P909-L961 HydrophobicContact CB-CD2 3.95Å; A911-L961 HydrophobicContact CB-CD1 4.12Å; L961-P963 HydrophobicContact CG-CB 4.42Å; L961-P963 WeakPolarHBondContact O-CD 3.48Å
962	A	93.7	Very high	90.8	Very high	9 Å²	9	44.7 Å²	44.7	7%	0.074	22%	0.219	C	C	.	.			trans	-105.2	92	168.2	0	0	0	0	0	110	L964 G965 L1012 L1013 V1014	A962-L964 PolarHBondContact O-N 3.47Å; A962-G965 PolarHBondContact O-N 2.95Å; A962-L1012 HydrophobicContact CB-CB 3.49Å; A962-L1012 VanDerWaalsContact CB-CB 3.49Å; A962-L1012 HydrophobicContact CB-CD1 4.08Å; A962-L1012 HydrophobicContact CB-CG 4.44Å; A962-L1013 CarbonylContact C-O 3.51Å; A962-L1013 VanDerWaalsContact C-O 3.26Å; A962-V1014 HydrophobicContact CB-CG2 4.11Å
963	P	91.4	Very high	91.7	Very high	33 Å²	33	48.7 Å²	48.7	21%	0.214	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-16.6	-159	30.9	-41.6	0	0	0	117	W853 A854 L961	W853-P963 HydrophobicContact CH2-CB 3.99Å; W853-P963 HydrophobicContact CH2-CG 3.73Å; W853-P963 HydrophobicContact CZ2-CB 3.29Å; W853-P963 HydrophobicContact CZ2-CG 3.44Å; W853-P963 VanDerWaalsContact CZ2-CG 3.44Å; A854-P963 HydrophobicContact CB-CG 4.32Å; L961-P963 HydrophobicContact CG-CB 4.42Å; L961-P963 WeakPolarHBondContact O-CD 3.48Å
964	L	94.2	Very high	92.8	Very high	36 Å²	36	43.2 Å²	43.2	19%	0.188	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-6.6	174.6	-63.4	-179.5	0	0	0	112.2	A854 A962 Y970 L1013 T1015 R1016	A854-L964 HydrophobicContact CB-CD1 4.45Å; A854-L964 HydrophobicContact CB-CD2 3.78Å; A854-L964 HydrophobicContact CB-CG 4.02Å; A962-L964 PolarHBondContact O-N 3.47Å; L964-Y970 HydrophobicContact CB-CD2 4.2Å; L964-Y970 HydrophobicContact CB-CE2 4.34Å; L964-Y970 HydrophobicContact CD1-CE2 4.05Å; L964-Y970 HydrophobicContact CD2-CE2 4.42Å; L964-L1013 HydrophobicContact CB-CB 3.75Å; L964-L1013 WeakPolarHBondContact CB-O 3.42Å; L964-L1013 HydrophobicContact CD1-CB 4.38Å; L964-L1013 PolarHBondContact N-O 2.74Å; L964-T1015 VanDerWaalsContact CD1-C 3.5Å; L964-R1016 HydrophobicContact CD1-CG 4.39Å
965	G	94.5	Very high	93.6	Very high	19 Å²	19	41.1 Å²	41.1	20%	0.196	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	75.4	-163.8	175.2	0	0	0	0	0	113.4	A962 L1012 L1013	A962-G965 PolarHBondContact O-N 2.95Å; G965-L1012 CarbonylContact O-C 3.58Å; G965-L1012 WeakPolarHBondContact O-CA 3.29Å; G965-L1013 PolarHBondContact O-N 3.31Å
966	P	96	Very high	94.1	Very high	32 Å²	32	45 Å²	45	21%	0.208	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	138.6	-173.6	29.9	-34.9	0	0	0	112.7	N968 K969 Y970 R1009 V1011 L1012	P966-N968 VanDerWaalsContact C-N 3.27Å; P966-N968 PolarHBondContact O-N 3.03Å; P966-K969 HydrophobicContact CG-CB 4.12Å; P966-K969 HydrophobicContact CG-CD 4.05Å; P966-K969 HydrophobicContact CG-CG 4.03Å; P966-K969 PolarHBondContact O-N 2.89Å; P966-Y970 PolarHBondContact O-N 3.23Å; P966-R1009 VanDerWaalsContact CB-O 3.25Å; P966-R1009 WeakPolarHBondContact CB-O 3.46Å; P966-V1011 WeakPolarHBondContact CA-O 3.06Å; P966-L1012 HydrophobicContact CB-CD2 3.81Å
967	I	97.9	Very high	94.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59	-34.7	-172.5	-168.9	170.2	0	0	0	112.6	K969 Y970 L971 L985 A1008 V1011 L1013 V1076	I967-K969 VanDerWaalsContact C-N 3.33Å; I967-K969 PolarHBondContact O-N 3.19Å; I967-Y970 PolarHBondContact O-N 2.66Å; I967-L971 HydrophobicContact CD1-CD1 4.23Å; I967-L971 HydrophobicContact CG1-CD1 3.76Å; I967-L971 HydrophobicContact CG1-CG 3.89Å; I967-L971 WeakPolarHBondContact O-CG 3.3Å; I967-L971 PolarHBondContact O-N 3.09Å; I967-L985 HydrophobicContact CD1-CB 4.26Å; I967-L985 HydrophobicContact CD1-CD1 3.89Å; I967-A1008 HydrophobicContact CG2-CB 3.85Å; I967-A1008 WeakPolarHBondContact CG2-O 3.02Å; I967-V1011 HydrophobicContact CB-CG1 4.33Å; I967-V1011 HydrophobicContact CG2-CB 3.79Å; I967-V1011 HydrophobicContact CG2-CG1 3.86Å; I967-V1011 PolarHBondContact N-O 3.14Å; I967-L1013 HydrophobicContact CB-CD1 4.43Å; I967-L1013 HydrophobicContact CB-CG 4.26Å; I967-L1013 HydrophobicContact CD1-CD2 4.32Å; I967-L1013 HydrophobicContact CG1-CD1 4.2Å; I967-L1013 HydrophobicContact CG1-CD2 4.5Å; I967-L1013 HydrophobicContact CG1-CG 4.45Å; I967-V1076 HydrophobicContact CD1-CG1 4.29Å; I967-V1076 HydrophobicContact CD1-CG2 3.99Å; I967-V1076 HydrophobicContact CG1-CG2 4.39Å; I967-V1076 HydrophobicContact CG2-CG2 3.95Å
968	N	96	Very high	94.7	Very high	25 Å²	25	45.8 Å²	45.8	13%	0.134	23%	0.231	C	C	.	.	H	α-helix	trans	-67.7	-26.1	177	67.1	2.4	0	0	0	114.6	P966 K972 A1008 R1009 E1075	P966-N968 VanDerWaalsContact C-N 3.27Å; P966-N968 PolarHBondContact O-N 3.03Å; N968-K972 WeakPolarHBondContact O-CG 3.43Å; N968-A1008 HydrophobicContact CB-CB 3.81Å; N968-A1008 VanDerWaalsContact CG-O 3.31Å; N968-A1008 PolarHBondContact N-O 3.17Å; N968-A1008 PolarHBondContact OD1-O 3.45Å; N968-R1009 PolarHBondContact ND2-N 3Å; N968-E1075 PolarHBondContact ND2-OE1 3.3Å
969	K	96.3	Very high	94.8	Very high	148 Å²	148	47.6 Å²	47.6	64%	0.643	24%	0.242	S	C	*	.	H	α-helix	trans	-85.9	-29.4	171.3	-64.6	-170.1	178.4	-172.5	0	111.8	P966 I967	P966-K969 HydrophobicContact CG-CB 4.12Å; P966-K969 HydrophobicContact CG-CD 4.05Å; P966-K969 HydrophobicContact CG-CG 4.03Å; P966-K969 PolarHBondContact O-N 2.89Å; I967-K969 VanDerWaalsContact C-N 3.33Å; I967-K969 PolarHBondContact O-N 3.19Å
970	Y	97.7	Very high	94.9	Very high	27 Å²	27	48.7 Å²	48.7	11%	0.106	25%	0.247	C	C	.	.	H	α-helix	trans	-66.7	-50.4	175.4	-175.6	-95.6	0	0	0	111.9	L964 P966 I967 K972 K973 R974 V977 L1013 R1016	L964-Y970 HydrophobicContact CB-CD2 4.2Å; L964-Y970 HydrophobicContact CB-CE2 4.34Å; L964-Y970 HydrophobicContact CD1-CE2 4.05Å; L964-Y970 HydrophobicContact CD2-CE2 4.42Å; P966-Y970 PolarHBondContact O-N 3.23Å; I967-Y970 PolarHBondContact O-N 2.66Å; Y970-K972 PolarHBondContact O-N 2.7Å; Y970-K973 CarbonylContact O-C 3.58Å; Y970-K973 WeakPolarHBondContact O-CA 3.48Å; Y970-K973 PolarHBondContact O-N 2.82Å; Y970-R974 HydrophobicContact CD1-CB 4.41Å; Y970-R974 HydrophobicContact CD1-CG 4.46Å; Y970-R974 HydrophobicContact CE1-CB 4.06Å; Y970-R974 HydrophobicContact CE1-CG 3.98Å; Y970-R974 HydrophobicContact CE2-CG 4.19Å; Y970-R974 PolarHBondContact O-N 3.43Å; Y970-V977 HydrophobicContact CE1-CG2 3.94Å; Y970-L1013 HydrophobicContact CD1-CD1 3.51Å; Y970-L1013 HydrophobicContact CD2-CD1 4.18Å; Y970-L1013 HydrophobicContact CE1-CD1 4.01Å; Y970-L1013 HydrophobicContact CG-CD1 3.62Å; Y970-R1016 WeakPolarHBondContact OH-CD 3.44Å; Y970-R1016 WeakPolarHBondContact OH-CG 3.45Å
971	L	97.3	Very high	95	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-66.1	-35.4	-175.3	-67	176.9	0	0	0	113.5	I967 K973 R974 V977 L982 V1076 Y1079	I967-L971 HydrophobicContact CD1-CD1 4.23Å; I967-L971 HydrophobicContact CG1-CD1 3.76Å; I967-L971 HydrophobicContact CG1-CG 3.89Å; I967-L971 WeakPolarHBondContact O-CG 3.3Å; I967-L971 PolarHBondContact O-N 3.09Å; L971-K973 PolarHBondContact O-N 3.27Å; L971-R974 CarbonylContact O-C 3.6Å; L971-R974 PolarHBondContact O-N 3.13Å; L971-V977 HydrophobicContact CD2-CB 3.85Å; L971-V977 HydrophobicContact CD2-CG1 4.04Å; L971-V977 HydrophobicContact CD2-CG2 3.9Å; L971-L982 HydrophobicContact CD1-CD2 3.8Å; L971-L982 HydrophobicContact CD2-CD2 3.56Å; L971-L982 HydrophobicContact CG-CD2 4.36Å; L971-V1076 HydrophobicContact CD1-CB 4.41Å; L971-V1076 HydrophobicContact CD1-CG1 4.02Å; L971-V1076 HydrophobicContact CD1-CG2 4.48Å; L971-V1076 WeakPolarHBondContact CD1-O 3.44Å; L971-Y1079 CarbonylContact C-O 3.57Å; L971-Y1079 HydrophobicContact CB-CD1 4.37Å; L971-Y1079 HydrophobicContact CD2-CD1 4.49Å
972	K	96.2	Very high	95.2	Very high	134 Å²	134	49 Å²	49	58%	0.583	25%	0.249	S	C	*	.	H	α-helix	trans	-57.7	-34.9	170.7	-72.6	-171.6	-176.2	-167.2	0	113.2	N968 Y970 Y1079 G1080	N968-K972 WeakPolarHBondContact O-CG 3.43Å; Y970-K972 PolarHBondContact O-N 2.7Å; K972-Y1079 WeakPolarHBondContact CG-O 3.46Å; K972-Y1079 PolarHBondContact N-O 2.92Å; K972-G1080 WeakPolarHBondContact CE-O 3.44Å; K972-G1080 PolarHBondContact NZ-O 3.3Å
973	K	96.4	Very high	95.4	Very high	172 Å²	172	48.5 Å²	48.5	75%	0.748	25%	0.245	S	C	*	.	H	α-helix	trans	-86.3	-11.1	176.5	-64	-168	175.6	-157	0	113	Y970 L971	Y970-K973 CarbonylContact O-C 3.58Å; Y970-K973 WeakPolarHBondContact O-CA 3.48Å; Y970-K973 PolarHBondContact O-N 2.82Å; L971-K973 PolarHBondContact O-N 3.27Å
974	R	94.6	Very high	95.5	Very high	84 Å²	84	49 Å²	49	32%	0.317	24%	0.244	S	C	.	.			trans	-136.8	65.9	-176.8	-62.2	-58.3	-59.4	-148.5	4.6	111.6	Y970 L971 D976 V977	Y970-R974 HydrophobicContact CD1-CB 4.41Å; Y970-R974 HydrophobicContact CD1-CG 4.46Å; Y970-R974 HydrophobicContact CE1-CB 4.06Å; Y970-R974 HydrophobicContact CE1-CG 3.98Å; Y970-R974 HydrophobicContact CE2-CG 4.19Å; Y970-R974 PolarHBondContact O-N 3.43Å; L971-R974 CarbonylContact O-C 3.6Å; L971-R974 PolarHBondContact O-N 3.13Å; R974-D976 VanDerWaalsContact C-OD1 3.23Å; R974-D976 WeakPolarHBondContact CA-OD1 3.46Å; R974-D976 VanDerWaalsContact CB-OD1 3.31Å; R974-D976 WeakPolarHBondContact CB-OD1 3.44Å; R974-D976 IonicContact CZ-OD1 2.72Å; R974-D976 IonicContact CZ-OD2 2.67Å; R974-D976 IonicContact NE-OD1 3.63Å; R974-D976 PolarHBondContact NE-OD1 3.05Å; R974-D976 IonicContact NE-OD2 3.45Å; R974-D976 PolarHBondContact NE-OD2 2.76Å; R974-D976 IonicContact NH2-OD1 2.77Å; R974-D976 IonicContact NH2-OD2 3.87Å; R974-D976 PolarHBondContact NH2-OD2 3.28Å; R974-D976 PolarHBondContact O-N 2.77Å; R974-V977 HydrophobicContact CB-CG2 3.82Å; R974-V977 WeakPolarHBondContact O-CG2 3.47Å; R974-V977 PolarHBondContact O-N 3.49Å
975	P	92.3	Very high	95.7	Very high	73 Å²	73	47.3 Å²	47.3	47%	0.474	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	1.7	174.4	31.6	-37.1	0	0	0	113.5	R1107	P975-R1107 PolarHBondContact O-NH1 3.47Å
976	D	93.8	Very high	95.9	Very high	92 Å²	92	46.4 Å²	46.4	49%	0.492	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-12	173.9	64.8	-64.5	0	0	0	114.2	R974 S978	R974-D976 VanDerWaalsContact C-OD1 3.23Å; R974-D976 WeakPolarHBondContact CA-OD1 3.46Å; R974-D976 VanDerWaalsContact CB-OD1 3.31Å; R974-D976 WeakPolarHBondContact CB-OD1 3.44Å; R974-D976 IonicContact CZ-OD1 2.72Å; R974-D976 IonicContact CZ-OD2 2.67Å; R974-D976 IonicContact NE-OD1 3.63Å; R974-D976 PolarHBondContact NE-OD1 3.05Å; R974-D976 IonicContact NE-OD2 3.45Å; R974-D976 PolarHBondContact NE-OD2 2.76Å; R974-D976 IonicContact NH2-OD1 2.77Å; R974-D976 IonicContact NH2-OD2 3.87Å; R974-D976 PolarHBondContact NH2-OD2 3.28Å; R974-D976 PolarHBondContact O-N 2.77Å; D976-S978 PolarHBondContact O-N 3.33Å
977	V	94.2	Very high	95.9	Very high	14 Å²	14	46.4 Å²	46.4	9%	0.085	22%	0.223	C	C	.	.			trans	-62.4	125	-178.7	176.5	0	0	0	0	110.6	Y970 L971 R974 T981 L982 Y1079	Y970-V977 HydrophobicContact CE1-CG2 3.94Å; L971-V977 HydrophobicContact CD2-CB 3.85Å; L971-V977 HydrophobicContact CD2-CG1 4.04Å; L971-V977 HydrophobicContact CD2-CG2 3.9Å; R974-V977 HydrophobicContact CB-CG2 3.82Å; R974-V977 WeakPolarHBondContact O-CG2 3.47Å; R974-V977 PolarHBondContact O-N 3.49Å; V977-T981 HydrophobicContact CG1-CG2 3.86Å; V977-L982 HydrophobicContact CB-CD2 4.33Å; V977-L982 HydrophobicContact CG1-CD2 3.61Å; V977-L982 HydrophobicContact CG1-CG 4.29Å; V977-Y1079 WeakPolarHBondContact O-CE1 3.48Å; V977-Y1079 PolarHBondContact O-OH 2.97Å; V977-Y1079 VanDerWaalsContact O-OH 3.06Å
978	S	94.5	Very high	95.8	Very high	37 Å²	37	47.2 Å²	47.2	26%	0.259	23%	0.227	S	C	.	.			trans	-67.5	149.4	-175.9	83.6	0	0	0	0	112.7	D976 H980 T981 L982	D976-S978 PolarHBondContact O-N 3.33Å; S978-H980 PolarHBondContact O-N 3.23Å; S978-T981 WeakPolarHBondContact O-CA 3.37Å; S978-T981 WeakPolarHBondContact O-CB 3.33Å; S978-T981 PolarHBondContact O-N 2.67Å; S978-T981 PolarHBondContact OG-N 3.27Å; S978-T981 VanDerWaalsContact OG-N 3.15Å; S978-T981 PolarHBondContact OG-OG1 3.06Å; S978-L982 PolarHBondContact O-N 2.74Å
979	V	94.9	Very high	95.9	Very high	37 Å²	37	46 Å²	46	22%	0.224	22%	0.221	C	C	.	.	H	α-helix	trans	-56.2	-37.5	175.3	177.1	0	0	0	0	111.6	T981 L982 T983 Y1077 P1109	V979-T981 PolarHBondContact O-N 2.66Å; V979-L982 WeakPolarHBondContact O-CB 3.47Å; V979-L982 PolarHBondContact O-N 2.95Å; V979-L982 VanDerWaalsContact O-N 3.17Å; V979-T983 PolarHBondContact O-N 2.84Å; V979-T983 PolarHBondContact O-OG1 3.47Å; V979-Y1077 HydrophobicContact CG1-CD1 4.49Å; V979-Y1077 HydrophobicContact CG1-CE1 3.95Å; V979-P1109 HydrophobicContact CG1-CG 3.62Å
980	H	94.3	Very high	96	Very high	42 Å²	42	39 Å²	39	19%	0.194	19%	0.191	C	C	.	.	H	α-helix	trans	-56.4	-46.9	172.4	177.7	-71.2	0	0	0	111.9	S978 T983 E984 M1144	S978-H980 PolarHBondContact O-N 3.23Å; H980-T983 PolarHBondContact O-N 3.29Å; H980-E984 WeakPolarHBondContact O-CB 3.42Å; H980-E984 PolarHBondContact O-N 3.21Å; H980-M1144 HydrophobicContact CB-CE 4.46Å
981	T	95.6	Very high	95.8	Very high	13 Å²	13	38.5 Å²	38.5	8%	0.08	19%	0.19	C	C	.	.	H	α-helix	trans	-64.9	-36.9	176.3	-47.7	0	0	0	0	112	V977 S978 V979 T983 E984 L985	V977-T981 HydrophobicContact CG1-CG2 3.86Å; S978-T981 WeakPolarHBondContact O-CA 3.37Å; S978-T981 WeakPolarHBondContact O-CB 3.33Å; S978-T981 PolarHBondContact O-N 2.67Å; S978-T981 PolarHBondContact OG-N 3.27Å; S978-T981 VanDerWaalsContact OG-N 3.15Å; S978-T981 PolarHBondContact OG-OG1 3.06Å; V979-T981 PolarHBondContact O-N 2.66Å; T981-T983 VanDerWaalsContact C-N 3.35Å; T981-E984 PolarHBondContact O-N 3.18Å; T981-L985 HydrophobicContact CG2-CD1 4.14Å; T981-L985 HydrophobicContact CG2-CG 4.44Å; T981-L985 WeakPolarHBondContact O-CB 3.5Å; T981-L985 VanDerWaalsContact O-CG 3.25Å; T981-L985 WeakPolarHBondContact O-CG 3.39Å; T981-L985 PolarHBondContact O-N 3.35Å
982	L	97.5	Very high	95.7	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.8	-41.8	173	-57	-174.2	0	0	0	111.6	L971 V977 S978 V979 M986 V1076 Y1077 Y1079	L971-L982 HydrophobicContact CD1-CD2 3.8Å; L971-L982 HydrophobicContact CD2-CD2 3.56Å; L971-L982 HydrophobicContact CG-CD2 4.36Å; V977-L982 HydrophobicContact CB-CD2 4.33Å; V977-L982 HydrophobicContact CG1-CD2 3.61Å; V977-L982 HydrophobicContact CG1-CG 4.29Å; S978-L982 PolarHBondContact O-N 2.74Å; V979-L982 WeakPolarHBondContact O-CB 3.47Å; V979-L982 PolarHBondContact O-N 2.95Å; V979-L982 VanDerWaalsContact O-N 3.17Å; L982-M986 WeakPolarHBondContact O-CB 3.47Å; L982-M986 VanDerWaalsContact O-CG 3.31Å; L982-M986 WeakPolarHBondContact O-CG 3.47Å; L982-M986 PolarHBondContact O-N 2.81Å; L982-V1076 HydrophobicContact CB-CG1 4.05Å; L982-V1076 HydrophobicContact CD1-CG1 4.47Å; L982-V1076 HydrophobicContact CD2-CG1 4.02Å; L982-V1076 HydrophobicContact CG-CG1 4.4Å; L982-Y1077 HydrophobicContact CB-CE1 4.31Å; L982-Y1077 HydrophobicContact CB-CE2 4.35Å; L982-Y1077 HydrophobicContact CD1-CD1 4.36Å; L982-Y1077 HydrophobicContact CD1-CG 4.49Å; L982-Y1079 HydrophobicContact CD1-CE1 4.34Å; L982-Y1079 HydrophobicContact CD1-CE2 3.85Å
983	T	96.9	Very high	95.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-67.4	-39.9	176.4	-49.5	0	0	0	0	112.3	V979 H980 T981 M986 H987 Y1077 I1112 I1137 L1141 M1144	V979-T983 PolarHBondContact O-N 2.84Å; V979-T983 PolarHBondContact O-OG1 3.47Å; H980-T983 PolarHBondContact O-N 3.29Å; T981-T983 VanDerWaalsContact C-N 3.35Å; T983-M986 PolarHBondContact O-N 2.95Å; T983-H987 WeakPolarHBondContact O-CB 3.43Å; T983-H987 PolarHBondContact O-N 3.4Å; T983-Y1077 VanDerWaalsContact CA-OH 3.23Å; T983-Y1077 WeakPolarHBondContact CA-OH 3.19Å; T983-Y1077 WeakPolarHBondContact CB-OH 3.41Å; T983-Y1077 PolarHBondContact N-OH 3.48Å; T983-Y1077 PolarHBondContact OG1-OH 2.89Å; T983-I1112 HydrophobicContact CG2-CD1 4Å; T983-I1137 HydrophobicContact CG2-CG2 3.61Å; T983-L1141 HydrophobicContact CG2-CB 4.2Å; T983-L1141 HydrophobicContact CG2-CD1 4.17Å; T983-M1144 HydrophobicContact CG2-CE 3.76Å; T983-M1144 VanDerWaalsContact OG1-CE 3.31Å; T983-M1144 WeakPolarHBondContact OG1-CE 3.18Å
984	E	95.2	Very high	95.5	Very high	42 Å²	42	25.1 Å²	25.1	20%	0.196	14%	0.136	C	C	.	.	H	α-helix	trans	-59.1	-52.1	173.7	179.2	-173.8	-170	0	0	111.7	H980 T981 M986 H987 Q988 H1017 L1141	H980-E984 WeakPolarHBondContact O-CB 3.42Å; H980-E984 PolarHBondContact O-N 3.21Å; T981-E984 PolarHBondContact O-N 3.18Å; E984-M986 VanDerWaalsContact C-N 3.32Å; E984-M986 PolarHBondContact O-N 2.8Å; E984-H987 WeakPolarHBondContact O-CB 3.47Å; E984-H987 PolarHBondContact O-N 3.2Å; E984-Q988 WeakPolarHBondContact O-CG 3.25Å; E984-Q988 PolarHBondContact O-N 3.1Å; E984-H1017 IonicContact OE1-ND1 2.72Å; E984-H1017 IonicContact OE2-CE1 2.68Å; E984-H1017 IonicContact OE2-CG 3.68Å; E984-H1017 IonicContact OE2-ND1 3.69Å; E984-H1017 PolarHBondContact OE2-ND1 3.39Å; E984-L1141 HydrophobicContact CB-CD1 4.25Å; E984-L1141 HydrophobicContact CB-CD2 4.34Å
985	L	97.2	Very high	95.4	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.005	13%	0.131	C	C	.	.	H	α-helix	trans	-63.4	-37.3	179	-67.1	170	0	0	0	111.9	I967 T981 Q988 V989 L1013 A1019	I967-L985 HydrophobicContact CD1-CB 4.26Å; I967-L985 HydrophobicContact CD1-CD1 3.89Å; T981-L985 HydrophobicContact CG2-CD1 4.14Å; T981-L985 HydrophobicContact CG2-CG 4.44Å; T981-L985 WeakPolarHBondContact O-CB 3.5Å; T981-L985 VanDerWaalsContact O-CG 3.25Å; T981-L985 WeakPolarHBondContact O-CG 3.39Å; T981-L985 PolarHBondContact O-N 3.35Å; L985-Q988 WeakPolarHBondContact O-CB 3.5Å; L985-Q988 PolarHBondContact O-N 2.98Å; L985-V989 WeakPolarHBondContact O-CG2 3.39Å; L985-V989 PolarHBondContact O-N 3.38Å; L985-V989 VanDerWaalsContact O-N 3.1Å; L985-L1013 HydrophobicContact CD1-CD2 4.07Å; L985-L1013 HydrophobicContact CD2-CD2 3.75Å; L985-L1013 HydrophobicContact CG-CD2 4.46Å; L985-A1019 HydrophobicContact CB-CB 4.47Å; L985-A1019 HydrophobicContact CD2-CB 4.01Å
986	M	98.4	Very high	95.3	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-76.5	-32.2	177.8	-70.2	-56.9	-62.9	0	0	113.2	L982 T983 E984 Q988 V989 A990 Y1069 T1072 L1073 V1076 Y1077	L982-M986 WeakPolarHBondContact O-CB 3.47Å; L982-M986 VanDerWaalsContact O-CG 3.31Å; L982-M986 WeakPolarHBondContact O-CG 3.47Å; L982-M986 PolarHBondContact O-N 2.81Å; T983-M986 PolarHBondContact O-N 2.95Å; E984-M986 VanDerWaalsContact C-N 3.32Å; E984-M986 PolarHBondContact O-N 2.8Å; M986-Q988 VanDerWaalsContact C-N 3.28Å; M986-Q988 PolarHBondContact O-N 3.41Å; M986-V989 HydrophobicContact CE-CB 4.46Å; M986-V989 HydrophobicContact CE-CG1 4.48Å; M986-V989 PolarHBondContact O-N 3.33Å; M986-V989 HydrophobicContact SD-CB 4.43Å; M986-V989 HydrophobicContact SD-CG2 4.21Å; M986-A990 PolarHBondContact O-N 3.48Å; M986-Y1069 HydrophobicContact CE-CD2 3.99Å; M986-Y1069 HydrophobicContact CE-CE2 3.41Å; M986-Y1069 VanDerWaalsContact CE-CE2 3.41Å; M986-Y1069 PolarHBondContact O-OH 3.42Å; M986-T1072 HydrophobicContact CE-CG2 3.74Å; M986-T1072 HydrophobicContact SD-CG2 4.31Å; M986-L1073 HydrophobicContact CB-CD2 3.77Å; M986-L1073 HydrophobicContact CE-CD2 3.69Å; M986-L1073 HydrophobicContact CE-CG 3.86Å; M986-L1073 HydrophobicContact CG-CD2 3.89Å; M986-V1076 HydrophobicContact CG-CB 4.25Å; M986-V1076 HydrophobicContact CG-CG1 3.83Å; M986-V1076 HydrophobicContact CG-CG2 4.42Å; M986-V1076 HydrophobicContact SD-CB 4.2Å; M986-V1076 HydrophobicContact SD-CG1 4.29Å; M986-V1076 HydrophobicContact SD-CG2 3.78Å; M986-Y1077 HydrophobicContact CG-CE2 4.38Å
987	H	96.6	Very high	95.1	Very high	32 Å²	32	17.6 Å²	17.6	15%	0.148	9%	0.093	C	C	.	.	H	α-helix	trans	-56	-46.3	166	178.4	-120.6	0	0	0	110.3	Y248 T983 E984 V989 A990 L991 V1134 I1137	Y248-H987 PolarHBondContact OH-NE2 3.26Å; T983-H987 WeakPolarHBondContact O-CB 3.43Å; T983-H987 PolarHBondContact O-N 3.4Å; E984-H987 WeakPolarHBondContact O-CB 3.47Å; E984-H987 PolarHBondContact O-N 3.2Å; H987-V989 VanDerWaalsContact C-N 3.34Å; H987-V989 PolarHBondContact O-N 3.46Å; H987-A990 CarbonylContact O-C 3.47Å; H987-A990 WeakPolarHBondContact O-CA 3.49Å; H987-A990 WeakPolarHBondContact O-CB 3.09Å; H987-A990 PolarHBondContact O-N 3Å; H987-L991 WeakPolarHBondContact O-CG 3.3Å; H987-L991 PolarHBondContact O-N 2.93Å; H987-V1134 PolarHBondContact CD2-O 2.94Å; H987-I1137 HydrophobicContact CB-CG2 3.75Å
988	Q	95.6	Very high	94.7	Very high	17 Å²	17	20.3 Å²	20.3	8%	0.079	11%	0.112	C	C	.	.	H	α-helix	trans	-61.3	-37	176.9	-68.4	177.8	26.4	0	0	113.6	H942 E984 L985 M986 L991 G992 H1017 F1018 A1019	H942-Q988 VanDerWaalsContact CB-O 3.24Å; H942-Q988 WeakPolarHBondContact CB-O 3.38Å; H942-Q988 VanDerWaalsContact CE1-CD 3.41Å; H942-Q988 WeakPolarHBondContact CE1-CG 3.36Å; H942-Q988 PolarHBondContact CE1-OE1 2.97Å; H942-Q988 PolarHBondContact ND1-OE1 3.19Å; E984-Q988 WeakPolarHBondContact O-CG 3.25Å; E984-Q988 PolarHBondContact O-N 3.1Å; L985-Q988 WeakPolarHBondContact O-CB 3.5Å; L985-Q988 PolarHBondContact O-N 2.98Å; M986-Q988 VanDerWaalsContact C-N 3.28Å; M986-Q988 PolarHBondContact O-N 3.41Å; Q988-L991 WeakPolarHBondContact O-CB 3.45Å; Q988-L991 PolarHBondContact O-N 3.16Å; Q988-G992 PolarHBondContact O-N 3.48Å; Q988-G992 VanDerWaalsContact O-N 3.09Å; Q988-H1017 PolarHBondContact NE2-O 2.92Å; Q988-F1018 VanDerWaalsContact OE1-CA 3.31Å; Q988-A1019 HydrophobicContact CB-CB 4.35Å
989	V	98.3	Very high	94.1	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.006	12%	0.117	C	C	.	.	H	α-helix	trans	-65.4	-41.8	171.1	175.6	0	0	0	0	111	L985 M986 H987 L991 G992 M993 L1006 V1011 A1019 I1021 Y1069	L985-V989 WeakPolarHBondContact O-CG2 3.39Å; L985-V989 PolarHBondContact O-N 3.38Å; L985-V989 VanDerWaalsContact O-N 3.1Å; M986-V989 HydrophobicContact CE-CB 4.46Å; M986-V989 HydrophobicContact CE-CG1 4.48Å; M986-V989 PolarHBondContact O-N 3.33Å; M986-V989 HydrophobicContact SD-CB 4.43Å; M986-V989 HydrophobicContact SD-CG2 4.21Å; H987-V989 VanDerWaalsContact C-N 3.34Å; H987-V989 PolarHBondContact O-N 3.46Å; V989-L991 VanDerWaalsContact C-N 3.31Å; V989-L991 PolarHBondContact O-N 3.19Å; V989-G992 PolarHBondContact O-N 2.67Å; V989-M993 PolarHBondContact O-N 3Å; V989-L1006 HydrophobicContact CG1-CD1 4.28Å; V989-V1011 HydrophobicContact CG1-CG2 4.07Å; V989-V1011 HydrophobicContact CG2-CB 4.25Å; V989-V1011 HydrophobicContact CG2-CG1 3.51Å; V989-V1011 HydrophobicContact CG2-CG2 3.66Å; V989-A1019 HydrophobicContact CG2-CB 4.27Å; V989-I1021 HydrophobicContact CG1-CD1 4.24Å; V989-I1021 HydrophobicContact CG1-CG1 4.2Å; V989-I1021 WeakPolarHBondContact O-CD1 3.47Å; V989-Y1069 HydrophobicContact CB-CE2 4.09Å; V989-Y1069 HydrophobicContact CG1-CD2 3.91Å; V989-Y1069 HydrophobicContact CG1-CE2 3.76Å
990	A	97.8	Very high	93.5	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-61.6	-38.1	174.3	0	0	0	0	0	112	M986 H987 G992 M993 A994 Y1069 V1134 I1137	M986-A990 PolarHBondContact O-N 3.48Å; H987-A990 CarbonylContact O-C 3.47Å; H987-A990 WeakPolarHBondContact O-CA 3.49Å; H987-A990 WeakPolarHBondContact O-CB 3.09Å; H987-A990 PolarHBondContact O-N 3Å; A990-G992 PolarHBondContact O-N 3.37Å; A990-M993 PolarHBondContact O-N 3.39Å; A990-A994 WeakPolarHBondContact O-CB 3.18Å; A990-A994 PolarHBondContact O-N 3.16Å; A990-Y1069 HydrophobicContact CB-CE2 4.2Å; A990-V1134 HydrophobicContact CB-CG2 3.55Å; A990-V1134 WeakPolarHBondContact O-CG2 3.36Å; A990-I1137 HydrophobicContact CB-CD1 4.49Å
991	L	93.9	Very high	92.9	Very high	17 Å²	17	22.3 Å²	22.3	9%	0.089	12%	0.119	C	C	.	.	H	α-helix	trans	-59	-45.9	172.9	-62.4	179	0	0	0	111.5	L249 H940 H987 Q988 V989 A994 Y995 V1134	L249-L991 HydrophobicContact CD1-CD2 3.22Å; L249-L991 HydrophobicContact CD2-CD2 3.7Å; L249-L991 HydrophobicContact CG-CD2 4.08Å; H940-L991 PolarHBondContact CE1-O 3.38Å; H987-L991 WeakPolarHBondContact O-CG 3.3Å; H987-L991 PolarHBondContact O-N 2.93Å; Q988-L991 WeakPolarHBondContact O-CB 3.45Å; Q988-L991 PolarHBondContact O-N 3.16Å; V989-L991 VanDerWaalsContact C-N 3.31Å; V989-L991 PolarHBondContact O-N 3.19Å; L991-A994 PolarHBondContact O-N 3.08Å; L991-Y995 PolarHBondContact O-N 3.27Å; L991-V1134 HydrophobicContact CD2-CB 4.43Å; L991-V1134 HydrophobicContact CD2-CG1 3.62Å; L991-V1134 HydrophobicContact CD2-CG2 3.89Å; L991-V1134 HydrophobicContact CG-CG2 4.47Å
992	G	94.9	Very high	92.6	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-63.1	-41.4	177.3	0	0	0	0	0	113.1	H940 Q988 V989 A990 Y995 L996	H940-G992 WeakPolarHBondContact ND1-CA 3.39Å; Q988-G992 PolarHBondContact O-N 3.48Å; Q988-G992 VanDerWaalsContact O-N 3.09Å; V989-G992 PolarHBondContact O-N 2.67Å; A990-G992 PolarHBondContact O-N 3.37Å; G992-Y995 PolarHBondContact O-N 3.2Å; G992-L996 PolarHBondContact O-N 2.78Å
993	M	96.8	Very high	92.3	Very high	2 Å²	2	21.7 Å²	21.7	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-72.4	-34.3	177.8	-70.9	-55.1	-50.9	0	0	113.4	V989 A990 Y995 L996 E997 H1003 L1006 I1021 D1065 F1130	V989-M993 PolarHBondContact O-N 3Å; A990-M993 PolarHBondContact O-N 3.39Å; M993-Y995 VanDerWaalsContact C-N 3.29Å; M993-Y995 PolarHBondContact O-N 3.39Å; M993-L996 HydrophobicContact CE-CD1 4.36Å; M993-L996 PolarHBondContact O-N 2.76Å; M993-L996 HydrophobicContact SD-CD1 3.95Å; M993-E997 WeakPolarHBondContact O-CB 3.26Å; M993-E997 PolarHBondContact O-N 3.14Å; M993-H1003 HydrophobicContact CE-CB 3.88Å; M993-H1003 HydrophobicContact SD-CB 4.18Å; M993-L1006 HydrophobicContact CE-CD2 4.15Å; M993-L1006 HydrophobicContact CG-CD1 4.35Å; M993-L1006 HydrophobicContact CG-CD2 3.74Å; M993-L1006 HydrophobicContact SD-CD1 3.99Å; M993-L1006 HydrophobicContact SD-CD2 3.76Å; M993-L1006 HydrophobicContact SD-CG 4.41Å; M993-I1021 HydrophobicContact CG-CD1 3.74Å; M993-I1021 HydrophobicContact SD-CD1 3.79Å; M993-D1065 HydrophobicContact CE-CB 3.7Å; M993-F1130 HydrophobicContact CB-CB 4.3Å; M993-F1130 HydrophobicContact CB-CD1 3.32Å; M993-F1130 HydrophobicContact CB-CD2 3.79Å; M993-F1130 HydrophobicContact CB-CE1 3.36Å; M993-F1130 HydrophobicContact CB-CE2 3.8Å; M993-F1130 HydrophobicContact CB-CG 3.53Å; M993-F1130 HydrophobicContact CB-CZ 3.59Å; M993-F1130 HydrophobicContact CE-CD2 4.39Å; M993-F1130 HydrophobicContact CE-CE2 3.63Å; M993-F1130 HydrophobicContact CE-CZ 3.73Å; M993-F1130 HydrophobicContact CG-CD1 4.2Å; M993-F1130 HydrophobicContact CG-CE1 3.73Å; M993-F1130 HydrophobicContact CG-CE2 4.37Å; M993-F1130 HydrophobicContact CG-CZ 3.81Å
994	A	93.1	Very high	91.9	Very high	23 Å²	23	21.9 Å²	21.9	19%	0.19	12%	0.116	C	C	.	.	H	α-helix	trans	-62.6	-37.4	173.3	0	0	0	0	0	111.9	A990 L991 S998 F1130 V1134	A990-A994 WeakPolarHBondContact O-CB 3.18Å; A990-A994 PolarHBondContact O-N 3.16Å; L991-A994 PolarHBondContact O-N 3.08Å; A994-S998 PolarHBondContact O-N 2.91Å; A994-F1130 HydrophobicContact CB-CB 3.83Å; A994-V1134 HydrophobicContact CB-CG2 4.16Å
995	Y	92.5	Very high	91.6	Very high	57 Å²	57	20.5 Å²	20.5	22%	0.224	11%	0.11	C	C	.	.	H	α-helix	trans	-62.2	-49.5	170.6	174.4	-94.4	0	0	0	111.6	L938 K939 H940 I943 L991 G992 M993 E997 S998 C999	L938-Y995 HydrophobicContact CB-CE1 4.22Å; L938-Y995 HydrophobicContact CD2-CE1 4.05Å; K939-Y995 PolarHBondContact N-OH 3.16Å; H940-Y995 HydrophobicContact CB-CD1 3.65Å; H940-Y995 HydrophobicContact CB-CD2 4.02Å; H940-Y995 HydrophobicContact CB-CE1 3.99Å; H940-Y995 HydrophobicContact CB-CE2 4.34Å; H940-Y995 HydrophobicContact CB-CG 3.66Å; H940-Y995 AromaticContact CG-CG 3.98Å; I943-Y995 HydrophobicContact CD1-CD1 3.56Å; I943-Y995 HydrophobicContact CD1-CE1 4.13Å; L991-Y995 PolarHBondContact O-N 3.27Å; G992-Y995 PolarHBondContact O-N 3.2Å; M993-Y995 VanDerWaalsContact C-N 3.29Å; M993-Y995 PolarHBondContact O-N 3.39Å; Y995-E997 VanDerWaalsContact C-N 3.34Å; Y995-E997 PolarHBondContact O-N 3.13Å; Y995-S998 PolarHBondContact O-N 2.82Å; Y995-S998 PolarHBondContact O-OG 2.72Å; Y995-C999 PolarHBondContact O-N 2.97Å; Y995-C999 PolarHBondContact O-SG 3.5Å; Y995-C999 VanDerWaalsContact O-SG 3.39Å
996	L	89.5	Confident	91.5	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-60.7	-40.3	177.9	-67.7	-176.9	0	0	0	112.9	L938 I943 G992 M993 C999 K1000 F1001	L938-L996 HydrophobicContact CD1-CD2 3.82Å; L938-L996 HydrophobicContact CD2-CD2 4.07Å; L938-L996 HydrophobicContact CG-CD2 4.44Å; I943-L996 HydrophobicContact CD1-CD1 4.28Å; I943-L996 HydrophobicContact CD1-CD2 3.66Å; I943-L996 HydrophobicContact CD1-CG 3.73Å; G992-L996 PolarHBondContact O-N 2.78Å; M993-L996 HydrophobicContact CE-CD1 4.36Å; M993-L996 PolarHBondContact O-N 2.76Å; M993-L996 HydrophobicContact SD-CD1 3.95Å; L996-C999 CarbonylContact O-C 3.47Å; L996-C999 PolarHBondContact O-N 2.94Å; L996-K1000 PolarHBondContact O-N 2.92Å; L996-F1001 HydrophobicContact CD2-CB 4.37Å; L996-F1001 HydrophobicContact CD2-CD1 3.87Å; L996-F1001 HydrophobicContact CD2-CG 4.42Å; L996-F1001 PolarHBondContact O-N 2.93Å
997	E	90	Very high	91.3	Very high	35 Å²	35	20.5 Å²	20.5	16%	0.164	11%	0.11	C	C	.	.	H	α-helix	trans	-59.4	-45.5	174	178.2	168.6	-117.6	0	0	111.5	M993 Y995 C999 K1000 S1062 F1130	M993-E997 WeakPolarHBondContact O-CB 3.26Å; M993-E997 PolarHBondContact O-N 3.14Å; Y995-E997 VanDerWaalsContact C-N 3.34Å; Y995-E997 PolarHBondContact O-N 3.13Å; E997-C999 VanDerWaalsContact C-N 3.31Å; E997-C999 PolarHBondContact O-N 2.67Å; E997-K1000 PolarHBondContact O-N 3.42Å; E997-S1062 VanDerWaalsContact OE1-CB 3.32Å; E997-S1062 WeakPolarHBondContact OE1-CB 3.41Å; E997-F1130 HydrophobicContact CB-CD2 4.29Å; E997-F1130 WeakPolarHBondContact OE2-CB 3.35Å; E997-F1130 PolarHBondContact OE2-N 3.13Å
998	S	85.5	Confident	91.3	Very high	70 Å²	70	19 Å²	19	49%	0.49	10%	0.103	S	C	.	.	H	α-helix	trans	-64	-33.8	175.1	76.7	0	0	0	0	113	A994 Y995 K1000	A994-S998 PolarHBondContact O-N 2.91Å; Y995-S998 PolarHBondContact O-N 2.82Å; Y995-S998 PolarHBondContact O-OG 2.72Å; S998-K1000 PolarHBondContact O-N 2.95Å
999	C	82.7	Confident	91.3	Very high	54 Å²	54	21.3 Å²	21.3	37%	0.365	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	4.5	174	-64.4	0	0	0	0	114	L938 Y995 L996 E997 F1001	L938-C999 HydrophobicContact CD2-CB 4.13Å; Y995-C999 PolarHBondContact O-N 2.97Å; Y995-C999 PolarHBondContact O-SG 3.5Å; Y995-C999 VanDerWaalsContact O-SG 3.39Å; L996-C999 CarbonylContact O-C 3.47Å; L996-C999 PolarHBondContact O-N 2.94Å; E997-C999 VanDerWaalsContact C-N 3.31Å; E997-C999 PolarHBondContact O-N 2.67Å; C999-F1001 HydrophobicContact CB-CB 4.31Å; C999-F1001 PolarHBondContact O-N 2.86Å
1000	K	80.9	Confident	91.1	Very high	98 Å²	98	21.7 Å²	21.7	43%	0.426	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	40.2	-175.1	-66.4	-69.7	-172.2	171	0	112.8	L996 E997 S998 L1030 D1035	L996-K1000 PolarHBondContact O-N 2.92Å; E997-K1000 PolarHBondContact O-N 3.42Å; S998-K1000 PolarHBondContact O-N 2.95Å; K1000-L1030 HydrophobicContact CB-CD1 4.42Å; K1000-L1030 WeakPolarHBondContact O-CG 3.4Å; K1000-L1030 PolarHBondContact O-N 3.25Å; K1000-D1035 IonicContact NZ-OD1 3.22Å; K1000-D1035 PolarHBondContact NZ-OD1 3.45Å
1001	F	82.3	Confident	91.1	Very high	6 Å²	6	21.7 Å²	21.7	3%	0.026	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	113.2	-174.4	-166	-88.3	0	0	0	110.5	T934 M935 L938 L996 C999 F1024 S1027 A1029	T934-F1001 HydrophobicContact CG2-CD2 4.13Å; T934-F1001 HydrophobicContact CG2-CE2 3.76Å; M935-F1001 HydrophobicContact CG-CZ 4.46Å; L938-F1001 HydrophobicContact CD1-CD1 3.85Å; L938-F1001 HydrophobicContact CD1-CD2 4.18Å; L938-F1001 HydrophobicContact CD1-CE1 3.69Å; L938-F1001 HydrophobicContact CD1-CE2 4.07Å; L938-F1001 HydrophobicContact CD1-CG 4.07Å; L938-F1001 HydrophobicContact CD1-CZ 3.81Å; L996-F1001 HydrophobicContact CD2-CB 4.37Å; L996-F1001 HydrophobicContact CD2-CD1 3.87Å; L996-F1001 HydrophobicContact CD2-CG 4.42Å; L996-F1001 PolarHBondContact O-N 2.93Å; C999-F1001 HydrophobicContact CB-CB 4.31Å; C999-F1001 PolarHBondContact O-N 2.86Å; F1001-F1024 HydrophobicContact CE1-CB 4.22Å; F1001-F1024 AromaticContact CE1-CD2 3.85Å; F1001-F1024 HydrophobicContact CE1-CD2 3.85Å; F1001-F1024 HydrophobicContact CE1-CG 4.44Å; F1001-F1024 HydrophobicContact CZ-CD2 4.21Å; F1001-S1027 VanDerWaalsContact CZ-CB 3.44Å; F1001-A1029 HydrophobicContact CD2-CB 4.36Å
1002	V	88.2	Confident	91.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	122	-172.5	-172.4	0	0	0	0	110.4	R1004 S1027 L1030 F1060 D1065	V1002-R1004 HydrophobicContact CB-CG 4.41Å; V1002-R1004 HydrophobicContact CG1-CG 3.81Å; V1002-S1027 VanDerWaalsContact O-CA 3.29Å; V1002-S1027 WeakPolarHBondContact O-CA 3.15Å; V1002-S1027 WeakPolarHBondContact O-CB 3.44Å; V1002-S1027 PolarHBondContact O-OG 2.92Å; V1002-L1030 HydrophobicContact CG2-CD1 3.86Å; V1002-L1030 HydrophobicContact CG2-CD2 3.98Å; V1002-L1030 HydrophobicContact CG2-CG 3.92Å; V1002-F1060 HydrophobicContact CG1-CB 4.19Å; V1002-D1065 WeakPolarHBondContact CA-OD2 3.43Å; V1002-D1065 VanDerWaalsContact CG1-OD2 3.31Å; V1002-D1065 WeakPolarHBondContact CG1-OD2 3.49Å
1003	H	91.2	Very high	91.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.118	C	C	.	.			trans	-68.9	-47.8	-171.8	-167.6	-72.2	0	0	0	112.8	M993 D1005 L1006 I1021 S1022 S1027 D1065	M993-H1003 HydrophobicContact CE-CB 3.88Å; M993-H1003 HydrophobicContact SD-CB 4.18Å; H1003-D1005 VanDerWaalsContact CE1-C 3.49Å; H1003-D1005 PolarHBondContact CE1-O 3.36Å; H1003-D1005 VanDerWaalsContact CE1-O 3.28Å; H1003-D1005 PolarHBondContact ND1-N 3.14Å; H1003-D1005 PolarHBondContact ND1-O 3.22Å; H1003-D1005 PolarHBondContact O-N 3.38Å; H1003-L1006 PolarHBondContact ND1-N 3.35Å; H1003-L1006 VanDerWaalsContact ND1-N 3.14Å; H1003-I1021 VanDerWaalsContact CD2-CG2 3.45Å; H1003-I1021 WeakPolarHBondContact CD2-CG2 3.41Å; H1003-I1021 WeakPolarHBondContact NE2-CG2 3.44Å; H1003-S1022 PolarHBondContact NE2-O 3.35Å; H1003-S1027 WeakPolarHBondContact CA-OG 3.27Å; H1003-S1027 PolarHBondContact O-OG 3.31Å; H1003-D1065 WeakPolarHBondContact CB-OD1 3.48Å; H1003-D1065 PolarHBondContact N-OD1 3.28Å; H1003-D1065 PolarHBondContact N-OD2 3.38Å
1004	R	88.6	Confident	91	Very high	5 Å²	5	22.9 Å²	22.9	2%	0.019	12%	0.119	C	C	.	.	S	Bend	trans	61.1	-7.1	178.5	-49.2	-171.3	-167	115.6	13.1	118	V1002 M1026 K1028 Y1037 Y1050 F1060 D1065	V1002-R1004 HydrophobicContact CB-CG 4.41Å; V1002-R1004 HydrophobicContact CG1-CG 3.81Å; R1004-M1026 PolarHBondContact NH1-O 2.96Å; R1004-K1028 PolarHBondContact NH2-O 3.44Å; R1004-Y1037 VanDerWaalsContact NH2-CB 3.25Å; R1004-Y1037 VanDerWaalsContact NH2-CG 3.31Å; R1004-Y1050 WeakPolarHBondContact O-CE1 3.42Å; R1004-Y1050 PolarHBondContact O-OH 3.39Å; R1004-F1060 HydrophobicContact CB-CD1 4.14Å; R1004-F1060 HydrophobicContact CB-CE1 4.45Å; R1004-F1060 HydrophobicContact CG-CB 3.98Å; R1004-F1060 HydrophobicContact CG-CD1 3.76Å; R1004-F1060 HydrophobicContact CG-CE1 4.49Å; R1004-F1060 HydrophobicContact CG-CG 3.99Å; R1004-D1065 PolarHBondContact N-OD1 2.87Å
1005	D	89	Confident	90.8	Very high	12 Å²	12	22.2 Å²	22.2	6%	0.064	11%	0.113	C	C	.	.			trans	-134.2	42.3	169.1	-164	26.7	0	0	0	112.1	H1003 A1007 R1009 N1010 P1046	H1003-D1005 VanDerWaalsContact CE1-C 3.49Å; H1003-D1005 PolarHBondContact CE1-O 3.36Å; H1003-D1005 VanDerWaalsContact CE1-O 3.28Å; H1003-D1005 PolarHBondContact ND1-N 3.14Å; H1003-D1005 PolarHBondContact ND1-O 3.22Å; H1003-D1005 PolarHBondContact O-N 3.38Å; D1005-A1007 PolarHBondContact O-N 2.84Å; D1005-R1009 IonicContact OD1-CZ 3.51Å; D1005-R1009 IonicContact OD1-NE 3.61Å; D1005-R1009 PolarHBondContact OD1-NE 3.4Å; D1005-R1009 IonicContact OD1-NH2 3.51Å; D1005-R1009 PolarHBondContact OD1-NH2 3.27Å; D1005-R1009 IonicContact OD2-NE 3.56Å; D1005-N1010 PolarHBondContact O-ND2 3.29Å; D1005-N1010 PolarHBondContact OD2-ND2 3.41Å; D1005-P1046 WeakPolarHBondContact OD1-CG 3.47Å
1006	L	95.1	Very high	90.7	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.005	12%	0.117	C	C	.	.			trans	-77.2	113.7	-179.5	-178.2	63.9	0	0	0	110.2	V989 M993 H1003 I1021 Y1069 T1072 F1130	V989-L1006 HydrophobicContact CG1-CD1 4.28Å; M993-L1006 HydrophobicContact CE-CD2 4.15Å; M993-L1006 HydrophobicContact CG-CD1 4.35Å; M993-L1006 HydrophobicContact CG-CD2 3.74Å; M993-L1006 HydrophobicContact SD-CD1 3.99Å; M993-L1006 HydrophobicContact SD-CD2 3.76Å; M993-L1006 HydrophobicContact SD-CG 4.41Å; H1003-L1006 PolarHBondContact ND1-N 3.35Å; H1003-L1006 VanDerWaalsContact ND1-N 3.14Å; L1006-I1021 HydrophobicContact CD1-CG2 4.44Å; L1006-Y1069 HydrophobicContact CD2-CD2 4.27Å; L1006-T1072 PolarHBondContact O-OG1 2.8Å; L1006-F1130 HydrophobicContact CD2-CZ 4.22Å
1007	A	95.1	Very high	90.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.135	C	C	.	.	S	Bend	trans	-159.1	161.3	-174.4	0	0	0	0	0	110.7	D1005 R1009 N1010 V1011 W1049 T1072	D1005-A1007 PolarHBondContact O-N 2.84Å; A1007-R1009 HydrophobicContact CB-CG 3.61Å; A1007-R1009 PolarHBondContact O-N 3.11Å; A1007-R1009 VanDerWaalsContact O-N 3.11Å; A1007-N1010 WeakPolarHBondContact O-CA 3.33Å; A1007-N1010 PolarHBondContact O-N 3.49Å; A1007-V1011 PolarHBondContact O-N 2.87Å; A1007-W1049 HydrophobicContact CB-CD2 4.15Å; A1007-W1049 HydrophobicContact CB-CG 4.06Å; A1007-W1049 HydrophobicContact CB-CZ2 4.44Å; A1007-W1049 VanDerWaalsContact CB-NE1 3.31Å; A1007-T1072 VanDerWaalsContact CA-OG1 3.3Å; A1007-T1072 WeakPolarHBondContact CA-OG1 3.47Å
1008	A	97.1	Very high	90.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-6.5	-179.9	0	0	0	0	0	114	I967 N968 N1010 T1072 E1075 V1076	I967-A1008 HydrophobicContact CG2-CB 3.85Å; I967-A1008 WeakPolarHBondContact CG2-O 3.02Å; N968-A1008 HydrophobicContact CB-CB 3.81Å; N968-A1008 VanDerWaalsContact CG-O 3.31Å; N968-A1008 PolarHBondContact N-O 3.17Å; N968-A1008 PolarHBondContact OD1-O 3.45Å; A1008-N1010 VanDerWaalsContact C-N 3.34Å; A1008-T1072 HydrophobicContact CB-CG2 4.2Å; A1008-E1075 HydrophobicContact CB-CB 3.61Å; A1008-E1075 VanDerWaalsContact CB-CD 3.45Å; A1008-E1075 HydrophobicContact CB-CG 4.18Å; A1008-E1075 WeakPolarHBondContact CB-OE2 3.37Å; A1008-E1075 PolarHBondContact N-OE2 3Å; A1008-V1076 HydrophobicContact CB-CG2 4.18Å
1009	R	94	Very high	91.2	Very high	66 Å²	66	22.2 Å²	22.2	25%	0.249	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-24	163.6	53.3	161.9	170.4	-68.6	-7	113.6	P966 N968 D1005 A1007 P1046	P966-R1009 VanDerWaalsContact CB-O 3.25Å; P966-R1009 WeakPolarHBondContact CB-O 3.46Å; N968-R1009 PolarHBondContact ND2-N 3Å; D1005-R1009 IonicContact OD1-CZ 3.51Å; D1005-R1009 IonicContact OD1-NE 3.61Å; D1005-R1009 PolarHBondContact OD1-NE 3.4Å; D1005-R1009 IonicContact OD1-NH2 3.51Å; D1005-R1009 PolarHBondContact OD1-NH2 3.27Å; D1005-R1009 IonicContact OD2-NE 3.56Å; A1007-R1009 HydrophobicContact CB-CG 3.61Å; A1007-R1009 PolarHBondContact O-N 3.11Å; A1007-R1009 VanDerWaalsContact O-N 3.11Å; R1009-P1046 VanDerWaalsContact NH2-CB 3.29Å
1010	N	94.9	Very high	91.9	Very high	10 Å²	10	19.8 Å²	19.8	5%	0.053	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-4.1	-170.9	-68.8	-4.7	0	0	0	112.1	D1005 A1007 A1008 S1022	D1005-N1010 PolarHBondContact O-ND2 3.29Å; D1005-N1010 PolarHBondContact OD2-ND2 3.41Å; A1007-N1010 WeakPolarHBondContact O-CA 3.33Å; A1007-N1010 PolarHBondContact O-N 3.49Å; A1008-N1010 VanDerWaalsContact C-N 3.34Å; N1010-S1022 WeakPolarHBondContact O-CB 3.2Å; N1010-S1022 PolarHBondContact O-N 3.28Å; N1010-S1022 PolarHBondContact O-OG 3.2Å
1011	V	97.5	Very high	92.6	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	109.7	162.7	175.6	0	0	0	0	108.3	P966 I967 V989 A1007 A1019 T1072	P966-V1011 WeakPolarHBondContact CA-O 3.06Å; I967-V1011 HydrophobicContact CB-CG1 4.33Å; I967-V1011 HydrophobicContact CG2-CB 3.79Å; I967-V1011 HydrophobicContact CG2-CG1 3.86Å; I967-V1011 PolarHBondContact N-O 3.14Å; V989-V1011 HydrophobicContact CG1-CG2 4.07Å; V989-V1011 HydrophobicContact CG2-CB 4.25Å; V989-V1011 HydrophobicContact CG2-CG1 3.51Å; V989-V1011 HydrophobicContact CG2-CG2 3.66Å; A1007-V1011 PolarHBondContact O-N 2.87Å; V1011-A1019 HydrophobicContact CG1-CB 4.07Å; V1011-T1072 HydrophobicContact CG2-CG2 4.18Å
1012	L	96.5	Very high	93	Very high	35 Å²	35	15.2 Å²	15.2	18%	0.183	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	146.7	-179.7	-49.1	-175.1	0	0	0	111.3	V944 A962 G965 P966 A1019 K1020 S1022	V944-L1012 HydrophobicContact CG2-CD1 4.29Å; A962-L1012 HydrophobicContact CB-CB 3.49Å; A962-L1012 VanDerWaalsContact CB-CB 3.49Å; A962-L1012 HydrophobicContact CB-CD1 4.08Å; A962-L1012 HydrophobicContact CB-CG 4.44Å; G965-L1012 CarbonylContact O-C 3.58Å; G965-L1012 WeakPolarHBondContact O-CA 3.29Å; P966-L1012 HydrophobicContact CB-CD2 3.81Å; L1012-A1019 CarbonylContact O-C 3.46Å; L1012-A1019 WeakPolarHBondContact O-CA 3.44Å; L1012-K1020 PolarHBondContact N-O 2.78Å; L1012-K1020 PolarHBondContact O-N 2.68Å; L1012-S1022 WeakPolarHBondContact CG-OG 3.47Å
1013	L	96	Very high	92.7	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	126.9	178.5	-64.9	-175.3	0	0	0	111.5	A962 L964 G965 I967 Y970 L985 A1019	A962-L1013 CarbonylContact C-O 3.51Å; A962-L1013 VanDerWaalsContact C-O 3.26Å; L964-L1013 HydrophobicContact CB-CB 3.75Å; L964-L1013 WeakPolarHBondContact CB-O 3.42Å; L964-L1013 HydrophobicContact CD1-CB 4.38Å; L964-L1013 PolarHBondContact N-O 2.74Å; G965-L1013 PolarHBondContact O-N 3.31Å; I967-L1013 HydrophobicContact CB-CD1 4.43Å; I967-L1013 HydrophobicContact CB-CG 4.26Å; I967-L1013 HydrophobicContact CD1-CD2 4.32Å; I967-L1013 HydrophobicContact CG1-CD1 4.2Å; I967-L1013 HydrophobicContact CG1-CD2 4.5Å; I967-L1013 HydrophobicContact CG1-CG 4.45Å; Y970-L1013 HydrophobicContact CD1-CD1 3.51Å; Y970-L1013 HydrophobicContact CD2-CD1 4.18Å; Y970-L1013 HydrophobicContact CE1-CD1 4.01Å; Y970-L1013 HydrophobicContact CG-CD1 3.62Å; L985-L1013 HydrophobicContact CD1-CD2 4.07Å; L985-L1013 HydrophobicContact CD2-CD2 3.75Å; L985-L1013 HydrophobicContact CG-CD2 4.46Å; L1013-A1019 HydrophobicContact CD2-CB 4.07Å
1014	V	91.2	Very high	91.5	Very high	8 Å²	8	17.5 Å²	17.5	5%	0.048	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-50.2	171.4	-175.3	0	0	0	0	109.6	A862 A962 F1018 K1020	A862-V1014 HydrophobicContact CB-CG1 3.77Å; A962-V1014 HydrophobicContact CB-CG2 4.11Å; V1014-F1018 HydrophobicContact CB-CB 4.19Å; V1014-F1018 HydrophobicContact CB-CD1 3.66Å; V1014-F1018 HydrophobicContact CB-CE1 4.21Å; V1014-F1018 HydrophobicContact CB-CG 3.98Å; V1014-F1018 HydrophobicContact CG1-CD1 3.83Å; V1014-F1018 HydrophobicContact CG1-CE1 4.16Å; V1014-F1018 HydrophobicContact CG2-CD1 4.06Å; V1014-F1018 HydrophobicContact CG2-CE1 4.2Å; V1014-F1018 HydrophobicContact CG2-CG 4.3Å; V1014-F1018 PolarHBondContact N-O 2.68Å; V1014-K1020 HydrophobicContact CG2-CD 3.62Å; V1014-K1020 HydrophobicContact CG2-CG 3.92Å
1015	T	89	Confident	89.9	Confident	10 Å²	10	18.7 Å²	18.7	6%	0.061	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	177.2	169.9	78.2	0	0	0	0	108.4	A862 L964 H1017 F1018	A862-T1015 HydrophobicContact CB-CG2 4.49Å; L964-T1015 VanDerWaalsContact CD1-C 3.5Å; T1015-H1017 PolarHBondContact O-N 2.89Å; T1015-H1017 VanDerWaalsContact O-N 3.09Å; T1015-H1017 PolarHBondContact OG1-N 3.07Å; T1015-F1018 PolarHBondContact O-N 3.4Å; T1015-F1018 WeakPolarHBondContact OG1-CB 3.49Å; T1015-F1018 PolarHBondContact OG1-N 3.13Å
1016	R	89.6	Confident	88.1	Confident	80 Å²	80	20.9 Å²	20.9	30%	0.302	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-19.7	178.5	-49.3	-163.2	-169.2	-168.3	9.6	114.3	N855 L964 Y970	N855-R1016 PolarHBondContact ND2-NH2 3.45Å; N855-R1016 PolarHBondContact OD1-NE 3.43Å; N855-R1016 PolarHBondContact OD1-NH2 2.84Å; N855-R1016 VanDerWaalsContact OD1-NH2 3.1Å; L964-R1016 HydrophobicContact CD1-CG 4.39Å; Y970-R1016 WeakPolarHBondContact OH-CD 3.44Å; Y970-R1016 WeakPolarHBondContact OH-CG 3.45Å
1017	H	89.3	Confident	86.3	Confident	80 Å²	80	21 Å²	21	37%	0.37	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121	16.8	-177.4	-63.5	-90.2	0	0	0	112	E984 Q988 T1015	E984-H1017 IonicContact OE1-ND1 2.72Å; E984-H1017 IonicContact OE2-CE1 2.68Å; E984-H1017 IonicContact OE2-CG 3.68Å; E984-H1017 IonicContact OE2-ND1 3.69Å; E984-H1017 PolarHBondContact OE2-ND1 3.39Å; Q988-H1017 PolarHBondContact NE2-O 2.92Å; T1015-H1017 PolarHBondContact O-N 2.89Å; T1015-H1017 VanDerWaalsContact O-N 3.09Å; T1015-H1017 PolarHBondContact OG1-N 3.07Å
1018	F	91.6	Very high	84.3	Confident	1 Å²	1	24.1 Å²	24.1	0%	0.004	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	105.8	-179.6	-173	-167.9	0	0	0	111.7	P859 Q863 R941 H942 Q988 V1014 T1015 K1020	P859-F1018 HydrophobicContact CB-CB 4.27Å; P859-F1018 HydrophobicContact CB-CD1 4.03Å; P859-F1018 HydrophobicContact CB-CG 4.26Å; P859-F1018 WeakPolarHBondContact O-CE1 3.11Å; Q863-F1018 HydrophobicContact CB-CE1 4.21Å; Q863-F1018 HydrophobicContact CB-CZ 4.38Å; R941-F1018 WeakPolarHBondContact O-CE2 3.4Å; H942-F1018 AromaticContact CE1-CD2 3.8Å; H942-F1018 AromaticContact CE1-CE2 3.74Å; H942-F1018 AromaticContact ND1-CD2 3.7Å; H942-F1018 AromaticContact ND1-CE2 3.52Å; Q988-F1018 VanDerWaalsContact OE1-CA 3.31Å; V1014-F1018 HydrophobicContact CB-CB 4.19Å; V1014-F1018 HydrophobicContact CB-CD1 3.66Å; V1014-F1018 HydrophobicContact CB-CE1 4.21Å; V1014-F1018 HydrophobicContact CB-CG 3.98Å; V1014-F1018 HydrophobicContact CG1-CD1 3.83Å; V1014-F1018 HydrophobicContact CG1-CE1 4.16Å; V1014-F1018 HydrophobicContact CG2-CD1 4.06Å; V1014-F1018 HydrophobicContact CG2-CE1 4.2Å; V1014-F1018 HydrophobicContact CG2-CG 4.3Å; V1014-F1018 PolarHBondContact N-O 2.68Å; T1015-F1018 PolarHBondContact O-N 3.4Å; T1015-F1018 WeakPolarHBondContact OG1-CB 3.49Å; T1015-F1018 PolarHBondContact OG1-N 3.13Å; F1018-K1020 HydrophobicContact CE2-CG 4.23Å
1019	A	96.2	Very high	81.6	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	147.9	174.5	0	0	0	0	0	112.7	H942 L985 Q988 V989 V1011 L1012 L1013	H942-A1019 PolarHBondContact ND1-O 2.7Å; L985-A1019 HydrophobicContact CB-CB 4.47Å; L985-A1019 HydrophobicContact CD2-CB 4.01Å; Q988-A1019 HydrophobicContact CB-CB 4.35Å; V989-A1019 HydrophobicContact CG2-CB 4.27Å; V1011-A1019 HydrophobicContact CG1-CB 4.07Å; L1012-A1019 CarbonylContact O-C 3.46Å; L1012-A1019 WeakPolarHBondContact O-CA 3.44Å; L1013-A1019 HydrophobicContact CD2-CB 4.07Å
1020	K	96.2	Very high	78.6	Confident	3 Å²	3	24.3 Å²	24.3	1%	0.013	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	141.4	168.2	-75.2	178.8	173.7	-81.8	0	111.1	R941 H942 I943 V944 E960 L1012 V1014 F1018	R941-K1020 WeakPolarHBondContact O-CE 3.35Å; R941-K1020 WeakPolarHBondContact O-CG 3.4Å; R941-K1020 PolarHBondContact O-NZ 3.11Å; H942-K1020 WeakPolarHBondContact O-CA 3.37Å; I943-K1020 PolarHBondContact O-NZ 3.1Å; V944-K1020 HydrophobicContact CG2-CB 3.67Å; V944-K1020 HydrophobicContact CG2-CD 4.05Å; E960-K1020 IonicContact OE1-NZ 2.69Å; E960-K1020 WeakPolarHBondContact OE2-CE 3.3Å; E960-K1020 IonicContact OE2-NZ 3.38Å; E960-K1020 PolarHBondContact OE2-NZ 3.43Å; L1012-K1020 PolarHBondContact N-O 2.78Å; L1012-K1020 PolarHBondContact O-N 2.68Å; V1014-K1020 HydrophobicContact CG2-CD 3.62Å; V1014-K1020 HydrophobicContact CG2-CG 3.92Å; F1018-K1020 HydrophobicContact CE2-CG 4.23Å
1021	I	96.4	Very high	75.6	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	137.2	172.1	-56.6	169.6	0	0	0	109.7	H942 V944 V989 M993 H1003 L1006	H942-I1021 WeakPolarHBondContact O-CG1 3.37Å; H942-I1021 PolarHBondContact O-N 3.43Å; V944-I1021 PolarHBondContact N-O 3.4Å; V989-I1021 HydrophobicContact CG1-CD1 4.24Å; V989-I1021 HydrophobicContact CG1-CG1 4.2Å; V989-I1021 WeakPolarHBondContact O-CD1 3.47Å; M993-I1021 HydrophobicContact CG-CD1 3.74Å; M993-I1021 HydrophobicContact SD-CD1 3.79Å; H1003-I1021 VanDerWaalsContact CD2-CG2 3.45Å; H1003-I1021 WeakPolarHBondContact CD2-CG2 3.41Å; H1003-I1021 WeakPolarHBondContact NE2-CG2 3.44Å; L1006-I1021 HydrophobicContact CD1-CG2 4.44Å
1022	S	91.5	Very high	72.4	Confident	9 Å²	9	35.3 Å²	35.3	6%	0.063	19%	0.186	C	C	.	.			trans	-136	173.1	-177.1	71.6	0	0	0	0	111.8	H1003 N1010 L1012 F1024	H1003-S1022 PolarHBondContact NE2-O 3.35Å; N1010-S1022 WeakPolarHBondContact O-CB 3.2Å; N1010-S1022 PolarHBondContact O-N 3.28Å; N1010-S1022 PolarHBondContact O-OG 3.2Å; L1012-S1022 WeakPolarHBondContact CG-OG 3.47Å; S1022-F1024 PolarHBondContact O-N 3.21Å; S1022-F1024 VanDerWaalsContact O-N 3.09Å
1023	D	80.4	Confident	69.1	Low	45 Å²	45	37.9 Å²	37.9	24%	0.241	22%	0.221	C	C	.	.			trans	55.9	28.1	173	-90.4	14.6	0	0	0	116.1	K913 G1025	K913-D1023 IonicContact NZ-OD1 3.2Å; K913-D1023 PolarHBondContact NZ-OD1 3.08Å; K913-D1023 IonicContact NZ-OD2 3.81Å; K913-D1023 PolarHBondContact NZ-OD2 3.07Å; D1023-G1025 PolarHBondContact O-N 3.33Å
1024	F	66	Low	66.2	Low	2 Å²	2	39.8 Å²	39.8	1%	0.009	24%	0.235	C	C	.	.			trans	-65.5	41.1	157.5	57.4	-87.1	0	0	0	113.1	M935 L938 I943 V944 F1001 S1022 S1027	M935-F1024 HydrophobicContact CB-CE2 3.91Å; M935-F1024 HydrophobicContact CE-CD2 3.65Å; M935-F1024 HydrophobicContact CE-CE2 3.56Å; M935-F1024 HydrophobicContact CE-CG 4.35Å; M935-F1024 HydrophobicContact CE-CZ 4.19Å; M935-F1024 HydrophobicContact CG-CD2 4.02Å; M935-F1024 HydrophobicContact CG-CE2 3.84Å; L938-F1024 HydrophobicContact CD1-CD2 4.07Å; L938-F1024 HydrophobicContact CD1-CE2 3.81Å; I943-F1024 HydrophobicContact CG2-CD1 4.2Å; I943-F1024 HydrophobicContact CG2-CE1 3.39Å; I943-F1024 HydrophobicContact CG2-CZ 3.67Å; V944-F1024 WeakPolarHBondContact O-CE1 3.45Å; V944-F1024 VanDerWaalsContact O-CZ 3.27Å; V944-F1024 WeakPolarHBondContact O-CZ 3.36Å; F1001-F1024 HydrophobicContact CE1-CB 4.22Å; F1001-F1024 AromaticContact CE1-CD2 3.85Å; F1001-F1024 HydrophobicContact CE1-CD2 3.85Å; F1001-F1024 HydrophobicContact CE1-CG 4.44Å; F1001-F1024 HydrophobicContact CZ-CD2 4.21Å; S1022-F1024 PolarHBondContact O-N 3.21Å; S1022-F1024 VanDerWaalsContact O-N 3.09Å; F1024-S1027 WeakPolarHBondContact CA-OG 3.48Å; F1024-S1027 VanDerWaalsContact CB-OG 3.3Å; F1024-S1027 WeakPolarHBondContact CB-OG 3.34Å; F1024-S1027 VanDerWaalsContact O-CB 3.26Å; F1024-S1027 WeakPolarHBondContact O-CB 3.45Å; F1024-S1027 PolarHBondContact O-OG 3.19Å; F1024-S1027 VanDerWaalsContact O-OG 3.06Å
1025	G	54.9	Low	64.1	Low	31 Å²	31	44.1 Å²	44.1	32%	0.32	26%	0.257	S	S	.	.			trans	-102.9	6.7	177.5	0	0	0	0	0	114	D1023	D1023-G1025 PolarHBondContact O-N 3.33Å
1026	M	52.8	Low	61.8	Low	57 Å²	57	48.8 Å²	48.8	28%	0.281	27%	0.274	S	S	.	.	S	Bend	trans	-101.5	1.5	157.1	-69.6	-156.2	74	0	0	112.1	F892 R1004 W1045	F892-M1026 HydrophobicContact CE1-CG 3.78Å; F892-M1026 HydrophobicContact CE1-SD 4.22Å; F892-M1026 HydrophobicContact CZ-CG 3.53Å; F892-M1026 HydrophobicContact CZ-SD 3.72Å; R1004-M1026 PolarHBondContact NH1-O 2.96Å; M1026-W1045 HydrophobicContact CE-CE3 4.05Å; M1026-W1045 HydrophobicContact CE-CH2 4.06Å; M1026-W1045 HydrophobicContact CE-CZ3 3.45Å; M1026-W1045 VanDerWaalsContact CE-CZ3 3.45Å
1027	S	56	Low	59.6	Low	4 Å²	4	47.9 Å²	47.9	3%	0.028	27%	0.271	C	S	.	.			trans	-79.9	140.4	-178.1	-46.9	0	0	0	0	110.4	F1001 V1002 H1003 F1024	F1001-S1027 VanDerWaalsContact CZ-CB 3.44Å; V1002-S1027 VanDerWaalsContact O-CA 3.29Å; V1002-S1027 WeakPolarHBondContact O-CA 3.15Å; V1002-S1027 WeakPolarHBondContact O-CB 3.44Å; V1002-S1027 PolarHBondContact O-OG 2.92Å; H1003-S1027 WeakPolarHBondContact CA-OG 3.27Å; H1003-S1027 PolarHBondContact O-OG 3.31Å; F1024-S1027 WeakPolarHBondContact CA-OG 3.48Å; F1024-S1027 VanDerWaalsContact CB-OG 3.3Å; F1024-S1027 WeakPolarHBondContact CB-OG 3.34Å; F1024-S1027 VanDerWaalsContact O-CB 3.26Å; F1024-S1027 WeakPolarHBondContact O-CB 3.45Å; F1024-S1027 PolarHBondContact O-OG 3.19Å; F1024-S1027 VanDerWaalsContact O-OG 3.06Å
1028	K	53.4	Low	57.7	Low	65 Å²	65	52.5 Å²	52.5	28%	0.283	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	140.5	168.4	-71.2	-179.6	163.2	-177.2	0	107.2	E931 R1004 Y1037	E931-K1028 WeakPolarHBondContact OE1-CE 3.33Å; E931-K1028 VanDerWaalsContact OE1-CG 3.31Å; E931-K1028 WeakPolarHBondContact OE1-CG 3.27Å; E931-K1028 IonicContact OE1-NZ 3.68Å; R1004-K1028 PolarHBondContact NH2-O 3.44Å; K1028-Y1037 HydrophobicContact CD-CE2 3.83Å
1029	A	40.2	Very low	55.4	Low	47 Å²	47	53.2 Å²	53.2	39%	0.388	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.6	143.8	162.8	0	0	0	0	0	109.4	T934 F1001	T934-A1029 HydrophobicContact CG2-CB 4.14Å; F1001-A1029 HydrophobicContact CD2-CB 4.36Å
1030	L	30.4	Very low	52.8	Low	23 Å²	23	57.7 Å²	57.7	12%	0.12	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-74.6	134.7	173.5	-67.9	172.9	0	0	0	109.9	K1000 V1002 S1034 D1035	K1000-L1030 HydrophobicContact CB-CD1 4.42Å; K1000-L1030 WeakPolarHBondContact O-CG 3.4Å; K1000-L1030 PolarHBondContact O-N 3.25Å; V1002-L1030 HydrophobicContact CG2-CD1 3.86Å; V1002-L1030 HydrophobicContact CG2-CD2 3.98Å; V1002-L1030 HydrophobicContact CG2-CG 3.92Å; L1030-S1034 WeakPolarHBondContact CB-O 3.47Å; L1030-D1035 WeakPolarHBondContact CD1-O 3.48Å
1031	N	32	Very low	50.1	Low	137 Å²	137	63.1 Å²	63.1	73%	0.733	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-64.9	144.1	173.2	-80.1	-8.5	0	0	0	109.9	G1033 S1034	N1031-G1033 PolarHBondContact O-N 2.95Å; N1031-S1034 PolarHBondContact O-N 3.02Å
1032	F	30.7	Very low	47.3	Very low	104 Å²	104	67.3 Å²	67.3	46%	0.456	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	123.9	-177.9	-120.9	-131.7	0	0	0	111.4	G175 P176 R178 N179	G175-F1032 WeakPolarHBondContact O-CE1 3.34Å; P176-F1032 VanDerWaalsContact CA-CE2 3.42Å; P176-F1032 HydrophobicContact CB-CD2 3.82Å; P176-F1032 HydrophobicContact CB-CE2 3.98Å; P176-F1032 HydrophobicContact CB-CG 4.33Å; P176-F1032 WeakPolarHBondContact O-CE2 3.27Å; P176-F1032 VanDerWaalsContact O-CZ 3.26Å; P176-F1032 WeakPolarHBondContact O-CZ 3.29Å; R178-F1032 HydrophobicContact CB-CE1 4.27Å; R178-F1032 HydrophobicContact CB-CZ 4.49Å; N179-F1032 HydrophobicContact CB-CE2 4.29Å; N179-F1032 HydrophobicContact CB-CZ 3.81Å; N179-F1032 VanDerWaalsContact ND2-CZ 3.27Å; N179-F1032 WeakPolarHBondContact ND2-CZ 3.43Å
1033	G	28	Very low	45	Very low	89 Å²	89	69.2 Å²	69.2	92%	0.918	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.3	-6.9	-174.5	0	0	0	0	0	115.7	N1031	N1031-G1033 PolarHBondContact O-N 2.95Å
1034	S	34.6	Very low	43.7	Very low	41 Å²	41	75.6 Å²	75.6	29%	0.287	44%	0.443	S	S	.	.			trans	-113.4	120.4	173.9	-166.6	0	0	0	0	111.4	L1030 N1031 Y1036	L1030-S1034 WeakPolarHBondContact CB-O 3.47Å; N1031-S1034 PolarHBondContact O-N 3.02Å; S1034-Y1036 PolarHBondContact O-N 3.39Å; S1034-Y1036 PolarHBondContact OG-O 3.02Å
1035	D	46.3	Very low	43.6	Very low	99 Å²	99	77.9 Å²	77.9	53%	0.529	45%	0.452	S	S	.	.	S	Bend	trans	-79.5	-2.6	172.9	-80.8	-55.7	0	0	0	113.4	K1000 L1030 D1061	K1000-D1035 IonicContact NZ-OD1 3.22Å; K1000-D1035 PolarHBondContact NZ-OD1 3.45Å; L1030-D1035 WeakPolarHBondContact CD1-O 3.48Å; D1035-D1061 WeakPolarHBondContact O-CB 3.34Å
1036	Y	40.9	Very low	44.6	Very low	107 Å²	107	77.6 Å²	77.6	42%	0.42	44%	0.444	S	S	.	.	S	Bend	trans	-139.1	162.5	178.8	69.7	-84.5	0	0	0	113.3	S1034 R1059 F1060	S1034-Y1036 PolarHBondContact O-N 3.39Å; S1034-Y1036 PolarHBondContact OG-O 3.02Å; Y1036-R1059 HydrophobicContact CD2-CG 3.95Å; Y1036-R1059 HydrophobicContact CG-CG 4.03Å; Y1036-F1060 CarbonylContact C-O 3.55Å; Y1036-F1060 WeakPolarHBondContact CA-O 3.41Å
1037	Y	44.1	Very low	45.9	Very low	61 Å²	61	78.2 Å²	78.2	24%	0.239	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	148.4	170.8	172.9	-104	0	0	0	110.7	R1004 K1028 A1039 R1059 F1060	R1004-Y1037 VanDerWaalsContact NH2-CB 3.25Å; R1004-Y1037 VanDerWaalsContact NH2-CG 3.31Å; K1028-Y1037 HydrophobicContact CD-CE2 3.83Å; Y1037-A1039 HydrophobicContact CE1-CB 4.02Å; Y1037-R1059 WeakPolarHBondContact O-CA 3.45Å; Y1037-F1060 HydrophobicContact CD1-CD2 4.14Å; Y1037-F1060 PolarHBondContact N-O 2.82Å; Y1037-F1060 PolarHBondContact O-N 3.15Å
1038	R	48.7	Very low	47.5	Very low	178 Å²	178	80.4 Å²	80.4	67%	0.672	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118	125.3	171.3	-159.3	178.5	-167	-170.3	0.8	109.7	F1058	R1038-F1058 WeakPolarHBondContact CA-O 2.74Å; R1038-F1058 HydrophobicContact CG-CB 4.35Å
1039	A	44.2	Very low	49.4	Very low	16 Å²	16	78.9 Å²	78.9	13%	0.132	45%	0.45	C	S	.	.			trans	-75.6	134.7	179.8	0	0	0	0	0	111.9	Y1037 W1045 F1058 F1060	Y1037-A1039 HydrophobicContact CE1-CB 4.02Å; A1039-W1045 HydrophobicContact CB-CH2 3.77Å; A1039-W1045 HydrophobicContact CB-CZ2 3.71Å; A1039-F1058 HydrophobicContact CB-CB 4.25Å; A1039-F1058 HydrophobicContact CB-CD1 4.4Å; A1039-F1058 PolarHBondContact N-O 2.94Å; A1039-F1060 HydrophobicContact CB-CE2 4.13Å
1040	A	40.5	Very low	51.8	Low	94 Å²	94	76.9 Å²	76.9	78%	0.777	43%	0.433	S	S	*	.	S	Bend	trans	-94	2	-176.2	0	0	0	0	0	114.4
1041	T	39.7	Very low	54.6	Low	116 Å²	116	75.8 Å²	75.8	71%	0.712	43%	0.427	S	S	*	.	S	Bend	trans	-154.4	141.2	-173.7	-31.4	0	0	0	0	111.3	G1043 W1045	T1041-G1043 PolarHBondContact O-N 2.98Å; T1041-W1045 WeakPolarHBondContact O-CZ2 3.49Å
1042	A	37.7	Very low	57.1	Low	89 Å²	89	69.4 Å²	69.4	74%	0.736	39%	0.393	S	S	*	.			trans	-81.4	105.9	176.4	0	0	0	0	0	111.2
1043	G	44.8	Very low	59.5	Low	48 Å²	48	65.5 Å²	65.5	50%	0.495	38%	0.376	S	S	.	.			trans	-100.2	-175.8	175.1	0	0	0	0	0	113.8	T1041 W1045	T1041-G1043 PolarHBondContact O-N 2.98Å; G1043-W1045 VanDerWaalsContact C-N 3.27Å; G1043-W1045 PolarHBondContact O-N 3.36Å
1044	K	51.1	Low	62.2	Low	179 Å²	179	61.4 Å²	61.4	78%	0.778	33%	0.333	S	S	*	.			trans	-75	79.5	168.1	-72.3	-165.1	174.7	-166.8	0	110.3
1045	W	65.8	Low	64	Low	51 Å²	51	61.1 Å²	61.1	19%	0.193	33%	0.328	C	S	.	.			trans	-74.6	141.4	-175.9	-62.1	115.8	0	0	0	113.4	M1026 A1039 T1041 G1043 L1047 Y1050 F1058 F1060	M1026-W1045 HydrophobicContact CE-CE3 4.05Å; M1026-W1045 HydrophobicContact CE-CH2 4.06Å; M1026-W1045 HydrophobicContact CE-CZ3 3.45Å; M1026-W1045 VanDerWaalsContact CE-CZ3 3.45Å; A1039-W1045 HydrophobicContact CB-CH2 3.77Å; A1039-W1045 HydrophobicContact CB-CZ2 3.71Å; T1041-W1045 WeakPolarHBondContact O-CZ2 3.49Å; G1043-W1045 VanDerWaalsContact C-N 3.27Å; G1043-W1045 PolarHBondContact O-N 3.36Å; W1045-L1047 HydrophobicContact CB-CD2 4.03Å; W1045-L1047 HydrophobicContact CB-CG 4.31Å; W1045-L1047 PolarHBondContact O-N 2.86Å; W1045-Y1050 HydrophobicContact CB-CE2 4Å; W1045-Y1050 HydrophobicContact CD2-CE2 4.11Å; W1045-Y1050 AromaticContact CE3-CE2 3.68Å; W1045-Y1050 HydrophobicContact CE3-CE2 3.68Å; W1045-Y1050 AromaticContact CE3-CZ 3.92Å; W1045-Y1050 VanDerWaalsContact CE3-OH 3.3Å; W1045-Y1050 HydrophobicContact CG-CE2 4.28Å; W1045-Y1050 HydrophobicContact CZ3-CE2 4.42Å; W1045-F1058 AromaticContact NE1-CE1 4Å; W1045-F1060 HydrophobicContact CH2-CZ 4.49Å; W1045-F1060 HydrophobicContact CZ3-CZ 4.23Å
1046	P	75.4	Confident	65.1	Low	24 Å²	24	60.7 Å²	60.7	16%	0.156	32%	0.32	C	S	.	.			trans	-80.4	60.2	175.7	35.1	-36.5	0	0	0	111.8	D1005 R1009 K1048 W1049 Y1050	D1005-P1046 WeakPolarHBondContact OD1-CG 3.47Å; R1009-P1046 VanDerWaalsContact NH2-CB 3.29Å; P1046-K1048 PolarHBondContact O-N 3.42Å; P1046-W1049 HydrophobicContact CB-CE3 4.04Å; P1046-W1049 PolarHBondContact O-N 3.22Å; P1046-Y1050 HydrophobicContact CG-CD1 4.26Å; P1046-Y1050 HydrophobicContact CG-CE1 3.54Å
1047	L	78.9	Confident	66.6	Low	71 Å²	71	62.8 Å²	62.8	37%	0.372	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-47.6	-34	-169.4	-64.4	173.6	0	0	0	115.2	W1045 W1049 Y1050 I1055	W1045-L1047 HydrophobicContact CB-CD2 4.03Å; W1045-L1047 HydrophobicContact CB-CG 4.31Å; W1045-L1047 PolarHBondContact O-N 2.86Å; L1047-W1049 PolarHBondContact O-N 3.1Å; L1047-W1049 VanDerWaalsContact O-N 3.16Å; L1047-Y1050 PolarHBondContact O-N 3.49Å; L1047-I1055 HydrophobicContact CD2-CG1 4.29Å; L1047-I1055 HydrophobicContact CD2-CG2 4.43Å
1048	K	90.5	Very high	67.9	Low	49 Å²	49	63.7 Å²	63.7	21%	0.213	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-64.5	-14.7	179.8	-69.9	-173.1	160	-161.9	0	114.9	P1046 P1083 Y1084 R1085 M1087 I1092	P1046-K1048 PolarHBondContact O-N 3.42Å; K1048-P1083 WeakPolarHBondContact CD-O 3.41Å; K1048-P1083 PolarHBondContact NZ-O 2.93Å; K1048-Y1084 HydrophobicContact CB-CD2 4.21Å; K1048-Y1084 HydrophobicContact CG-CD2 4.32Å; K1048-Y1084 PolarHBondContact NZ-O 2.88Å; K1048-Y1084 WeakPolarHBondContact O-CE2 3.08Å; K1048-R1085 PolarHBondContact NZ-O 3.48Å; K1048-M1087 WeakPolarHBondContact CE-O 3.35Å; K1048-I1092 HydrophobicContact CD-CD1 4.43Å; K1048-I1092 HydrophobicContact CG-CD1 3.79Å
1049	W	93.6	Very high	69.2	Low	33 Å²	33	60 Å²	60	13%	0.125	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-103.2	-8.1	173.9	-69.6	-99	0	0	0	112.8	A1007 P1046 L1047 S1068 I1071 E1075 P1083	A1007-W1049 HydrophobicContact CB-CD2 4.15Å; A1007-W1049 HydrophobicContact CB-CG 4.06Å; A1007-W1049 HydrophobicContact CB-CZ2 4.44Å; A1007-W1049 VanDerWaalsContact CB-NE1 3.31Å; P1046-W1049 HydrophobicContact CB-CE3 4.04Å; P1046-W1049 PolarHBondContact O-N 3.22Å; L1047-W1049 PolarHBondContact O-N 3.1Å; L1047-W1049 VanDerWaalsContact O-N 3.16Å; W1049-S1068 WeakPolarHBondContact O-CA 3.49Å; W1049-S1068 PolarHBondContact O-OG 2.68Å; W1049-S1068 VanDerWaalsContact O-OG 3.09Å; W1049-I1071 VanDerWaalsContact CD1-CG2 3.47Å; W1049-I1071 HydrophobicContact CD2-CG2 4.49Å; W1049-I1071 HydrophobicContact CG-CG2 4.02Å; W1049-E1075 PolarHBondContact NE1-OE2 3.44Å; W1049-P1083 HydrophobicContact CH2-CG 4.22Å; W1049-P1083 HydrophobicContact CZ2-CG 3.81Å
1050	Y	89.5	Confident	71	Confident	6 Å²	6	59.3 Å²	59.3	2%	0.024	31%	0.313	C	S	.	.			trans	-85.2	142.7	-169.3	-79	9	0	0	0	112.3	R1004 W1045 P1046 L1047 C1054 F1060 W1067	R1004-Y1050 WeakPolarHBondContact O-CE1 3.42Å; R1004-Y1050 PolarHBondContact O-OH 3.39Å; W1045-Y1050 HydrophobicContact CB-CE2 4Å; W1045-Y1050 HydrophobicContact CD2-CE2 4.11Å; W1045-Y1050 AromaticContact CE3-CE2 3.68Å; W1045-Y1050 HydrophobicContact CE3-CE2 3.68Å; W1045-Y1050 AromaticContact CE3-CZ 3.92Å; W1045-Y1050 VanDerWaalsContact CE3-OH 3.3Å; W1045-Y1050 HydrophobicContact CG-CE2 4.28Å; W1045-Y1050 HydrophobicContact CZ3-CE2 4.42Å; P1046-Y1050 HydrophobicContact CG-CD1 4.26Å; P1046-Y1050 HydrophobicContact CG-CE1 3.54Å; L1047-Y1050 PolarHBondContact O-N 3.49Å; Y1050-C1054 HydrophobicContact CD2-CB 3.99Å; Y1050-C1054 HydrophobicContact CG-CB 4.1Å; Y1050-F1060 HydrophobicContact CD2-CE1 4.05Å; Y1050-F1060 HydrophobicContact CD2-CZ 4.2Å; Y1050-F1060 HydrophobicContact CE1-CE1 4.18Å; Y1050-F1060 AromaticContact CE2-CE1 3.54Å; Y1050-F1060 HydrophobicContact CE2-CE1 3.54Å; Y1050-F1060 AromaticContact CE2-CZ 3.59Å; Y1050-F1060 HydrophobicContact CE2-CZ 3.59Å; Y1050-F1060 AromaticContact CZ-CE1 3.58Å; Y1050-W1067 PolarHBondContact O-NE1 3.02Å
1051	A	90.5	Very high	73.2	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.279	C	S	.	.			trans	-73.3	155.7	172.7	0	0	0	0	0	110.6	E1053 C1054 I1055 W1067	A1051-E1053 VanDerWaalsContact C-N 3.25Å; A1051-E1053 VanDerWaalsContact CB-CD 3.44Å; A1051-E1053 WeakPolarHBondContact CB-OE1 3.4Å; A1051-E1053 VanDerWaalsContact CB-OE2 3.24Å; A1051-E1053 WeakPolarHBondContact CB-OE2 3.28Å; A1051-E1053 PolarHBondContact O-N 3.41Å; A1051-C1054 WeakPolarHBondContact O-CB 3.28Å; A1051-C1054 PolarHBondContact O-N 3.1Å; A1051-I1055 PolarHBondContact O-N 2.8Å; A1051-W1067 HydrophobicContact CB-CB 3.76Å; A1051-W1067 HydrophobicContact CB-CD2 3.99Å; A1051-W1067 HydrophobicContact CB-CE3 4.45Å; A1051-W1067 HydrophobicContact CB-CG 3.67Å
1052	P	82.9	Confident	75.7	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.019	25%	0.25	C	S	.	.	H	α-helix	trans	-51.9	-41.4	-179.2	-27.8	35.8	0	0	0	113.3	C1054 I1055 Y1056 W1067 F1122	P1052-C1054 VanDerWaalsContact C-N 3.32Å; P1052-C1054 PolarHBondContact O-N 3.48Å; P1052-I1055 PolarHBondContact O-N 3.49Å; P1052-I1055 VanDerWaalsContact O-N 3.08Å; P1052-Y1056 HydrophobicContact CB-CD2 4.1Å; P1052-Y1056 HydrophobicContact CB-CE2 4.08Å; P1052-Y1056 VanDerWaalsContact O-CD2 3.28Å; P1052-Y1056 WeakPolarHBondContact O-CD2 3.26Å; P1052-Y1056 PolarHBondContact O-N 2.96Å; P1052-W1067 HydrophobicContact CG-CH2 3.94Å; P1052-W1067 HydrophobicContact CG-CZ2 4.41Å; P1052-W1067 HydrophobicContact CG-CZ3 4.15Å; P1052-F1122 HydrophobicContact CB-CE2 4.06Å; P1052-F1122 HydrophobicContact CB-CZ 4.1Å; P1052-F1122 HydrophobicContact CG-CD2 4Å; P1052-F1122 HydrophobicContact CG-CE2 3.9Å; P1052-F1122 HydrophobicContact CG-CZ 4.42Å
1053	E	82.6	Confident	78.4	Confident	22 Å²	22	48.5 Å²	48.5	10%	0.103	23%	0.225	C	C	.	.	H	α-helix	trans	-68.1	-25.8	179.3	73.4	-75.8	-178.8	0	0	114.3	A1051 I1055 Y1057 F1058 R1059 S1064 R1127	A1051-E1053 VanDerWaalsContact C-N 3.25Å; A1051-E1053 VanDerWaalsContact CB-CD 3.44Å; A1051-E1053 WeakPolarHBondContact CB-OE1 3.4Å; A1051-E1053 VanDerWaalsContact CB-OE2 3.24Å; A1051-E1053 WeakPolarHBondContact CB-OE2 3.28Å; A1051-E1053 PolarHBondContact O-N 3.41Å; E1053-I1055 VanDerWaalsContact C-N 3.35Å; E1053-Y1057 HydrophobicContact CB-CD2 4.07Å; E1053-Y1057 WeakPolarHBondContact O-CA 3.46Å; E1053-Y1057 WeakPolarHBondContact O-CB 3.35Å; E1053-Y1057 PolarHBondContact O-N 3.09Å; E1053-Y1057 VanDerWaalsContact O-N 3.08Å; E1053-F1058 PolarHBondContact O-N 3.31Å; E1053-R1059 HydrophobicContact CB-CB 4.42Å; E1053-R1059 HydrophobicContact CG-CB 4.33Å; E1053-R1059 HydrophobicContact CG-CG 4.41Å; E1053-R1059 PolarHBondContact O-N 2.81Å; E1053-R1059 VanDerWaalsContact O-N 3.16Å; E1053-S1064 WeakPolarHBondContact OE1-CB 3.45Å; E1053-R1127 IonicContact OE1-CZ 2.98Å; E1053-R1127 IonicContact OE1-NH1 3.63Å; E1053-R1127 PolarHBondContact OE1-NH1 3.31Å; E1053-R1127 IonicContact OE1-NH2 2.63Å; E1053-R1127 PolarHBondContact OE1-NH2 3.25Å; E1053-R1127 IonicContact OE2-CZ 3.56Å; E1053-R1127 IonicContact OE2-NH1 3.52Å; E1053-R1127 PolarHBondContact OE2-NH1 3.03Å; E1053-R1127 IonicContact OE2-NH2 3.59Å; E1053-R1127 PolarHBondContact OE2-NH2 3.06Å
1054	C	83.5	Confident	80.8	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.02	20%	0.202	C	C	.	.	H	α-helix	trans	-70.9	-33.5	171.1	-58.8	0	0	0	0	111.8	Y1050 A1051 P1052 F1058 R1059 F1060 S1064	Y1050-C1054 HydrophobicContact CD2-CB 3.99Å; Y1050-C1054 HydrophobicContact CG-CB 4.1Å; A1051-C1054 WeakPolarHBondContact O-CB 3.28Å; A1051-C1054 PolarHBondContact O-N 3.1Å; P1052-C1054 VanDerWaalsContact C-N 3.32Å; P1052-C1054 PolarHBondContact O-N 3.48Å; C1054-F1058 VanDerWaalsContact O-CA 3.31Å; C1054-F1058 WeakPolarHBondContact O-CA 3.36Å; C1054-F1058 PolarHBondContact O-N 2.96Å; C1054-R1059 WeakPolarHBondContact CA-O 3.26Å; C1054-R1059 PolarHBondContact SG-O 3.09Å; C1054-F1060 HydrophobicContact CB-CD1 4.18Å; C1054-F1060 HydrophobicContact CB-CE1 3.7Å; C1054-F1060 HydrophobicContact CB-CZ 4.02Å; C1054-F1060 VanDerWaalsContact SG-CD1 3.59Å; C1054-S1064 WeakPolarHBondContact SG-CB 3.5Å
1055	I	72.3	Confident	82.9	Confident	35 Å²	35	37.8 Å²	37.8	18%	0.179	17%	0.165	C	C	.	.	H	α-helix	trans	-85.5	-44.4	-175.3	-55	170	0	0	0	110.2	L1047 A1051 P1052 E1053 L1093	L1047-I1055 HydrophobicContact CD2-CG1 4.29Å; L1047-I1055 HydrophobicContact CD2-CG2 4.43Å; A1051-I1055 PolarHBondContact O-N 2.8Å; P1052-I1055 PolarHBondContact O-N 3.49Å; P1052-I1055 VanDerWaalsContact O-N 3.08Å; E1053-I1055 VanDerWaalsContact C-N 3.35Å; I1055-L1093 HydrophobicContact CB-CD2 4.26Å; I1055-L1093 HydrophobicContact CD1-CD2 3.82Å; I1055-L1093 HydrophobicContact CG2-CD1 3.99Å; I1055-L1093 HydrophobicContact CG2-CD2 4.01Å; I1055-L1093 HydrophobicContact CG2-CG 4.48Å
1056	Y	69.6	Low	84.5	Confident	90 Å²	90	35.3 Å²	35.3	35%	0.353	16%	0.156	S	C	.	.	H	α-helix	trans	-79	-38.3	-178.9	-65.4	-48.6	0	0	0	113.8	P1052 L1093 D1097	P1052-Y1056 HydrophobicContact CB-CD2 4.1Å; P1052-Y1056 HydrophobicContact CB-CE2 4.08Å; P1052-Y1056 VanDerWaalsContact O-CD2 3.28Å; P1052-Y1056 WeakPolarHBondContact O-CD2 3.26Å; P1052-Y1056 PolarHBondContact O-N 2.96Å; Y1056-L1093 HydrophobicContact CE1-CD1 3.98Å; Y1056-L1093 HydrophobicContact CE1-CD2 4.18Å; Y1056-L1093 HydrophobicContact CE2-CD2 4.36Å; Y1056-D1097 VanDerWaalsContact OH-CG 3.26Å; Y1056-D1097 PolarHBondContact OH-OD1 3.01Å; Y1056-D1097 PolarHBondContact OH-OD2 2.99Å
1057	Y	73.4	Confident	85.5	Confident	150 Å²	150	34.2 Å²	34.2	59%	0.588	15%	0.148	S	C	*	.	S	Bend	trans	-120.4	-2.1	-169.2	-48.2	-56	0	0	0	114.2	E1053 R1059	E1053-Y1057 HydrophobicContact CB-CD2 4.07Å; E1053-Y1057 WeakPolarHBondContact O-CA 3.46Å; E1053-Y1057 WeakPolarHBondContact O-CB 3.35Å; E1053-Y1057 PolarHBondContact O-N 3.09Å; E1053-Y1057 VanDerWaalsContact O-N 3.08Å; Y1057-R1059 PolarHBondContact O-N 2.9Å
1058	F	70.4	Confident	86.4	Confident	81 Å²	81	31 Å²	31	36%	0.355	13%	0.132	S	C	.	.			trans	55.1	26.1	-169.8	-60.5	-84.2	0	0	0	113.4	R1038 A1039 W1045 E1053 C1054 F1060	R1038-F1058 WeakPolarHBondContact CA-O 2.74Å; R1038-F1058 HydrophobicContact CG-CB 4.35Å; A1039-F1058 HydrophobicContact CB-CB 4.25Å; A1039-F1058 HydrophobicContact CB-CD1 4.4Å; A1039-F1058 PolarHBondContact N-O 2.94Å; W1045-F1058 AromaticContact NE1-CE1 4Å; E1053-F1058 PolarHBondContact O-N 3.31Å; C1054-F1058 VanDerWaalsContact O-CA 3.31Å; C1054-F1058 WeakPolarHBondContact O-CA 3.36Å; C1054-F1058 PolarHBondContact O-N 2.96Å; F1058-F1060 WeakPolarHBondContact O-CD2 3.31Å; F1058-F1060 WeakPolarHBondContact O-CE2 3.5Å
1059	R	75.7	Confident	86.8	Confident	99 Å²	99	28.7 Å²	28.7	37%	0.374	12%	0.121	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	125.2	179.9	176.8	178.8	167.1	146.6	0.1	110	Y1036 Y1037 E1053 C1054 Y1057 D1061	Y1036-R1059 HydrophobicContact CD2-CG 3.95Å; Y1036-R1059 HydrophobicContact CG-CG 4.03Å; Y1037-R1059 WeakPolarHBondContact O-CA 3.45Å; E1053-R1059 HydrophobicContact CB-CB 4.42Å; E1053-R1059 HydrophobicContact CG-CB 4.33Å; E1053-R1059 HydrophobicContact CG-CG 4.41Å; E1053-R1059 PolarHBondContact O-N 2.81Å; E1053-R1059 VanDerWaalsContact O-N 3.16Å; C1054-R1059 WeakPolarHBondContact CA-O 3.26Å; C1054-R1059 PolarHBondContact SG-O 3.09Å; Y1057-R1059 PolarHBondContact O-N 2.9Å; R1059-D1061 IonicContact CZ-OD2 2.74Å; R1059-D1061 VanDerWaalsContact CZ-OD2 3.25Å; R1059-D1061 IonicContact NE-OD2 3.31Å; R1059-D1061 PolarHBondContact NE-OD2 3.4Å; R1059-D1061 IonicContact NH2-OD2 2.68Å; R1059-D1061 PolarHBondContact NH2-OD2 2.78Å
1060	F	82.9	Confident	87	Confident	2 Å²	2	27.1 Å²	27.1	1%	0.009	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	118.8	176.6	-63.8	-86.8	0	0	0	111.2	V1002 R1004 Y1036 Y1037 A1039 W1045 Y1050 C1054 F1058	V1002-F1060 HydrophobicContact CG1-CB 4.19Å; R1004-F1060 HydrophobicContact CB-CD1 4.14Å; R1004-F1060 HydrophobicContact CB-CE1 4.45Å; R1004-F1060 HydrophobicContact CG-CB 3.98Å; R1004-F1060 HydrophobicContact CG-CD1 3.76Å; R1004-F1060 HydrophobicContact CG-CE1 4.49Å; R1004-F1060 HydrophobicContact CG-CG 3.99Å; Y1036-F1060 CarbonylContact C-O 3.55Å; Y1036-F1060 WeakPolarHBondContact CA-O 3.41Å; Y1037-F1060 HydrophobicContact CD1-CD2 4.14Å; Y1037-F1060 PolarHBondContact N-O 2.82Å; Y1037-F1060 PolarHBondContact O-N 3.15Å; A1039-F1060 HydrophobicContact CB-CE2 4.13Å; W1045-F1060 HydrophobicContact CH2-CZ 4.49Å; W1045-F1060 HydrophobicContact CZ3-CZ 4.23Å; Y1050-F1060 HydrophobicContact CD2-CE1 4.05Å; Y1050-F1060 HydrophobicContact CD2-CZ 4.2Å; Y1050-F1060 HydrophobicContact CE1-CE1 4.18Å; Y1050-F1060 AromaticContact CE2-CE1 3.54Å; Y1050-F1060 HydrophobicContact CE2-CE1 3.54Å; Y1050-F1060 AromaticContact CE2-CZ 3.59Å; Y1050-F1060 HydrophobicContact CE2-CZ 3.59Å; Y1050-F1060 AromaticContact CZ-CE1 3.58Å; C1054-F1060 HydrophobicContact CB-CD1 4.18Å; C1054-F1060 HydrophobicContact CB-CE1 3.7Å; C1054-F1060 HydrophobicContact CB-CZ 4.02Å; C1054-F1060 VanDerWaalsContact SG-CD1 3.59Å; F1058-F1060 WeakPolarHBondContact O-CD2 3.31Å; F1058-F1060 WeakPolarHBondContact O-CE2 3.5Å
1061	D	86.5	Confident	87.5	Confident	11 Å²	11	26.8 Å²	26.8	6%	0.059	11%	0.114	C	C	.	.			trans	-142.7	177.4	175.1	60.9	41.4	0	0	0	111.2	D1035 R1059 K1063 S1064 D1065	D1035-D1061 WeakPolarHBondContact O-CB 3.34Å; R1059-D1061 IonicContact CZ-OD2 2.74Å; R1059-D1061 VanDerWaalsContact CZ-OD2 3.25Å; R1059-D1061 IonicContact NE-OD2 3.31Å; R1059-D1061 PolarHBondContact NE-OD2 3.4Å; R1059-D1061 IonicContact NH2-OD2 2.68Å; R1059-D1061 PolarHBondContact NH2-OD2 2.78Å; D1061-K1063 PolarHBondContact O-N 2.91Å; D1061-K1063 VanDerWaalsContact O-N 3.15Å; D1061-K1063 WeakPolarHBondContact OD1-CA 3.45Å; D1061-K1063 WeakPolarHBondContact OD1-CB 3.42Å; D1061-K1063 PolarHBondContact OD1-N 3.33Å; D1061-S1064 PolarHBondContact N-OG 3.17Å; D1061-S1064 VanDerWaalsContact N-OG 3.09Å; D1061-S1064 WeakPolarHBondContact O-CB 3.45Å; D1061-S1064 PolarHBondContact O-N 3.09Å; D1061-S1064 PolarHBondContact O-OG 3.03Å; D1061-S1064 PolarHBondContact OD1-N 2.93Å; D1061-S1064 VanDerWaalsContact OD1-N 3.11Å; D1061-D1065 PolarHBondContact O-N 3.29Å
1062	S	91.4	Very high	87.8	Confident	15 Å²	15	26.8 Å²	26.8	11%	0.105	11%	0.114	C	C	.	.	H	α-helix	trans	-58.8	-27.4	-179	-48.3	0	0	0	0	113.6	E997 S1064 D1065 V1066	E997-S1062 VanDerWaalsContact OE1-CB 3.32Å; E997-S1062 WeakPolarHBondContact OE1-CB 3.41Å; S1062-S1064 VanDerWaalsContact C-N 3.34Å; S1062-D1065 PolarHBondContact O-N 3.09Å; S1062-V1066 WeakPolarHBondContact O-CG2 3.44Å; S1062-V1066 PolarHBondContact O-N 2.96Å
1063	K	95.7	Very high	88.6	Confident	46 Å²	46	26.7 Å²	26.7	20%	0.2	11%	0.114	C	C	.	.	H	α-helix	trans	-74.8	-25.9	177.3	-61.2	-66.8	-171.1	169.2	0	111.8	D1061 V1066 W1067 G1124 R1127 P1128	D1061-K1063 PolarHBondContact O-N 2.91Å; D1061-K1063 VanDerWaalsContact O-N 3.15Å; D1061-K1063 WeakPolarHBondContact OD1-CA 3.45Å; D1061-K1063 WeakPolarHBondContact OD1-CB 3.42Å; D1061-K1063 PolarHBondContact OD1-N 3.33Å; K1063-V1066 PolarHBondContact O-N 3.1Å; K1063-W1067 PolarHBondContact O-N 2.86Å; K1063-G1124 WeakPolarHBondContact CB-O 3.36Å; K1063-G1124 WeakPolarHBondContact CD-O 3.39Å; K1063-G1124 VanDerWaalsContact CG-O 3.31Å; K1063-G1124 WeakPolarHBondContact CG-O 3.44Å; K1063-R1127 HydrophobicContact CD-CB 4.42Å; K1063-R1127 PolarHBondContact NZ-O 2.9Å; K1063-R1127 WeakPolarHBondContact O-CD 3.43Å; K1063-R1127 PolarHBondContact O-NH1 2.71Å; K1063-P1128 PolarHBondContact NZ-O 2.79Å
1064	S	93.8	Very high	89.3	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.007	11%	0.113	C	C	.	.	H	α-helix	trans	-72.1	-33.5	168	73.6	0	0	0	0	113.3	E1053 C1054 D1061 S1062 W1067 S1068	E1053-S1064 WeakPolarHBondContact OE1-CB 3.45Å; C1054-S1064 WeakPolarHBondContact SG-CB 3.5Å; D1061-S1064 PolarHBondContact N-OG 3.17Å; D1061-S1064 VanDerWaalsContact N-OG 3.09Å; D1061-S1064 WeakPolarHBondContact O-CB 3.45Å; D1061-S1064 PolarHBondContact O-N 3.09Å; D1061-S1064 PolarHBondContact O-OG 3.03Å; D1061-S1064 PolarHBondContact OD1-N 2.93Å; D1061-S1064 VanDerWaalsContact OD1-N 3.11Å; S1062-S1064 VanDerWaalsContact C-N 3.34Å; S1064-W1067 PolarHBondContact O-N 3.35Å; S1064-S1068 PolarHBondContact O-N 3.37Å; S1064-S1068 VanDerWaalsContact O-N 3.17Å; S1064-S1068 PolarHBondContact O-OG 3.27Å
1065	D	96.7	Very high	90	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-69	-33.7	169.9	-73	-35.9	0	0	0	111.5	M993 V1002 H1003 R1004 D1061 S1062 W1067 S1068 Y1069 F1130	M993-D1065 HydrophobicContact CE-CB 3.7Å; V1002-D1065 WeakPolarHBondContact CA-OD2 3.43Å; V1002-D1065 VanDerWaalsContact CG1-OD2 3.31Å; V1002-D1065 WeakPolarHBondContact CG1-OD2 3.49Å; H1003-D1065 WeakPolarHBondContact CB-OD1 3.48Å; H1003-D1065 PolarHBondContact N-OD1 3.28Å; H1003-D1065 PolarHBondContact N-OD2 3.38Å; R1004-D1065 PolarHBondContact N-OD1 2.87Å; D1061-D1065 PolarHBondContact O-N 3.29Å; S1062-D1065 PolarHBondContact O-N 3.09Å; D1065-W1067 VanDerWaalsContact C-N 3.33Å; D1065-W1067 PolarHBondContact O-N 3Å; D1065-S1068 CarbonylContact O-C 3.59Å; D1065-S1068 WeakPolarHBondContact O-CA 3.39Å; D1065-S1068 WeakPolarHBondContact O-CB 3.5Å; D1065-S1068 PolarHBondContact O-N 2.84Å; D1065-S1068 VanDerWaalsContact O-N 3.14Å; D1065-Y1069 WeakPolarHBondContact O-CB 3.4Å; D1065-Y1069 PolarHBondContact O-N 2.88Å; D1065-F1130 HydrophobicContact CB-CE2 3.81Å; D1065-F1130 HydrophobicContact CB-CZ 3.96Å
1066	V	98.4	Very high	91.3	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61	-38.9	173.9	164.2	0	0	0	0	112.1	S1062 K1063 Y1069 G1070 C1119 R1127 P1128 F1130 L1133	S1062-V1066 WeakPolarHBondContact O-CG2 3.44Å; S1062-V1066 PolarHBondContact O-N 2.96Å; K1063-V1066 PolarHBondContact O-N 3.1Å; V1066-Y1069 WeakPolarHBondContact O-CB 3.41Å; V1066-Y1069 PolarHBondContact O-N 2.91Å; V1066-G1070 PolarHBondContact O-N 2.9Å; V1066-G1070 VanDerWaalsContact O-N 3.07Å; V1066-C1119 HydrophobicContact CG1-CB 4.24Å; V1066-C1119 WeakPolarHBondContact O-CB 3.38Å; V1066-R1127 HydrophobicContact CG1-CB 3.91Å; V1066-P1128 HydrophobicContact CG1-CG 4.16Å; V1066-F1130 HydrophobicContact CB-CE2 4.42Å; V1066-F1130 HydrophobicContact CB-CZ 4.31Å; V1066-F1130 HydrophobicContact CG2-CD1 4.25Å; V1066-F1130 HydrophobicContact CG2-CD2 3.68Å; V1066-F1130 HydrophobicContact CG2-CE1 4.05Å; V1066-F1130 HydrophobicContact CG2-CE2 3.46Å; V1066-F1130 VanDerWaalsContact CG2-CE2 3.46Å; V1066-F1130 HydrophobicContact CG2-CG 4.09Å; V1066-F1130 HydrophobicContact CG2-CZ 3.66Å; V1066-L1133 HydrophobicContact CG1-CD1 4.12Å; V1066-L1133 HydrophobicContact CG2-CD1 4.16Å
1067	W	97.5	Very high	92.6	Very high	1 Å²	1	21 Å²	21	0%	0.004	9%	0.088	C	C	.	.	H	α-helix	trans	-62.6	-46.5	171	177	-76.2	0	0	0	111.5	Y1050 A1051 P1052 K1063 S1064 D1065 Y1069 G1070 I1071 L1096 C1119 W1120	Y1050-W1067 PolarHBondContact O-NE1 3.02Å; A1051-W1067 HydrophobicContact CB-CB 3.76Å; A1051-W1067 HydrophobicContact CB-CD2 3.99Å; A1051-W1067 HydrophobicContact CB-CE3 4.45Å; A1051-W1067 HydrophobicContact CB-CG 3.67Å; P1052-W1067 HydrophobicContact CG-CH2 3.94Å; P1052-W1067 HydrophobicContact CG-CZ2 4.41Å; P1052-W1067 HydrophobicContact CG-CZ3 4.15Å; K1063-W1067 PolarHBondContact O-N 2.86Å; S1064-W1067 PolarHBondContact O-N 3.35Å; D1065-W1067 VanDerWaalsContact C-N 3.33Å; D1065-W1067 PolarHBondContact O-N 3Å; W1067-Y1069 PolarHBondContact O-N 3.28Å; W1067-G1070 WeakPolarHBondContact O-CA 3.32Å; W1067-G1070 PolarHBondContact O-N 2.96Å; W1067-I1071 PolarHBondContact O-N 3.28Å; W1067-I1071 VanDerWaalsContact O-N 3.09Å; W1067-L1096 HydrophobicContact CH2-CD1 4.09Å; W1067-L1096 HydrophobicContact CH2-CD2 3.86Å; W1067-L1096 HydrophobicContact CH2-CG 4.47Å; W1067-L1096 HydrophobicContact CZ2-CD1 3.65Å; W1067-L1096 HydrophobicContact CZ2-CD2 3.82Å; W1067-L1096 HydrophobicContact CZ2-CG 4.35Å; W1067-C1119 WeakPolarHBondContact CA-O 3.41Å; W1067-W1120 AromaticContact CD2-CD1 3.93Å; W1067-W1120 HydrophobicContact CE3-CB 4.23Å; W1067-W1120 HydrophobicContact CH2-CB 4.32Å; W1067-W1120 HydrophobicContact CZ3-CB 4.04Å; W1067-W1120 WeakPolarHBondContact CZ3-O 3.49Å
1068	S	97.6	Very high	93.8	Very high	3 Å²	3	14.7 Å²	14.7	2%	0.021	7%	0.066	C	C	.	.	H	α-helix	trans	-59.4	-35.7	177.1	-52.3	0	0	0	0	111.9	W1049 S1064 D1065 I1071 T1072	W1049-S1068 WeakPolarHBondContact O-CA 3.49Å; W1049-S1068 PolarHBondContact O-OG 2.68Å; W1049-S1068 VanDerWaalsContact O-OG 3.09Å; S1064-S1068 PolarHBondContact O-N 3.37Å; S1064-S1068 VanDerWaalsContact O-N 3.17Å; S1064-S1068 PolarHBondContact O-OG 3.27Å; D1065-S1068 CarbonylContact O-C 3.59Å; D1065-S1068 WeakPolarHBondContact O-CA 3.39Å; D1065-S1068 WeakPolarHBondContact O-CB 3.5Å; D1065-S1068 PolarHBondContact O-N 2.84Å; D1065-S1068 VanDerWaalsContact O-N 3.14Å; S1068-I1071 PolarHBondContact O-N 3.28Å; S1068-T1072 WeakPolarHBondContact O-CB 3.4Å; S1068-T1072 PolarHBondContact O-N 3.47Å; S1068-T1072 PolarHBondContact O-OG1 2.94Å
1069	Y	98.6	Very high	95	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-66.6	-38.7	172.4	179.9	-99.4	0	0	0	112.4	M986 V989 A990 L1006 D1065 V1066 W1067 I1071 T1072 L1073 F1130 L1133 I1137	M986-Y1069 HydrophobicContact CE-CD2 3.99Å; M986-Y1069 HydrophobicContact CE-CE2 3.41Å; M986-Y1069 VanDerWaalsContact CE-CE2 3.41Å; M986-Y1069 PolarHBondContact O-OH 3.42Å; V989-Y1069 HydrophobicContact CB-CE2 4.09Å; V989-Y1069 HydrophobicContact CG1-CD2 3.91Å; V989-Y1069 HydrophobicContact CG1-CE2 3.76Å; A990-Y1069 HydrophobicContact CB-CE2 4.2Å; L1006-Y1069 HydrophobicContact CD2-CD2 4.27Å; D1065-Y1069 WeakPolarHBondContact O-CB 3.4Å; D1065-Y1069 PolarHBondContact O-N 2.88Å; V1066-Y1069 WeakPolarHBondContact O-CB 3.41Å; V1066-Y1069 PolarHBondContact O-N 2.91Å; W1067-Y1069 PolarHBondContact O-N 3.28Å; Y1069-I1071 PolarHBondContact O-N 3.26Å; Y1069-T1072 CarbonylContact O-C 3.26Å; Y1069-T1072 WeakPolarHBondContact O-CB 3.34Å; Y1069-T1072 PolarHBondContact O-N 2.79Å; Y1069-L1073 HydrophobicContact CD1-CD1 4Å; Y1069-L1073 HydrophobicContact CD1-CG 4.27Å; Y1069-L1073 HydrophobicContact CE1-CD1 3.54Å; Y1069-L1073 HydrophobicContact CE1-CD2 4.33Å; Y1069-L1073 HydrophobicContact CE1-CG 3.82Å; Y1069-L1073 PolarHBondContact O-N 3.29Å; Y1069-F1130 HydrophobicContact CD1-CE1 4.31Å; Y1069-F1130 HydrophobicContact CD2-CE1 4.09Å; Y1069-F1130 AromaticContact CG-CE1 3.77Å; Y1069-F1130 HydrophobicContact CG-CE1 3.77Å; Y1069-L1133 HydrophobicContact CD1-CD1 3.75Å; Y1069-L1133 HydrophobicContact CE1-CD1 4.03Å; Y1069-L1133 HydrophobicContact CE1-CD2 4.49Å; Y1069-I1137 HydrophobicContact CE1-CD1 4.08Å; Y1069-I1137 WeakPolarHBondContact OH-CD1 3.32Å
1070	G	98.6	Very high	96	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-59.1	-43.2	170.9	0	0	0	0	0	112.7	V1066 W1067 L1073 W1074 W1120	V1066-G1070 PolarHBondContact O-N 2.9Å; V1066-G1070 VanDerWaalsContact O-N 3.07Å; W1067-G1070 WeakPolarHBondContact O-CA 3.32Å; W1067-G1070 PolarHBondContact O-N 2.96Å; G1070-L1073 WeakPolarHBondContact O-CB 3.2Å; G1070-L1073 PolarHBondContact O-N 2.85Å; G1070-W1074 PolarHBondContact O-N 3.12Å; G1070-W1074 VanDerWaalsContact O-N 3.08Å; G1070-W1120 VanDerWaalsContact C-NE1 3.32Å; G1070-W1120 VanDerWaalsContact O-CZ2 3.27Å; G1070-W1120 WeakPolarHBondContact O-CZ2 3.4Å
1071	I	98.1	Very high	96.6	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-66.2	-38.4	173.8	-55.3	-65.4	0	0	0	111.1	W1049 W1067 S1068 Y1069 W1074 E1075 P1083 Y1084 L1102 W1120	W1049-I1071 VanDerWaalsContact CD1-CG2 3.47Å; W1049-I1071 HydrophobicContact CD2-CG2 4.49Å; W1049-I1071 HydrophobicContact CG-CG2 4.02Å; W1067-I1071 PolarHBondContact O-N 3.28Å; W1067-I1071 VanDerWaalsContact O-N 3.09Å; S1068-I1071 PolarHBondContact O-N 3.28Å; Y1069-I1071 PolarHBondContact O-N 3.26Å; I1071-W1074 WeakPolarHBondContact O-CB 3.47Å; I1071-W1074 PolarHBondContact O-N 3.3Å; I1071-W1074 VanDerWaalsContact O-N 3.13Å; I1071-E1075 PolarHBondContact O-N 3.07Å; I1071-P1083 HydrophobicContact CG2-CB 4.01Å; I1071-P1083 HydrophobicContact CG2-CG 3.89Å; I1071-Y1084 HydrophobicContact CD1-CE2 3.91Å; I1071-Y1084 WeakPolarHBondContact CD1-OH 3.35Å; I1071-L1102 HydrophobicContact CD1-CD1 3.93Å; I1071-W1120 HydrophobicContact CD1-CZ2 3.87Å; I1071-W1120 VanDerWaalsContact CD1-NE1 3.32Å
1072	T	98.5	Very high	96.9	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-64.2	-39.4	175.9	-55.7	0	0	0	0	112	M986 L1006 A1007 A1008 V1011 S1068 Y1069 W1074 E1075 V1076	M986-T1072 HydrophobicContact CE-CG2 3.74Å; M986-T1072 HydrophobicContact SD-CG2 4.31Å; L1006-T1072 PolarHBondContact O-OG1 2.8Å; A1007-T1072 VanDerWaalsContact CA-OG1 3.3Å; A1007-T1072 WeakPolarHBondContact CA-OG1 3.47Å; A1008-T1072 HydrophobicContact CB-CG2 4.2Å; V1011-T1072 HydrophobicContact CG2-CG2 4.18Å; S1068-T1072 WeakPolarHBondContact O-CB 3.4Å; S1068-T1072 PolarHBondContact O-N 3.47Å; S1068-T1072 PolarHBondContact O-OG1 2.94Å; Y1069-T1072 CarbonylContact O-C 3.26Å; Y1069-T1072 WeakPolarHBondContact O-CB 3.34Å; Y1069-T1072 PolarHBondContact O-N 2.79Å; T1072-W1074 VanDerWaalsContact C-N 3.34Å; T1072-E1075 PolarHBondContact O-N 3.36Å; T1072-V1076 WeakPolarHBondContact O-CG2 3.31Å; T1072-V1076 PolarHBondContact O-N 3.07Å
1073	L	98.6	Very high	97.1	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.005	8%	0.078	C	C	.	.	H	α-helix	trans	-58.4	-47.1	169.6	-78.9	172.1	0	0	0	110.2	M986 Y1069 G1070 E1075 V1076 Y1077 I1112 I1115 M1116	M986-L1073 HydrophobicContact CB-CD2 3.77Å; M986-L1073 HydrophobicContact CE-CD2 3.69Å; M986-L1073 HydrophobicContact CE-CG 3.86Å; M986-L1073 HydrophobicContact CG-CD2 3.89Å; Y1069-L1073 HydrophobicContact CD1-CD1 4Å; Y1069-L1073 HydrophobicContact CD1-CG 4.27Å; Y1069-L1073 HydrophobicContact CE1-CD1 3.54Å; Y1069-L1073 HydrophobicContact CE1-CD2 4.33Å; Y1069-L1073 HydrophobicContact CE1-CG 3.82Å; Y1069-L1073 PolarHBondContact O-N 3.29Å; G1070-L1073 WeakPolarHBondContact O-CB 3.2Å; G1070-L1073 PolarHBondContact O-N 2.85Å; L1073-E1075 PolarHBondContact O-N 3.45Å; L1073-V1076 PolarHBondContact O-N 3.5Å; L1073-V1076 VanDerWaalsContact O-N 3.16Å; L1073-Y1077 HydrophobicContact CD2-CD2 4.43Å; L1073-Y1077 HydrophobicContact CD2-CE2 3.86Å; L1073-Y1077 VanDerWaalsContact O-CD2 3.29Å; L1073-Y1077 WeakPolarHBondContact O-CD2 3.18Å; L1073-Y1077 PolarHBondContact O-N 2.93Å; L1073-I1112 HydrophobicContact CD2-CG2 4.38Å; L1073-I1115 HydrophobicContact CD1-CG2 3.91Å; L1073-M1116 HydrophobicContact CB-CE 3.95Å; L1073-M1116 HydrophobicContact CB-CG 3.91Å; L1073-M1116 HydrophobicContact CD1-CG 4.17Å
1074	W	98.4	Very high	96.9	Very high	21 Å²	21	16 Å²	16	8%	0.08	7%	0.07	C	C	.	.	H	α-helix	trans	-61.3	-43.7	178.9	-170.4	95.3	0	0	0	112.6	G1070 I1071 T1072 V1076 S1078 E1081 P1083 L1102 S1103 P1105 M1116 W1120	G1070-W1074 PolarHBondContact O-N 3.12Å; G1070-W1074 VanDerWaalsContact O-N 3.08Å; I1071-W1074 WeakPolarHBondContact O-CB 3.47Å; I1071-W1074 PolarHBondContact O-N 3.3Å; I1071-W1074 VanDerWaalsContact O-N 3.13Å; T1072-W1074 VanDerWaalsContact C-N 3.34Å; W1074-V1076 VanDerWaalsContact C-N 3.3Å; W1074-V1076 PolarHBondContact O-N 3.45Å; W1074-S1078 WeakPolarHBondContact O-CB 3.4Å; W1074-S1078 PolarHBondContact O-N 3.26Å; W1074-S1078 PolarHBondContact O-OG 3.34Å; W1074-E1081 HydrophobicContact CH2-CB 3.96Å; W1074-E1081 HydrophobicContact CZ3-CB 3.97Å; W1074-P1083 HydrophobicContact CE3-CB 4.02Å; W1074-P1083 HydrophobicContact CZ3-CB 4.17Å; W1074-L1102 HydrophobicContact CB-CD1 4.33Å; W1074-L1102 HydrophobicContact CD2-CD1 3.89Å; W1074-L1102 HydrophobicContact CE3-CD1 4.35Å; W1074-L1102 HydrophobicContact CG-CB 4.31Å; W1074-L1102 HydrophobicContact CG-CD1 3.85Å; W1074-S1103 PolarHBondContact NE1-O 3.22Å; W1074-P1105 HydrophobicContact CD2-CG 4.49Å; W1074-P1105 HydrophobicContact CG-CG 4.21Å; W1074-M1116 HydrophobicContact CB-SD 4.11Å; W1074-W1120 HydrophobicContact CB-CH2 4.02Å; W1074-W1120 HydrophobicContact CB-CZ2 3.96Å; W1074-W1120 AromaticContact CD1-CH2 3.91Å; W1074-W1120 HydrophobicContact CG-CH2 4.24Å
1075	E	98.2	Very high	96.4	Very high	6 Å²	6	23.5 Å²	23.5	3%	0.028	10%	0.098	C	C	.	.	H	α-helix	trans	-57.1	-41.5	172.9	-78.3	-174.7	97.5	0	0	112.1	N968 A1008 W1049 I1071 T1072 L1073 S1078 Y1079 G1080 P1083	N968-E1075 PolarHBondContact ND2-OE1 3.3Å; A1008-E1075 HydrophobicContact CB-CB 3.61Å; A1008-E1075 VanDerWaalsContact CB-CD 3.45Å; A1008-E1075 HydrophobicContact CB-CG 4.18Å; A1008-E1075 WeakPolarHBondContact CB-OE2 3.37Å; A1008-E1075 PolarHBondContact N-OE2 3Å; W1049-E1075 PolarHBondContact NE1-OE2 3.44Å; I1071-E1075 PolarHBondContact O-N 3.07Å; T1072-E1075 PolarHBondContact O-N 3.36Å; L1073-E1075 PolarHBondContact O-N 3.45Å; E1075-S1078 WeakPolarHBondContact CA-OG 3.46Å; E1075-S1078 PolarHBondContact O-OG 2.91Å; E1075-S1078 VanDerWaalsContact O-OG 3.06Å; E1075-Y1079 PolarHBondContact O-N 3.5Å; E1075-G1080 WeakPolarHBondContact O-CA 3.47Å; E1075-G1080 PolarHBondContact O-N 2.95Å; E1075-P1083 HydrophobicContact CG-CG 4.36Å
1076	V	98.3	Very high	95.8	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-74.4	-43	-175.7	165.7	0	0	0	0	112	I967 L971 L982 M986 A1008 T1072 L1073 W1074 S1078 Y1079	I967-V1076 HydrophobicContact CD1-CG1 4.29Å; I967-V1076 HydrophobicContact CD1-CG2 3.99Å; I967-V1076 HydrophobicContact CG1-CG2 4.39Å; I967-V1076 HydrophobicContact CG2-CG2 3.95Å; L971-V1076 HydrophobicContact CD1-CB 4.41Å; L971-V1076 HydrophobicContact CD1-CG1 4.02Å; L971-V1076 HydrophobicContact CD1-CG2 4.48Å; L971-V1076 WeakPolarHBondContact CD1-O 3.44Å; L982-V1076 HydrophobicContact CB-CG1 4.05Å; L982-V1076 HydrophobicContact CD1-CG1 4.47Å; L982-V1076 HydrophobicContact CD2-CG1 4.02Å; L982-V1076 HydrophobicContact CG-CG1 4.4Å; M986-V1076 HydrophobicContact CG-CB 4.25Å; M986-V1076 HydrophobicContact CG-CG1 3.83Å; M986-V1076 HydrophobicContact CG-CG2 4.42Å; M986-V1076 HydrophobicContact SD-CB 4.2Å; M986-V1076 HydrophobicContact SD-CG1 4.29Å; M986-V1076 HydrophobicContact SD-CG2 3.78Å; A1008-V1076 HydrophobicContact CB-CG2 4.18Å; T1072-V1076 WeakPolarHBondContact O-CG2 3.31Å; T1072-V1076 PolarHBondContact O-N 3.07Å; L1073-V1076 PolarHBondContact O-N 3.5Å; L1073-V1076 VanDerWaalsContact O-N 3.16Å; W1074-V1076 VanDerWaalsContact C-N 3.3Å; W1074-V1076 PolarHBondContact O-N 3.45Å; V1076-S1078 VanDerWaalsContact C-N 3.31Å; V1076-S1078 PolarHBondContact O-N 2.92Å; V1076-Y1079 PolarHBondContact O-N 3.3Å
1077	Y	98.1	Very high	95.1	Very high	3 Å²	3	32.8 Å²	32.8	1%	0.012	15%	0.147	C	C	.	.	H	α-helix	trans	-80.4	-11.6	-180	-72.7	-105.7	0	0	0	113.6	V979 L982 T983 M986 L1073 Y1079 P1105 C1108 I1112 M1116	V979-Y1077 HydrophobicContact CG1-CD1 4.49Å; V979-Y1077 HydrophobicContact CG1-CE1 3.95Å; L982-Y1077 HydrophobicContact CB-CE1 4.31Å; L982-Y1077 HydrophobicContact CB-CE2 4.35Å; L982-Y1077 HydrophobicContact CD1-CD1 4.36Å; L982-Y1077 HydrophobicContact CD1-CG 4.49Å; T983-Y1077 VanDerWaalsContact CA-OH 3.23Å; T983-Y1077 WeakPolarHBondContact CA-OH 3.19Å; T983-Y1077 WeakPolarHBondContact CB-OH 3.41Å; T983-Y1077 PolarHBondContact N-OH 3.48Å; T983-Y1077 PolarHBondContact OG1-OH 2.89Å; M986-Y1077 HydrophobicContact CG-CE2 4.38Å; L1073-Y1077 HydrophobicContact CD2-CD2 4.43Å; L1073-Y1077 HydrophobicContact CD2-CE2 3.86Å; L1073-Y1077 VanDerWaalsContact O-CD2 3.29Å; L1073-Y1077 WeakPolarHBondContact O-CD2 3.18Å; L1073-Y1077 PolarHBondContact O-N 2.93Å; Y1077-Y1079 VanDerWaalsContact C-N 3.34Å; Y1077-P1105 WeakPolarHBondContact O-CB 3.44Å; Y1077-C1108 HydrophobicContact CD1-CB 4.17Å; Y1077-C1108 HydrophobicContact CG-CB 4.4Å; Y1077-I1112 HydrophobicContact CD1-CG2 4.48Å; Y1077-I1112 HydrophobicContact CD2-CG2 4.29Å; Y1077-I1112 HydrophobicContact CE1-CB 4.37Å; Y1077-I1112 HydrophobicContact CE1-CG1 4.12Å; Y1077-I1112 HydrophobicContact CE1-CG2 4Å; Y1077-I1112 HydrophobicContact CE2-CG2 3.82Å; Y1077-M1116 HydrophobicContact CD2-CE 4.24Å; Y1077-M1116 HydrophobicContact CG-CE 4.28Å
1078	S	97.1	Very high	94.1	Very high	18 Å²	18	38.6 Å²	38.6	13%	0.126	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	6.1	161.8	61.9	0	0	0	0	113.4	W1074 E1075 V1076 G1080 E1081	W1074-S1078 WeakPolarHBondContact O-CB 3.4Å; W1074-S1078 PolarHBondContact O-N 3.26Å; W1074-S1078 PolarHBondContact O-OG 3.34Å; E1075-S1078 WeakPolarHBondContact CA-OG 3.46Å; E1075-S1078 PolarHBondContact O-OG 2.91Å; E1075-S1078 VanDerWaalsContact O-OG 3.06Å; V1076-S1078 VanDerWaalsContact C-N 3.31Å; V1076-S1078 PolarHBondContact O-N 2.92Å; S1078-G1080 PolarHBondContact O-N 2.84Å; S1078-E1081 PolarHBondContact OG-N 2.77Å
1079	Y	97.1	Very high	92.8	Very high	29 Å²	29	39.9 Å²	39.9	11%	0.114	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	29	179	-65	-112.9	0	0	0	113.9	L971 K972 V977 L982 E1075 V1076 Y1077 R1107	L971-Y1079 CarbonylContact C-O 3.57Å; L971-Y1079 HydrophobicContact CB-CD1 4.37Å; L971-Y1079 HydrophobicContact CD2-CD1 4.49Å; K972-Y1079 WeakPolarHBondContact CG-O 3.46Å; K972-Y1079 PolarHBondContact N-O 2.92Å; V977-Y1079 WeakPolarHBondContact O-CE1 3.48Å; V977-Y1079 PolarHBondContact O-OH 2.97Å; V977-Y1079 VanDerWaalsContact O-OH 3.06Å; L982-Y1079 HydrophobicContact CD1-CE1 4.34Å; L982-Y1079 HydrophobicContact CD1-CE2 3.85Å; E1075-Y1079 PolarHBondContact O-N 3.5Å; V1076-Y1079 PolarHBondContact O-N 3.3Å; Y1077-Y1079 VanDerWaalsContact C-N 3.34Å; Y1079-R1107 HydrophobicContact CE2-CB 4.11Å; Y1079-R1107 VanDerWaalsContact CE2-CD 3.43Å; Y1079-R1107 HydrophobicContact CE2-CG 4.4Å; Y1079-R1107 VanDerWaalsContact CZ-NH1 3.29Å; Y1079-R1107 PolarHBondContact OH-NH1 3.03Å
1080	G	96.2	Very high	91.5	Very high	4 Å²	4	43.6 Å²	43.6	4%	0.041	22%	0.216	C	C	.	.	S	Bend	trans	102.6	19.2	173.7	0	0	0	0	0	115.3	K972 E1075 S1078	K972-G1080 WeakPolarHBondContact CE-O 3.44Å; K972-G1080 PolarHBondContact NZ-O 3.3Å; E1075-G1080 WeakPolarHBondContact O-CA 3.47Å; E1075-G1080 PolarHBondContact O-N 2.95Å; S1078-G1080 PolarHBondContact O-N 2.84Å
1081	E	95.7	Very high	90.8	Very high	91 Å²	91	48.6 Å²	48.6	43%	0.425	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-63.6	155	172	-67.2	-161.2	127.1	0	0	112.3	W1074 S1078 R1085	W1074-E1081 HydrophobicContact CH2-CB 3.96Å; W1074-E1081 HydrophobicContact CZ3-CB 3.97Å; S1078-E1081 PolarHBondContact OG-N 2.77Å; E1081-R1085 IonicContact OE1-NH1 2.87Å; E1081-R1085 PolarHBondContact OE1-NH1 2.88Å
1082	R	92.9	Very high	89.9	Confident	147 Å²	147	49 Å²	49	56%	0.555	24%	0.241	S	C	*	.	P	Polyproline II helix	trans	-80.2	121.4	176.8	-78	179.5	140.6	133.1	1.2	109	E730 R1085	E730-R1082 IonicContact OE2-CZ 3.08Å; E730-R1082 IonicContact OE2-NH1 2.7Å; E730-R1082 IonicContact OE2-NH2 3.67Å; E730-R1082 PolarHBondContact OE2-NH2 3.16Å; R1082-R1085 PolarHBondContact O-N 2.98Å
1083	P	94.3	Very high	88.8	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.006	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	148.1	178.5	26.6	-34.2	0	0	0	110.8	K1048 W1049 I1071 W1074 E1075 R1085 L1102	K1048-P1083 WeakPolarHBondContact CD-O 3.41Å; K1048-P1083 PolarHBondContact NZ-O 2.93Å; W1049-P1083 HydrophobicContact CH2-CG 4.22Å; W1049-P1083 HydrophobicContact CZ2-CG 3.81Å; I1071-P1083 HydrophobicContact CG2-CB 4.01Å; I1071-P1083 HydrophobicContact CG2-CG 3.89Å; W1074-P1083 HydrophobicContact CE3-CB 4.02Å; W1074-P1083 HydrophobicContact CZ3-CB 4.17Å; E1075-P1083 HydrophobicContact CG-CG 4.36Å; P1083-R1085 PolarHBondContact O-N 3.25Å; P1083-R1085 VanDerWaalsContact O-N 3.13Å; P1083-L1102 HydrophobicContact CB-CD1 3.97Å
1084	Y	91.8	Very high	87.9	Confident	9 Å²	9	52.6 Å²	52.6	4%	0.035	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	39	-178	-47.1	-83	0	0	0	112.8	K1048 I1071 D1086 M1087 I1092 M1095 L1102	K1048-Y1084 HydrophobicContact CB-CD2 4.21Å; K1048-Y1084 HydrophobicContact CG-CD2 4.32Å; K1048-Y1084 PolarHBondContact NZ-O 2.88Å; K1048-Y1084 WeakPolarHBondContact O-CE2 3.08Å; I1071-Y1084 HydrophobicContact CD1-CE2 3.91Å; I1071-Y1084 WeakPolarHBondContact CD1-OH 3.35Å; Y1084-D1086 VanDerWaalsContact C-N 3.28Å; Y1084-D1086 PolarHBondContact O-N 2.99Å; Y1084-M1087 HydrophobicContact CD1-SD 4.06Å; Y1084-M1087 PolarHBondContact O-N 2.87Å; Y1084-I1092 HydrophobicContact CD1-CD1 4.38Å; Y1084-I1092 HydrophobicContact CD1-CG1 4.03Å; Y1084-I1092 HydrophobicContact CD1-CG2 4.13Å; Y1084-I1092 HydrophobicContact CD2-CD1 3.99Å; Y1084-I1092 HydrophobicContact CD2-CG1 4.5Å; Y1084-I1092 HydrophobicContact CD2-CG2 4.47Å; Y1084-I1092 HydrophobicContact CE1-CG2 4.02Å; Y1084-I1092 HydrophobicContact CE2-CG2 4.37Å; Y1084-I1092 HydrophobicContact CG-CD1 3.75Å; Y1084-I1092 HydrophobicContact CG-CG1 3.9Å; Y1084-I1092 HydrophobicContact CG-CG2 4.37Å; Y1084-M1095 HydrophobicContact CD1-CE 4.2Å; Y1084-M1095 HydrophobicContact CE1-CE 3.66Å; Y1084-L1102 HydrophobicContact CD1-CD2 3.56Å; Y1084-L1102 HydrophobicContact CD1-CG 4.06Å; Y1084-L1102 HydrophobicContact CD2-CD1 4.42Å; Y1084-L1102 HydrophobicContact CD2-CD2 4.41Å; Y1084-L1102 HydrophobicContact CE1-CD1 4.16Å; Y1084-L1102 HydrophobicContact CE1-CD2 3.63Å; Y1084-L1102 HydrophobicContact CE1-CG 3.58Å; Y1084-L1102 HydrophobicContact CE2-CD1 3.92Å; Y1084-L1102 HydrophobicContact CE2-CD2 4.48Å; Y1084-L1102 HydrophobicContact CE2-CG 4.26Å; Y1084-L1102 HydrophobicContact CG-CD2 3.96Å
1085	R	83.7	Confident	87.5	Confident	158 Å²	158	53.1 Å²	53.1	60%	0.596	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-30.5	-58.8	-158.9	-166.6	-175.8	-165.4	131.5	-4.9	113.8	K1048 E1081 R1082 P1083	K1048-R1085 PolarHBondContact NZ-O 3.48Å; E1081-R1085 IonicContact OE1-NH1 2.87Å; E1081-R1085 PolarHBondContact OE1-NH1 2.88Å; R1082-R1085 PolarHBondContact O-N 2.98Å; P1083-R1085 PolarHBondContact O-N 3.25Å; P1083-R1085 VanDerWaalsContact O-N 3.13Å
1086	D	83.9	Confident	86.8	Confident	141 Å²	141	53 Å²	53	75%	0.754	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	7.2	-169.6	-40.3	-65.8	0	0	0	114.1	Y1084	Y1084-D1086 VanDerWaalsContact C-N 3.28Å; Y1084-D1086 PolarHBondContact O-N 2.99Å
1087	M	83.1	Confident	85.9	Confident	56 Å²	56	56.9 Å²	56.9	28%	0.276	29%	0.291	S	S	.	.			trans	-94.9	137.7	-179.3	-54.6	173.3	72	0	0	112.8	K1048 Y1084 Q1091 I1092 M1095	K1048-M1087 WeakPolarHBondContact CE-O 3.35Å; Y1084-M1087 HydrophobicContact CD1-SD 4.06Å; Y1084-M1087 PolarHBondContact O-N 2.87Å; M1087-Q1091 HydrophobicContact CB-CB 4.32Å; M1087-Q1091 HydrophobicContact CE-CB 4.1Å; M1087-Q1091 WeakPolarHBondContact CE-O 3.46Å; M1087-I1092 HydrophobicContact CB-CD1 4.26Å; M1087-I1092 HydrophobicContact CB-CG1 3.73Å; M1087-I1092 HydrophobicContact CE-CG1 4.23Å; M1087-I1092 HydrophobicContact SD-CG1 4.4Å; M1087-M1095 HydrophobicContact CE-CB 3.97Å; M1087-M1095 HydrophobicContact CE-CG 4.4Å; M1087-M1095 HydrophobicContact CE-SD 3.82Å; M1087-M1095 HydrophobicContact SD-SD 4.19Å
1088	K	77.2	Confident	85.4	Confident	123 Å²	123	63.4 Å²	63.4	54%	0.535	32%	0.321	S	S	.	.			trans	-81.7	162.5	169	-65.4	-171	174.1	-169.5	0	112.1	D725 A1090 Q1091 I1092	D725-K1088 WeakPolarHBondContact OD2-CD 3.42Å; D725-K1088 WeakPolarHBondContact OD2-CE 3.45Å; D725-K1088 IonicContact OD2-NZ 3.82Å; D725-K1088 PolarHBondContact OD2-NZ 2.92Å; K1088-A1090 PolarHBondContact O-N 2.83Å; K1088-Q1091 WeakPolarHBondContact O-CB 3.39Å; K1088-Q1091 PolarHBondContact O-N 2.78Å; K1088-I1092 WeakPolarHBondContact O-CG1 3.34Å; K1088-I1092 PolarHBondContact O-N 2.81Å
1089	G	69.5	Low	84.7	Confident	29 Å²	29	65 Å²	65	30%	0.299	34%	0.341	S	S	.	.	H	α-helix	trans	-50.9	-46.6	-177	0	0	0	0	0	114.6	Q1091 I1092 L1093	G1089-Q1091 VanDerWaalsContact C-N 3.35Å; G1089-Q1091 PolarHBondContact O-N 2.86Å; G1089-I1092 PolarHBondContact O-N 2.68Å; G1089-L1093 WeakPolarHBondContact O-CG 3.46Å; G1089-L1093 PolarHBondContact O-N 2.93Å
1090	A	71.6	Confident	84.4	Confident	78 Å²	78	68.1 Å²	68.1	65%	0.645	36%	0.359	S	S	*	.	H	α-helix	trans	-64.4	-34.6	178.1	0	0	0	0	0	113.7	K1088 A1094	K1088-A1090 PolarHBondContact O-N 2.83Å; A1090-A1094 WeakPolarHBondContact O-CB 3.14Å; A1090-A1094 PolarHBondContact O-N 2.94Å
1091	Q	84	Confident	84.3	Confident	105 Å²	105	70.3 Å²	70.3	49%	0.491	37%	0.366	S	S	.	.	H	α-helix	trans	-71.3	-35	175.5	-65.7	167.8	-48.7	0	0	111.4	M1087 K1088 G1089 M1095	M1087-Q1091 HydrophobicContact CB-CB 4.32Å; M1087-Q1091 HydrophobicContact CE-CB 4.1Å; M1087-Q1091 WeakPolarHBondContact CE-O 3.46Å; K1088-Q1091 WeakPolarHBondContact O-CB 3.39Å; K1088-Q1091 PolarHBondContact O-N 2.78Å; G1089-Q1091 VanDerWaalsContact C-N 3.35Å; G1089-Q1091 PolarHBondContact O-N 2.86Å; Q1091-M1095 WeakPolarHBondContact O-CB 3.17Å; Q1091-M1095 PolarHBondContact O-N 2.92Å; Q1091-M1095 VanDerWaalsContact O-N 3.08Å
1092	I	79.2	Confident	84.2	Confident	9 Å²	9	66.7 Å²	66.7	5%	0.046	35%	0.35	C	S	.	.	H	α-helix	trans	-66.6	-47.9	175.1	-63.4	169	0	0	0	109.8	K1048 Y1084 M1087 K1088 G1089 A1094 M1095 L1096	K1048-I1092 HydrophobicContact CD-CD1 4.43Å; K1048-I1092 HydrophobicContact CG-CD1 3.79Å; Y1084-I1092 HydrophobicContact CD1-CD1 4.38Å; Y1084-I1092 HydrophobicContact CD1-CG1 4.03Å; Y1084-I1092 HydrophobicContact CD1-CG2 4.13Å; Y1084-I1092 HydrophobicContact CD2-CD1 3.99Å; Y1084-I1092 HydrophobicContact CD2-CG1 4.5Å; Y1084-I1092 HydrophobicContact CD2-CG2 4.47Å; Y1084-I1092 HydrophobicContact CE1-CG2 4.02Å; Y1084-I1092 HydrophobicContact CE2-CG2 4.37Å; Y1084-I1092 HydrophobicContact CG-CD1 3.75Å; Y1084-I1092 HydrophobicContact CG-CG1 3.9Å; Y1084-I1092 HydrophobicContact CG-CG2 4.37Å; M1087-I1092 HydrophobicContact CB-CD1 4.26Å; M1087-I1092 HydrophobicContact CB-CG1 3.73Å; M1087-I1092 HydrophobicContact CE-CG1 4.23Å; M1087-I1092 HydrophobicContact SD-CG1 4.4Å; K1088-I1092 WeakPolarHBondContact O-CG1 3.34Å; K1088-I1092 PolarHBondContact O-N 2.81Å; G1089-I1092 PolarHBondContact O-N 2.68Å; I1092-A1094 PolarHBondContact O-N 3.44Å; I1092-M1095 WeakPolarHBondContact O-CB 3.48Å; I1092-M1095 PolarHBondContact O-N 2.72Å; I1092-L1096 HydrophobicContact CG2-CD1 3.88Å; I1092-L1096 HydrophobicContact CG2-CG 4.21Å; I1092-L1096 VanDerWaalsContact O-CG 3.28Å; I1092-L1096 WeakPolarHBondContact O-CG 3.37Å; I1092-L1096 PolarHBondContact O-N 2.95Å
1093	L	75.6	Confident	84.4	Confident	31 Å²	31	64 Å²	64	16%	0.162	35%	0.353	C	S	.	.	H	α-helix	trans	-56.2	-53	176	-70.4	176.3	0	0	0	111.6	I1055 Y1056 G1089 M1095 L1096 D1097	I1055-L1093 HydrophobicContact CB-CD2 4.26Å; I1055-L1093 HydrophobicContact CD1-CD2 3.82Å; I1055-L1093 HydrophobicContact CG2-CD1 3.99Å; I1055-L1093 HydrophobicContact CG2-CD2 4.01Å; I1055-L1093 HydrophobicContact CG2-CG 4.48Å; Y1056-L1093 HydrophobicContact CE1-CD1 3.98Å; Y1056-L1093 HydrophobicContact CE1-CD2 4.18Å; Y1056-L1093 HydrophobicContact CE2-CD2 4.36Å; G1089-L1093 WeakPolarHBondContact O-CG 3.46Å; G1089-L1093 PolarHBondContact O-N 2.93Å; L1093-M1095 PolarHBondContact O-N 2.74Å; L1093-M1095 VanDerWaalsContact O-N 3.16Å; L1093-L1096 PolarHBondContact O-N 3.39Å; L1093-D1097 PolarHBondContact O-N 2.94Å
1094	A	80.7	Confident	84.5	Confident	46 Å²	46	68.8 Å²	68.8	38%	0.38	37%	0.371	S	S	.	.	H	α-helix	trans	-57.4	-33.9	178.2	0	0	0	0	0	113.3	A1090 I1092 Q1098	A1090-A1094 WeakPolarHBondContact O-CB 3.14Å; A1090-A1094 PolarHBondContact O-N 2.94Å; I1092-A1094 PolarHBondContact O-N 3.44Å; A1094-Q1098 WeakPolarHBondContact O-CG 3.45Å; A1094-Q1098 PolarHBondContact O-N 3Å
1095	M	88.8	Confident	84.8	Confident	32 Å²	32	68.9 Å²	68.9	16%	0.158	37%	0.373	C	S	.	.	H	α-helix	trans	-70.2	-43	173.1	-170.7	-165.8	91.7	0	0	111.9	Y1084 M1087 Q1091 I1092 L1093 Q1098 L1100	Y1084-M1095 HydrophobicContact CD1-CE 4.2Å; Y1084-M1095 HydrophobicContact CE1-CE 3.66Å; M1087-M1095 HydrophobicContact CE-CB 3.97Å; M1087-M1095 HydrophobicContact CE-CG 4.4Å; M1087-M1095 HydrophobicContact CE-SD 3.82Å; M1087-M1095 HydrophobicContact SD-SD 4.19Å; Q1091-M1095 WeakPolarHBondContact O-CB 3.17Å; Q1091-M1095 PolarHBondContact O-N 2.92Å; Q1091-M1095 VanDerWaalsContact O-N 3.08Å; I1092-M1095 WeakPolarHBondContact O-CB 3.48Å; I1092-M1095 PolarHBondContact O-N 2.72Å; L1093-M1095 PolarHBondContact O-N 2.74Å; L1093-M1095 VanDerWaalsContact O-N 3.16Å; M1095-Q1098 PolarHBondContact O-N 3.35Å; M1095-L1100 HydrophobicContact CG-CB 3.64Å; M1095-L1100 HydrophobicContact CG-CD1 4.26Å; M1095-L1100 WeakPolarHBondContact O-CB 3.32Å; M1095-L1100 PolarHBondContact O-N 3.26Å
1096	L	84.1	Confident	85.2	Confident	2 Å²	2	66.8 Å²	66.8	1%	0.01	38%	0.383	C	S	.	.	H	α-helix	trans	-68.8	-37.6	-178.8	-67.2	176.6	0	0	0	112.7	W1067 I1092 L1093 Q1098 G1099 R1101	W1067-L1096 HydrophobicContact CH2-CD1 4.09Å; W1067-L1096 HydrophobicContact CH2-CD2 3.86Å; W1067-L1096 HydrophobicContact CH2-CG 4.47Å; W1067-L1096 HydrophobicContact CZ2-CD1 3.65Å; W1067-L1096 HydrophobicContact CZ2-CD2 3.82Å; W1067-L1096 HydrophobicContact CZ2-CG 4.35Å; I1092-L1096 HydrophobicContact CG2-CD1 3.88Å; I1092-L1096 HydrophobicContact CG2-CG 4.21Å; I1092-L1096 VanDerWaalsContact O-CG 3.28Å; I1092-L1096 WeakPolarHBondContact O-CG 3.37Å; I1092-L1096 PolarHBondContact O-N 2.95Å; L1093-L1096 PolarHBondContact O-N 3.39Å; L1096-Q1098 VanDerWaalsContact C-N 3.3Å; L1096-G1099 PolarHBondContact O-N 3.05Å; L1096-R1101 PolarHBondContact O-NH1 3.19Å
1097	D	79.1	Confident	85.5	Confident	83 Å²	83	66.2 Å²	66.2	44%	0.444	37%	0.37	S	S	.	.	H	α-helix	trans	-66.3	-31.9	176.1	-59.2	-26.4	0	0	0	111.5	Y1056 L1093 G1099	Y1056-D1097 VanDerWaalsContact OH-CG 3.26Å; Y1056-D1097 PolarHBondContact OH-OD1 3.01Å; Y1056-D1097 PolarHBondContact OH-OD2 2.99Å; L1093-D1097 PolarHBondContact O-N 2.94Å; D1097-G1099 PolarHBondContact O-N 3.1Å
1098	Q	87.5	Confident	86.1	Confident	139 Å²	139	63.8 Å²	63.8	65%	0.65	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	5.1	170.9	-70.9	170.2	17.4	0	0	113.5	A1094 M1095 L1096 L1100	A1094-Q1098 WeakPolarHBondContact O-CG 3.45Å; A1094-Q1098 PolarHBondContact O-N 3Å; M1095-Q1098 PolarHBondContact O-N 3.35Å; L1096-Q1098 VanDerWaalsContact C-N 3.3Å; Q1098-L1100 HydrophobicContact CB-CD1 4.33Å; Q1098-L1100 HydrophobicContact CB-CG 4.28Å; Q1098-L1100 PolarHBondContact O-N 3.3Å
1099	G	83.6	Confident	86.9	Confident	52 Å²	52	59.7 Å²	59.7	54%	0.536	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	-6.3	-176.3	0	0	0	0	0	114.8	L1096 D1097 R1101	L1096-G1099 PolarHBondContact O-N 3.05Å; D1097-G1099 PolarHBondContact O-N 3.1Å; G1099-R1101 PolarHBondContact O-NH1 3.42Å
1100	L	89.8	Confident	88.1	Confident	95 Å²	95	63.3 Å²	63.3	50%	0.497	35%	0.353	S	S	.	.			trans	-69.9	152.3	179	-61.5	173.5	0	0	0	111	M1095 Q1098	M1095-L1100 HydrophobicContact CG-CB 3.64Å; M1095-L1100 HydrophobicContact CG-CD1 4.26Å; M1095-L1100 WeakPolarHBondContact O-CB 3.32Å; M1095-L1100 PolarHBondContact O-N 3.26Å; Q1098-L1100 HydrophobicContact CB-CD1 4.33Å; Q1098-L1100 HydrophobicContact CB-CG 4.28Å; Q1098-L1100 PolarHBondContact O-N 3.3Å
1101	R	93.7	Very high	89.2	Confident	49 Å²	49	62.3 Å²	62.3	19%	0.185	34%	0.341	C	S	.	.			trans	-140.3	170.7	-175.9	-62.6	-62	-179	-96.5	4.1	111	L1096 G1099 W1120	L1096-R1101 PolarHBondContact O-NH1 3.19Å; G1099-R1101 PolarHBondContact O-NH1 3.42Å; R1101-W1120 HydrophobicContact CB-CE3 3.95Å; R1101-W1120 HydrophobicContact CB-CZ3 4.35Å; R1101-W1120 HydrophobicContact CG-CB 4.37Å; R1101-W1120 HydrophobicContact CG-CE3 4.3Å; R1101-W1120 PolarHBondContact NE-O 2.92Å; R1101-W1120 PolarHBondContact NH2-O 2.65Å
1102	L	94.9	Very high	89.9	Confident	16 Å²	16	57.3 Å²	57.3	8%	0.084	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-60.3	135	172	-71	170.2	0	0	0	110.4	I1071 W1074 P1083 Y1084 Y1113 W1120	I1071-L1102 HydrophobicContact CD1-CD1 3.93Å; W1074-L1102 HydrophobicContact CB-CD1 4.33Å; W1074-L1102 HydrophobicContact CD2-CD1 3.89Å; W1074-L1102 HydrophobicContact CE3-CD1 4.35Å; W1074-L1102 HydrophobicContact CG-CB 4.31Å; W1074-L1102 HydrophobicContact CG-CD1 3.85Å; P1083-L1102 HydrophobicContact CB-CD1 3.97Å; Y1084-L1102 HydrophobicContact CD1-CD2 3.56Å; Y1084-L1102 HydrophobicContact CD1-CG 4.06Å; Y1084-L1102 HydrophobicContact CD2-CD1 4.42Å; Y1084-L1102 HydrophobicContact CD2-CD2 4.41Å; Y1084-L1102 HydrophobicContact CE1-CD1 4.16Å; Y1084-L1102 HydrophobicContact CE1-CD2 3.63Å; Y1084-L1102 HydrophobicContact CE1-CG 3.58Å; Y1084-L1102 HydrophobicContact CE2-CD1 3.92Å; Y1084-L1102 HydrophobicContact CE2-CD2 4.48Å; Y1084-L1102 HydrophobicContact CE2-CG 4.26Å; Y1084-L1102 HydrophobicContact CG-CD2 3.96Å; L1102-Y1113 WeakPolarHBondContact O-CE2 3.41Å; L1102-Y1113 PolarHBondContact O-OH 2.99Å; L1102-W1120 HydrophobicContact CB-CH2 3.81Å; L1102-W1120 HydrophobicContact CB-CZ3 4.11Å; L1102-W1120 HydrophobicContact CD1-CH2 4.28Å; L1102-W1120 HydrophobicContact CD1-CZ2 4.23Å
1103	S	95.5	Very high	90.8	Very high	89 Å²	89	58.4 Å²	58.4	62%	0.622	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-67.7	156.2	178.2	53.1	0	0	0	0	112.8	W1074 P1105	W1074-S1103 PolarHBondContact NE1-O 3.22Å; S1103-P1105 WeakPolarHBondContact O-CD 3.45Å
1104	R	97.6	Very high	91.8	Very high	102 Å²	102	59.3 Å²	59.3	39%	0.385	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-62.1	123.9	178.8	-173.7	164.5	65.2	62.8	4.7	111.1	C1108 E1110 Y1113	R1104-C1108 WeakPolarHBondContact CD-O 3.42Å; R1104-C1108 HydrophobicContact CG-CB 3.82Å; R1104-C1108 PolarHBondContact NH1-O 2.94Å; R1104-E1110 WeakPolarHBondContact CD-OE2 3.19Å; R1104-E1110 IonicContact CZ-OE2 3.62Å; R1104-E1110 IonicContact NE-OE2 3.75Å; R1104-E1110 PolarHBondContact NE-OE2 3.06Å; R1104-E1110 IonicContact NH2-OE2 2.77Å; R1104-Y1113 VanDerWaalsContact CA-CE2 3.47Å; R1104-Y1113 HydrophobicContact CB-CD1 3.78Å; R1104-Y1113 HydrophobicContact CB-CD2 3.63Å; R1104-Y1113 HydrophobicContact CB-CE1 3.94Å; R1104-Y1113 HydrophobicContact CB-CE2 3.79Å; R1104-Y1113 HydrophobicContact CB-CG 3.63Å; R1104-Y1113 HydrophobicContact CG-CD1 4.09Å; R1104-Y1113 HydrophobicContact CG-CD2 3.86Å; R1104-Y1113 HydrophobicContact CG-CG 3.61Å
1105	P	97	Very high	92.6	Very high	11 Å²	11	57.2 Å²	57.2	7%	0.071	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-58.9	143.3	171.9	-22.7	32.7	0	0	0	111.2	W1074 Y1077 S1103 R1107 C1108	W1074-P1105 HydrophobicContact CD2-CG 4.49Å; W1074-P1105 HydrophobicContact CG-CG 4.21Å; Y1077-P1105 WeakPolarHBondContact O-CB 3.44Å; S1103-P1105 WeakPolarHBondContact O-CD 3.45Å; P1105-R1107 VanDerWaalsContact C-N 3.27Å; P1105-R1107 PolarHBondContact O-N 3.1Å; P1105-R1107 VanDerWaalsContact O-N 3.12Å; P1105-C1108 HydrophobicContact CB-CB 4.01Å; P1105-C1108 HydrophobicContact CG-CB 4.21Å; P1105-C1108 WeakPolarHBondContact O-CB 3.4Å; P1105-C1108 PolarHBondContact O-N 3.21Å
1106	S	92.4	Very high	93.1	Very high	115 Å²	115	55.7 Å²	55.7	80%	0.804	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-38.6	-170.3	56.7	0	0	0	0	114.4
1107	R	90.2	Very high	93.7	Very high	129 Å²	129	59.9 Å²	59.9	49%	0.487	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	4.3	178.4	-63.2	178.9	177.2	-170.9	3.9	114.3	P975 Y1079 P1105	P975-R1107 PolarHBondContact O-NH1 3.47Å; Y1079-R1107 HydrophobicContact CE2-CB 4.11Å; Y1079-R1107 VanDerWaalsContact CE2-CD 3.43Å; Y1079-R1107 HydrophobicContact CE2-CG 4.4Å; Y1079-R1107 VanDerWaalsContact CZ-NH1 3.29Å; Y1079-R1107 PolarHBondContact OH-NH1 3.03Å; P1105-R1107 VanDerWaalsContact C-N 3.27Å; P1105-R1107 PolarHBondContact O-N 3.1Å; P1105-R1107 VanDerWaalsContact O-N 3.12Å
1108	C	96	Very high	94.6	Very high	4 Å²	4	59.8 Å²	59.8	3%	0.027	32%	0.322	C	S	.	.			trans	-83.5	125.6	-178.5	-172.4	0	0	0	0	111.5	Y1077 R1104 P1105 M1116	Y1077-C1108 HydrophobicContact CD1-CB 4.17Å; Y1077-C1108 HydrophobicContact CG-CB 4.4Å; R1104-C1108 WeakPolarHBondContact CD-O 3.42Å; R1104-C1108 HydrophobicContact CG-CB 3.82Å; R1104-C1108 PolarHBondContact NH1-O 2.94Å; P1105-C1108 HydrophobicContact CB-CB 4.01Å; P1105-C1108 HydrophobicContact CG-CB 4.21Å; P1105-C1108 WeakPolarHBondContact O-CB 3.4Å; P1105-C1108 PolarHBondContact O-N 3.21Å; C1108-M1116 WeakPolarHBondContact SG-CE 3.33Å
1109	P	94.8	Very high	95.1	Very high	37 Å²	37	53.2 Å²	53.2	24%	0.24	29%	0.291	C	S	.	.			trans	-62.8	145	171	-20.7	32.9	0	0	0	112.1	V979 S1111 I1112 Y1113	V979-P1109 HydrophobicContact CG1-CG 3.62Å; P1109-S1111 PolarHBondContact O-N 3.22Å; P1109-I1112 HydrophobicContact CB-CG1 4.23Å; P1109-I1112 HydrophobicContact CG-CG1 4.2Å; P1109-I1112 PolarHBondContact O-N 3.37Å; P1109-Y1113 PolarHBondContact O-N 2.99Å
1110	E	94.8	Very high	95.8	Very high	106 Å²	106	50.8 Å²	50.8	50%	0.495	27%	0.266	S	S	.	.	H	α-helix	trans	-60.3	-33.8	-179.4	-160.7	58.1	-122.2	0	0	112.5	R1104 I1112 Y1113 S1114	R1104-E1110 WeakPolarHBondContact CD-OE2 3.19Å; R1104-E1110 IonicContact CZ-OE2 3.62Å; R1104-E1110 IonicContact NE-OE2 3.75Å; R1104-E1110 PolarHBondContact NE-OE2 3.06Å; R1104-E1110 IonicContact NH2-OE2 2.77Å; E1110-I1112 VanDerWaalsContact C-N 3.32Å; E1110-I1112 PolarHBondContact O-N 3.43Å; E1110-Y1113 PolarHBondContact O-N 2.91Å; E1110-Y1113 WeakPolarHBondContact OE1-CD1 3.35Å; E1110-S1114 WeakPolarHBondContact O-CB 3.46Å; E1110-S1114 PolarHBondContact O-N 3.33Å
1111	S	95	Very high	96	Very high	56 Å²	56	49.2 Å²	49.2	39%	0.392	26%	0.258	S	S	.	.	H	α-helix	trans	-63.1	-33.5	174.3	55.2	0	0	0	0	113.5	P1109 I1115	P1109-S1111 PolarHBondContact O-N 3.22Å; S1111-I1115 PolarHBondContact O-N 3.45Å
1112	I	97.6	Very high	95.6	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-79.1	-37.6	174.8	-58.5	-64.8	0	0	0	110.6	T983 L1073 Y1077 P1109 E1110 S1114 I1115 M1116 I1140	T983-I1112 HydrophobicContact CG2-CD1 4Å; L1073-I1112 HydrophobicContact CD2-CG2 4.38Å; Y1077-I1112 HydrophobicContact CD1-CG2 4.48Å; Y1077-I1112 HydrophobicContact CD2-CG2 4.29Å; Y1077-I1112 HydrophobicContact CE1-CB 4.37Å; Y1077-I1112 HydrophobicContact CE1-CG1 4.12Å; Y1077-I1112 HydrophobicContact CE1-CG2 4Å; Y1077-I1112 HydrophobicContact CE2-CG2 3.82Å; P1109-I1112 HydrophobicContact CB-CG1 4.23Å; P1109-I1112 HydrophobicContact CG-CG1 4.2Å; P1109-I1112 PolarHBondContact O-N 3.37Å; E1110-I1112 VanDerWaalsContact C-N 3.32Å; E1110-I1112 PolarHBondContact O-N 3.43Å; I1112-S1114 VanDerWaalsContact C-N 3.32Å; I1112-S1114 PolarHBondContact O-N 3.49Å; I1112-I1115 WeakPolarHBondContact O-CA 3.28Å; I1112-I1115 WeakPolarHBondContact O-CB 3.45Å; I1112-I1115 PolarHBondContact O-N 3.26Å; I1112-I1115 VanDerWaalsContact O-N 3.1Å; I1112-M1116 HydrophobicContact CG2-CE 4.15Å; I1112-M1116 PolarHBondContact O-N 2.71Å; I1112-I1140 HydrophobicContact CD1-CD1 3.98Å; I1112-I1140 HydrophobicContact CD1-CG2 3.95Å
1113	Y	98.2	Very high	95	Very high	32 Å²	32	54.7 Å²	54.7	13%	0.125	28%	0.284	C	S	.	.	H	α-helix	trans	-69.1	-30.1	176	-175.4	-113.3	0	0	0	112.9	L1102 R1104 P1109 E1110 I1115 M1116 Q1117 W1120	L1102-Y1113 WeakPolarHBondContact O-CE2 3.41Å; L1102-Y1113 PolarHBondContact O-OH 2.99Å; R1104-Y1113 VanDerWaalsContact CA-CE2 3.47Å; R1104-Y1113 HydrophobicContact CB-CD1 3.78Å; R1104-Y1113 HydrophobicContact CB-CD2 3.63Å; R1104-Y1113 HydrophobicContact CB-CE1 3.94Å; R1104-Y1113 HydrophobicContact CB-CE2 3.79Å; R1104-Y1113 HydrophobicContact CB-CG 3.63Å; R1104-Y1113 HydrophobicContact CG-CD1 4.09Å; R1104-Y1113 HydrophobicContact CG-CD2 3.86Å; R1104-Y1113 HydrophobicContact CG-CG 3.61Å; P1109-Y1113 PolarHBondContact O-N 2.99Å; E1110-Y1113 PolarHBondContact O-N 2.91Å; E1110-Y1113 WeakPolarHBondContact OE1-CD1 3.35Å; Y1113-I1115 VanDerWaalsContact C-N 3.3Å; Y1113-I1115 PolarHBondContact O-N 3.24Å; Y1113-M1116 HydrophobicContact CD2-CB 4.3Å; Y1113-M1116 HydrophobicContact CD2-SD 3.81Å; Y1113-M1116 WeakPolarHBondContact O-CB 3.48Å; Y1113-M1116 PolarHBondContact O-N 2.94Å; Y1113-Q1117 HydrophobicContact CD1-CG 4.45Å; Y1113-Q1117 HydrophobicContact CE1-CG 4.1Å; Y1113-Q1117 VanDerWaalsContact CE1-NE2 3.27Å; Y1113-Q1117 WeakPolarHBondContact O-CG 3.04Å; Y1113-Q1117 PolarHBondContact O-N 3.06Å; Y1113-Q1117 PolarHBondContact O-NE2 2.91Å; Y1113-Q1117 VanDerWaalsContact O-NE2 3.15Å; Y1113-W1120 HydrophobicContact CE2-CZ3 4.19Å
1114	S	97.2	Very high	94.5	Very high	50 Å²	50	51.1 Å²	51.1	35%	0.35	26%	0.262	S	S	.	.	H	α-helix	trans	-59.6	-40.8	166.8	-174.5	0	0	0	0	111.5	E1110 I1112 Q1117 Q1118	E1110-S1114 WeakPolarHBondContact O-CB 3.46Å; E1110-S1114 PolarHBondContact O-N 3.33Å; I1112-S1114 VanDerWaalsContact C-N 3.32Å; I1112-S1114 PolarHBondContact O-N 3.49Å; S1114-Q1117 PolarHBondContact O-N 3.48Å; S1114-Q1118 VanDerWaalsContact O-CG 3.28Å; S1114-Q1118 WeakPolarHBondContact O-CG 3.49Å; S1114-Q1118 PolarHBondContact O-N 2.76Å; S1114-Q1118 PolarHBondContact O-NE2 3.34Å; S1114-Q1118 PolarHBondContact OG-NE2 2.88Å; S1114-Q1118 VanDerWaalsContact OG-NE2 3.13Å
1115	I	97.9	Very high	93.8	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-64.8	-43	173.6	-66.8	173.3	0	0	0	111.3	L1073 S1111 I1112 Y1113 Q1117 Q1118 C1119 L1133 T1136 I1137 I1140	L1073-I1115 HydrophobicContact CD1-CG2 3.91Å; S1111-I1115 PolarHBondContact O-N 3.45Å; I1112-I1115 WeakPolarHBondContact O-CA 3.28Å; I1112-I1115 WeakPolarHBondContact O-CB 3.45Å; I1112-I1115 PolarHBondContact O-N 3.26Å; I1112-I1115 VanDerWaalsContact O-N 3.1Å; Y1113-I1115 VanDerWaalsContact C-N 3.3Å; Y1113-I1115 PolarHBondContact O-N 3.24Å; I1115-Q1117 VanDerWaalsContact C-N 3.31Å; I1115-Q1117 PolarHBondContact O-N 3.08Å; I1115-Q1118 PolarHBondContact O-N 3.27Å; I1115-C1119 PolarHBondContact O-N 2.83Å; I1115-C1119 PolarHBondContact O-SG 3.16Å; I1115-C1119 VanDerWaalsContact O-SG 3.39Å; I1115-L1133 HydrophobicContact CG2-CD2 3.44Å; I1115-L1133 VanDerWaalsContact CG2-CD2 3.44Å; I1115-T1136 HydrophobicContact CD1-CG2 3.81Å; I1115-T1136 HydrophobicContact CG1-CG2 4.21Å; I1115-I1137 HydrophobicContact CD1-CG1 3.66Å; I1115-I1140 HydrophobicContact CD1-CD1 3.56Å
1116	M	98.4	Very high	93.5	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-56.4	-45.8	174.5	-62.7	-179	-167.5	0	0	111.3	L1073 W1074 Y1077 C1108 I1112 Y1113 Q1118 C1119 W1120	L1073-M1116 HydrophobicContact CB-CE 3.95Å; L1073-M1116 HydrophobicContact CB-CG 3.91Å; L1073-M1116 HydrophobicContact CD1-CG 4.17Å; W1074-M1116 HydrophobicContact CB-SD 4.11Å; Y1077-M1116 HydrophobicContact CD2-CE 4.24Å; Y1077-M1116 HydrophobicContact CG-CE 4.28Å; C1108-M1116 WeakPolarHBondContact SG-CE 3.33Å; I1112-M1116 HydrophobicContact CG2-CE 4.15Å; I1112-M1116 PolarHBondContact O-N 2.71Å; Y1113-M1116 HydrophobicContact CD2-CB 4.3Å; Y1113-M1116 HydrophobicContact CD2-SD 3.81Å; Y1113-M1116 WeakPolarHBondContact O-CB 3.48Å; Y1113-M1116 PolarHBondContact O-N 2.94Å; M1116-Q1118 PolarHBondContact O-N 3.15Å; M1116-C1119 WeakPolarHBondContact O-CB 3.47Å; M1116-C1119 PolarHBondContact O-N 2.86Å; M1116-W1120 HydrophobicContact CB-CD2 4.45Å; M1116-W1120 HydrophobicContact CB-CE3 4.11Å; M1116-W1120 HydrophobicContact CB-CH2 3.76Å; M1116-W1120 HydrophobicContact CB-CZ2 4.1Å; M1116-W1120 HydrophobicContact CB-CZ3 3.76Å; M1116-W1120 HydrophobicContact CG-CH2 4.31Å; M1116-W1120 PolarHBondContact O-N 3.01Å; M1116-W1120 HydrophobicContact SD-CH2 3.96Å
1117	Q	97.3	Very high	93.6	Very high	89 Å²	89	51.8 Å²	51.8	42%	0.416	26%	0.262	S	S	.	.	H	α-helix	trans	-63.1	-39.8	177.3	-71.1	169.5	94.8	0	0	112.7	Y1113 S1114 I1115 W1120 N1121	Y1113-Q1117 HydrophobicContact CD1-CG 4.45Å; Y1113-Q1117 HydrophobicContact CE1-CG 4.1Å; Y1113-Q1117 VanDerWaalsContact CE1-NE2 3.27Å; Y1113-Q1117 WeakPolarHBondContact O-CG 3.04Å; Y1113-Q1117 PolarHBondContact O-N 3.06Å; Y1113-Q1117 PolarHBondContact O-NE2 2.91Å; Y1113-Q1117 VanDerWaalsContact O-NE2 3.15Å; S1114-Q1117 PolarHBondContact O-N 3.48Å; I1115-Q1117 VanDerWaalsContact C-N 3.31Å; I1115-Q1117 PolarHBondContact O-N 3.08Å; Q1117-W1120 CarbonylContact O-C 3.59Å; Q1117-W1120 PolarHBondContact O-N 3.38Å; Q1117-W1120 VanDerWaalsContact O-N 3.13Å; Q1117-N1121 PolarHBondContact O-N 3.44Å
1118	Q	97.2	Very high	93.7	Very high	82 Å²	82	46.4 Å²	46.4	38%	0.383	24%	0.244	S	C	.	.	H	α-helix	trans	-64.7	-40.6	174.2	-69.8	167.1	50.7	0	0	112	S1114 I1115 M1116 W1120 N1121 P1128	S1114-Q1118 VanDerWaalsContact O-CG 3.28Å; S1114-Q1118 WeakPolarHBondContact O-CG 3.49Å; S1114-Q1118 PolarHBondContact O-N 2.76Å; S1114-Q1118 PolarHBondContact O-NE2 3.34Å; S1114-Q1118 PolarHBondContact OG-NE2 2.88Å; S1114-Q1118 VanDerWaalsContact OG-NE2 3.13Å; I1115-Q1118 PolarHBondContact O-N 3.27Å; M1116-Q1118 PolarHBondContact O-N 3.15Å; Q1118-W1120 PolarHBondContact O-N 2.67Å; Q1118-N1121 PolarHBondContact O-N 3.09Å; Q1118-P1128 HydrophobicContact CB-CG 4.44Å; Q1118-P1128 WeakPolarHBondContact O-CD 3.2Å
1119	C	98.5	Very high	93.5	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.7	-30.8	170.9	-72.3	0	0	0	0	112.7	V1066 W1067 I1115 M1116 R1127	V1066-C1119 HydrophobicContact CG1-CB 4.24Å; V1066-C1119 WeakPolarHBondContact O-CB 3.38Å; W1067-C1119 WeakPolarHBondContact CA-O 3.41Å; I1115-C1119 PolarHBondContact O-N 2.83Å; I1115-C1119 PolarHBondContact O-SG 3.16Å; I1115-C1119 VanDerWaalsContact O-SG 3.39Å; M1116-C1119 WeakPolarHBondContact O-CB 3.47Å; M1116-C1119 PolarHBondContact O-N 2.86Å; C1119-R1127 VanDerWaalsContact O-CD 3.32Å; C1119-R1127 WeakPolarHBondContact O-CD 3.44Å
1120	W	97.5	Very high	93.6	Very high	2 Å²	2	46.3 Å²	46.3	1%	0.008	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	21.1	179.8	-54.1	-37.5	0	0	0	114.8	W1067 G1070 I1071 W1074 R1101 L1102 Y1113 M1116 Q1117 Q1118 F1122	W1067-W1120 AromaticContact CD2-CD1 3.93Å; W1067-W1120 HydrophobicContact CE3-CB 4.23Å; W1067-W1120 HydrophobicContact CH2-CB 4.32Å; W1067-W1120 HydrophobicContact CZ3-CB 4.04Å; W1067-W1120 WeakPolarHBondContact CZ3-O 3.49Å; G1070-W1120 VanDerWaalsContact C-NE1 3.32Å; G1070-W1120 VanDerWaalsContact O-CZ2 3.27Å; G1070-W1120 WeakPolarHBondContact O-CZ2 3.4Å; I1071-W1120 HydrophobicContact CD1-CZ2 3.87Å; I1071-W1120 VanDerWaalsContact CD1-NE1 3.32Å; W1074-W1120 HydrophobicContact CB-CH2 4.02Å; W1074-W1120 HydrophobicContact CB-CZ2 3.96Å; W1074-W1120 AromaticContact CD1-CH2 3.91Å; W1074-W1120 HydrophobicContact CG-CH2 4.24Å; R1101-W1120 HydrophobicContact CB-CE3 3.95Å; R1101-W1120 HydrophobicContact CB-CZ3 4.35Å; R1101-W1120 HydrophobicContact CG-CB 4.37Å; R1101-W1120 HydrophobicContact CG-CE3 4.3Å; R1101-W1120 PolarHBondContact NE-O 2.92Å; R1101-W1120 PolarHBondContact NH2-O 2.65Å; L1102-W1120 HydrophobicContact CB-CH2 3.81Å; L1102-W1120 HydrophobicContact CB-CZ3 4.11Å; L1102-W1120 HydrophobicContact CD1-CH2 4.28Å; L1102-W1120 HydrophobicContact CD1-CZ2 4.23Å; Y1113-W1120 HydrophobicContact CE2-CZ3 4.19Å; M1116-W1120 HydrophobicContact CB-CD2 4.45Å; M1116-W1120 HydrophobicContact CB-CE3 4.11Å; M1116-W1120 HydrophobicContact CB-CH2 3.76Å; M1116-W1120 HydrophobicContact CB-CZ2 4.1Å; M1116-W1120 HydrophobicContact CB-CZ3 3.76Å; M1116-W1120 HydrophobicContact CG-CH2 4.31Å; M1116-W1120 PolarHBondContact O-N 3.01Å; M1116-W1120 HydrophobicContact SD-CH2 3.96Å; Q1117-W1120 CarbonylContact O-C 3.59Å; Q1117-W1120 PolarHBondContact O-N 3.38Å; Q1117-W1120 VanDerWaalsContact O-N 3.13Å; Q1118-W1120 PolarHBondContact O-N 2.67Å; W1120-F1122 PolarHBondContact O-N 3.27Å
1121	N	94.6	Very high	93.2	Very high	61 Å²	61	42.2 Å²	42.2	33%	0.326	23%	0.227	S	C	.	.			trans	-56.1	132.6	164.7	-163	-42.6	0	0	0	108.6	Q1117 Q1118 E1123 H1126 R1127	Q1117-N1121 PolarHBondContact O-N 3.44Å; Q1118-N1121 PolarHBondContact O-N 3.09Å; N1121-E1123 VanDerWaalsContact C-N 3.32Å; N1121-E1123 PolarHBondContact O-N 3.27Å; N1121-E1123 PolarHBondContact OD1-N 3.41Å; N1121-H1126 HydrophobicContact CB-CB 4.4Å; N1121-H1126 WeakPolarHBondContact ND2-CB 3.44Å; N1121-R1127 HydrophobicContact CB-CG 3.92Å; N1121-R1127 PolarHBondContact O-NE 3.05Å
1122	F	85.7	Confident	92.9	Very high	74 Å²	74	44.3 Å²	44.3	33%	0.325	23%	0.23	S	C	.	.	S	Bend	trans	-59.5	-47.8	-176.4	-167.9	-90.2	0	0	0	109.9	P1052 W1120 G1124 R1127	P1052-F1122 HydrophobicContact CB-CE2 4.06Å; P1052-F1122 HydrophobicContact CB-CZ 4.1Å; P1052-F1122 HydrophobicContact CG-CD2 4Å; P1052-F1122 HydrophobicContact CG-CE2 3.9Å; P1052-F1122 HydrophobicContact CG-CZ 4.42Å; W1120-F1122 PolarHBondContact O-N 3.27Å; F1122-G1124 PolarHBondContact O-N 2.87Å; F1122-R1127 PolarHBondContact O-NH2 3.13Å
1123	E	82.8	Confident	92.7	Very high	107 Å²	107	44.3 Å²	44.3	50%	0.5	23%	0.231	S	C	.	.	S	Bend	trans	-78.4	120.5	177.4	-71.9	-57.8	154.6	0	0	112.1	N1121 V1125 H1126	N1121-E1123 VanDerWaalsContact C-N 3.32Å; N1121-E1123 PolarHBondContact O-N 3.27Å; N1121-E1123 PolarHBondContact OD1-N 3.41Å; E1123-V1125 HydrophobicContact CB-CG2 4.31Å; E1123-V1125 PolarHBondContact O-N 3.03Å; E1123-V1125 VanDerWaalsContact O-N 3.15Å; E1123-H1126 PolarHBondContact O-N 2.67Å
1124	G	84.4	Confident	92.2	Very high	14 Å²	14	43 Å²	43	14%	0.144	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-57.7	-30.8	-177.7	0	0	0	0	0	114	K1063 F1122 H1126 R1127	K1063-G1124 WeakPolarHBondContact CB-O 3.36Å; K1063-G1124 WeakPolarHBondContact CD-O 3.39Å; K1063-G1124 VanDerWaalsContact CG-O 3.31Å; K1063-G1124 WeakPolarHBondContact CG-O 3.44Å; F1122-G1124 PolarHBondContact O-N 2.87Å; G1124-H1126 VanDerWaalsContact C-N 3.29Å; G1124-H1126 PolarHBondContact O-N 3.05Å; G1124-R1127 PolarHBondContact O-N 3.11Å
1125	V	82.8	Confident	91.4	Very high	106 Å²	106	41.5 Å²	41.5	64%	0.642	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-68.1	-26.1	178.6	-59.8	0	0	0	0	113.4	E1123	E1123-V1125 HydrophobicContact CB-CG2 4.31Å; E1123-V1125 PolarHBondContact O-N 3.03Å; E1123-V1125 VanDerWaalsContact O-N 3.15Å
1126	H	89.5	Confident	90.8	Very high	131 Å²	131	43.6 Å²	43.6	61%	0.606	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-95.5	-4.3	-178.8	-64.1	-41.1	0	0	0	113.7	N1121 E1123 G1124	N1121-H1126 HydrophobicContact CB-CB 4.4Å; N1121-H1126 WeakPolarHBondContact ND2-CB 3.44Å; E1123-H1126 PolarHBondContact O-N 2.67Å; G1124-H1126 VanDerWaalsContact C-N 3.29Å; G1124-H1126 PolarHBondContact O-N 3.05Å
1127	R	96.1	Very high	90.5	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.015	23%	0.227	C	C	.	.	S	Bend	trans	-72	149.7	167.4	-57.2	174.3	-161.1	148.8	11.4	109.2	E1053 K1063 V1066 C1119 N1121 F1122 G1124	E1053-R1127 IonicContact OE1-CZ 2.98Å; E1053-R1127 IonicContact OE1-NH1 3.63Å; E1053-R1127 PolarHBondContact OE1-NH1 3.31Å; E1053-R1127 IonicContact OE1-NH2 2.63Å; E1053-R1127 PolarHBondContact OE1-NH2 3.25Å; E1053-R1127 IonicContact OE2-CZ 3.56Å; E1053-R1127 IonicContact OE2-NH1 3.52Å; E1053-R1127 PolarHBondContact OE2-NH1 3.03Å; E1053-R1127 IonicContact OE2-NH2 3.59Å; E1053-R1127 PolarHBondContact OE2-NH2 3.06Å; K1063-R1127 HydrophobicContact CD-CB 4.42Å; K1063-R1127 PolarHBondContact NZ-O 2.9Å; K1063-R1127 WeakPolarHBondContact O-CD 3.43Å; K1063-R1127 PolarHBondContact O-NH1 2.71Å; V1066-R1127 HydrophobicContact CG1-CB 3.91Å; C1119-R1127 VanDerWaalsContact O-CD 3.32Å; C1119-R1127 WeakPolarHBondContact O-CD 3.44Å; N1121-R1127 HydrophobicContact CB-CG 3.92Å; N1121-R1127 PolarHBondContact O-NE 3.05Å; F1122-R1127 PolarHBondContact O-NH2 3.13Å; G1124-R1127 PolarHBondContact O-N 3.11Å
1128	P	91.5	Very high	89.9	Confident	16 Å²	16	39.8 Å²	39.8	10%	0.104	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-63.6	167.4	174.8	27	-34.7	0	0	0	112.2	K1063 V1066 Q1118 E1132 L1133	K1063-P1128 PolarHBondContact NZ-O 2.79Å; V1066-P1128 HydrophobicContact CG1-CG 4.16Å; Q1118-P1128 HydrophobicContact CB-CG 4.44Å; Q1118-P1128 WeakPolarHBondContact O-CD 3.2Å; P1128-E1132 HydrophobicContact CB-CB 4.16Å; P1128-L1133 HydrophobicContact CB-CD2 4.32Å; P1128-L1133 HydrophobicContact CB-CG 4.17Å; P1128-L1133 HydrophobicContact CG-CD1 4.33Å; P1128-L1133 HydrophobicContact CG-CD2 3.64Å; P1128-L1133 HydrophobicContact CG-CG 3.83Å
1129	T	92.3	Very high	89.2	Confident	39 Å²	39	41.7 Å²	41.7	24%	0.239	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-82.1	165.3	161.8	59	0	0	0	0	110.4	A1131 E1132 L1133	T1129-A1131 VanDerWaalsContact C-N 3.26Å; T1129-A1131 PolarHBondContact O-N 2.79Å; T1129-E1132 VanDerWaalsContact CB-OE2 3.31Å; T1129-E1132 WeakPolarHBondContact CB-OE2 3.43Å; T1129-E1132 WeakPolarHBondContact CG2-OE2 3.29Å; T1129-E1132 PolarHBondContact N-OE2 3.29Å; T1129-E1132 PolarHBondContact O-N 3.41Å; T1129-E1132 VanDerWaalsContact OG1-CD 3.32Å; T1129-E1132 WeakPolarHBondContact OG1-CG 3.32Å; T1129-E1132 PolarHBondContact OG1-N 3.15Å; T1129-E1132 PolarHBondContact OG1-OE2 3.13Å; T1129-L1133 WeakPolarHBondContact O-CG 3.36Å; T1129-L1133 PolarHBondContact O-N 3.05Å
1130	F	96.1	Very high	88.7	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-67.5	-29.5	172.8	-77.6	-71.6	0	0	0	112.4	M993 A994 E997 L1006 D1065 V1066 Y1069 L1133 V1134	M993-F1130 HydrophobicContact CB-CB 4.3Å; M993-F1130 HydrophobicContact CB-CD1 3.32Å; M993-F1130 HydrophobicContact CB-CD2 3.79Å; M993-F1130 HydrophobicContact CB-CE1 3.36Å; M993-F1130 HydrophobicContact CB-CE2 3.8Å; M993-F1130 HydrophobicContact CB-CG 3.53Å; M993-F1130 HydrophobicContact CB-CZ 3.59Å; M993-F1130 HydrophobicContact CE-CD2 4.39Å; M993-F1130 HydrophobicContact CE-CE2 3.63Å; M993-F1130 HydrophobicContact CE-CZ 3.73Å; M993-F1130 HydrophobicContact CG-CD1 4.2Å; M993-F1130 HydrophobicContact CG-CE1 3.73Å; M993-F1130 HydrophobicContact CG-CE2 4.37Å; M993-F1130 HydrophobicContact CG-CZ 3.81Å; A994-F1130 HydrophobicContact CB-CB 3.83Å; E997-F1130 HydrophobicContact CB-CD2 4.29Å; E997-F1130 WeakPolarHBondContact OE2-CB 3.35Å; E997-F1130 PolarHBondContact OE2-N 3.13Å; L1006-F1130 HydrophobicContact CD2-CZ 4.22Å; D1065-F1130 HydrophobicContact CB-CE2 3.81Å; D1065-F1130 HydrophobicContact CB-CZ 3.96Å; V1066-F1130 HydrophobicContact CB-CE2 4.42Å; V1066-F1130 HydrophobicContact CB-CZ 4.31Å; V1066-F1130 HydrophobicContact CG2-CD1 4.25Å; V1066-F1130 HydrophobicContact CG2-CD2 3.68Å; V1066-F1130 HydrophobicContact CG2-CE1 4.05Å; V1066-F1130 HydrophobicContact CG2-CE2 3.46Å; V1066-F1130 VanDerWaalsContact CG2-CE2 3.46Å; V1066-F1130 HydrophobicContact CG2-CG 4.09Å; V1066-F1130 HydrophobicContact CG2-CZ 3.66Å; Y1069-F1130 HydrophobicContact CD1-CE1 4.31Å; Y1069-F1130 HydrophobicContact CD2-CE1 4.09Å; Y1069-F1130 AromaticContact CG-CE1 3.77Å; Y1069-F1130 HydrophobicContact CG-CE1 3.77Å; F1130-L1133 HydrophobicContact CD1-CD1 3.75Å; F1130-L1133 HydrophobicContact CE1-CD1 4.04Å; F1130-L1133 PolarHBondContact O-N 3.36Å; F1130-V1134 WeakPolarHBondContact O-CB 3.46Å; F1130-V1134 VanDerWaalsContact O-CG2 3.27Å; F1130-V1134 WeakPolarHBondContact O-CG2 3.33Å; F1130-V1134 PolarHBondContact O-N 3.4Å
1131	A	86.4	Confident	88.2	Confident	21 Å²	21	44.2 Å²	44.2	17%	0.174	23%	0.226	C	C	.	.	H	α-helix	trans	-59.4	-44.6	170.9	0	0	0	0	0	112.2	T1129 L1135	T1129-A1131 VanDerWaalsContact C-N 3.26Å; T1129-A1131 PolarHBondContact O-N 2.79Å; A1131-L1135 WeakPolarHBondContact O-CD1 3.49Å; A1131-L1135 VanDerWaalsContact O-CG 3.26Å; A1131-L1135 WeakPolarHBondContact O-CG 3.35Å; A1131-L1135 PolarHBondContact O-N 3.21Å
1132	E	88.6	Confident	87.6	Confident	99 Å²	99	49.9 Å²	49.9	46%	0.463	24%	0.243	S	C	.	.	H	α-helix	trans	-69	-37.7	177.5	-70.5	159.9	125.5	0	0	112.5	P1128 T1129 L1135 T1136	P1128-E1132 HydrophobicContact CB-CB 4.16Å; T1129-E1132 VanDerWaalsContact CB-OE2 3.31Å; T1129-E1132 WeakPolarHBondContact CB-OE2 3.43Å; T1129-E1132 WeakPolarHBondContact CG2-OE2 3.29Å; T1129-E1132 PolarHBondContact N-OE2 3.29Å; T1129-E1132 PolarHBondContact O-N 3.41Å; T1129-E1132 VanDerWaalsContact OG1-CD 3.32Å; T1129-E1132 WeakPolarHBondContact OG1-CG 3.32Å; T1129-E1132 PolarHBondContact OG1-N 3.15Å; T1129-E1132 PolarHBondContact OG1-OE2 3.13Å; E1132-L1135 PolarHBondContact O-N 2.96Å; E1132-T1136 WeakPolarHBondContact O-CB 3.37Å; E1132-T1136 PolarHBondContact O-N 3.23Å; E1132-T1136 PolarHBondContact O-OG1 3.13Å
1133	L	93.7	Very high	87.5	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-61.2	-48.3	174	-72.7	172.5	0	0	0	111.8	V1066 Y1069 I1115 P1128 T1129 F1130 L1135 T1136 I1137	V1066-L1133 HydrophobicContact CG1-CD1 4.12Å; V1066-L1133 HydrophobicContact CG2-CD1 4.16Å; Y1069-L1133 HydrophobicContact CD1-CD1 3.75Å; Y1069-L1133 HydrophobicContact CE1-CD1 4.03Å; Y1069-L1133 HydrophobicContact CE1-CD2 4.49Å; I1115-L1133 HydrophobicContact CG2-CD2 3.44Å; I1115-L1133 VanDerWaalsContact CG2-CD2 3.44Å; P1128-L1133 HydrophobicContact CB-CD2 4.32Å; P1128-L1133 HydrophobicContact CB-CG 4.17Å; P1128-L1133 HydrophobicContact CG-CD1 4.33Å; P1128-L1133 HydrophobicContact CG-CD2 3.64Å; P1128-L1133 HydrophobicContact CG-CG 3.83Å; T1129-L1133 WeakPolarHBondContact O-CG 3.36Å; T1129-L1133 PolarHBondContact O-N 3.05Å; F1130-L1133 HydrophobicContact CD1-CD1 3.75Å; F1130-L1133 HydrophobicContact CE1-CD1 4.04Å; F1130-L1133 PolarHBondContact O-N 3.36Å; L1133-L1135 VanDerWaalsContact C-N 3.32Å; L1133-L1135 PolarHBondContact O-N 3.2Å; L1133-T1136 PolarHBondContact O-N 3.02Å; L1133-I1137 WeakPolarHBondContact O-CB 3.38Å; L1133-I1137 VanDerWaalsContact O-CG1 3.26Å; L1133-I1137 WeakPolarHBondContact O-CG1 3.26Å; L1133-I1137 PolarHBondContact O-N 2.56Å
1134	V	88.3	Confident	87.5	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.018	25%	0.246	C	C	.	.	H	α-helix	trans	-52.4	-50	175.3	158.3	0	0	0	0	111.2	Y248 L249 H987 A990 L991 A994 F1130 S1138	Y248-V1134 HydrophobicContact CE1-CG1 3.99Å; L249-V1134 HydrophobicContact CD1-CG1 3.31Å; H987-V1134 PolarHBondContact CD2-O 2.94Å; A990-V1134 HydrophobicContact CB-CG2 3.55Å; A990-V1134 WeakPolarHBondContact O-CG2 3.36Å; L991-V1134 HydrophobicContact CD2-CB 4.43Å; L991-V1134 HydrophobicContact CD2-CG1 3.62Å; L991-V1134 HydrophobicContact CD2-CG2 3.89Å; L991-V1134 HydrophobicContact CG-CG2 4.47Å; A994-V1134 HydrophobicContact CB-CG2 4.16Å; F1130-V1134 WeakPolarHBondContact O-CB 3.46Å; F1130-V1134 VanDerWaalsContact O-CG2 3.27Å; F1130-V1134 WeakPolarHBondContact O-CG2 3.33Å; F1130-V1134 PolarHBondContact O-N 3.4Å; V1134-S1138 WeakPolarHBondContact O-CB 3.19Å; V1134-S1138 PolarHBondContact O-N 2.81Å
1135	L	81	Confident	86.9	Confident	20 Å²	20	52.1 Å²	52.1	11%	0.105	28%	0.276	C	S	.	.	H	α-helix	trans	-65.2	-41	-179	-67.8	166.2	0	0	0	112.5	Y248 Y259 A1131 E1132 L1133 S1138 R1139	Y248-L1135 HydrophobicContact CD1-CD2 3.63Å; Y248-L1135 HydrophobicContact CE1-CD2 3.79Å; Y259-L1135 HydrophobicContact CD1-CD2 4.11Å; Y259-L1135 HydrophobicContact CD2-CD1 3.29Å; Y259-L1135 HydrophobicContact CD2-CD2 3.81Å; Y259-L1135 HydrophobicContact CD2-CG 4.19Å; Y259-L1135 HydrophobicContact CE1-CD2 3.77Å; Y259-L1135 HydrophobicContact CE2-CD1 3.64Å; Y259-L1135 HydrophobicContact CE2-CD2 3.46Å; Y259-L1135 VanDerWaalsContact CE2-CD2 3.46Å; Y259-L1135 HydrophobicContact CE2-CG 4.17Å; Y259-L1135 HydrophobicContact CG-CD1 3.88Å; Y259-L1135 HydrophobicContact CG-CD2 4.13Å; Y259-L1135 VanDerWaalsContact CZ-CD2 3.42Å; A1131-L1135 WeakPolarHBondContact O-CD1 3.49Å; A1131-L1135 VanDerWaalsContact O-CG 3.26Å; A1131-L1135 WeakPolarHBondContact O-CG 3.35Å; A1131-L1135 PolarHBondContact O-N 3.21Å; E1132-L1135 PolarHBondContact O-N 2.96Å; L1133-L1135 VanDerWaalsContact C-N 3.32Å; L1133-L1135 PolarHBondContact O-N 3.2Å; L1135-S1138 PolarHBondContact O-N 2.84Å; L1135-R1139 WeakPolarHBondContact O-CG 3.25Å; L1135-R1139 PolarHBondContact O-N 2.95Å; L1135-R1139 VanDerWaalsContact O-N 3.08Å
1136	T	85.1	Confident	85.8	Confident	46 Å²	46	50.7 Å²	50.7	28%	0.282	27%	0.271	S	S	.	.	H	α-helix	trans	-71.1	-43	-177.7	-51.8	0	0	0	0	111.2	I1115 E1132 L1133 R1139 I1140	I1115-T1136 HydrophobicContact CD1-CG2 3.81Å; I1115-T1136 HydrophobicContact CG1-CG2 4.21Å; E1132-T1136 WeakPolarHBondContact O-CB 3.37Å; E1132-T1136 PolarHBondContact O-N 3.23Å; E1132-T1136 PolarHBondContact O-OG1 3.13Å; L1133-T1136 PolarHBondContact O-N 3.02Å; T1136-R1139 PolarHBondContact O-N 2.68Å; T1136-I1140 HydrophobicContact CG2-CD1 4.48Å; T1136-I1140 WeakPolarHBondContact O-CG1 3.47Å; T1136-I1140 PolarHBondContact O-N 3.34Å; T1136-I1140 VanDerWaalsContact O-N 3.09Å
1137	I	90.4	Very high	84.2	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-68.3	-37.1	176	-60.2	171.7	0	0	0	110.7	T983 H987 A990 Y1069 I1115 L1133 R1139 I1140 L1141	T983-I1137 HydrophobicContact CG2-CG2 3.61Å; H987-I1137 HydrophobicContact CB-CG2 3.75Å; A990-I1137 HydrophobicContact CB-CD1 4.49Å; Y1069-I1137 HydrophobicContact CE1-CD1 4.08Å; Y1069-I1137 WeakPolarHBondContact OH-CD1 3.32Å; I1115-I1137 HydrophobicContact CD1-CG1 3.66Å; L1133-I1137 WeakPolarHBondContact O-CB 3.38Å; L1133-I1137 VanDerWaalsContact O-CG1 3.26Å; L1133-I1137 WeakPolarHBondContact O-CG1 3.26Å; L1133-I1137 PolarHBondContact O-N 2.56Å; I1137-R1139 VanDerWaalsContact C-N 3.32Å; I1137-R1139 PolarHBondContact O-N 2.99Å; I1137-I1140 PolarHBondContact O-N 3.02Å; I1137-L1141 VanDerWaalsContact O-CB 3.32Å; I1137-L1141 WeakPolarHBondContact O-CB 3.47Å; I1137-L1141 PolarHBondContact O-N 3.36Å
1138	S	85.9	Confident	81.7	Confident	7 Å²	7	55.8 Å²	55.8	5%	0.049	30%	0.302	C	S	.	.	H	α-helix	trans	-59.5	-37.3	172.3	172.2	0	0	0	0	113.5	Y248 V1134 L1135 R1142	Y248-S1138 WeakPolarHBondContact OH-CB 3.33Å; Y248-S1138 PolarHBondContact OH-OG 3.2Å; V1134-S1138 WeakPolarHBondContact O-CB 3.19Å; V1134-S1138 PolarHBondContact O-N 2.81Å; L1135-S1138 PolarHBondContact O-N 2.84Å; S1138-R1142 WeakPolarHBondContact O-CG 3.34Å; S1138-R1142 PolarHBondContact O-N 3.33Å; S1138-R1142 PolarHBondContact O-NE 3.13Å; S1138-R1142 PolarHBondContact OG-NH2 3.26Å
1139	R	83	Confident	79	Confident	123 Å²	123	60.5 Å²	60.5	46%	0.464	33%	0.33	S	S	.	.	H	α-helix	trans	-67.5	-45.8	173.4	-70.8	168.6	-178.1	132.7	-5.5	111.2	L1135 T1136 I1137 R1142 A1143	L1135-R1139 WeakPolarHBondContact O-CG 3.25Å; L1135-R1139 PolarHBondContact O-N 2.95Å; L1135-R1139 VanDerWaalsContact O-N 3.08Å; T1136-R1139 PolarHBondContact O-N 2.68Å; I1137-R1139 VanDerWaalsContact C-N 3.32Å; I1137-R1139 PolarHBondContact O-N 2.99Å; R1139-R1142 PolarHBondContact O-N 2.91Å; R1139-A1143 WeakPolarHBondContact O-CB 3.47Å; R1139-A1143 PolarHBondContact O-N 3.48Å; R1139-A1143 VanDerWaalsContact O-N 3.15Å
1140	I	86.9	Confident	76.1	Confident	25 Å²	25	65.6 Å²	65.6	13%	0.128	36%	0.356	C	S	.	.	H	α-helix	trans	-64.1	-43.6	178.6	-64.2	165.5	0	0	0	111.4	I1112 I1115 T1136 I1137 R1142 A1143 M1144	I1112-I1140 HydrophobicContact CD1-CD1 3.98Å; I1112-I1140 HydrophobicContact CD1-CG2 3.95Å; I1115-I1140 HydrophobicContact CD1-CD1 3.56Å; T1136-I1140 HydrophobicContact CG2-CD1 4.48Å; T1136-I1140 WeakPolarHBondContact O-CG1 3.47Å; T1136-I1140 PolarHBondContact O-N 3.34Å; T1136-I1140 VanDerWaalsContact O-N 3.09Å; I1137-I1140 PolarHBondContact O-N 3.02Å; I1140-R1142 VanDerWaalsContact C-N 3.34Å; I1140-R1142 PolarHBondContact O-N 3.31Å; I1140-A1143 PolarHBondContact O-N 2.93Å; I1140-A1143 VanDerWaalsContact O-N 3.08Å; I1140-M1144 HydrophobicContact CG2-CE 4.48Å; I1140-M1144 PolarHBondContact O-N 2.94Å
1141	L	86.3	Confident	73	Confident	29 Å²	29	71.9 Å²	71.9	15%	0.152	39%	0.388	C	S	.	.	H	α-helix	trans	-60.9	-41.3	179.9	-175.3	62.2	0	0	0	111.9	T983 E984 I1137 A1143 M1144	T983-L1141 HydrophobicContact CG2-CB 4.2Å; T983-L1141 HydrophobicContact CG2-CD1 4.17Å; E984-L1141 HydrophobicContact CB-CD1 4.25Å; E984-L1141 HydrophobicContact CB-CD2 4.34Å; I1137-L1141 VanDerWaalsContact O-CB 3.32Å; I1137-L1141 WeakPolarHBondContact O-CB 3.47Å; I1137-L1141 PolarHBondContact O-N 3.36Å; L1141-A1143 VanDerWaalsContact C-N 3.31Å; L1141-A1143 PolarHBondContact O-N 3.41Å; L1141-M1144 HydrophobicContact CD1-CE 3.96Å
1142	R	82.6	Confident	70.1	Confident	180 Å²	180	76.1 Å²	76.1	68%	0.679	42%	0.415	S	S	*	.	H	α-helix	trans	-71.3	-21.6	174.7	-74.5	-179.5	-72.6	158.6	-10.9	114.3	S1138 R1139 I1140	S1138-R1142 WeakPolarHBondContact O-CG 3.34Å; S1138-R1142 PolarHBondContact O-N 3.33Å; S1138-R1142 PolarHBondContact O-NE 3.13Å; S1138-R1142 PolarHBondContact OG-NH2 3.26Å; R1139-R1142 PolarHBondContact O-N 2.91Å; I1140-R1142 VanDerWaalsContact C-N 3.34Å; I1140-R1142 PolarHBondContact O-N 3.31Å
1143	A	83	Confident	67.3	Low	84 Å²	84	78 Å²	78	69%	0.694	43%	0.427	S	S	*	.	H	α-helix	trans	-91.2	-15.2	180	0	0	0	0	0	113.5	R1139 I1140 L1141	R1139-A1143 WeakPolarHBondContact O-CB 3.47Å; R1139-A1143 PolarHBondContact O-N 3.48Å; R1139-A1143 VanDerWaalsContact O-N 3.15Å; I1140-A1143 PolarHBondContact O-N 2.93Å; I1140-A1143 VanDerWaalsContact O-N 3.08Å; L1141-A1143 VanDerWaalsContact C-N 3.31Å; L1141-A1143 PolarHBondContact O-N 3.41Å
1144	M	84.4	Confident	64.4	Low	40 Å²	40	82.8 Å²	82.8	20%	0.197	46%	0.458	C	S	.	.	S	Bend	trans	-77.4	142.2	173.1	-74.8	-171.4	-66	0	0	111	H980 T983 I1140 L1141 S1146	H980-M1144 HydrophobicContact CB-CE 4.46Å; T983-M1144 HydrophobicContact CG2-CE 3.76Å; T983-M1144 VanDerWaalsContact OG1-CE 3.31Å; T983-M1144 WeakPolarHBondContact OG1-CE 3.18Å; I1140-M1144 HydrophobicContact CG2-CE 4.48Å; I1140-M1144 PolarHBondContact O-N 2.94Å; L1141-M1144 HydrophobicContact CD1-CE 3.96Å; M1144-S1146 PolarHBondContact O-N 3.33Å
1145	P	70.4	Confident	61.7	Low	118 Å²	118	89.6 Å²	89.6	77%	0.766	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-61	125.4	166.5	27.4	-33	0	0	0	108.6
1146	S	59.6	Low	59.4	Low	76 Å²	76	96.2 Å²	96.2	53%	0.531	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-61.7	144.1	170.6	52.6	0	0	0	0	109.3	M1144 Q1148	M1144-S1146 PolarHBondContact O-N 3.33Å; S1146-Q1148 VanDerWaalsContact C-N 3.35Å; S1146-Q1148 PolarHBondContact O-N 3.25Å
1147	P	57.1	Low	56.8	Low	77 Å²	77	101.7 Å²	101.7	50%	0.5	55%	0.547	S	S	.	.			trans	-65.6	98.5	174.3	27	-32.9	0	0	0	108.2	T1149	P1147-T1149 PolarHBondContact O-N 3.33Å; P1147-T1149 VanDerWaalsContact O-N 3.12Å
1148	Q	42.2	Very low	54.1	Low	166 Å²	166	108.8 Å²	108.8	78%	0.776	58%	0.58	S	S	*	*			trans	-56.3	120.7	176.2	-72	-174.1	-11.9	0	0	108.3	S1146 N1150	S1146-Q1148 VanDerWaalsContact C-N 3.35Å; S1146-Q1148 PolarHBondContact O-N 3.25Å; Q1148-N1150 PolarHBondContact O-N 3.37Å
1149	T	36.1	Very low	51.4	Low	114 Å²	114	116.9 Å²	116.9	70%	0.699	62%	0.616	S	S	*	*			trans	-59.2	125.4	159	40.1	0	0	0	0	106.6	P1147 I1151	P1147-T1149 PolarHBondContact O-N 3.33Å; P1147-T1149 VanDerWaalsContact O-N 3.12Å; T1149-I1151 PolarHBondContact O-N 3.2Å
1150	N	30.3	Very low	49	Very low	147 Å²	147	118.9 Å²	118.9	79%	0.786	63%	0.63	S	S	*	*			trans	-70.2	71.5	174.1	-82.4	-24	0	0	0	109.6	Q1148 C1152	Q1148-N1150 PolarHBondContact O-N 3.37Å; N1150-C1152 PolarHBondContact O-N 3.4Å
1151	I	31.2	Very low	46.3	Very low	132 Å²	132	125.3 Å²	125.3	68%	0.677	66%	0.66	S	S	*	*			trans	-67.5	90.3	158.4	-59.8	175.7	0	0	0	104.7	T1149 I1153	T1149-I1151 PolarHBondContact O-N 3.2Å; I1151-I1153 VanDerWaalsContact C-N 3.25Å; I1151-I1153 PolarHBondContact O-N 3.39Å
1152	C	26.6	Very low	43.9	Very low	109 Å²	109	130.1 Å²	130.1	74%	0.736	69%	0.691	S	S	*	*			trans	-60.3	95.8	165.7	-67.5	0	0	0	0	107.3	N1150 P1154	N1150-C1152 PolarHBondContact O-N 3.4Å; C1152-P1154 WeakPolarHBondContact O-CD 3.44Å; C1152-P1154 VanDerWaalsContact O-N 3.11Å
1153	I	30.1	Very low	41.4	Very low	140 Å²	140	127.9 Å²	127.9	72%	0.718	69%	0.692	S	S	*	*			trans	-55.3	117.4	167.2	-59.7	174.8	0	0	0	105.5	I1151 N1155	I1151-I1153 VanDerWaalsContact C-N 3.25Å; I1151-I1153 PolarHBondContact O-N 3.39Å; I1153-N1155 PolarHBondContact O-N 3.21Å; I1153-N1155 VanDerWaalsContact O-N 3.08Å
1154	P	32.4	Very low	39	Very low	102 Å²	102	131.4 Å²	131.4	66%	0.662	70%	0.699	S	S	*	*			trans	-63.2	118.8	176.7	-19.2	32.4	0	0	0	107.4	C1152 H1156	C1152-P1154 WeakPolarHBondContact O-CD 3.44Å; C1152-P1154 VanDerWaalsContact O-N 3.11Å; P1154-H1156 VanDerWaalsContact C-N 3.28Å; P1154-H1156 PolarHBondContact O-N 3.02Å
1155	N	30.1	Very low	36.5	Very low	145 Å²	145	134.4 Å²	134.4	78%	0.775	72%	0.724	S	S	*	*			trans	-63.8	93.3	174.8	-103.4	-9.4	0	0	0	108.5	I1153 H1157	I1153-N1155 PolarHBondContact O-N 3.21Å; I1153-N1155 VanDerWaalsContact O-N 3.08Å; N1155-H1157 VanDerWaalsContact C-N 3.29Å; N1155-H1157 PolarHBondContact O-N 2.65Å
1156	H	34	Very low	34.7	Very low	159 Å²	159	132.4 Å²	132.4	74%	0.736	73%	0.725	S	S	*	*			trans	-67.6	91.5	169	-101.4	27.6	0	0	0	108.2	P1154 H1158	P1154-H1156 VanDerWaalsContact C-N 3.28Å; P1154-H1156 PolarHBondContact O-N 3.02Å; H1156-H1158 PolarHBondContact O-N 2.97Å
1157	H	30.2	Very low	33.5	Very low	162 Å²	162	133.6 Å²	133.6	75%	0.75	73%	0.733	S	S	*	*			trans	-61.5	90	160	-78.8	-22.9	0	0	0	108.8	N1155 H1159	N1155-H1157 VanDerWaalsContact C-N 3.29Å; N1155-H1157 PolarHBondContact O-N 2.65Å; H1157-H1159 PolarHBondContact O-N 2.78Å; H1157-H1159 VanDerWaalsContact O-N 3.11Å
1158	H	34.2	Very low	32.4	Very low	150 Å²	150	136.4 Å²	136.4	69%	0.694	74%	0.744	S	S	*	*			trans	-67.7	103.6	160.9	-95.2	21.7	0	0	0	108.5	H1156 H1160	H1156-H1158 PolarHBondContact O-N 2.97Å; H1158-H1160 VanDerWaalsContact C-N 3.33Å; H1158-H1160 PolarHBondContact O-N 3.08Å
1159	H	28.4	Very low	32.1	Very low	177 Å²	177	134.5 Å²	134.5	82%	0.819	74%	0.739	S	S	*	*			trans	-61.7	93.4	164.6	-83	-66.8	0	0	0	109.6	H1157 H1161	H1157-H1159 PolarHBondContact O-N 2.78Å; H1157-H1159 VanDerWaalsContact O-N 3.11Å; H1159-H1161 PolarHBondContact O-N 3.46Å
1160	H	33.9	Very low	31.9	Very low	164 Å²	164	135.1 Å²	135.1	76%	0.759	74%	0.737	S	S	*	*			trans	-78.4	96.8	160.1	-103.2	-69.2	0	0	0	109.4	H1158 T1162	H1158-H1160 VanDerWaalsContact C-N 3.33Å; H1158-H1160 PolarHBondContact O-N 3.08Å; H1160-T1162 PolarHBondContact O-N 3.17Å
1161	H	29.3	Very low	31.9	Very low	161 Å²	161	134.6 Å²	134.6	75%	0.745	73%	0.734	S	S	*	*			trans	-62.4	116.6	158.3	-100.7	-79.5	0	0	0	109.3	H1159	H1159-H1161 PolarHBondContact O-N 3.46Å
1162	T	34.9	Very low	31.9	Very low	130 Å²	130	134.8 Å²	134.8	80%	0.798	74%	0.742	S	S	*	*			trans	-131.9	142.6	149.2	50.4	0	0	0	0	108	H1160	H1160-T1162 PolarHBondContact O-N 3.17Å
1163	N	32.1	Very low	32.2	Very low	133 Å²	133	134.8 Å²	134.8	71%	0.711	74%	0.743	S	S	*	*			trans	-107.5	148	-169.2	-61.4	-31.3	0	0	0	111
1164	N	31.3	Very low	32.3	Very low	157 Å²	157	135.5 Å²	135.5	84%	0.84	75%	0.748	S	S	*	*			trans	49.7	143.9	142	-86.8	-1.9	0	0	0	120.9
1165	S	32.6	Very low	32.3	Very low	103 Å²	103	135 Å²	135	72%	0.72	75%	0.747	S	S	*	*			cis	-158.5	147.9	9.4	-93.8	0	0	0	0	112.3
1166	G	32.3	Very low	32.3	Very low	77 Å²	77	135.6 Å²	135.6	79%	0.794	75%	0.75	S	S	*	*			trans	82.9	158.6	144.9	0	0	0	0	0	118.6
1167	S	33.9	Very low	32.1	Very low	100 Å²	100	135.1 Å²	135.1	70%	0.699	75%	0.753	S	S	*	*			cis	-165.6	157.3	-15.9	-154.2	0	0	0	0	111.1
1168	N	35.1	Very low	32.1	Very low	136 Å²	136	134.2 Å²	134.2	73%	0.727	75%	0.754	S	S	*	*			trans	73.4	145.8	164.2	-48.9	-10.3	0	0	0	115.2
1169	N	34.3	Very low	32	Very low	127 Å²	127	133.1 Å²	133.1	68%	0.679	76%	0.757	S	S	*	*			cis	-156.4	137.3	0.6	-117	4.4	0	0	0	114
1170	I	33.9	Very low	32	Very low	126 Å²	126	132.7 Å²	132.7	65%	0.646	76%	0.76	S	S	*	*			trans	55.9	102.8	131.5	-56.3	173.8	0	0	0	121.5
1171	N	28.5	Very low	31.8	Very low	137 Å²	137	130.8 Å²	130.8	73%	0.733	77%	0.765	S	S	*	*				53.4	153.8	121.5	-50.5	-11.8	0	0	0	125.8
1172	T	31.5	Very low	31.8	Very low	136 Å²	136	127.6 Å²	127.6	83%	0.834	76%	0.761	S	S	*	*			trans	74.8	136.7	161.5	72.6	0	0	0	0	116.3
1173	S	32.9	Very low	31.6	Very low	109 Å²	109	128.3 Å²	128.3	76%	0.762	76%	0.76	S	S	*	*			cis	-139.6	169.7	-2.8	-67.6	0	0	0	0	108
1174	N	32.6	Very low	31.3	Very low	154 Å²	154	129.9 Å²	129.9	82%	0.824	77%	0.768	S	S	*	*			cis	-157.9	168.5	31.7	-163.1	10.5	0	0	0	112.3
1175	S	33.1	Very low	31.8	Very low	91 Å²	91	127.3 Å²	127.3	64%	0.636	76%	0.759	S	S	*	*			trans	-61.2	164.8	-176.8	-46.1	0	0	0	0	114.8
1176	N	30	Very low	31.6	Very low	159 Å²	159	128.8 Å²	128.8	85%	0.85	77%	0.765	S	S	*	*			cis	-137.6	165.7	25.6	-66.9	-70.9	0	0	0	113.5
1177	N	29.2	Very low	31.5	Very low	148 Å²	148	134 Å²	134	79%	0.791	77%	0.765	S	S	*	*			trans	-150.1	149.6	177.2	-135.2	-7.4	0	0	0	112.3
1178	N	31	Very low	31.2	Very low	144 Å²	144	137.9 Å²	137.9	77%	0.77	77%	0.77	S	S	*	*			trans	66.5	156.6	178.1	-51.6	-30.8	0	0	0	115
1179	V	31.7	Very low	31.1	Very low	126 Å²	126	136.9 Å²	136.9	76%	0.764	76%	0.764	S	S	*	*			cis	-140.2	145.6	24	175.4	0	0	0	0	112
1180	L	27	Very low	31.1	Very low	168 Å²	168	138.8 Å²	138.8	88%	0.88	77%	0.769	S	S	*	*			trans	19.7	123	166.7	-82.6	72.4	0	0	0	121.3
1181	S	30.7	Very low	30.9	Very low	124 Å²	124	139.2 Å²	139.2	87%	0.867	77%	0.772	S	S	*	*				-157	150.7	126.4	61.8	0	0	0	0	112
1182	S	28.7	Very low	31.2	Very low	94 Å²	94	141.7 Å²	141.7	66%	0.657	78%	0.779	S	S	*	*			trans	-80	165	-174.4	53.5	0	0	0	0	114.9
1183	N	31.2	Very low	31.1	Very low	145 Å²	145	140 Å²	140	78%	0.775	77%	0.772	S	S	*	*				178.4	140.4	111.5	-85.8	-13.7	0	0	0	115.5
1184	L	25.7	Very low	31.6	Very low	166 Å²	166	139.9 Å²	139.9	87%	0.869	77%	0.769	S	S	*	*			trans	-145.9	170	150.8	-133.6	79.6	0	0	0	106.3
1185	P	41.8	Very low	31.5	Very low	103 Å²	103	138.3 Å²	138.3	67%	0.669	77%	0.765	S	S	*	*				-120.1	172	-109.2	38.2	-23.4	0	0	0	115
1186	T	28.1	Very low	31.6	Very low	135 Å²	135	142.8 Å²	142.8	83%	0.828	78%	0.776	S	S	*	*			trans	169.7	157.8	132.7	32.3	0	0	0	0	115.8
1187	K	30.8	Very low	31.6	Very low	185 Å²	185	143 Å²	143	80%	0.804	77%	0.771	S	S	*	*			trans	79.1	110.3	150.1	-82.7	-179.4	174.8	-174.9	0	124.2
1188	F	28.4	Very low	31.8	Very low	183 Å²	183	143.7 Å²	143.7	80%	0.803	77%	0.769	S	S	*	*				52.8	116.8	116.4	-85	-90.4	0	0	0	123.9
1189	D	31.7	Very low	31.9	Very low	114 Å²	114	142.7 Å²	142.7	61%	0.61	76%	0.764	S	S	*	*				47.7	126.4	129.5	-59.4	9.4	0	0	0	124.4
1190	H	34.9	Very low	31.9	Very low	167 Å²	167	143.2 Å²	143.2	77%	0.773	76%	0.763	S	S	*	*				-177.4	139.5	91.8	-94.4	-47.4	0	0	0	116.5
1191	L	29.8	Very low	32.3	Very low	136 Å²	136	139.6 Å²	139.6	71%	0.712	75%	0.751	S	S	*	*			trans	31.9	130.4	151.6	-84.9	74.6	0	0	0	123.7
1192	H	35.1	Very low	32.2	Very low	189 Å²	189	140.7 Å²	140.7	88%	0.875	75%	0.748	S	S	*	*				-154.2	158.9	106.6	-106	72.1	0	0	0	111.9
1193	S	28.9	Very low	32.5	Very low	100 Å²	100	146 Å²	146	70%	0.699	76%	0.759	S	S	*	*			trans	-143.4	-170.2	-173.5	-49.3	0	0	0	0	109.1
1194	P	43.4	Very low	32.4	Very low	106 Å²	106	145.9 Å²	145.9	69%	0.688	76%	0.758	S	S	*	*			cis	-143.3	-177.1	-0.5	38.8	-16.3	0	0	0	117.9
1195	T	29.8	Very low	32.9	Very low	121 Å²	121	145.7 Å²	145.7	74%	0.742	76%	0.758	S	S	*	*			trans	55.3	124.6	148.3	46.4	0	0	0	0	123.6
1196	H	36.5	Very low	32.4	Very low	186 Å²	186	147.6 Å²	147.6	86%	0.861	76%	0.763	S	S	*	*				-167.4	172.2	108	-113.3	-83.7	0	0	0	112.7
1197	Q	29.4	Very low	32.7	Very low	163 Å²	163	148.8 Å²	148.8	76%	0.762	76%	0.764	S	S	*	*			trans	-113.8	143.7	-175.8	-58.8	167.2	-43.9	0	0	112.5
1198	H	34.3	Very low	32.8	Very low	162 Å²	162	146 Å²	146	75%	0.75	76%	0.758	S	S	*	*				169.6	140.5	123.9	-99.9	-62.8	0	0	0	116.4
1199	N	32.3	Very low	33.1	Very low	124 Å²	124	144.2 Å²	144.2	66%	0.663	76%	0.757	S	S	*	*			trans	50.8	138.2	137.1	-65.9	14.8	0	0	0	125.7
1200	N	32.4	Very low	33.2	Very low	136 Å²	136	144.8 Å²	144.8	73%	0.727	76%	0.76	S	S	*	*			trans	85.5	103.6	135.6	-72.6	10.9	0	0	0	123.7
1201	S	33.5	Very low	33	Very low	92 Å²	92	143.3 Å²	143.3	64%	0.643	76%	0.758	S	S	*	*				76.4	123.1	110.2	-53.8	0	0	0	0	123.1
1202	N	29.3	Very low	33	Very low	148 Å²	148	142.3 Å²	142.3	79%	0.791	76%	0.758	S	S	*	*			trans	53.8	114.8	138.3	-60.9	-2.8	0	0	0	120.7
1203	K	35	Very low	32.8	Very low	204 Å²	204	139.1 Å²	139.1	89%	0.887	75%	0.751	S	S	*	*				-171.8	163.6	97.8	-101.9	175	-178.2	-178.5	0	113.3
1204	N	29.5	Very low	33	Very low	144 Å²	144	141.7 Å²	141.7	77%	0.77	76%	0.755	S	S	*	*			trans	-79.9	165.6	170.7	-54.9	-19.7	0	0	0	110.8
1205	D	35.5	Very low	32.5	Very low	161 Å²	161	143.5 Å²	143.5	86%	0.861	76%	0.758	S	S	*	*				-163.8	161.8	113.6	-98.3	-29.2	0	0	0	112.5
1206	N	32.9	Very low	32.7	Very low	144 Å²	144	145.2 Å²	145.2	77%	0.77	76%	0.757	S	S	*	*			trans	-97.7	153.9	-172.5	-58.8	-66.7	0	0	0	113
1207	N	33.9	Very low	32.7	Very low	159 Å²	159	141.7 Å²	141.7	85%	0.85	75%	0.745	S	S	*	*				-166	163.4	116.4	-120.5	-44.5	0	0	0	116.1
1208	N	32.9	Very low	32.9	Very low	126 Å²	126	140.1 Å²	140.1	67%	0.674	74%	0.741	S	S	*	*			trans	-91.1	163.5	178.6	-68.4	-51.9	0	0	0	113.3
1209	N	34.2	Very low	33	Very low	146 Å²	146	139 Å²	139	78%	0.781	74%	0.741	S	S	*	*				176.6	104.4	114.6	-87.7	-24.5	0	0	0	115.8
1210	N	34.2	Very low	33.2	Very low	127 Å²	127	139.3 Å²	139.3	68%	0.679	75%	0.748	S	S	*	*				36.9	128.7	125.9	-59.4	-6.8	0	0	0	123.9
1211	N	31	Very low	33.2	Very low	136 Å²	136	135.8 Å²	135.8	73%	0.727	74%	0.744	S	S	*	*				80.8	105.8	128.7	-66.4	1.8	0	0	0	124
1212	T	29.9	Very low	33.2	Very low	115 Å²	115	140.1 Å²	140.1	71%	0.706	76%	0.759	S	S	*	*				45.2	127.8	125.8	62.5	0	0	0	0	122.4
1213	T	31.3	Very low	33.3	Very low	121 Å²	121	141.7 Å²	141.7	74%	0.742	76%	0.761	S	S	*	*				179	124.9	102.7	29.4	0	0	0	0	115.8
1214	I	31.3	Very low	33.7	Very low	154 Å²	154	137.1 Å²	137.1	79%	0.79	75%	0.752	S	S	*	*			trans	44.2	155.6	134.8	-29.7	172.3	0	0	0	122.3
1215	I	33.6	Very low	33.9	Very low	144 Å²	144	137.2 Å²	137.2	74%	0.738	75%	0.751	S	S	*	*			trans	90.6	132.1	165.8	-59.7	179.4	0	0	0	113.7
1216	H	34.2	Very low	33.4	Very low	158 Å²	158	138.2 Å²	138.2	73%	0.731	75%	0.751	S	S	*	*			cis	-163.9	178.8	-9.4	-115.4	23.8	0	0	0	108.1
1217	N	35.4	Very low	33.3	Very low	111 Å²	111	140.1 Å²	140.1	59%	0.594	75%	0.753	S	S	*	*			cis	177.6	176.2	-32.3	-172.1	8.4	0	0	0	108.1
1218	N	35.1	Very low	33	Very low	130 Å²	130	138 Å²	138	70%	0.695	75%	0.75	S	S	*	*			trans	72.6	144.7	175.5	-63	-21.9	0	0	0	117.6
1219	N	35.7	Very low	33.5	Very low	138 Å²	138	137.2 Å²	137.2	74%	0.738	75%	0.752	S	S	*	*			cis	167.1	149.9	-21.8	-122	-27.3	0	0	0	104.9
1220	T	37.1	Very low	33.2	Very low	131 Å²	131	138.1 Å²	138.1	80%	0.804	76%	0.756	S	S	*	*			cis	-132	-171.4	4.4	68.9	0	0	0	0	107.8
1221	G	31.3	Very low	33	Very low	63 Å²	63	143 Å²	143	65%	0.649	77%	0.765	S	S	*	*			cis	159.2	-152.5	-0.2	0	0	0	0	0	112.5
1222	L	34.9	Very low	33	Very low	182 Å²	182	148.5 Å²	148.5	95%	0.953	78%	0.775	S	S	*	*			trans	67.2	141.1	-173.4	-66.7	177.7	0	0	0	117
1223	H	31.3	Very low	33.1	Very low	181 Å²	181	151.5 Å²	151.5	84%	0.838	79%	0.786	S	S	*	*			trans	-148.5	-178.2	-168.5	-104.9	-67.9	0	0	0	106.3
1224	P	42.6	Very low	33.2	Very low	109 Å²	109	149.6 Å²	149.6	71%	0.708	79%	0.79	S	S	*	*			cis	-114.6	-147.2	-18.2	19.9	6.2	0	0	0	108.1
1225	I	33.3	Very low	33.3	Very low	146 Å²	146	145.2 Å²	145.2	75%	0.749	78%	0.783	S	S	*	*			cis	-144.8	141.7	5.2	-51.5	161.2	0	0	0	108.9	F1227	I1225-F1227 HydrophobicContact CG2-CD2 4.34Å
1226	E	26.4	Very low	33.6	Very low	182 Å²	182	147.1 Å²	147.1	85%	0.85	79%	0.793	S	S	*	*			trans	-138.4	148.2	154.3	-172	-173.9	-116.2	0	0	106.8
1227	F	30.2	Very low	33.5	Very low	184 Å²	184	142.6 Å²	142.6	81%	0.807	79%	0.789	S	S	*	*			trans	-155.3	136	167.9	-102.6	-64.1	0	0	0	114.8	I1225	I1225-F1227 HydrophobicContact CG2-CD2 4.34Å
1228	S	27.2	Very low	33.7	Very low	113 Å²	113	143.1 Å²	143.1	79%	0.79	80%	0.797	S	S	*	*			trans	-132.5	154.5	149.4	-80.6	0	0	0	0	108.6
1229	P	42.6	Very low	34	Very low	111 Å²	111	142.4 Å²	142.4	72%	0.721	80%	0.802	S	S	*	*			trans	-100	153.2	-152.8	36.4	-35.7	0	0	0	115
1230	L	28.8	Very low	34.1	Very low	164 Å²	164	141.4 Å²	141.4	86%	0.859	80%	0.801	S	S	*	*				-178.3	160.9	123.4	-102	168.4	0	0	0	114.8
1231	R	29.7	Very low	34.2	Very low	231 Å²	231	140.2 Å²	140.2	87%	0.872	80%	0.798	S	S	*	*			trans	67.3	126	168.2	-65.1	-173.7	178.9	-153.9	-0.6	120
1232	R	31.6	Very low	34.6	Very low	250 Å²	250	142.7 Å²	142.7	94%	0.943	81%	0.805	S	S	*	*				-138.6	150.5	128.4	-99.9	-169.1	-178.7	-159.7	0.4	110.7
1233	L	31.3	Very low	34.6	Very low	179 Å²	179	138.1 Å²	138.1	94%	0.937	80%	0.802	S	S	*	*			trans	-135.2	159.3	168.9	-92.6	171	0	0	0	108
1234	G	34.3	Very low	34.8	Very low	80 Å²	80	132.9 Å²	132.9	83%	0.825	80%	0.797	S	S	*	*			trans	175.2	146.5	169.1	0	0	0	0	0	110.2
1235	G	33.2	Very low	34.6	Very low	62 Å²	62	134.3 Å²	134.3	64%	0.639	81%	0.809	S	S	*	*			cis	175.7	-174.2	-3.2	0	0	0	0	0	111
1236	I	39	Very low	34.6	Very low	184 Å²	184	130.6 Å²	130.6	94%	0.944	81%	0.808	S	S	*	*			trans	73.4	135.3	-179.1	-45.3	157.9	0	0	0	112.1
1237	G	33.8	Very low	35.1	Very low	64 Å²	64	128.4 Å²	128.4	66%	0.66	81%	0.806	S	S	*	*			cis	172.8	176.1	1.1	0	0	0	0	0	109.7
1238	T	38.9	Very low	35.4	Very low	122 Å²	122	126.6 Å²	126.6	75%	0.748	81%	0.805	S	S	*	*			cis	-169.8	133.8	-13	37.5	0	0	0	0	110.9
1239	S	40.2	Very low	35.8	Very low	115 Å²	115	126.3 Å²	126.3	80%	0.804	80%	0.803	S	S	*	*			trans	67.1	159.2	157.1	77.9	0	0	0	0	119.1
1240	T	38.4	Very low	35.5	Very low	117 Å²	117	125 Å²	125	72%	0.718	81%	0.81	S	S	*	*			cis	-151.1	154.2	9.8	47.7	0	0	0	0	113.5
1241	S	39.8	Very low	35.8	Very low	105 Å²	105	121.1 Å²	121.1	73%	0.734	81%	0.809	S	S	*	*			trans	42.8	154.6	140.9	64.9	0	0	0	0	124.6
1242	S	39.7	Very low	36.3	Very low	115 Å²	115	114.7 Å²	114.7	80%	0.804	80%	0.8	S	S	*	*			cis	178.2	142.7	-20.9	55.8	0	0	0	0	112.6
1243	G	34.7	Very low	36.8	Very low	86 Å²	86	110.2 Å²	110.2	89%	0.887	79%	0.794	S	S	*	*			trans	81.2	160.9	164.1	0	0	0	0	0	117.5
1244	G	35	Very low	37.2	Very low	72 Å²	72	104.6 Å²	104.6	74%	0.742	78%	0.78	S	S	*	*			cis	170.4	143.1	-11.5	0	0	0	0	0	115
1245	S	37.6	Very low	37.8	Very low	138 Å²	138	108 Å²	108	97%	0.965	79%	0.785	S	S	*	*			trans	69.6	145	168.5	-57.3	0	0	0	0	119.8
1246	G	34.9	Very low	38.2	Very low	69 Å²	69	110.2 Å²	110.2	71%	0.711	79%	0.791	S	S	*	*			trans	-173.6	-19.2	178.9	0	0	0	0	0	127
1247	V	36.5	Very low	38.5	Very low	135 Å²	135	114.7 Å²	114.7	82%	0.818	80%	0.804	S	S	*	*			trans	63.2	153	169.8	-138.2	0	0	0	0	120.8
1248	N	36	Very low	38.7	Very low	147 Å²	147	117.3 Å²	117.3	79%	0.786	81%	0.811	S	S	*	*			trans	71.4	148.1	162.4	-71.4	-14.5	0	0	0	120.6
1249	S	36.4	Very low	38.7	Very low	106 Å²	106	117 Å²	117	74%	0.741	81%	0.814	S	S	*	*			cis	-174.1	143.2	-21.6	52.2	0	0	0	0	112.3
1250	G	35.2	Very low	38.6	Very low	85 Å²	85	117.1 Å²	117.1	88%	0.876	82%	0.815	S	S	*	*			trans	88	151.9	175.9	0	0	0	0	0	114.2
1251	G	35.4	Very low	38.6	Very low	81 Å²	81	117.1 Å²	117.1	84%	0.835	82%	0.821	S	S	*	*			cis	122.2	132.7	8.1	0	0	0	0	0	110.5
1252	S	40.3	Very low	38.6	Very low	97 Å²	97	117.9 Å²	117.9	68%	0.678	83%	0.826	S	S	*	*			cis	-156.9	173.8	-0.2	56.2	0	0	0	0	111.3
1253	D	41.4	Very low	38.5	Very low	155 Å²	155	118.1 Å²	118.1	83%	0.829	83%	0.828	S	S	*	*			trans	66.1	150.1	159.1	-45.7	-48.4	0	0	0	119.9
1254	G	40.1	Very low	38.8	Very low	62 Å²	62	120.4 Å²	120.4	64%	0.639	82%	0.823	S	S	*	*			cis	-175.9	148.7	-7.2	0	0	0	0	0	115
1255	T	46.5	Very low	39.1	Very low	151 Å²	151	124.1 Å²	124.1	93%	0.926	83%	0.83	S	S	*	*			trans	51.8	119.3	159.9	53.9	0	0	0	0	121.3
1256	S	43.3	Very low	39.2	Very low	108 Å²	108	122.9 Å²	122.9	76%	0.755	82%	0.818	S	S	*	*			trans	-86.2	159.7	162.7	54.6	0	0	0	0	113.4
1257	F	44.4	Very low	39.6	Very low	279 Å²	279	127.8 Å²	127.8	100%	1.224	83%	0.828	S	S	*	*				-144.1	0	127.3	-119.8	-72.5	0	0	0	110.3

Retrieved 1,257 of 1,257 residues in 346.3 ms (Link to these results)

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