A0A087XCT2_POEFO Loading...

Synapse defective Rho GTPase homolog 2

AlphaFold DB , UniProt , Accession A0A087XCT2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 976 aa.

						>A0A087XCT2_POEFO|A0A087XCT2
SKEIFKPPGITKYFHTCAFIENFQTPCANGREASRLTNEPSSWSPQLTTTITVSKKRNWLQQSSQPKSHCTKDELQGMLGAEESCQLPPAPSPSPEFVRSTGGALPRPVRPQIPQVRSSTDVVVGQCKVSPHPRSVDPSEENDADDEGEIWYNPIPEDDEPETSRRPCIRLVVPPQGEAQRRPGRGADVAQVGWTSEGSSGPEAVMEGPGCGTGDLSSGNAAHSTEALHLHRQMLACKPPEEGGPSSSRPTEIKKLAFVQNQVIADVLDLPNVVSFSPPSSPNPTKKSSSINWSFPDKIKSPRTVRKISMKMKKLPELSRKLSVKGTQNSNTSSNGNCQTSGPPRLAPSGGGPASRNVISRYHLDSSVSTQHSFNKKKNDGSSKSASKGGYLSDGDSPELVAKSGKHGSAEGKGGKGKDAEGGSSRLNGTELDIDAFRHYSFTDQPKCSQYISGLMSLHFYGAEDLKPPRIDSRDVYCAIQVDSVNKARTALLTCRTSFLDMDHTFNIELENAQHLKLVVFSWEPTPKRNRVCCHGTVVLPALFRVTRTHQLAVKLEPRGLIYVKLNLMEQWQNSLDGGPDGDREPQVFGVEAWRVVERENTGLMVPLIIYKCINEIERRGCQVVGLYRLCGSAAVKKELREAFERDSQGAELCESMFPDINVITGVLKDYLRELPYPLITKQLYEAVLETMATRPLKMAAAGCENDLADSEYTVSLLEILPEVERMTLRKLLDHLKRVASYQEMNKMTCQNLAVCFGPVLLSQRQEASCHTNRVFIDSEELASALHFKKHIEVLHYLLQLWPDYFNLISQTSHANLFVDPNDQSSLRFPAAPPLRRRKERPQFLNLSEAEMAGVLRPKPGRLDSPSNRYAGDWSGCGESYFPSELLLPPSKEEADYDDVPSEDTEAAEEAHEKDAAEEDDQILPKEHTYQAYMKIQDISPVLSNRVNLRDLQESIDTLIGNLERELNKNKLNVGY
					

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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	S	28.6	Very low	33.9	Very low	167 Å²	167	143.2 Å²	143.2	100%	1.168	79%	0.791	S	S	*	*				0	128.5	0	-48.3	0	0	0	0	109.1
2	K	32.1	Very low	33.3	Very low	172 Å²	172	144.2 Å²	144.2	75%	0.748	78%	0.781	S	S	*	*			trans	61.4	161	172.2	-64.6	174.6	156.7	-80.7	0	115.5
3	E	33.6	Very low	32.7	Very low	131 Å²	131	145.5 Å²	145.5	61%	0.612	77%	0.77	S	S	*	*			cis	-155	136.2	-25.5	-110.7	155.6	175.7	0	0	110.7
4	I	35.9	Very low	32.2	Very low	125 Å²	125	146.6 Å²	146.6	64%	0.641	77%	0.765	S	S	*	*			trans	23.6	131.7	137.6	-32.4	163.8	0	0	0	120.6
5	F	30.1	Very low	31.9	Very low	191 Å²	191	147.1 Å²	147.1	84%	0.838	76%	0.762	S	S	*	*				160.6	141.2	116.6	-94.3	-72.3	0	0	0	117.6
6	K	29	Very low	31.4	Very low	192 Å²	192	144.6 Å²	144.6	84%	0.835	76%	0.756	S	S	*	*			trans	-106.2	-172.9	157.8	-99.9	-177.4	179.5	-179.8	0	107.8
7	P	55	Low	31	Very low	118 Å²	118	143.3 Å²	143.3	77%	0.766	76%	0.76	S	S	*	*			cis	-126.2	-137.3	15.1	37.5	-12.5	0	0	0	110.2
8	P	49.8	Very low	30.7	Very low	129 Å²	129	139.8 Å²	139.8	84%	0.838	75%	0.754	S	S	*	*			cis	-130.8	-151.3	-10.7	43	-22.9	0	0	0	114.1
9	G	27	Very low	30.4	Very low	67 Å²	67	142.7 Å²	142.7	69%	0.691	76%	0.759	S	S	*	*			trans	-166.9	169.1	173.3	0	0	0	0	0	114.4
10	I	26	Very low	30.2	Very low	169 Å²	169	142.5 Å²	142.5	87%	0.867	76%	0.757	S	S	*	*			trans	-176.2	158.6	-179.1	-113	156.3	0	0	0	109.9
11	T	25.6	Very low	29.9	Very low	114 Å²	114	142.9 Å²	142.9	70%	0.699	76%	0.755	S	S	*	*			cis	-165.9	161.6	-30.8	-97	0	0	0	0	111.8
12	K	27.1	Very low	29.8	Very low	155 Å²	155	139.8 Å²	139.8	67%	0.674	73%	0.725	S	S	*	*			trans	-33	151.3	173.1	-50	166.9	-178.8	174.3	0	120.3
13	Y	25.9	Very low	29.4	Very low	162 Å²	162	139.1 Å²	139.1	64%	0.635	72%	0.722	S	S	*	*				160.9	149	100.5	-100.2	-63.6	0	0	0	118.7
14	F	25.7	Very low	29	Very low	160 Å²	160	140.6 Å²	140.6	70%	0.702	73%	0.729	S	S	*	*			trans	61.7	156.5	155.5	-67	-56.3	0	0	0	120.4
15	H	26.4	Very low	28.6	Very low	154 Å²	154	140 Å²	140	71%	0.713	73%	0.732	S	S	*	*			cis	-158	-163.4	-8.4	-125.3	-33.7	0	0	0	109.3
16	T	24.8	Very low	28.6	Very low	108 Å²	108	137 Å²	137	66%	0.663	73%	0.731	S	S	*	*			cis	-167.5	160.1	7.3	-2.6	0	0	0	0	111.7
17	C	24.2	Very low	28.5	Very low	122 Å²	122	133.6 Å²	133.6	82%	0.824	73%	0.73	S	S	*	*			trans	62.1	158.9	148.3	-69.4	0	0	0	0	122.8
18	A	25.6	Very low	27.2	Very low	80 Å²	80	132.9 Å²	132.9	66%	0.661	73%	0.734	S	S	*	*			cis	-170.2	153.1	-20.7	0	0	0	0	0	115.6
19	F	24.5	Very low	26	Very low	195 Å²	195	134.8 Å²	134.8	86%	0.855	74%	0.737	S	S	*	*			trans	58.4	147.3	142.6	-88.7	-58.9	0	0	0	127.7
20	I	26.4	Very low	26	Very low	138 Å²	138	134.3 Å²	134.3	71%	0.708	73%	0.732	S	S	*	*			trans	75.6	136.7	146.2	-73.6	163.1	0	0	0	118
21	E	25.7	Very low	26	Very low	152 Å²	152	137.3 Å²	137.3	71%	0.71	73%	0.733	S	S	*	*			cis	-176.4	179.4	-11.3	-107.5	-173.2	160.5	0	0	107.9
22	N	25.1	Very low	25.9	Very low	102 Å²	102	139.4 Å²	139.4	55%	0.545	74%	0.735	S	S	.	*			cis	-163.3	164.8	-9.5	-121.7	-22.1	0	0	0	112.2
23	F	24.3	Very low	25.9	Very low	157 Å²	157	136.7 Å²	136.7	69%	0.689	74%	0.741	S	S	*	*			trans	62	150.5	151	-82.4	-129.4	0	0	0	120.9
24	Q	24.7	Very low	25.7	Very low	162 Å²	162	133.9 Å²	133.9	76%	0.757	75%	0.745	S	S	*	*			cis	-158	171	-20.9	-139.9	178.1	14.8	0	0	110.4
25	T	28	Very low	25.6	Very low	113 Å²	113	136.5 Å²	136.5	69%	0.693	75%	0.75	S	S	*	*			trans	-93.9	-177.1	-179.9	54.5	0	0	0	0	113.7
26	P	30.4	Very low	25.5	Very low	128 Å²	128	135.9 Å²	135.9	83%	0.831	75%	0.751	S	S	*	*				-136	154.6	110.6	38.2	-29.8	0	0	0	115.1
27	C	25.9	Very low	25.4	Very low	121 Å²	121	136 Å²	136	82%	0.818	75%	0.752	S	S	*	*			trans	-134.6	134.7	168.8	-70.8	0	0	0	0	110.7
28	A	27.3	Very low	25.4	Very low	102 Å²	102	137.6 Å²	137.6	84%	0.843	75%	0.753	S	S	*	*			trans	-168.7	148	167.3	0	0	0	0	0	110.7
29	N	26.3	Very low	25.2	Very low	169 Å²	169	142.2 Å²	142.2	90%	0.904	76%	0.76	S	S	*	*			cis	-165.6	155	-28.4	-158.5	-8.2	0	0	0	109
30	G	25.7	Very low	25.3	Very low	57 Å²	57	138.4 Å²	138.4	59%	0.588	76%	0.755	S	S	*	*			trans	103.3	102.2	150.8	0	0	0	0	0	120.8
31	R	25.7	Very low	25.1	Very low	233 Å²	233	136 Å²	136	88%	0.879	75%	0.751	S	S	*	*				60	158.8	128	-65.9	-175.6	177.4	157.7	0.6	122.3
32	E	25.2	Very low	25	Very low	158 Å²	158	134.2 Å²	134.2	74%	0.738	76%	0.755	S	S	*	*			cis	-175.3	144	-29.9	-173	161.9	-170.7	0	0	109.3
33	A	25.3	Very low	24.8	Very low	97 Å²	97	141.7 Å²	141.7	80%	0.802	78%	0.776	S	S	*	*			trans	63.6	160.8	166.8	0	0	0	0	0	119.5
34	S	23.4	Very low	24.8	Very low	103 Å²	103	139.3 Å²	139.3	72%	0.72	78%	0.778	S	S	*	*			cis	-172	160.9	-34.5	-169.6	0	0	0	0	110.7
35	R	23.7	Very low	24.8	Very low	216 Å²	216	137.7 Å²	137.7	82%	0.815	78%	0.782	S	S	*	*			trans	93	121.8	155.3	-60	-164	-179.6	-169.5	-0.3	122.5
36	L	22.6	Very low	24.6	Very low	140 Å²	140	140 Å²	140	73%	0.733	79%	0.785	S	S	*	*			trans	85.6	106.8	131.8	-70.5	169.3	0	0	0	122.4
37	T	23.5	Very low	24.5	Very low	110 Å²	110	142.2 Å²	142.2	68%	0.675	79%	0.789	S	S	*	*			trans	53	121.6	131.1	56.9	0	0	0	0	121.6
38	N	23.4	Very low	24.6	Very low	157 Å²	157	140.3 Å²	140.3	84%	0.84	77%	0.774	S	S	*	*				-165.6	145.1	99.6	-93	-19.9	0	0	0	113.4
39	E	23.2	Very low	24.7	Very low	177 Å²	177	139.9 Å²	139.9	83%	0.827	76%	0.761	S	S	*	*			trans	-76.8	159.8	166.4	-77.9	-83.2	124.2	0	0	111.2
40	P	26	Very low	24.9	Very low	115 Å²	115	135.6 Å²	135.6	75%	0.747	74%	0.741	S	S	*	*				-140.1	109.4	125.2	34.7	-20.4	0	0	0	115.1
41	S	22.7	Very low	25.3	Very low	88 Å²	88	136.9 Å²	136.9	62%	0.615	73%	0.733	S	S	*	*			trans	31.6	109.1	138.3	61.8	0	0	0	0	120
42	S	22.7	Very low	25.6	Very low	114 Å²	114	130 Å²	130	80%	0.797	72%	0.717	S	S	*	*			trans	-21.4	136	152.2	56.6	0	0	0	0	118.4
43	W	21.5	Very low	25.9	Very low	258 Å²	258	125.6 Å²	125.6	98%	0.977	70%	0.701	S	S	*	*			trans	-109	145.6	150	-84.5	11.3	0	0	0	110
44	S	23.3	Very low	26	Very low	107 Å²	107	125.3 Å²	125.3	75%	0.748	69%	0.693	S	S	*	*			trans	-104.1	139.9	-176.8	52.3	0	0	0	0	112.4
45	P	26.1	Very low	26.5	Very low	129 Å²	129	130.5 Å²	130.5	84%	0.838	70%	0.703	S	S	*	*			trans	-69.3	144.6	169.9	-15	29.9	0	0	0	112.1
46	Q	23.6	Very low	26.7	Very low	162 Å²	162	129.8 Å²	129.8	76%	0.757	71%	0.706	S	S	*	*			trans	-89.8	161.7	171.4	-70.2	178.7	-27	0	0	111.6	T48	Q46-T48 PolarHBondContact O-N 3.01Å; Q46-T48 VanDerWaalsContact O-N 3.07Å
47	L	27.1	Very low	27.4	Very low	174 Å²	174	134.1 Å²	134.1	91%	0.911	71%	0.712	S	S	*	*			trans	-79	84.5	-173.2	-72.2	164.2	0	0	0	112.7	T49	L47-T49 PolarHBondContact O-N 2.94Å
48	T	29.1	Very low	27.6	Very low	80 Å²	80	136.1 Å²	136.1	49%	0.491	72%	0.719	S	S	.	*			trans	-72.8	119.4	174.3	46.1	0	0	0	0	112.3	Q46 T50	Q46-T48 PolarHBondContact O-N 3.01Å; Q46-T48 VanDerWaalsContact O-N 3.07Å; T48-T50 PolarHBondContact O-N 3.46Å
49	T	29.6	Very low	27.7	Very low	94 Å²	94	140.1 Å²	140.1	58%	0.577	72%	0.722	S	S	*	*			trans	-82.2	102.2	179	-61.6	0	0	0	0	111	L47 I51	L47-T49 PolarHBondContact O-N 2.94Å; T49-I51 HydrophobicContact CG2-CG1 4.46Å
50	T	29.8	Very low	27.7	Very low	79 Å²	79	139.4 Å²	139.4	49%	0.485	72%	0.723	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.1	126.3	-178.5	-59.3	0	0	0	0	111.6	T48	T48-T50 PolarHBondContact O-N 3.46Å
51	I	33.5	Very low	27.7	Very low	84 Å²	84	142.9 Å²	142.9	43%	0.431	73%	0.73	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.3	125.7	176.8	-55.7	179.8	0	0	0	109.7	T49 V53 T505 N507	T49-I51 HydrophobicContact CG2-CG1 4.46Å; I51-V53 HydrophobicContact CG2-CG2 3.97Å; I51-T505 PolarHBondContact N-O 3.15Å; I51-T505 VanDerWaalsContact N-O 3.15Å; I51-N507 PolarHBondContact O-N 3.06Å
52	T	33.3	Very low	27.9	Very low	88 Å²	88	147.3 Å²	147.3	54%	0.54	74%	0.74	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.5	130.2	176.5	-58	0	0	0	0	109.1	N507	T52-N507 HydrophobicContact CG2-CB 4.28Å; T52-N507 PolarHBondContact OG1-ND2 3.16Å
53	V	31.5	Very low	27.9	Very low	66 Å²	66	147.3 Å²	147.3	40%	0.4	74%	0.74	S	S	.	*			trans	-128.1	107.1	-173.8	-174	0	0	0	0	110.6	I51	I51-V53 HydrophobicContact CG2-CG2 3.97Å
54	S	26.6	Very low	28	Very low	91 Å²	91	140.8 Å²	140.8	64%	0.636	73%	0.734	S	S	*	*			trans	-118	126	171.9	56.5	0	0	0	0	110
55	K	33.3	Very low	28	Very low	212 Å²	212	143.6 Å²	143.6	92%	0.922	74%	0.736	S	S	*	*			trans	-134.7	132.5	170.6	-92.2	-169.8	173	-176.4	0	110.3
56	K	29.3	Very low	27.9	Very low	201 Å²	201	143.6 Å²	143.6	87%	0.874	74%	0.735	S	S	*	*			trans	-118.5	149.5	-173.8	-180	173.3	-177.6	170.5	0	110.1
57	R	36	Very low	28	Very low	231 Å²	231	145.1 Å²	145.1	87%	0.872	74%	0.739	S	S	*	*			trans	98.4	149.7	-179.6	-68.2	-178.9	168.4	167.1	-2.2	115.4
58	N	29.2	Very low	27.7	Very low	152 Å²	152	142.5 Å²	142.5	81%	0.813	74%	0.736	S	S	*	*			cis	-167.9	148.4	-37.4	-123.2	7	0	0	0	108
59	W	24.1	Very low	27.4	Very low	241 Å²	241	148 Å²	148	91%	0.913	76%	0.755	S	S	*	*			trans	-89.8	142.6	176	-82.4	83.1	0	0	0	113
60	L	24.1	Very low	27	Very low	161 Å²	161	149.6 Å²	149.6	84%	0.843	77%	0.769	S	S	*	*			trans	-146	101.1	160.4	-97	177.7	0	0	0	110.1
61	Q	26.4	Very low	26.7	Very low	189 Å²	189	152 Å²	152	88%	0.883	78%	0.784	S	S	*	*			trans	-152.6	156.9	149.2	-112.6	-177.9	29.4	0	0	109.6
62	Q	25.6	Very low	26.4	Very low	180 Å²	180	156.6 Å²	156.6	84%	0.841	80%	0.801	S	S	*	*			trans	-112	129.9	-160.7	-68	177.9	-34.6	0	0	113.2
63	S	23	Very low	26	Very low	114 Å²	114	159.4 Å²	159.4	80%	0.797	81%	0.813	S	S	*	*			trans	34.3	120.3	137.4	169.2	0	0	0	0	119.6
64	S	23.7	Very low	25.6	Very low	121 Å²	121	165.2 Å²	165.2	85%	0.846	84%	0.836	S	S	*	*				-140.6	135	124.8	55.2	0	0	0	0	111.5
65	Q	23.8	Very low	25.7	Very low	167 Å²	167	167.9 Å²	167.9	78%	0.78	84%	0.842	S	S	*	*			trans	-116.5	152	170.2	-82.6	-168.9	-6.3	0	0	109.6
66	P	24.2	Very low	25.3	Very low	128 Å²	128	165.6 Å²	165.6	83%	0.831	83%	0.834	S	S	*	*			trans	-118.2	152.4	135.6	35.2	-29.1	0	0	0	111.7
67	K	24	Very low	25.2	Very low	194 Å²	194	159.1 Å²	159.1	84%	0.843	82%	0.824	S	S	*	*			trans	-90.5	149.1	178.6	-59.4	175.8	-179.9	179	0	111.7
68	S	22.6	Very low	24.6	Very low	120 Å²	120	156.4 Å²	156.4	84%	0.839	82%	0.824	S	S	*	*			trans	-155.5	152.4	142.2	61.5	0	0	0	0	111.7
69	H	21.9	Very low	24.5	Very low	194 Å²	194	157.2 Å²	157.2	90%	0.898	83%	0.827	S	S	*	*			trans	-100.1	148	163.3	-71.8	-107.5	0	0	0	108.6
70	C	21.9	Very low	24.5	Very low	129 Å²	129	149 Å²	149	87%	0.872	82%	0.818	S	S	*	*			trans	-161.2	-177.9	132.6	-142.9	0	0	0	0	111.6
71	T	23.4	Very low	24.6	Very low	128 Å²	128	146 Å²	146	79%	0.785	82%	0.816	S	S	*	*			trans	-111	177.6	-163.6	50.5	0	0	0	0	114.7
72	K	27.4	Very low	24.7	Very low	181 Å²	181	145.9 Å²	145.9	79%	0.787	82%	0.815	S	S	*	*			trans	-31.9	150.5	159.3	-58.5	-179.5	172	-175.1	0	113.5
73	D	24.4	Very low	24.8	Very low	148 Å²	148	144.3 Å²	144.3	79%	0.791	81%	0.808	S	S	*	*				-143.5	-171.4	54	-88.9	-52.3	0	0	0	111.5
74	E	23.8	Very low	24.9	Very low	188 Å²	188	143.5 Å²	143.5	88%	0.879	80%	0.802	S	S	*	*			cis	-149.6	-172	24.2	-153.5	170.7	-178.5	0	0	112.4
75	L	27.6	Very low	24.8	Very low	147 Å²	147	142.7 Å²	142.7	77%	0.77	80%	0.795	S	S	*	*			trans	-135.2	-173.9	-163.3	-133.3	171.7	0	0	0	112.1
76	Q	25.6	Very low	24.9	Very low	164 Å²	164	143.5 Å²	143.5	77%	0.766	80%	0.799	S	S	*	*			trans	66.5	145.6	-177.9	-96.9	67.2	13.2	0	0	116.5
77	G	27.3	Very low	24.9	Very low	64 Å²	64	145.1 Å²	145.1	66%	0.66	80%	0.8	S	S	*	*			cis	113.5	119.7	-5.1	0	0	0	0	0	114.1
78	M	23.3	Very low	26.2	Very low	174 Å²	174	141.1 Å²	141.1	86%	0.857	79%	0.794	S	S	*	*			trans	-136.3	170	177.6	-86.2	-92.3	67.8	0	0	112.1
79	L	25.8	Very low	27.7	Very low	169 Å²	169	141.2 Å²	141.2	89%	0.885	79%	0.791	S	S	*	*			trans	-128.1	163.6	-146.9	-67.1	163	0	0	0	115.7
80	G	24.2	Very low	28.1	Very low	70 Å²	70	136.4 Å²	136.4	72%	0.722	79%	0.786	S	S	*	*			trans	145.4	115.9	169.5	0	0	0	0	0	111.4
81	A	27.6	Very low	29.5	Very low	97 Å²	97	136.7 Å²	136.7	80%	0.802	79%	0.786	S	S	*	*			cis	81.1	127.5	22.8	0	0	0	0	0	113.3
82	E	27.9	Very low	29.9	Very low	187 Å²	187	135.8 Å²	135.8	87%	0.874	79%	0.785	S	S	*	*			cis	-142.8	-164.4	-5	-57.1	-170.8	119.7	0	0	108.1
83	E	28.1	Very low	31.2	Very low	147 Å²	147	133 Å²	133	69%	0.687	79%	0.785	S	S	*	*			cis	-165.5	176.1	2.7	-145.8	-68.3	94	0	0	108.5
84	S	24.4	Very low	31.4	Very low	96 Å²	96	131 Å²	131	67%	0.671	78%	0.783	S	S	*	*			trans	84.4	146.5	149.2	85.3	0	0	0	0	118.5
85	C	22.7	Very low	32.8	Very low	104 Å²	104	127.3 Å²	127.3	70%	0.703	78%	0.775	S	S	*	*			cis	-165.6	166.8	-24.3	-138.6	0	0	0	0	112.7
86	Q	24	Very low	32.8	Very low	185 Å²	185	127.5 Å²	127.5	86%	0.864	77%	0.772	S	S	*	*			trans	79.7	162.4	157	-65.9	-179.4	12.7	0	0	123.3
87	L	25.7	Very low	32.9	Very low	162 Å²	162	127.7 Å²	127.7	85%	0.848	77%	0.771	S	S	*	*			trans	-161.4	179.9	-169.2	-98.5	169.2	0	0	0	106.9
88	P	51.3	Low	32.9	Very low	110 Å²	110	130 Å²	130	71%	0.714	77%	0.772	S	S	*	*			cis	-126.8	-137.8	-7.9	36.6	-12.3	0	0	0	109.4
89	P	52.7	Low	33.1	Very low	121 Å²	121	132.6 Å²	132.6	79%	0.786	77%	0.772	S	S	*	*			cis	-133.6	-169.8	-17.4	41.6	-22.2	0	0	0	116
90	A	31.6	Very low	33.1	Very low	94 Å²	94	129.5 Å²	129.5	78%	0.777	77%	0.765	S	S	*	*			trans	-144.6	167.2	169.2	0	0	0	0	0	111.3
91	P	50.3	Low	33.2	Very low	134 Å²	134	132.8 Å²	132.8	87%	0.87	77%	0.771	S	S	*	*			trans	-127.9	157.9	165.8	38.5	-25.7	0	0	0	115.5
92	S	33.4	Very low	33.2	Very low	109 Å²	109	132.2 Å²	132.2	76%	0.762	77%	0.774	S	S	*	*			trans	-123.1	-175.7	168.9	59.5	0	0	0	0	110.5
93	P	53.4	Low	33.2	Very low	122 Å²	122	127 Å²	127	79%	0.792	77%	0.771	S	S	*	*				-151.8	179.5	95.9	38.4	-19.1	0	0	0	117.1
94	S	28.8	Very low	33.1	Very low	108 Å²	108	124.8 Å²	124.8	76%	0.755	78%	0.778	S	S	*	*			trans	-148.7	173.9	174.2	-48.1	0	0	0	0	108.8
95	P	53.8	Low	33.3	Very low	109 Å²	109	128.1 Å²	128.1	71%	0.708	79%	0.787	S	S	*	*				-156.9	-163.5	96.2	36.2	-12.6	0	0	0	115.3
96	E	26.3	Very low	33.8	Very low	152 Å²	152	128.3 Å²	128.3	71%	0.71	79%	0.787	S	S	*	*			trans	70.3	161.5	159.7	-64.3	-171.5	-166.4	0	0	117.8
97	F	28.6	Very low	34.4	Very low	168 Å²	168	130.9 Å²	130.9	74%	0.737	79%	0.789	S	S	*	*			cis	-165.3	179.2	-26.2	-103.5	-27.3	0	0	0	107.9
98	V	28.2	Very low	34.8	Very low	113 Å²	113	128.4 Å²	128.4	69%	0.685	78%	0.782	S	S	*	*			cis	-151.5	162.9	4.7	-124.5	0	0	0	0	109.5
99	R	26	Very low	33.6	Very low	228 Å²	228	130 Å²	130	86%	0.86	79%	0.789	S	S	*	*			trans	67.3	118	165.2	-71	178.7	-172.3	171.3	4.9	116.8
100	S	25.6	Very low	32.3	Very low	104 Å²	104	135.2 Å²	135.2	73%	0.727	79%	0.793	S	S	*	*				80.8	141.7	78.5	-53.5	0	0	0	0	112.9
101	T	28	Very low	32.6	Very low	139 Å²	139	134.9 Å²	134.9	85%	0.853	78%	0.783	S	S	*	*			cis	-158.4	144.2	25.5	-32.2	0	0	0	0	113.1
102	G	27.5	Very low	31.3	Very low	84 Å²	84	137.7 Å²	137.7	87%	0.866	79%	0.785	S	S	*	*			trans	73	149.9	171.4	0	0	0	0	0	115.2
103	G	27.7	Very low	30.9	Very low	78 Å²	78	139.5 Å²	139.5	80%	0.804	78%	0.784	S	S	*	*			cis	165.3	150.5	-5.1	0	0	0	0	0	108.9
104	A	26.3	Very low	30.2	Very low	101 Å²	101	138.5 Å²	138.5	84%	0.835	78%	0.778	S	S	*	*			cis	-153.6	-147.4	-2.7	0	0	0	0	0	110.4
105	L	27.5	Very low	29.9	Very low	166 Å²	166	141.4 Å²	141.4	87%	0.869	78%	0.779	S	S	*	*			trans	-140.1	170.2	-176.9	-81.6	168.9	0	0	0	109.7
106	P	34.1	Very low	28.5	Very low	107 Å²	107	141.1 Å²	141.1	70%	0.695	78%	0.775	S	S	*	*			cis	-135.7	162.9	11.5	40	-22.4	0	0	0	117.6
107	R	35.6	Very low	28.3	Very low	240 Å²	240	145.3 Å²	145.3	91%	0.906	79%	0.785	S	S	*	*			trans	-84.3	148.5	141.7	-81.5	-179.3	170.2	174	-3.1	108.1
108	P	34.6	Very low	28	Very low	110 Å²	110	142.3 Å²	142.3	71%	0.714	79%	0.785	S	S	*	*				-154	-177.1	118.6	32	-10.4	0	0	0	116.7
109	V	25.2	Very low	27.8	Very low	142 Å²	142	142 Å²	142	86%	0.861	79%	0.787	S	S	*	*			trans	89.8	143.9	160.2	-163.9	0	0	0	0	117.4
110	R	25.8	Very low	27.8	Very low	231 Å²	231	136.6 Å²	136.6	87%	0.872	78%	0.78	S	S	*	*			trans	-123.7	-122.4	-167.9	-177.5	-164.1	169.6	173.8	-1.9	110.3
111	P	38.2	Very low	27.7	Very low	87 Å²	87	138.4 Å²	138.4	57%	0.565	78%	0.782	S	S	*	*			trans	-93.1	171.1	-133.2	39.3	-32.2	0	0	0	115.1
112	Q	23.3	Very low	27.6	Very low	194 Å²	194	138.2 Å²	138.2	91%	0.907	78%	0.78	S	S	*	*				-150.2	145.3	128.3	-118.9	152.2	100.5	0	0	115.8
113	I	25.3	Very low	27.5	Very low	146 Å²	146	139.9 Å²	139.9	75%	0.749	77%	0.773	S	S	*	*			trans	-129.3	157.1	171.5	-73.5	166.6	0	0	0	102.1
114	P	37.5	Very low	27.4	Very low	102 Å²	102	143.2 Å²	143.2	66%	0.662	78%	0.777	S	S	*	*			cis	-138	-159	15.3	20.5	8.9	0	0	0	114.7
115	Q	23.5	Very low	27.3	Very low	168 Å²	168	141.6 Å²	141.6	79%	0.785	77%	0.771	S	S	*	*			trans	101.9	151.1	142.4	-63.8	-147.2	21.6	0	0	119.9
116	V	23.2	Very low	27.2	Very low	103 Å²	103	142.7 Å²	142.7	62%	0.624	77%	0.771	S	S	*	*			cis	-178.3	155.8	-39.2	123	0	0	0	0	109.3
117	R	22.3	Very low	26.8	Very low	240 Å²	240	142.8 Å²	142.8	91%	0.906	77%	0.774	S	S	*	*			trans	69.5	157.2	174.9	-77.7	154.7	-169.5	-176.7	2	115.3
118	S	23.4	Very low	26.2	Very low	105 Å²	105	140.8 Å²	140.8	73%	0.734	77%	0.771	S	S	*	*			cis	-147.4	164.5	6.2	45.3	0	0	0	0	113.8
119	S	23.6	Very low	25.7	Very low	106 Å²	106	142.2 Å²	142.2	74%	0.741	78%	0.778	S	S	*	*			trans	1.4	158.2	147.6	-35.3	0	0	0	0	121
120	T	26.2	Very low	25.7	Very low	116 Å²	116	140.6 Å²	140.6	71%	0.712	77%	0.773	S	S	*	*			cis	-157.6	144.6	35.5	46.3	0	0	0	0	115.1
121	D	23.7	Very low	26.3	Very low	142 Å²	142	135.5 Å²	135.5	76%	0.759	77%	0.77	S	S	*	*			trans	48.1	162	133.3	-58.7	-68.4	0	0	0	126.3
122	V	25.4	Very low	25.6	Very low	135 Å²	135	139.7 Å²	139.7	82%	0.818	78%	0.781	S	S	*	*			trans	81	136.7	164.7	-167	0	0	0	0	117.4
123	V	24.7	Very low	26.8	Very low	119 Å²	119	135.4 Å²	135.4	72%	0.721	77%	0.77	S	S	*	*			cis	174.7	144.8	-46.7	146.1	0	0	0	0	108.6
124	V	25.4	Very low	26.8	Very low	147 Å²	147	139.5 Å²	139.5	89%	0.891	78%	0.776	S	S	*	*			trans	69.9	142	174.7	164	0	0	0	0	115.6
125	G	25.1	Very low	26.3	Very low	67 Å²	67	139.5 Å²	139.5	69%	0.691	78%	0.778	S	S	*	*			cis	-156	-175.2	10.6	0	0	0	0	0	116.5
126	Q	25.4	Very low	26.4	Very low	189 Å²	189	138.7 Å²	138.7	88%	0.883	79%	0.785	S	S	*	*			trans	-90.5	174.5	-175.1	-58.5	163.3	-19.2	0	0	110.7
127	C	24.5	Very low	26.5	Very low	110 Å²	110	140.8 Å²	140.8	74%	0.743	79%	0.793	S	S	*	*			cis	-139.7	154.8	20.7	-68.4	0	0	0	0	109.3
128	K	23.8	Very low	27.9	Very low	197 Å²	197	134.6 Å²	134.6	86%	0.857	78%	0.783	S	S	*	*			cis	70.3	107.3	45.9	-161.1	-177.9	-171.1	-179.4	0	114.6
129	V	23.5	Very low	28	Very low	140 Å²	140	135.4 Å²	135.4	85%	0.848	79%	0.789	S	S	*	*			trans	172.8	147.6	140.8	147.9	0	0	0	0	111.2
130	S	25.1	Very low	28.4	Very low	108 Å²	108	139 Å²	139	76%	0.755	79%	0.794	S	S	*	*			trans	-132.7	167.3	172.4	-38.6	0	0	0	0	107.4
131	P	39.8	Very low	28.5	Very low	125 Å²	125	142.7 Å²	142.7	81%	0.812	80%	0.803	S	S	*	*				-156.3	-168.8	50.9	43.2	-19.2	0	0	0	118.4
132	H	22.6	Very low	28.8	Very low	175 Å²	175	143 Å²	143	81%	0.81	81%	0.805	S	S	*	*			trans	-39.9	-178.2	158.7	-87.4	22.4	0	0	0	119.5
133	P	49.8	Very low	29	Very low	104 Å²	104	144.7 Å²	144.7	68%	0.675	81%	0.809	S	S	*	*			cis	-143.7	-169.2	-27.7	37.9	-18.3	0	0	0	114.9
134	R	24.3	Very low	29.4	Very low	232 Å²	232	142.6 Å²	142.6	88%	0.875	81%	0.805	S	S	*	*			trans	132.4	130	153.2	-76.4	178.1	178.2	177.6	-0.3	111.4
135	S	26.1	Very low	29.7	Very low	101 Å²	101	141 Å²	141	71%	0.706	79%	0.791	S	S	*	*			cis	96.5	113.6	33	76.9	0	0	0	0	114.4
136	V	26.1	Very low	30.2	Very low	151 Å²	151	143 Å²	143	92%	0.915	79%	0.786	S	S	*	*			trans	174	149.8	146.9	144.5	0	0	0	0	109.8
137	D	26.4	Very low	30.4	Very low	148 Å²	148	139.2 Å²	139.2	79%	0.791	77%	0.768	S	S	*	*			trans	-157.7	163.4	176	-161.4	35.8	0	0	0	105.6
138	P	50.1	Low	30.7	Very low	109 Å²	109	137.5 Å²	137.5	71%	0.708	77%	0.769	S	S	*	*			cis	-125.9	-166.5	-6.4	43.6	-28	0	0	0	112.9
139	S	26.7	Very low	31.1	Very low	123 Å²	123	133.5 Å²	133.5	86%	0.86	75%	0.754	S	S	*	*			trans	-166.1	152	145	-134	0	0	0	0	113
140	E	31.8	Very low	31.5	Very low	182 Å²	182	134.4 Å²	134.4	85%	0.85	75%	0.752	S	S	*	*			trans	-88.4	156.8	175.3	-58.2	160.9	97.7	0	0	112.4
141	E	28.9	Very low	31.7	Very low	193 Å²	193	139.5 Å²	139.5	90%	0.902	76%	0.755	S	S	*	*				-165.1	156.7	123.1	-163.3	147.5	-165.3	0	0	110.1
142	N	30	Very low	31.2	Very low	148 Å²	148	144.3 Å²	144.3	79%	0.791	76%	0.758	S	S	*	*			trans	-106.8	146.8	172.5	-75	-92.5	0	0	0	109.8
143	D	28.8	Very low	31.5	Very low	170 Å²	170	142.9 Å²	142.9	91%	0.909	76%	0.757	S	S	*	*			trans	-134.4	142.9	158.2	-109.5	-33.9	0	0	0	109.2
144	A	32.1	Very low	30.8	Very low	75 Å²	75	143 Å²	143	62%	0.62	76%	0.757	S	S	*	*			trans	-153.6	176.6	-174.5	0	0	0	0	0	110.8
145	D	33	Very low	31.1	Very low	113 Å²	113	139.1 Å²	139.1	60%	0.604	75%	0.752	S	S	*	*			trans	69.3	161	172.2	-57.4	-9.8	0	0	0	114.7	R529	D145-R529 IonicContact OD1-NH2 2.76Å; D145-R529 IonicContact OD2-CZ 3.68Å; D145-R529 VanDerWaalsContact OD2-CZ 3.25Å; D145-R529 IonicContact OD2-NH1 3.6Å; D145-R529 PolarHBondContact OD2-NH1 3.49Å; D145-R529 IonicContact OD2-NH2 2.84Å; D145-R529 PolarHBondContact OD2-NH2 3.04Å
146	D	35.2	Very low	31.5	Very low	110 Å²	110	139.7 Å²	139.7	59%	0.588	75%	0.754	S	S	*	*			cis	-155.1	143.7	-19.7	-114.1	-12.5	0	0	0	105.7	R529	D146-R529 IonicContact OD2-CZ 2.88Å; D146-R529 IonicContact OD2-NH2 3.57Å; D146-R529 PolarHBondContact OD2-NH2 2.68Å
147	E	29.6	Very low	31.8	Very low	110 Å²	110	141.3 Å²	141.3	51%	0.514	75%	0.752	S	S	.	*			cis	-140.7	179.9	4.5	-60.1	-172.2	46.8	0	0	111	E149 K528	E147-E149 HydrophobicContact CB-CG 4.37Å; E147-K528 WeakPolarHBondContact OE1-CD 3.4Å; E147-K528 IonicContact OE1-NZ 3.16Å; E147-K528 PolarHBondContact OE1-NZ 2.82Å; E147-K528 WeakPolarHBondContact OE2-CD 3.49Å; E147-K528 IonicContact OE2-NZ 3.89Å; E147-K528 PolarHBondContact OE2-NZ 3.11Å
148	G	30	Very low	32	Very low	74 Å²	74	142.1 Å²	142.1	76%	0.763	76%	0.756	S	S	*	*			trans	-127.4	62	172.8	0	0	0	0	0	112.8	I150	G148-I150 PolarHBondContact O-N 2.73Å
149	E	33.8	Very low	31.1	Very low	113 Å²	113	144.9 Å²	144.9	53%	0.528	77%	0.765	S	S	.	*			trans	-65.3	122.2	-175.6	-63.2	-168.7	151	0	0	112.9	E147 W151 K528	E147-E149 HydrophobicContact CB-CG 4.37Å; E149-W151 PolarHBondContact OE2-NE1 3.48Å; E149-K528 IonicContact OE1-NZ 2.65Å; E149-K528 PolarHBondContact OE1-NZ 2.97Å
150	I	32.2	Very low	31.3	Very low	159 Å²	159	147.3 Å²	147.3	82%	0.815	76%	0.762	S	S	*	*			trans	-108.9	111.6	163	-58	-179.6	0	0	0	107.9	G148	G148-I150 PolarHBondContact O-N 2.73Å
151	W	29.3	Very low	31.3	Very low	215 Å²	215	143.4 Å²	143.4	81%	0.814	75%	0.753	S	S	*	*			trans	-69.6	129.5	179.5	-74.7	59.3	0	0	0	110.6	E149 N153	E149-W151 PolarHBondContact OE2-NE1 3.48Å; W151-N153 PolarHBondContact O-N 2.84Å
152	Y	28.3	Very low	31	Very low	226 Å²	226	143.7 Å²	143.7	89%	0.886	75%	0.754	S	S	*	*			trans	-72.8	121.6	159.7	-88.1	-96.4	0	0	0	107.8	P154	Y152-P154 WeakPolarHBondContact O-CD 3.23Å
153	N	29.1	Very low	30.8	Very low	144 Å²	144	143 Å²	143	77%	0.77	76%	0.755	S	S	*	*			trans	-96.2	110.4	170.5	-165.3	62.2	0	0	0	108.4	W151	W151-N153 PolarHBondContact O-N 2.84Å
154	P	35.4	Very low	30.7	Very low	106 Å²	106	139.5 Å²	139.5	69%	0.688	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-62.7	138.7	169.1	-15.1	30.2	0	0	0	109	Y152	Y152-P154 WeakPolarHBondContact O-CD 3.23Å
155	I	31.1	Very low	30.3	Very low	151 Å²	151	147.7 Å²	147.7	77%	0.774	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-81.3	136.7	162.4	-63.2	178.5	0	0	0	106.1
156	P	32.9	Very low	29.8	Very low	114 Å²	114	152.9 Å²	152.9	74%	0.74	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-61.6	150.9	-172.7	-23.9	34.6	0	0	0	113.6
157	E	32.3	Very low	29.1	Very low	185 Å²	185	153.6 Å²	153.6	86%	0.864	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-86.1	147.1	153.9	-61.6	179.3	143.4	0	0	107.4	D159	E157-D159 PolarHBondContact O-N 2.8Å
158	D	32.3	Very low	28.7	Very low	165 Å²	165	153.8 Å²	153.8	88%	0.882	79%	0.793	S	S	*	*			trans	-77.2	114.6	-175	-67.4	-60.1	0	0	0	111.9	E160	D158-E160 PolarHBondContact O-N 3.24Å
159	D	29.9	Very low	28.4	Very low	167 Å²	167	158.2 Å²	158.2	89%	0.893	80%	0.798	S	S	*	*			trans	-76.9	107.9	168.4	-87.7	-50.1	0	0	0	110.5	E157	E157-D159 PolarHBondContact O-N 2.8Å
160	E	31.5	Very low	27.9	Very low	174 Å²	174	163 Å²	163	81%	0.813	81%	0.811	S	S	*	*			trans	-111.6	150.4	164.3	-94.4	-79.7	106.7	0	0	110.6	D158	D158-E160 PolarHBondContact O-N 3.24Å
161	P	31.1	Very low	27.4	Very low	100 Å²	100	162 Å²	162	65%	0.649	81%	0.807	S	S	*	*			trans	-95.2	128.6	-145.9	33.8	-36.7	0	0	0	116.5
162	E	22.8	Very low	27.2	Very low	198 Å²	198	157.6 Å²	157.6	93%	0.925	80%	0.803	S	S	*	*			trans	-90.5	120.5	159.2	-84.4	-145	147.2	0	0	112.9	S164	E162-S164 PolarHBondContact O-N 3.23Å
163	T	25.6	Very low	26.9	Very low	134 Å²	134	152.9 Å²	152.9	82%	0.822	80%	0.798	S	S	*	*			trans	-86.1	104.5	173.9	56.6	0	0	0	0	112.8
164	S	28	Very low	27.2	Very low	96 Å²	96	151.4 Å²	151.4	67%	0.671	80%	0.796	S	S	*	*			trans	56.4	128.7	141.4	-176.8	0	0	0	0	120.1	E162	E162-S164 PolarHBondContact O-N 3.23Å
165	R	23.5	Very low	26.9	Very low	248 Å²	248	152.2 Å²	152.2	94%	0.936	80%	0.801	S	S	*	*			trans	-146	138.3	133	-111	151.5	-155	-133.4	3.4	114
166	R	22.3	Very low	26.8	Very low	221 Å²	221	154.6 Å²	154.6	83%	0.834	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-81	153.8	-177.1	-56.2	169.8	176.3	156.4	-3.5	111.7
167	P	19.6	Very low	26.5	Very low	125 Å²	125	152.8 Å²	152.8	81%	0.812	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-66.2	136.9	148.6	31.2	-32.4	0	0	0	109.5
168	C	22.1	Very low	26.1	Very low	115 Å²	115	153.4 Å²	153.4	78%	0.777	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-103.7	125.7	176.8	-172.3	0	0	0	0	110.2
169	I	24.3	Very low	25.9	Very low	166 Å²	166	150.2 Å²	150.2	85%	0.851	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-95.7	132.9	171.3	-60.6	175.3	0	0	0	108.3
170	R	21.4	Very low	25.6	Very low	214 Å²	214	150.1 Å²	150.1	81%	0.808	80%	0.804	S	S	*	*			trans	-134.7	119.3	173.7	-98.2	-161	160.2	-159.1	-2.8	112.7
171	L	22.6	Very low	25.4	Very low	139 Å²	139	152.5 Å²	152.5	73%	0.728	81%	0.806	S	S	*	*			trans	61.2	154.6	148.6	-76.9	89	0	0	0	120.2
172	V	25.1	Very low	25.1	Very low	122 Å²	122	159.1 Å²	159.1	74%	0.739	82%	0.818	S	S	*	*			cis	-168.8	-177.8	-36.6	99.5	0	0	0	0	109
173	V	23.1	Very low	25.7	Very low	127 Å²	127	156 Å²	156	77%	0.77	82%	0.815	S	S	*	*			trans	93.8	121.5	170.7	-167.1	0	0	0	0	116.4
174	P	33.8	Very low	25.7	Very low	113 Å²	113	152.5 Å²	152.5	73%	0.734	81%	0.806	S	S	*	*			trans	-119.3	178.7	174.3	43.2	-33.3	0	0	0	114.3
175	P	30.6	Very low	25.5	Very low	123 Å²	123	160.3 Å²	160.3	80%	0.799	82%	0.821	S	S	*	*			trans	-107	-174.6	160.1	38	-29.6	0	0	0	114.2
176	Q	27.7	Very low	25.5	Very low	200 Å²	200	151.8 Å²	151.8	94%	0.935	81%	0.809	S	S	*	*			trans	-72.7	172.6	-171	-63.4	154.9	-40.9	0	0	114.5
177	G	26.8	Very low	25.6	Very low	76 Å²	76	145.4 Å²	145.4	78%	0.784	80%	0.804	S	S	*	*			cis	-165.7	-153.8	13.4	0	0	0	0	0	115.6
178	E	24.7	Very low	25.8	Very low	199 Å²	199	146.8 Å²	146.8	93%	0.93	81%	0.805	S	S	*	*			trans	-87.5	156.9	-156.3	-50.8	176.7	106.3	0	0	118.3
179	A	26.5	Very low	26	Very low	97 Å²	97	147.5 Å²	147.5	80%	0.802	81%	0.805	S	S	*	*				-175.8	138.4	127.1	0	0	0	0	0	116.2
180	Q	25.3	Very low	26	Very low	165 Å²	165	143.1 Å²	143.1	77%	0.771	79%	0.794	S	S	*	*			trans	57.5	90.6	146.1	-118.3	65.6	-26.1	0	0	125.5
181	R	25.8	Very low	26.1	Very low	224 Å²	224	141.6 Å²	141.6	85%	0.845	80%	0.796	S	S	*	*				22.9	127.7	126.9	-57.7	-179.1	-175.3	-175.2	2.3	122.4
182	R	25.5	Very low	26.2	Very low	239 Å²	239	141.4 Å²	141.4	90%	0.902	80%	0.8	S	S	*	*				35.2	144.6	108.3	-96	-173	-169.5	179.1	6.2	120.1
183	P	36.5	Very low	26.2	Very low	132 Å²	132	138.1 Å²	138.1	86%	0.857	79%	0.791	S	S	*	*				-146.2	-170.2	67.5	43	-25.8	0	0	0	116.9
184	G	23.6	Very low	26.2	Very low	62 Å²	62	143.3 Å²	143.3	64%	0.639	80%	0.797	S	S	*	*			trans	-161.9	176.6	169.4	0	0	0	0	0	110.8
185	R	24.3	Very low	25.8	Very low	260 Å²	260	143.3 Å²	143.3	98%	0.981	80%	0.795	S	S	*	*			trans	71.2	151.9	-159.8	-52.6	175.4	177.2	-102.4	1.2	112.3
186	G	23.7	Very low	25.5	Very low	68 Å²	68	142.7 Å²	142.7	70%	0.701	79%	0.794	S	S	*	*			cis	-147.8	161.7	-6.6	0	0	0	0	0	108.9
187	A	24.2	Very low	25.3	Very low	88 Å²	88	142.5 Å²	142.5	73%	0.727	79%	0.792	S	S	*	*				102.6	139.8	72.3	0	0	0	0	0	111.5
188	D	24.4	Very low	25.3	Very low	154 Å²	154	142.8 Å²	142.8	82%	0.824	80%	0.796	S	S	*	*			trans	67.2	147.2	165.5	-54.7	-31.2	0	0	0	117.9
189	V	26	Very low	25.4	Very low	130 Å²	130	138.8 Å²	138.8	79%	0.788	79%	0.79	S	S	*	*			cis	-160.5	169.3	-4.4	112.2	0	0	0	0	112.1
190	A	23.9	Very low	25.4	Very low	73 Å²	73	140 Å²	140	60%	0.603	79%	0.792	S	S	*	*			trans	91.4	131.6	158.3	0	0	0	0	0	122.1
191	Q	23.3	Very low	25.3	Very low	183 Å²	183	135.3 Å²	135.3	86%	0.855	79%	0.789	S	S	*	*			trans	55.9	127.8	142.3	-70.8	174.7	-68.2	0	0	119.5
192	V	26.4	Very low	26.3	Very low	135 Å²	135	131.2 Å²	131.2	82%	0.818	79%	0.791	S	S	*	*			cis	-145.4	149.9	5	-179.6	0	0	0	0	105.8
193	G	25.3	Very low	26.2	Very low	53 Å²	53	128.5 Å²	128.5	55%	0.546	79%	0.788	S	S	.	*			cis	119.1	59.4	22.3	0	0	0	0	0	110.1
194	W	22.6	Very low	25.8	Very low	236 Å²	236	126.6 Å²	126.6	89%	0.894	78%	0.784	S	S	*	*				92.3	125.8	101.1	-91.3	61	0	0	0	115.9
195	T	24.3	Very low	26	Very low	113 Å²	113	129.7 Å²	129.7	69%	0.693	79%	0.79	S	S	*	*			trans	50	120.2	147.6	56.5	0	0	0	0	123.2
196	S	24.6	Very low	26.1	Very low	110 Å²	110	124.4 Å²	124.4	77%	0.769	78%	0.779	S	S	*	*				-165.5	134.2	128.3	-85	0	0	0	0	107.1
197	E	24.6	Very low	26.2	Very low	195 Å²	195	129 Å²	129	91%	0.911	78%	0.782	S	S	*	*				62.7	136.5	69	-71	-150.6	134.8	0	0	115.2
198	G	25.1	Very low	26.3	Very low	83 Å²	83	128 Å²	128	86%	0.856	78%	0.78	S	S	*	*			trans	145.1	137.6	170.2	0	0	0	0	0	115.3
199	S	27.5	Very low	27.1	Very low	115 Å²	115	127.5 Å²	127.5	80%	0.804	79%	0.785	S	S	*	*			trans	-134	164.2	168.3	-177.4	0	0	0	0	109.2
200	S	26.6	Very low	27.1	Very low	121 Å²	121	124.5 Å²	124.5	85%	0.846	78%	0.78	S	S	*	*			trans	73.7	161.1	179.3	75.5	0	0	0	0	118
201	G	24.4	Very low	27.2	Very low	68 Å²	68	127.7 Å²	127.7	70%	0.701	80%	0.797	S	S	*	*			trans	-93.2	-146.4	-173.6	0	0	0	0	0	114.4
202	P	45.6	Very low	27.4	Very low	138 Å²	138	122.1 Å²	122.1	90%	0.896	79%	0.789	S	S	*	*			cis	-130.9	-122.1	23.5	40.7	-20.2	0	0	0	115.1
203	E	23.9	Very low	27.4	Very low	181 Å²	181	122.3 Å²	122.3	85%	0.846	79%	0.79	S	S	*	*			trans	-94.7	162.3	-156.3	-51.9	-178.1	99.2	0	0	117.9
204	A	27.9	Very low	27.5	Very low	93 Å²	93	122.7 Å²	122.7	77%	0.769	79%	0.794	S	S	*	*			trans	69.9	159.4	140.4	0	0	0	0	0	120.1
205	V	27.3	Very low	27.7	Very low	127 Å²	127	118.4 Å²	118.4	77%	0.77	79%	0.789	S	S	*	*			cis	-165.6	-178.1	-19.4	135.9	0	0	0	0	106.9
206	M	27.3	Very low	27.9	Very low	149 Å²	149	119.7 Å²	119.7	73%	0.734	79%	0.79	S	S	*	*			trans	83.3	137.8	166	-130.6	68.7	164.4	0	0	115
207	E	25.9	Very low	28	Very low	165 Å²	165	119.1 Å²	119.1	77%	0.771	79%	0.786	S	S	*	*			cis	-148.1	161.6	-12.5	-124.9	171.8	169.9	0	0	107
208	G	24.9	Very low	28.1	Very low	67 Å²	67	116 Å²	116	69%	0.691	79%	0.787	S	S	*	*				89.6	150.2	60.9	0	0	0	0	0	111.6
209	P	41.3	Very low	28	Very low	142 Å²	142	114.9 Å²	114.9	92%	0.922	78%	0.775	S	S	*	*			cis	-121.2	-170.6	-13.6	42.9	-27.5	0	0	0	112
210	G	27.6	Very low	28	Very low	67 Å²	67	117.3 Å²	117.3	69%	0.691	78%	0.779	S	S	*	*			cis	166.7	-168.6	-5.3	0	0	0	0	0	113
211	C	25.3	Very low	27.9	Very low	141 Å²	141	115.6 Å²	115.6	95%	0.953	77%	0.772	S	S	*	*			trans	74.8	127.4	-176.8	-161.3	0	0	0	0	115.5
212	G	26.6	Very low	27.9	Very low	66 Å²	66	116.2 Å²	116.2	68%	0.68	77%	0.771	S	S	*	*			cis	-174.4	166.8	-4.4	0	0	0	0	0	109.2
213	T	27.3	Very low	26.9	Very low	139 Å²	139	118.2 Å²	118.2	85%	0.853	77%	0.767	S	S	*	*			cis	-153	164	8	-51.9	0	0	0	0	109.2
214	G	26.7	Very low	26.9	Very low	61 Å²	61	113.6 Å²	113.6	63%	0.629	76%	0.755	S	S	*	*			trans	-69.5	-167.1	-175.4	0	0	0	0	0	116.5
215	D	26.5	Very low	26.8	Very low	145 Å²	145	114.5 Å²	114.5	78%	0.775	75%	0.752	S	S	*	*			cis	-160.1	176.5	37.3	-82.5	-17.6	0	0	0	110.2
216	L	29	Very low	26.6	Very low	140 Å²	140	116.4 Å²	116.4	73%	0.733	75%	0.752	S	S	*	*			cis	-165.9	167.5	-23.3	-103.8	168.9	0	0	0	109.6
217	S	27.6	Very low	26.4	Very low	98 Å²	98	113 Å²	113	69%	0.685	75%	0.748	S	S	*	*			trans	52.3	111.8	148.9	-64.5	0	0	0	0	123.3
218	S	25.7	Very low	26.2	Very low	131 Å²	131	112.3 Å²	112.3	92%	0.916	75%	0.749	S	S	*	*				32.3	130.6	108.6	-166.6	0	0	0	0	121.1
219	G	23.9	Very low	26.2	Very low	59 Å²	59	116.7 Å²	116.7	61%	0.608	75%	0.751	S	S	*	*			trans	143.5	134.2	142.7	0	0	0	0	0	117.4
220	N	26.4	Very low	25.4	Very low	165 Å²	165	116.9 Å²	116.9	88%	0.882	74%	0.743	S	S	*	*			trans	61.2	141.9	159	-62	-13.2	0	0	0	118.1
221	A	24.4	Very low	25.3	Very low	86 Å²	86	120.7 Å²	120.7	71%	0.711	74%	0.743	S	S	*	*			cis	105.1	100.7	23.9	0	0	0	0	0	114.5
222	A	25.8	Very low	25.3	Very low	81 Å²	81	123 Å²	123	67%	0.669	73%	0.731	S	S	*	*			trans	74.7	157.3	145.6	0	0	0	0	0	121.5
223	H	24.1	Very low	25.3	Very low	179 Å²	179	127 Å²	127	83%	0.829	73%	0.732	S	S	*	*			trans	72.9	142.8	162.9	-59.5	-56.9	0	0	0	118.5
224	S	23.2	Very low	25.2	Very low	85 Å²	85	126.5 Å²	126.5	59%	0.594	72%	0.722	S	S	*	*			cis	-169.5	178.5	-20.3	-157.2	0	0	0	0	109.6
225	T	25.4	Very low	25.2	Very low	112 Å²	112	130.6 Å²	130.6	69%	0.687	73%	0.729	S	S	*	*			trans	59.4	148	153.5	50	0	0	0	0	118.5
226	E	23.1	Very low	25.1	Very low	166 Å²	166	127.4 Å²	127.4	78%	0.776	72%	0.722	S	S	*	*			cis	-153.7	158.3	-7.6	-112.8	166.4	146.5	0	0	107
227	A	23	Very low	24.8	Very low	78 Å²	78	126.4 Å²	126.4	65%	0.645	73%	0.725	S	S	*	*				40.5	133.8	87.7	0	0	0	0	0	113.7
228	L	23.3	Very low	24.7	Very low	151 Å²	151	131.6 Å²	131.6	79%	0.791	74%	0.736	S	S	*	*			cis	-150.8	142.7	29.6	-80.9	170.9	0	0	0	108.7
229	H	23.3	Very low	25.9	Very low	159 Å²	159	130.7 Å²	130.7	74%	0.736	73%	0.727	S	S	*	*				84.7	149.2	68.7	-154.5	-171.7	0	0	0	113.9
230	L	25.1	Very low	26.6	Very low	146 Å²	146	133 Å²	133	76%	0.764	73%	0.731	S	S	*	*			trans	75.5	147	-177	-47.3	176.2	0	0	0	114.2
231	H	25.3	Very low	26.6	Very low	147 Å²	147	133.2 Å²	133.2	68%	0.681	73%	0.727	S	S	*	*			cis	-137.1	127.4	22.3	-162.1	82.5	0	0	0	113.7
232	R	26.7	Very low	26.7	Very low	188 Å²	188	137.6 Å²	137.6	71%	0.709	73%	0.733	S	S	*	*			trans	52.7	128.8	137.4	-132.4	164.4	-174.1	-174.2	3.9	119.9
233	Q	25.9	Very low	26.7	Very low	150 Å²	150	137.6 Å²	137.6	70%	0.701	74%	0.74	S	S	*	*				52.1	140.1	71.4	-105.4	-165.8	1	0	0	113.1
234	M	24.9	Very low	26.6	Very low	129 Å²	129	132.6 Å²	132.6	64%	0.635	74%	0.737	S	S	*	*			cis	-171.5	-179.8	8.9	-164.7	163.5	52.2	0	0	111.2
235	L	26.9	Very low	27.9	Very low	148 Å²	148	134.1 Å²	134.1	78%	0.775	75%	0.745	S	S	*	*			trans	84.4	154.5	155.3	-58.5	169.8	0	0	0	119.1
236	A	24.6	Very low	28	Very low	77 Å²	77	134.5 Å²	134.5	64%	0.636	75%	0.752	S	S	*	*			cis	-175.4	175.7	-33.9	0	0	0	0	0	112
237	C	22	Very low	28.2	Very low	119 Å²	119	131.8 Å²	131.8	80%	0.804	75%	0.752	S	S	*	*			trans	73.6	81.9	149.1	-67.3	0	0	0	0	121.2
238	K	25.7	Very low	28.4	Very low	208 Å²	208	133.3 Å²	133.3	90%	0.904	76%	0.758	S	S	*	*				60.9	158.5	117.6	-85.3	-160.6	171.2	-170.7	0	122.4
239	P	51.9	Low	28.6	Very low	112 Å²	112	137.3 Å²	137.3	73%	0.727	76%	0.762	S	S	*	*			trans	-98.8	-165	-164.7	42.8	-37.4	0	0	0	113
240	P	36.9	Very low	29.8	Very low	108 Å²	108	134.7 Å²	134.7	70%	0.701	76%	0.759	S	S	*	*				-157.7	-176.6	88.6	47.3	-28.3	0	0	0	117.6
241	E	26.5	Very low	29.9	Very low	169 Å²	169	134.2 Å²	134.2	79%	0.79	76%	0.763	S	S	*	*			trans	61.9	156.8	156.4	-49.9	-156.4	142.6	0	0	119.8
242	E	26.5	Very low	30	Very low	178 Å²	178	134.5 Å²	134.5	83%	0.832	77%	0.765	S	S	*	*			cis	-157.9	172.2	-17.9	-123.1	-156.5	148.1	0	0	110.7
243	G	26.1	Very low	30	Very low	80 Å²	80	133 Å²	133	83%	0.825	77%	0.769	S	S	*	*			trans	102	139.3	143.6	0	0	0	0	0	121.7
244	G	23.1	Very low	30	Very low	75 Å²	75	133.5 Å²	133.5	77%	0.773	77%	0.769	S	S	*	*			trans	-140.9	-148	155.3	0	0	0	0	0	107.5
245	P	50.6	Low	30	Very low	117 Å²	117	136 Å²	136	76%	0.76	78%	0.776	S	S	*	*			cis	-135.5	-172.1	-23.9	42.9	-26.8	0	0	0	113.2
246	S	27.7	Very low	30	Very low	119 Å²	119	136.7 Å²	136.7	83%	0.832	78%	0.78	S	S	*	*			trans	63.3	176.3	168	80.7	0	0	0	0	115.7
247	S	26.1	Very low	30.1	Very low	110 Å²	110	136.3 Å²	136.3	77%	0.769	78%	0.777	S	S	*	*			cis	-150.2	162.9	-8.7	-159.3	0	0	0	0	105.3
248	S	27.7	Very low	30.3	Very low	110 Å²	110	139.9 Å²	139.9	77%	0.769	78%	0.779	S	S	*	*			cis	-170.5	168.3	41.7	55.8	0	0	0	0	113.4
249	R	28.1	Very low	30.5	Very low	234 Å²	234	135.4 Å²	135.4	88%	0.883	77%	0.768	S	S	*	*			trans	-88.4	-174.1	166.9	-113.6	176.9	162.3	-179.5	-7	110.5
250	P	47.4	Very low	29.4	Very low	104 Å²	104	137.7 Å²	137.7	68%	0.675	77%	0.769	S	S	*	*			cis	-132	-167.4	-30.2	39.8	-23.3	0	0	0	111.9
251	T	26.9	Very low	28.9	Very low	136 Å²	136	139 Å²	139	83%	0.834	77%	0.771	S	S	*	*				-168.7	123.4	116.7	-73.8	0	0	0	0	110
252	E	27.3	Very low	29	Very low	154 Å²	154	137.8 Å²	137.8	72%	0.72	77%	0.765	S	S	*	*			trans	-89.1	161.7	162.5	-60.9	-178.9	103.8	0	0	109.7
253	I	28.1	Very low	29	Very low	156 Å²	156	136.2 Å²	136.2	80%	0.8	77%	0.767	S	S	*	*				-161.1	116.2	116.1	-101	152.7	0	0	0	111.9
254	K	25.5	Very low	29.2	Very low	161 Å²	161	138.6 Å²	138.6	70%	0.7	76%	0.76	S	S	*	*			trans	23.9	132.1	141.4	-56.8	164.9	-173.4	172.9	0	119.3
255	K	25.2	Very low	29.6	Very low	182 Å²	182	139.1 Å²	139.1	79%	0.791	76%	0.756	S	S	*	*			cis	75.9	110.5	38.5	-172.2	-171.2	178.4	178.4	0	114.8
256	L	25.5	Very low	28.4	Very low	162 Å²	162	141 Å²	141	85%	0.848	76%	0.76	S	S	*	*				-163.3	133.6	129.8	-117.2	72	0	0	0	105
257	A	28.1	Very low	28.5	Very low	69 Å²	69	141.2 Å²	141.2	57%	0.57	76%	0.756	S	S	*	*			cis	76.4	139.4	34.2	0	0	0	0	0	112.2
258	F	25.5	Very low	28.7	Very low	194 Å²	194	143.4 Å²	143.4	85%	0.851	76%	0.758	S	S	*	*			cis	-168.1	-156.2	3	-152.1	-105.8	0	0	0	108.8
259	V	30.5	Very low	28.6	Very low	113 Å²	113	145.1 Å²	145.1	69%	0.685	76%	0.759	S	S	*	*			trans	79	133.2	156.2	-173.4	0	0	0	0	115.8
260	Q	27.6	Very low	28.6	Very low	160 Å²	160	141 Å²	141	75%	0.748	75%	0.754	S	S	*	*			cis	-152.9	-179.5	-13.3	-117.1	175.5	-68	0	0	106.6
261	N	27.7	Very low	28.6	Very low	136 Å²	136	141.2 Å²	141.2	73%	0.727	76%	0.755	S	S	*	*			cis	-149.5	179.3	16.9	-147.7	-2.8	0	0	0	113.4
262	Q	27.2	Very low	28.8	Very low	143 Å²	143	141.5 Å²	141.5	67%	0.668	75%	0.751	S	S	*	*			trans	-136.9	154	-169.2	-177.6	-177.7	14.3	0	0	112	I264	Q262-I264 HydrophobicContact CG-CD1 4.22Å; Q262-I264 HydrophobicContact CG-CG1 3.87Å
263	V	28.2	Very low	28.8	Very low	146 Å²	146	140.3 Å²	140.3	89%	0.885	75%	0.754	S	S	*	*			trans	-134.8	151.8	162.1	-175.1	0	0	0	0	108.8
264	I	30	Very low	28.9	Very low	130 Å²	130	139 Å²	139	67%	0.667	75%	0.753	S	S	*	*			trans	-141.5	167.2	-165.2	-48.7	176.7	0	0	0	109.8	Q262	Q262-I264 HydrophobicContact CG-CD1 4.22Å; Q262-I264 HydrophobicContact CG-CG1 3.87Å
265	A	30.9	Very low	28.9	Very low	85 Å²	85	135.6 Å²	135.6	70%	0.702	75%	0.75	S	S	*	*			trans	99.7	148.1	160.8	0	0	0	0	0	116.2
266	D	25.2	Very low	29	Very low	156 Å²	156	136.5 Å²	136.5	83%	0.834	76%	0.755	S	S	*	*			cis	-143.8	-179.9	10.1	-136.2	-29.8	0	0	0	114.8
267	V	30	Very low	29	Very low	124 Å²	124	133.8 Å²	133.8	75%	0.752	75%	0.749	S	S	*	*			trans	-125.4	160.2	-173.8	172.7	0	0	0	0	111.8
268	L	29.7	Very low	29.7	Very low	156 Å²	156	136 Å²	136	82%	0.817	76%	0.758	S	S	*	*			trans	145.2	152.7	157	-79.8	159.9	0	0	0	110.3
269	D	26.3	Very low	30.3	Very low	146 Å²	146	132.7 Å²	132.7	78%	0.781	76%	0.756	S	S	*	*			cis	-159.8	173.3	-35.9	-148.1	-25.2	0	0	0	109.5
270	L	28.6	Very low	30.1	Very low	149 Å²	149	133 Å²	133	78%	0.78	76%	0.763	S	S	*	*			trans	-99.2	167.3	-175.1	-136.2	78.3	0	0	0	113.6
271	P	47.7	Very low	30.6	Very low	108 Å²	108	130.8 Å²	130.8	70%	0.701	77%	0.765	S	S	*	*				-163	159.4	82	42	-20.1	0	0	0	121.8
272	N	30.2	Very low	31.2	Very low	141 Å²	141	130.5 Å²	130.5	75%	0.754	77%	0.77	S	S	*	*			trans	86.8	150.5	137.2	-79.4	-22.7	0	0	0	126.8
273	V	26.8	Very low	31.5	Very low	129 Å²	129	130.5 Å²	130.5	78%	0.782	78%	0.775	S	S	*	*			trans	75.2	106	172.4	-165.3	0	0	0	0	115.8
274	V	30.6	Very low	32.2	Very low	128 Å²	128	128.4 Å²	128.4	78%	0.776	76%	0.764	S	S	*	*			cis	82.1	122.9	26.4	-174	0	0	0	0	113.9
275	S	25.4	Very low	32.1	Very low	91 Å²	91	128.2 Å²	128.2	64%	0.636	77%	0.77	S	S	*	*			cis	-138.9	-155.6	4.9	-144.2	0	0	0	0	110.8
276	F	27.6	Very low	32.1	Very low	201 Å²	201	133.6 Å²	133.6	88%	0.882	78%	0.777	S	S	*	*			cis	-148.5	167.1	26.1	-101.8	-83.3	0	0	0	113.1
277	S	26	Very low	32.6	Very low	105 Å²	105	136 Å²	136	73%	0.734	78%	0.78	S	S	*	*			trans	-91.3	-162.9	-173	-28.3	0	0	0	0	113.7
278	P	41.3	Very low	32.4	Very low	116 Å²	116	135.7 Å²	135.7	75%	0.753	78%	0.784	S	S	*	*			cis	-140	-158.9	15.2	47.4	-27.6	0	0	0	114.7
279	P	39.6	Very low	32.4	Very low	124 Å²	124	133.4 Å²	133.4	81%	0.805	78%	0.78	S	S	*	*			cis	-124.1	-178.8	-20.4	22.8	1.2	0	0	0	115
280	S	25.8	Very low	32.5	Very low	120 Å²	120	131.9 Å²	131.9	84%	0.839	78%	0.781	S	S	*	*			trans	-94	169.6	-173	-44.2	0	0	0	0	116.5
281	S	37	Very low	32.6	Very low	112 Å²	112	131.5 Å²	131.5	78%	0.783	78%	0.779	S	S	*	*			trans	-67.9	173.3	161.6	-38.7	0	0	0	0	113
282	P	41.8	Very low	31.4	Very low	130 Å²	130	133.6 Å²	133.6	84%	0.844	78%	0.784	S	S	*	*				-151.4	173.8	94.9	39.4	-21.2	0	0	0	117.4
283	N	33.2	Very low	31.4	Very low	143 Å²	143	138 Å²	138	77%	0.765	79%	0.79	S	S	*	*			trans	-83.8	157.5	173.7	-153.6	-16.7	0	0	0	110.7
284	P	42.8	Very low	31.5	Very low	102 Å²	102	136.7 Å²	136.7	66%	0.662	79%	0.787	S	S	*	*				-165.5	140.1	97.9	38.9	-16.4	0	0	0	120.3
285	T	28.2	Very low	31.6	Very low	127 Å²	127	140.5 Å²	140.5	78%	0.779	79%	0.793	S	S	*	*			trans	62.5	164.2	144.4	69.2	0	0	0	0	119.6
286	K	30.7	Very low	32.5	Very low	197 Å²	197	141.8 Å²	141.8	86%	0.857	80%	0.799	S	S	*	*			cis	-153.9	150	9.6	-145.7	168.1	-174.8	174.9	0	111.7
287	K	35.9	Very low	32.6	Very low	207 Å²	207	137.8 Å²	137.8	90%	0.9	79%	0.787	S	S	*	*			trans	-34.5	142.7	-176.6	-56.2	178.2	177	-175.6	0	120.4
288	S	26	Very low	32.8	Very low	118 Å²	118	140.8 Å²	140.8	83%	0.825	79%	0.787	S	S	*	*				-153.4	177	125.1	83.7	0	0	0	0	110.6
289	S	28.3	Very low	32.6	Very low	107 Å²	107	143.5 Å²	143.5	75%	0.748	79%	0.793	S	S	*	*			trans	-154.8	151.4	-177.3	-57.5	0	0	0	0	114.2
290	S	28.6	Very low	32.2	Very low	115 Å²	115	146.8 Å²	146.8	80%	0.804	80%	0.795	S	S	*	*			trans	70.5	173.7	171.6	78.3	0	0	0	0	117.5
291	I	30.6	Very low	32.7	Very low	141 Å²	141	146.6 Å²	146.6	72%	0.723	79%	0.793	S	S	*	*			trans	83.5	104.5	-162.2	-54.9	167	0	0	0	110.8
292	N	23.9	Very low	33	Very low	151 Å²	151	147.5 Å²	147.5	81%	0.807	80%	0.797	S	S	*	*			cis	72.3	106.5	40.2	-160.5	8.6	0	0	0	113.7
293	W	28.4	Very low	32.4	Very low	234 Å²	234	152.6 Å²	152.6	89%	0.886	80%	0.799	S	S	*	*			trans	-127.2	135.8	-179	-86.5	103.2	0	0	0	112.3
294	S	29.7	Very low	32.3	Very low	101 Å²	101	152.2 Å²	152.2	71%	0.706	80%	0.802	S	S	*	*			trans	-127.5	151.9	-175.9	53.1	0	0	0	0	112
295	F	32.6	Very low	31.7	Very low	209 Å²	209	152.1 Å²	152.1	92%	0.917	80%	0.8	S	S	*	*			trans	-58.3	153.5	177.1	-80.5	-90.5	0	0	0	113.8
296	P	45	Very low	32	Very low	118 Å²	118	156.8 Å²	156.8	77%	0.766	80%	0.803	S	S	*	*				-144.9	-176.4	108.2	39.6	-26.5	0	0	0	113.7
297	D	29.7	Very low	32.3	Very low	117 Å²	117	156.7 Å²	156.7	63%	0.626	80%	0.802	S	S	*	*			cis	-173.3	153.5	-48.2	178.7	32.8	0	0	0	108.8
298	K	30.4	Very low	32.2	Very low	168 Å²	168	153.7 Å²	153.7	73%	0.73	80%	0.795	S	S	*	*			trans	67.9	143.7	-174.1	-59.4	122.5	176.8	131.7	0	113.9
299	I	36.7	Very low	32.5	Very low	172 Å²	172	152.9 Å²	152.9	88%	0.882	79%	0.789	S	S	*	*				-140	169.7	64.7	-75.4	158.1	0	0	0	112.2
300	K	30.8	Very low	32.8	Very low	193 Å²	193	155.9 Å²	155.9	84%	0.839	79%	0.793	S	S	*	*			trans	-89.6	157.1	-170.1	-54.5	169.2	-175.6	174.6	0	114.2
301	S	37.2	Very low	32.9	Very low	116 Å²	116	159.8 Å²	159.8	81%	0.811	80%	0.796	S	S	*	*			trans	-66.4	159.1	171.4	-34.1	0	0	0	0	113.4
302	P	42.1	Very low	33.3	Very low	131 Å²	131	161.6 Å²	161.6	85%	0.851	80%	0.803	S	S	*	*				-150.9	-175.4	91.6	40.3	-22	0	0	0	116.7
303	R	30.2	Very low	33.8	Very low	237 Å²	237	164.5 Å²	164.5	89%	0.894	81%	0.809	S	S	*	*			trans	-78.7	167.9	176.2	-61.2	172.5	167	-171.9	-4.8	113.7
304	T	30.5	Very low	34	Very low	135 Å²	135	161.6 Å²	161.6	83%	0.828	80%	0.802	S	S	*	*			trans	141.3	140.5	144.7	-68.3	0	0	0	0	110.9
305	V	29.5	Very low	34.3	Very low	101 Å²	101	163.1 Å²	163.1	61%	0.612	80%	0.802	S	S	*	*			cis	166.8	133.4	-23.5	132.9	0	0	0	0	107.4
306	R	36	Very low	34.5	Very low	225 Å²	225	158.4 Å²	158.4	85%	0.849	79%	0.792	S	S	*	*			trans	70.5	150.1	160.4	-78.3	168.9	-176.7	123.8	-1	123.3
307	K	36.8	Very low	34	Very low	194 Å²	194	161.6 Å²	161.6	84%	0.843	80%	0.797	S	S	*	*			trans	70.5	153.9	155.1	-83.8	-178.9	167.7	-176.1	0	116.1
308	I	32.7	Very low	34.1	Very low	145 Å²	145	164.4 Å²	164.4	74%	0.744	81%	0.811	S	S	*	*			cis	-155.5	166.7	0.8	27.8	168.3	0	0	0	108.1
309	S	32.2	Very low	34.4	Very low	100 Å²	100	161.4 Å²	161.4	70%	0.699	81%	0.811	S	S	*	*			cis	-172.4	-125	-25.1	61.4	0	0	0	0	109.5
310	M	34.3	Very low	34.5	Very low	170 Å²	170	165.3 Å²	165.3	84%	0.837	82%	0.815	S	S	*	*			trans	70.8	144.3	172.9	-66	177.4	56.7	0	0	118.7
311	K	32.3	Very low	34.9	Very low	197 Å²	197	165.8 Å²	165.8	86%	0.857	82%	0.817	S	S	*	*			cis	-158.1	140.1	-30.2	-164.3	171.4	-178.8	178.6	0	109
312	M	38.3	Very low	34.8	Very low	179 Å²	179	168.2 Å²	168.2	88%	0.882	82%	0.82	S	S	*	*			trans	-65.9	158.3	-174.7	-68.2	-172.2	-100.7	0	0	115.3
313	K	34.3	Very low	34.1	Very low	212 Å²	212	166.3 Å²	166.3	92%	0.922	81%	0.81	S	S	*	*			trans	-126.7	116.3	147.3	-145.8	173	-174.1	-179.4	0	111.6
314	K	33.2	Very low	34.2	Very low	174 Å²	174	161.1 Å²	161.1	76%	0.757	80%	0.804	S	S	*	*			trans	-66.1	162.9	172.6	-120.8	-179.7	170.4	-171.5	0	109.7
315	L	35	Very low	34.2	Very low	133 Å²	133	163.4 Å²	163.4	70%	0.696	80%	0.803	S	S	*	*			cis	-169	-171.1	33	-108.2	166.8	0	0	0	106.5
316	P	38.1	Very low	34.1	Very low	109 Å²	109	162.3 Å²	162.3	71%	0.708	81%	0.811	S	S	*	*			cis	-126.4	162	-9.3	34.8	-16.8	0	0	0	116.1
317	E	33.9	Very low	33.8	Very low	186 Å²	186	156.5 Å²	156.5	87%	0.869	80%	0.801	S	S	*	*			trans	-86.7	148.9	160.7	-61.6	168	114.2	0	0	110.4
318	L	32.4	Very low	33.5	Very low	175 Å²	175	155.5 Å²	155.5	92%	0.916	80%	0.799	S	S	*	*			trans	-128.7	118.5	161.8	-94.9	172.9	0	0	0	110
319	S	35.9	Very low	33.2	Very low	106 Å²	106	155 Å²	155	74%	0.741	80%	0.798	S	S	*	*			trans	-93.2	150.8	-178.6	59.2	0	0	0	0	112.1
320	R	39.2	Very low	33	Very low	254 Å²	254	154.2 Å²	154.2	96%	0.958	79%	0.793	S	S	*	*			trans	-160.8	121.4	150.1	-104.9	154	-163.8	179.6	5.2	110.1
321	K	38.9	Very low	32.6	Very low	202 Å²	202	152.8 Å²	152.8	88%	0.878	79%	0.788	S	S	*	*			trans	-103.6	158.5	159.9	-76.5	-171.3	174.1	-175.2	0	108.6
322	L	34.2	Very low	32.3	Very low	167 Å²	167	149 Å²	149	87%	0.874	78%	0.782	S	S	*	*			trans	145.1	146.1	164.7	-84.5	163.9	0	0	0	107.9
323	S	28.7	Very low	31.8	Very low	92 Å²	92	145 Å²	145	64%	0.643	77%	0.772	S	S	*	*			cis	-158.5	149.7	-10.4	-154.9	0	0	0	0	112.8
324	V	31.5	Very low	31.5	Very low	127 Å²	127	140.2 Å²	140.2	77%	0.77	77%	0.765	S	S	*	*			trans	28.9	115.3	140.9	-180	0	0	0	0	121.4
325	K	29.7	Very low	31.3	Very low	184 Å²	184	139.9 Å²	139.9	80%	0.8	77%	0.772	S	S	*	*				45	118.5	129	-161.1	179.2	-178.2	177.7	0	120.9
326	G	29.3	Very low	31	Very low	77 Å²	77	137.4 Å²	137.4	79%	0.794	78%	0.778	S	S	*	*			trans	-126.2	159.5	158	0	0	0	0	0	111.5
327	T	28.7	Very low	30.5	Very low	103 Å²	103	139.4 Å²	139.4	63%	0.632	78%	0.783	S	S	*	*			trans	-142	126.9	-164	-47.7	0	0	0	0	113.5
328	Q	30.4	Very low	30.1	Very low	173 Å²	173	135 Å²	135	81%	0.808	77%	0.771	S	S	*	*			trans	54.9	165.2	161.3	-69	173.9	-6.9	0	0	116.4
329	N	26.8	Very low	29.8	Very low	135 Å²	135	134.3 Å²	134.3	72%	0.722	76%	0.763	S	S	*	*			cis	-148.7	178.6	-3.8	-132.5	5.9	0	0	0	106.4
330	S	27.6	Very low	29.3	Very low	84 Å²	84	134.7 Å²	134.7	59%	0.587	76%	0.762	S	S	*	*			cis	-168	159	12.7	48.3	0	0	0	0	110.3
331	N	25.7	Very low	28.8	Very low	139 Å²	139	128.5 Å²	128.5	74%	0.743	76%	0.757	S	S	*	*			trans	51.2	144.6	137	-63	4.3	0	0	0	121
332	T	26.1	Very low	28.1	Very low	118 Å²	118	122.5 Å²	122.5	72%	0.724	75%	0.752	S	S	*	*			cis	-160	165.5	16.6	-10.2	0	0	0	0	113.2
333	S	28.1	Very low	28.9	Very low	96 Å²	96	120.5 Å²	120.5	67%	0.671	75%	0.75	S	S	*	*			trans	0.9	154.8	144.3	60.2	0	0	0	0	121.1
334	S	28.8	Very low	30	Very low	111 Å²	111	120.8 Å²	120.8	78%	0.776	75%	0.749	S	S	*	*			cis	-171.9	175.9	8.1	32.5	0	0	0	0	112.4
335	N	29	Very low	30	Very low	167 Å²	167	125.1 Å²	125.1	89%	0.893	75%	0.752	S	S	*	*			trans	-45.9	150.6	162.3	-72.6	-14.5	0	0	0	114.4
336	G	27.1	Very low	30.1	Very low	80 Å²	80	123.1 Å²	123.1	83%	0.825	75%	0.749	S	S	*	*			trans	-158	147.2	166.1	0	0	0	0	0	111.3
337	N	28	Very low	30.4	Very low	152 Å²	152	123.8 Å²	123.8	81%	0.813	75%	0.747	S	S	*	*			trans	-132.5	165.9	-177.7	-173.9	23.6	0	0	0	109.9
338	C	25.2	Very low	31.4	Very low	93 Å²	93	125 Å²	125	63%	0.628	76%	0.756	S	S	*	*			trans	67.9	165.5	173.9	-59	0	0	0	0	116.5
339	Q	27.3	Very low	31.6	Very low	160 Å²	160	123 Å²	123	75%	0.748	76%	0.762	S	S	*	*			cis	-166.5	164.6	-35.8	-103.5	-170.4	20.4	0	0	108.3
340	T	25.9	Very low	31.6	Very low	115 Å²	115	120.3 Å²	120.3	71%	0.706	77%	0.766	S	S	*	*			trans	64.3	124.8	150.3	49	0	0	0	0	124.7
341	S	27.2	Very low	31.6	Very low	124 Å²	124	120.4 Å²	120.4	87%	0.867	78%	0.78	S	S	*	*			trans	69.2	133.8	132.1	66.4	0	0	0	0	125.4
342	G	25.9	Very low	31.9	Very low	75 Å²	75	117.4 Å²	117.4	77%	0.773	78%	0.782	S	S	*	*			trans	128	117.7	142.7	0	0	0	0	0	120.1
343	P	50.2	Low	32.4	Very low	126 Å²	126	118.4 Å²	118.4	82%	0.818	79%	0.791	S	S	*	*			trans	-116.9	-160.6	170.7	45.1	-34.5	0	0	0	112
344	P	52	Low	32.6	Very low	98 Å²	98	118.9 Å²	118.9	64%	0.636	80%	0.8	S	S	*	*			cis	-146.7	-171.3	-0.1	46.8	-27.4	0	0	0	118.7
345	R	30.5	Very low	32.7	Very low	218 Å²	218	119.7 Å²	119.7	82%	0.823	81%	0.806	S	S	*	*			trans	73.2	155.4	156.3	-65.9	176.3	-172	-90.3	0.3	119.4
346	L	33.1	Very low	32.7	Very low	142 Å²	142	122.6 Å²	122.6	74%	0.743	80%	0.804	S	S	*	*			cis	-165.5	160.7	-20	-109.4	171	0	0	0	111.1
347	A	34	Very low	33	Very low	91 Å²	91	125.1 Å²	125.1	75%	0.752	80%	0.799	S	S	*	*			trans	-162	164.6	171.3	0	0	0	0	0	113.6
348	P	51	Low	33	Very low	127 Å²	127	123.7 Å²	123.7	83%	0.825	80%	0.796	S	S	*	*			trans	-136.8	157.3	173.5	40.2	-24.5	0	0	0	119.1
349	S	33.2	Very low	33.3	Very low	132 Å²	132	126.2 Å²	126.2	92%	0.923	80%	0.801	S	S	*	*			trans	82.4	131.3	157.4	-154.1	0	0	0	0	120.6
350	G	27.2	Very low	33.6	Very low	78 Å²	78	123.4 Å²	123.4	80%	0.804	80%	0.799	S	S	*	*			trans	164.5	-9.4	161	0	0	0	0	0	126.3
351	G	28.8	Very low	34	Very low	87 Å²	87	128.8 Å²	128.8	90%	0.897	81%	0.807	S	S	*	*			trans	88.3	165.3	167.3	0	0	0	0	0	120.4
352	G	30.5	Very low	34.1	Very low	75 Å²	75	132.1 Å²	132.1	77%	0.773	80%	0.801	S	S	*	*			trans	98.5	126.1	175.2	0	0	0	0	0	115.9
353	P	37	Very low	34.2	Very low	140 Å²	140	137.9 Å²	137.9	91%	0.909	81%	0.808	S	S	*	*			trans	-97	114.2	-172.2	34.9	-32.3	0	0	0	114.9
354	A	31.8	Very low	33.1	Very low	105 Å²	105	138.5 Å²	138.5	87%	0.868	80%	0.803	S	S	*	*			trans	-153	113.6	155.6	0	0	0	0	0	109
355	S	32	Very low	31.8	Very low	128 Å²	128	140.3 Å²	140.3	90%	0.895	81%	0.808	S	S	*	*			trans	-124.5	126.1	-175.5	52.6	0	0	0	0	112.5
356	R	29.2	Very low	31.6	Very low	228 Å²	228	135.2 Å²	135.2	86%	0.86	81%	0.806	S	S	*	*			trans	-128.2	126.8	172.9	-160.5	176.9	-176.2	176.3	2.5	107.3
357	N	32.3	Very low	31.5	Very low	133 Å²	133	133.1 Å²	133.1	71%	0.711	80%	0.803	S	S	*	*			trans	78.5	114.5	163.6	-57.3	-15.1	0	0	0	121.3
358	V	29.1	Very low	31.3	Very low	123 Å²	123	135.1 Å²	135.1	75%	0.745	81%	0.805	S	S	*	*				81.8	128.4	113.6	173.8	0	0	0	0	122.1
359	I	30.4	Very low	30.2	Very low	145 Å²	145	133.6 Å²	133.6	74%	0.744	80%	0.798	S	S	*	*			trans	86.6	96.4	154.9	-78.7	162.8	0	0	0	121.8
360	S	35	Very low	30.1	Very low	101 Å²	101	133.2 Å²	133.2	71%	0.706	79%	0.79	S	S	*	*				41.9	132.8	119.7	-37.8	0	0	0	0	123.5
361	R	32.9	Very low	30.4	Very low	229 Å²	229	136.3 Å²	136.3	86%	0.864	78%	0.784	S	S	*	*				-170.9	161.4	99.5	-102.6	-165.7	-73.8	-161.5	-0.9	115.4
362	Y	29.5	Very low	30.3	Very low	193 Å²	193	141 Å²	141	76%	0.757	78%	0.782	S	S	*	*			trans	-21.9	143.9	174.5	-58.8	-94.1	0	0	0	120.3
363	H	27.5	Very low	30.3	Very low	196 Å²	196	141.1 Å²	141.1	91%	0.907	77%	0.771	S	S	*	*				-137.6	172.6	127.4	-102.8	-85.1	0	0	0	109.5
364	L	28.1	Very low	30	Very low	139 Å²	139	142.7 Å²	142.7	73%	0.728	76%	0.764	S	S	*	*			trans	-125.2	159.2	-156.8	-91.3	167.3	0	0	0	115
365	D	24.2	Very low	29.6	Very low	137 Å²	137	144.6 Å²	144.6	73%	0.733	76%	0.759	S	S	*	*			trans	76.1	151.9	149.1	-64.5	-33.9	0	0	0	123.6
366	S	26.2	Very low	29.4	Very low	111 Å²	111	147.4 Å²	147.4	78%	0.776	76%	0.755	S	S	*	*			trans	80.2	142	161.8	-76.7	0	0	0	0	120.6
367	S	31.4	Very low	29.3	Very low	97 Å²	97	146 Å²	146	68%	0.678	76%	0.756	S	S	*	*			cis	-170.6	145.6	-13.5	-108	0	0	0	0	113.1
368	V	29.5	Very low	29	Very low	133 Å²	133	149 Å²	149	81%	0.806	76%	0.762	S	S	*	*			trans	33.3	122.4	157.4	-82.9	0	0	0	0	122.1
369	S	28.6	Very low	29	Very low	96 Å²	96	150.2 Å²	150.2	67%	0.671	76%	0.764	S	S	*	*				101.2	154.7	88.7	-157.5	0	0	0	0	112.3
370	T	31.4	Very low	28.8	Very low	124 Å²	124	151.4 Å²	151.4	76%	0.761	77%	0.772	S	S	*	*			cis	-158	136.6	47.3	41.2	0	0	0	0	111.8
371	Q	32.3	Very low	28.4	Very low	142 Å²	142	149.9 Å²	149.9	66%	0.664	77%	0.773	S	S	*	*				60.4	130.3	98.8	-70.8	-151.8	8.4	0	0	121
372	H	27.4	Very low	28.2	Very low	185 Å²	185	144.2 Å²	144.2	86%	0.856	77%	0.768	S	S	*	*				-178.9	155.3	124.9	-90.3	-56.9	0	0	0	110.5
373	S	30.8	Very low	28.4	Very low	78 Å²	78	140.7 Å²	140.7	55%	0.545	77%	0.772	S	S	.	*			cis	-163	124.1	-38.2	-95.7	0	0	0	0	113.7
374	F	29.5	Very low	28.8	Very low	174 Å²	174	140.9 Å²	140.9	76%	0.763	77%	0.77	S	S	*	*			trans	41.7	133.6	147.6	-65.1	-72.5	0	0	0	127
375	N	25.2	Very low	29.3	Very low	145 Å²	145	139.9 Å²	139.9	78%	0.775	77%	0.774	S	S	*	*			trans	-172	156.8	141.7	-93.5	-47.3	0	0	0	110.8
376	K	26.5	Very low	29.8	Very low	186 Å²	186	138.3 Å²	138.3	81%	0.809	78%	0.78	S	S	*	*			cis	-155.1	27.4	-28.4	-144.1	178.3	-177.6	159.1	0	117.4
377	K	28.5	Very low	30.2	Very low	200 Å²	200	139 Å²	139	87%	0.87	79%	0.786	S	S	*	*			trans	67.2	125.5	159.3	178.2	-167.4	-177	175	0	121
378	K	25.8	Very low	30.5	Very low	195 Å²	195	144.7 Å²	144.7	85%	0.848	80%	0.798	S	S	*	*				178.4	161	124.9	-103.5	-171.3	178.3	-170.7	0	115.2
379	N	28.2	Very low	30.5	Very low	148 Å²	148	142 Å²	142	79%	0.791	80%	0.797	S	S	*	*			trans	-98.4	150.8	175.1	-71.7	4.7	0	0	0	112.5
380	D	25.6	Very low	30.8	Very low	170 Å²	170	141.1 Å²	141.1	91%	0.909	80%	0.803	S	S	*	*				175.2	162.9	119.1	-90.6	-31.5	0	0	0	108.5
381	G	27.3	Very low	31.1	Very low	69 Å²	69	145.3 Å²	145.3	71%	0.711	81%	0.807	S	S	*	*			cis	-173.1	169.8	-0.8	0	0	0	0	0	111.6
382	S	27.9	Very low	31.1	Very low	110 Å²	110	144.6 Å²	144.6	77%	0.769	81%	0.807	S	S	*	*			trans	-55.7	148.5	-174.5	162.4	0	0	0	0	117.2
383	S	34.2	Very low	31.6	Very low	119 Å²	119	140.7 Å²	140.7	83%	0.832	80%	0.8	S	S	*	*				-165.7	160.2	129.2	-86.7	0	0	0	0	115
384	K	37.2	Very low	31.6	Very low	201 Å²	201	144.2 Å²	144.2	87%	0.874	81%	0.813	S	S	*	*			trans	-135.9	147.5	-177.6	-58.7	175	-178.9	175.8	0	111.8
385	S	37.4	Very low	31.7	Very low	117 Å²	117	139.2 Å²	139.2	82%	0.818	81%	0.811	S	S	*	*			trans	-167.1	141.7	146	50.1	0	0	0	0	109.1
386	A	35.7	Very low	31.9	Very low	104 Å²	104	139.8 Å²	139.8	86%	0.86	81%	0.814	S	S	*	*			cis	99.3	87.2	3.1	0	0	0	0	0	117.5
387	S	33.9	Very low	32.9	Very low	127 Å²	127	135.7 Å²	135.7	89%	0.888	81%	0.808	S	S	*	*			trans	-129.4	176.4	163.4	65.4	0	0	0	0	110.9
388	K	38	Very low	34.2	Very low	215 Å²	215	131.3 Å²	131.3	94%	0.935	80%	0.801	S	S	*	*			trans	-160	127.6	-168.7	-177.4	-179.6	171.7	-173.4	0	115.2
389	G	28.8	Very low	34.9	Very low	77 Å²	77	129.8 Å²	129.8	79%	0.794	80%	0.796	S	S	*	*			trans	162.6	150.4	167.9	0	0	0	0	0	110.8
390	G	36.1	Very low	35.3	Very low	77 Å²	77	129.7 Å²	129.7	79%	0.794	80%	0.795	S	S	*	*			cis	110.2	131.2	9.2	0	0	0	0	0	111.3
391	Y	36.5	Very low	35.6	Very low	212 Å²	212	127 Å²	127	83%	0.831	78%	0.784	S	S	*	*			cis	-166.3	140.5	6.3	-160.1	-126.5	0	0	0	111.6
392	L	33.8	Very low	36	Very low	128 Å²	128	128.4 Å²	128.4	67%	0.67	79%	0.79	S	S	*	*			trans	59	154.6	155.4	-70.1	-174.2	0	0	0	126.4
393	S	37.1	Very low	36.6	Very low	102 Å²	102	132.9 Å²	132.9	71%	0.713	80%	0.795	S	S	*	*			trans	90.7	147	145	-69.4	0	0	0	0	122.1
394	D	30.9	Very low	36.5	Very low	152 Å²	152	133.3 Å²	133.3	81%	0.813	80%	0.798	S	S	*	*			cis	-169.3	158	-35.8	-135.7	-37.2	0	0	0	111.4
395	G	32.3	Very low	36.1	Very low	70 Å²	70	127.1 Å²	127.1	72%	0.722	79%	0.792	S	S	*	*			trans	71.8	154.8	174.4	0	0	0	0	0	116.4
396	D	27.7	Very low	35.7	Very low	156 Å²	156	131.1 Å²	131.1	83%	0.834	79%	0.794	S	S	*	*			cis	-151.1	179.6	7.5	-164.6	10.5	0	0	0	111.3
397	S	49.2	Very low	35.6	Very low	100 Å²	100	135.1 Å²	135.1	70%	0.699	80%	0.795	S	S	*	*			trans	-155.1	159.9	-176.8	-69.1	0	0	0	0	110.9
398	P	55.8	Low	35.3	Very low	109 Å²	109	132.6 Å²	132.6	71%	0.708	79%	0.789	S	S	*	*				-161.5	166.9	81.2	42.4	-21.1	0	0	0	119.9
399	E	39	Very low	35	Very low	162 Å²	162	128.3 Å²	128.3	76%	0.757	79%	0.786	S	S	*	*			trans	61.8	160.6	142.6	-73.4	175.7	-176.9	0	0	121.1	V401	E399-V401 HydrophobicContact CG-CG2 4.39Å
400	L	37.4	Very low	35.1	Very low	147 Å²	147	128.8 Å²	128.8	77%	0.77	78%	0.782	S	S	*	*			cis	-127.9	135.6	12.5	-69.7	161.4	0	0	0	110.1
401	V	32.4	Very low	34.7	Very low	112 Å²	112	134.3 Å²	134.3	68%	0.679	79%	0.788	S	S	*	*				75.4	110	68.3	178.6	0	0	0	0	116.6	E399	E399-V401 HydrophobicContact CG-CG2 4.39Å
402	A	35.3	Very low	34.5	Very low	100 Å²	100	127.5 Å²	127.5	83%	0.826	78%	0.782	S	S	*	*			trans	-152.4	149.6	147.3	0	0	0	0	0	109.9
403	K	39.7	Very low	34.4	Very low	204 Å²	204	132.1 Å²	132.1	89%	0.887	80%	0.796	S	S	*	*			trans	-138	143.2	-171.1	-72.4	-179.7	178.2	173	0	114.7
404	S	33	Very low	33.9	Very low	127 Å²	127	131.1 Å²	131.1	89%	0.888	80%	0.802	S	S	*	*			trans	-171.8	126.4	149	-171.1	0	0	0	0	106.2
405	G	28.9	Very low	33.8	Very low	72 Å²	72	127.9 Å²	127.9	74%	0.742	81%	0.805	S	S	*	*			cis	115.9	139	44.9	0	0	0	0	0	107.3
406	K	28.6	Very low	33.8	Very low	201 Å²	201	135.1 Å²	135.1	87%	0.874	82%	0.817	S	S	*	*			cis	-161.1	168.7	2.9	-168.2	173.5	-179.8	179	0	109.1
407	H	33.8	Very low	33.9	Very low	187 Å²	187	131.4 Å²	131.4	87%	0.866	82%	0.815	S	S	*	*			trans	-36.6	162.5	-179.3	-67.1	-94.4	0	0	0	119.3
408	G	27.2	Very low	33	Very low	74 Å²	74	135.1 Å²	135.1	76%	0.763	82%	0.819	S	S	*	*			cis	-163.2	-149.5	22.6	0	0	0	0	0	117.7
409	S	30.8	Very low	31.7	Very low	125 Å²	125	136 Å²	136	87%	0.874	82%	0.817	S	S	*	*			trans	-145.2	149.1	-153.1	-176	0	0	0	0	116.5
410	A	30.8	Very low	31.2	Very low	87 Å²	87	133 Å²	133	72%	0.719	82%	0.82	S	S	*	*			trans	-173.8	126.9	151.9	0	0	0	0	0	107.5
411	E	29.4	Very low	30.6	Very low	194 Å²	194	135.7 Å²	135.7	91%	0.907	83%	0.829	S	S	*	*				55.1	126.6	72.3	-62.2	-158.8	134.9	0	0	115.1
412	G	30.7	Very low	30.3	Very low	68 Å²	68	134.1 Å²	134.1	70%	0.701	84%	0.836	S	S	*	*			cis	172.9	168.9	-5.5	0	0	0	0	0	113.1
413	K	31.6	Very low	29.9	Very low	225 Å²	225	133.2 Å²	133.2	98%	0.978	84%	0.836	S	S	*	*			trans	68.1	150.9	-174.9	-52.6	171	-178	171.1	0	114.7
414	G	27.4	Very low	29.3	Very low	81 Å²	81	129.1 Å²	129.1	84%	0.835	83%	0.833	S	S	*	*			cis	151.3	108.8	-9	0	0	0	0	0	112.8
415	G	29.5	Very low	29.1	Very low	85 Å²	85	127.7 Å²	127.7	88%	0.876	82%	0.823	S	S	*	*			trans	-169.8	155.6	-179.7	0	0	0	0	0	114
416	K	31.7	Very low	29.1	Very low	222 Å²	222	133.3 Å²	133.3	97%	0.965	82%	0.822	S	S	*	*			trans	-93	144	-179.4	-65.9	178.4	177.3	178.6	0	111.7
417	G	29.4	Very low	29.2	Very low	78 Å²	78	131.3 Å²	131.3	80%	0.804	82%	0.82	S	S	*	*			trans	-175	114.6	167.7	0	0	0	0	0	115
418	K	30.9	Very low	29.2	Very low	178 Å²	178	130.9 Å²	130.9	77%	0.774	82%	0.824	S	S	*	*			trans	-60.5	160.4	153.8	-95.6	172.7	137.6	-72.4	0	109.6
419	D	28.9	Very low	29.5	Very low	126 Å²	126	130.1 Å²	130.1	67%	0.674	82%	0.817	S	S	*	*			cis	-156	-174.6	16.7	-108.4	-37.8	0	0	0	110.1
420	A	27.4	Very low	30.2	Very low	99 Å²	99	130.3 Å²	130.3	82%	0.818	81%	0.812	S	S	*	*			trans	112.1	143.5	155.6	0	0	0	0	0	118.4
421	E	25.3	Very low	31.2	Very low	204 Å²	204	133.1 Å²	133.1	95%	0.953	81%	0.811	S	S	*	*			trans	-101.2	163.2	-164.1	-61.8	161.9	111.8	0	0	113.4
422	G	26.6	Very low	33.1	Very low	80 Å²	80	126.6 Å²	126.6	83%	0.825	78%	0.782	S	S	*	*			trans	-166.8	17.5	173.7	0	0	0	0	0	114.8	S424	G422-S424 PolarHBondContact O-N 2.7Å
423	G	26.4	Very low	35.3	Very low	81 Å²	81	128.1 Å²	128.1	84%	0.835	77%	0.774	S	S	*	*			trans	-78.5	104.3	-179.1	0	0	0	0	0	111.4	S425	G423-S425 PolarHBondContact O-N 3.13Å
424	S	27.2	Very low	37.7	Very low	118 Å²	118	120.7 Å²	120.7	83%	0.825	74%	0.744	S	S	*	*			trans	-66.4	117.1	174.7	-166.8	0	0	0	0	110.9	G422 R426	G422-S424 PolarHBondContact O-N 2.7Å; S424-R426 PolarHBondContact O-N 2.97Å
425	S	27.9	Very low	40.3	Very low	97 Å²	97	124.4 Å²	124.4	68%	0.678	75%	0.745	S	S	*	*			trans	-68.8	114	177.1	54.2	0	0	0	0	110.9	G423 L427	G423-S425 PolarHBondContact O-N 3.13Å; S425-L427 PolarHBondContact O-N 3.33Å
426	R	29.2	Very low	43	Very low	189 Å²	189	122.6 Å²	122.6	71%	0.713	72%	0.722	S	S	*	*			trans	-58.5	133	170.7	-64.4	-176.4	177.1	-142.4	-4.9	109.8	S424 E431	S424-R426 PolarHBondContact O-N 2.97Å; R426-E431 IonicContact CZ-OE1 3.46Å; R426-E431 IonicContact NH1-OE1 2.8Å; R426-E431 PolarHBondContact NH1-OE1 3.08Å; R426-E431 IonicContact NH1-OE2 2.69Å; R426-E431 PolarHBondContact NH1-OE2 3.03Å; R426-E431 IonicContact NH2-OE1 2.59Å
427	L	31.3	Very low	45.8	Very low	159 Å²	159	112.6 Å²	112.6	83%	0.832	68%	0.678	S	S	*	*			trans	-105.9	137.9	172.1	-69.2	173.5	0	0	0	109	S425 G429	S425-L427 PolarHBondContact O-N 3.33Å; L427-G429 PolarHBondContact O-N 3.02Å; L427-G429 VanDerWaalsContact O-N 3.09Å
428	N	33.8	Very low	48.7	Very low	178 Å²	178	115.9 Å²	115.9	95%	0.952	67%	0.666	S	S	*	*			trans	-72.7	104.1	-174.6	-67.3	-1.8	0	0	0	111.7
429	G	34	Very low	51.6	Low	59 Å²	59	113.7 Å²	113.7	61%	0.608	66%	0.659	S	S	*	*	S	Bend	trans	-138.8	156.8	157.7	0	0	0	0	0	107.1	L427 E431	L427-G429 PolarHBondContact O-N 3.02Å; L427-G429 VanDerWaalsContact O-N 3.09Å; G429-E431 PolarHBondContact O-N 2.97Å
430	T	44.3	Very low	54.6	Low	128 Å²	128	107.9 Å²	107.9	79%	0.785	63%	0.627	S	S	*	*			trans	-48.6	98.8	-173.5	42.1	0	0	0	0	112.6	L432	T430-L432 PolarHBondContact O-N 3.4Å
431	E	52.9	Low	57.6	Low	146 Å²	146	103.8 Å²	103.8	68%	0.682	59%	0.592	S	S	*	*			trans	-69.7	105.6	-179.4	-167.4	167	171	0	0	107.7	R426 G429 D433	R426-E431 IonicContact CZ-OE1 3.46Å; R426-E431 IonicContact NH1-OE1 2.8Å; R426-E431 PolarHBondContact NH1-OE1 3.08Å; R426-E431 IonicContact NH1-OE2 2.69Å; R426-E431 PolarHBondContact NH1-OE2 3.03Å; R426-E431 IonicContact NH2-OE1 2.59Å; G429-E431 PolarHBondContact O-N 2.97Å; E431-D433 PolarHBondContact O-N 2.96Å
432	L	68.3	Low	60.5	Low	58 Å²	58	98.1 Å²	98.1	30%	0.304	57%	0.565	S	S	.	*			trans	-61.2	117	176.4	-76.4	167	0	0	0	108.3	T430 I434 Y461 F499	T430-L432 PolarHBondContact O-N 3.4Å; L432-I434 VanDerWaalsContact C-N 3.33Å; L432-I434 PolarHBondContact O-N 3.42Å; L432-Y461 WeakPolarHBondContact CD1-O 3.35Å; L432-Y461 HydrophobicContact CD2-CD1 3.74Å; L432-Y461 HydrophobicContact CD2-CG 4.29Å; L432-F499 HydrophobicContact CD1-CE1 3.92Å; L432-F499 HydrophobicContact CD1-CE2 4.48Å; L432-F499 HydrophobicContact CD1-CZ 3.52Å
433	D	78.1	Confident	63.2	Low	99 Å²	99	98.4 Å²	98.4	53%	0.529	55%	0.551	S	S	.	*			trans	-70.8	90.2	175.6	-175.4	-0.4	0	0	0	109.5	E431 D435 A436 F437	E431-D433 PolarHBondContact O-N 2.96Å; D433-D435 PolarHBondContact O-N 3.07Å; D433-D435 PolarHBondContact OD1-N 3.13Å; D433-A436 HydrophobicContact CB-CB 4.16Å; D433-A436 WeakPolarHBondContact O-CB 3.4Å; D433-A436 PolarHBondContact O-N 3Å; D433-A436 PolarHBondContact OD1-N 3.25Å; D433-F437 WeakPolarHBondContact O-CD2 3.39Å
434	I	81.2	Confident	65.9	Low	69 Å²	69	100.4 Å²	100.4	35%	0.354	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-60.5	-33.6	-179.5	-66.8	172	0	0	0	110.7	L432 A436 F437 Y563	L432-I434 VanDerWaalsContact C-N 3.33Å; L432-I434 PolarHBondContact O-N 3.42Å; I434-A436 PolarHBondContact O-N 3.3Å; I434-F437 PolarHBondContact O-N 2.94Å; I434-F437 VanDerWaalsContact O-N 3.13Å; I434-Y563 HydrophobicContact CG2-CE1 4.02Å
435	D	81	Confident	68.4	Low	159 Å²	159	96.9 Å²	96.9	85%	0.85	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-71.3	-19	-178.4	-69	-31.2	0	0	0	112.3	D433 F437	D433-D435 PolarHBondContact O-N 3.07Å; D433-D435 PolarHBondContact OD1-N 3.13Å; D435-F437 VanDerWaalsContact C-N 3.28Å; D435-F437 PolarHBondContact O-N 2.86Å
436	A	86.4	Confident	70.8	Confident	48 Å²	48	96 Å²	96	40%	0.397	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-72.8	-13.9	171.5	0	0	0	0	0	114.2	D433 I434	D433-A436 HydrophobicContact CB-CB 4.16Å; D433-A436 WeakPolarHBondContact O-CB 3.4Å; D433-A436 PolarHBondContact O-N 3Å; D433-A436 PolarHBondContact OD1-N 3.25Å; I434-A436 PolarHBondContact O-N 3.3Å
437	F	90.7	Very high	72.8	Confident	11 Å²	11	97.5 Å²	97.5	5%	0.048	52%	0.517	C	S	.	.	S	Bend	trans	-94.2	114.8	-178.4	-72	-98.7	0	0	0	112.1	D433 I434 D435 H439 Y461 Q551 A553 Y563	D433-F437 WeakPolarHBondContact O-CD2 3.39Å; I434-F437 PolarHBondContact O-N 2.94Å; I434-F437 VanDerWaalsContact O-N 3.13Å; D435-F437 VanDerWaalsContact C-N 3.28Å; D435-F437 PolarHBondContact O-N 2.86Å; F437-H439 PolarHBondContact O-N 3.45Å; F437-H439 VanDerWaalsContact O-N 3.16Å; F437-Y461 AromaticContact CE1-CD2 3.74Å; F437-Y461 HydrophobicContact CE1-CD2 3.74Å; F437-Y461 HydrophobicContact CE1-CE2 4.22Å; F437-Y461 HydrophobicContact CE1-CG 4.39Å; F437-Y461 AromaticContact CZ-CD2 3.55Å; F437-Y461 HydrophobicContact CZ-CD2 3.55Å; F437-Y461 HydrophobicContact CZ-CE2 4.02Å; F437-Y461 AromaticContact CZ-CG 3.83Å; F437-Y461 HydrophobicContact CZ-CG 3.83Å; F437-Q551 HydrophobicContact CD1-CB 3.81Å; F437-Q551 HydrophobicContact CD1-CG 4.5Å; F437-Q551 HydrophobicContact CE1-CB 4.02Å; F437-Q551 HydrophobicContact CE1-CG 4.21Å; F437-Q551 HydrophobicContact CG-CB 4.33Å; F437-A553 HydrophobicContact CB-CB 4.07Å; F437-Y563 HydrophobicContact CB-CD1 3.85Å; F437-Y563 HydrophobicContact CB-CE1 4.22Å; F437-Y563 AromaticContact CD1-CD1 3.96Å; F437-Y563 HydrophobicContact CD1-CD1 3.96Å; F437-Y563 AromaticContact CD2-CD1 3.93Å; F437-Y563 HydrophobicContact CD2-CD1 3.93Å; F437-Y563 HydrophobicContact CE2-CD1 4.47Å; F437-Y563 AromaticContact CG-CD1 3.65Å; F437-Y563 HydrophobicContact CG-CD1 3.65Å; F437-Y563 HydrophobicContact CG-CE1 4.43Å
438	R	91	Very high	74.5	Confident	147 Å²	147	90.8 Å²	90.8	56%	0.555	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64	119.7	176.5	-179.7	177.1	178.4	-117.7	-2.2	110	Y440 Q551 L552 A553	R438-Y440 PolarHBondContact O-N 3.03Å; R438-Q551 PolarHBondContact N-O 3.22Å; R438-L552 HydrophobicContact CB-CD2 4.24Å; R438-L552 CarbonylContact O-C 3.5Å; R438-L552 VanDerWaalsContact O-CA 3.3Å; R438-L552 WeakPolarHBondContact O-CA 3.33Å; R438-A553 PolarHBondContact O-N 3.48Å
439	H	91.1	Very high	76.4	Confident	132 Å²	132	87 Å²	87	61%	0.611	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.6	130.6	173.2	-79	53	0	0	0	110.9	F437	F437-H439 PolarHBondContact O-N 3.45Å; F437-H439 VanDerWaalsContact O-N 3.16Å
440	Y	92.5	Very high	78.7	Confident	5 Å²	5	89 Å²	89	2%	0.02	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	119.2	-175.4	-176	-76.5	0	0	0	110.2	R438 Q445 T537 V538 V539 L543 L552 A553 K555	R438-Y440 PolarHBondContact O-N 3.03Å; Y440-Q445 HydrophobicContact CE1-CG 4.42Å; Y440-Q445 HydrophobicContact CE2-CG 4.31Å; Y440-Q445 WeakPolarHBondContact OH-CG 2.76Å; Y440-T537 WeakPolarHBondContact CE1-O 3.39Å; Y440-V538 HydrophobicContact CD1-CG2 4.26Å; Y440-V538 HydrophobicContact CE1-CB 4.27Å; Y440-V538 HydrophobicContact CE1-CG1 4.35Å; Y440-V538 HydrophobicContact CE1-CG2 4Å; Y440-V538 HydrophobicContact CE2-CG1 4.25Å; Y440-V538 WeakPolarHBondContact OH-CA 3.35Å; Y440-V539 PolarHBondContact OH-N 2.72Å; Y440-L543 HydrophobicContact CE2-CD1 4.47Å; Y440-L552 HydrophobicContact CD2-CD1 3.9Å; Y440-L552 HydrophobicContact CD2-CD2 4.18Å; Y440-L552 HydrophobicContact CE2-CD1 4.45Å; Y440-L552 HydrophobicContact CG-CD1 4.14Å; Y440-A553 PolarHBondContact N-O 2.74Å; Y440-K555 WeakPolarHBondContact O-CB 3.44Å; Y440-K555 PolarHBondContact O-N 2.84Å
441	S	89.4	Confident	80.6	Confident	12 Å²	12	89.8 Å²	89.8	8%	0.084	45%	0.453	C	S	.	.			trans	-117.7	141.1	168.9	-158.6	0	0	0	0	110.7	T443 D444 Q445	S441-T443 PolarHBondContact OG-OG1 2.74Å; S441-D444 WeakPolarHBondContact CB-OD2 3.48Å; S441-Q445 WeakPolarHBondContact O-CG 3.45Å; S441-Q445 PolarHBondContact O-NE2 3.32Å
442	F	86.9	Confident	82.2	Confident	85 Å²	85	84 Å²	84	37%	0.373	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-67.8	-36.6	179.6	177.9	-114.8	0	0	0	112.7	D444 Q445 T537 V539	F442-D444 PolarHBondContact O-N 3.05Å; F442-D444 VanDerWaalsContact O-N 3.16Å; F442-Q445 PolarHBondContact O-N 3.43Å; F442-T537 WeakPolarHBondContact CB-O 3.33Å; F442-T537 HydrophobicContact CD2-CG2 3.82Å; F442-T537 WeakPolarHBondContact CD2-O 3.38Å; F442-T537 HydrophobicContact CE2-CG2 3.67Å; F442-T537 HydrophobicContact CZ-CG2 4.26Å; F442-V539 HydrophobicContact CD2-CG2 3.97Å; F442-V539 HydrophobicContact CE2-CG2 3.76Å
443	T	83.4	Confident	82.9	Confident	87 Å²	87	83.9 Å²	83.9	53%	0.534	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-58	-28.1	-179.6	47.4	0	0	0	0	113.8	S441	S441-T443 PolarHBondContact OG-OG1 2.74Å
444	D	82.8	Confident	83.1	Confident	123 Å²	123	79.6 Å²	79.6	66%	0.658	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-98.1	4.3	-166.8	-47.5	-16.5	0	0	0	111.9	S441 F442	S441-D444 WeakPolarHBondContact CB-OD2 3.48Å; F442-D444 PolarHBondContact O-N 3.05Å; F442-D444 VanDerWaalsContact O-N 3.16Å
445	Q	80.9	Confident	83.3	Confident	44 Å²	44	78.4 Å²	78.4	21%	0.206	40%	0.404	C	S	.	.	S	Bend	trans	-90.9	143.6	-174.1	-55.9	-54.4	-46.5	0	0	112.9	Y440 S441 F442 K447 V539	Y440-Q445 HydrophobicContact CE1-CG 4.42Å; Y440-Q445 HydrophobicContact CE2-CG 4.31Å; Y440-Q445 WeakPolarHBondContact OH-CG 2.76Å; S441-Q445 WeakPolarHBondContact O-CG 3.45Å; S441-Q445 PolarHBondContact O-NE2 3.32Å; F442-Q445 PolarHBondContact O-N 3.43Å; Q445-K447 PolarHBondContact O-N 3.19Å; Q445-V539 HydrophobicContact CB-CG2 4.33Å; Q445-V539 HydrophobicContact CG-CG2 4.48Å
446	P	76.8	Confident	83.8	Confident	78 Å²	78	70.8 Å²	70.8	51%	0.506	36%	0.364	S	S	.	.			trans	-66.1	135.4	170.8	29.2	-34.2	0	0	0	110.3	C448 A542	P446-C448 PolarHBondContact O-N 3.3Å; P446-A542 HydrophobicContact CG-CB 4.47Å
447	K	72.8	Confident	84	Confident	221 Å²	221	69.6 Å²	69.6	96%	0.961	35%	0.352	S	S	*	.			trans	-61.4	109.5	172.3	-66.3	-176.8	179.8	-178.5	0	109.2	Q445	Q445-K447 PolarHBondContact O-N 3.19Å
448	C	66.6	Low	84.2	Confident	17 Å²	17	69.1 Å²	69.1	12%	0.115	35%	0.35	C	S	.	.			trans	-107.6	123	-177.9	-168.8	0	0	0	0	110	P446 V539 P541 A542 R545	P446-C448 PolarHBondContact O-N 3.3Å; C448-V539 HydrophobicContact CB-CG1 4.22Å; C448-P541 PolarHBondContact SG-O 3.31Å; C448-P541 VanDerWaalsContact SG-O 3.35Å; C448-A542 HydrophobicContact CB-CB 4.19Å; C448-R545 PolarHBondContact SG-NH2 2.71Å
449	S	72.9	Confident	84.3	Confident	100 Å²	100	63.3 Å²	63.3	70%	0.699	33%	0.329	S	S	*	.			trans	-94.7	3.6	176.8	54.7	0	0	0	0	113.8	Y451	S449-Y451 WeakPolarHBondContact O-CE2 3.26Å
450	Q	82.8	Confident	84.3	Confident	101 Å²	101	57 Å²	57	47%	0.472	30%	0.3	S	S	.	.			trans	-73.7	169.1	172	-67.1	172.3	-47.2	0	0	110.4	Q514 P541	Q450-Q514 PolarHBondContact O-NE2 3.2Å; Q450-P541 HydrophobicContact CB-CB 3.9Å; Q450-P541 WeakPolarHBondContact O-CG 3.38Å
451	Y	84.9	Confident	84.2	Confident	143 Å²	143	59.3 Å²	59.3	56%	0.561	31%	0.309	S	S	*	.			trans	-130.6	154.4	178.3	-61.3	-85.7	0	0	0	108.3	S449 N512 A513 Q514	S449-Y451 WeakPolarHBondContact O-CE2 3.26Å; Y451-N512 HydrophobicContact CD1-CB 4.35Å; Y451-N512 WeakPolarHBondContact CD1-O 3.45Å; Y451-N512 HydrophobicContact CG-CB 4.38Å; Y451-A513 WeakPolarHBondContact CA-O 3.29Å; Y451-Q514 HydrophobicContact CD1-CG 3.35Å; Y451-Q514 HydrophobicContact CE1-CG 3.48Å; Y451-Q514 VanDerWaalsContact CE1-CG 3.48Å; Y451-Q514 HydrophobicContact CG-CG 4.28Å
452	I	86	Confident	84.2	Confident	26 Å²	26	58.8 Å²	58.8	13%	0.133	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	138.7	179.9	-153.4	157	0	0	0	111.9	L510 A513 L540 P541 F544 L568	I452-L510 HydrophobicContact CG2-CD1 4.16Å; I452-A513 PolarHBondContact N-O 3.49Å; I452-A513 PolarHBondContact O-N 2.86Å; I452-L540 HydrophobicContact CG2-CB 3.63Å; I452-P541 HydrophobicContact CB-CG 4.19Å; I452-P541 HydrophobicContact CG2-CG 4.16Å; I452-F544 HydrophobicContact CD1-CB 3.78Å; I452-F544 HydrophobicContact CD1-CD2 4.08Å; I452-F544 HydrophobicContact CD1-CG 4.38Å; I452-L568 HydrophobicContact CD1-CD2 3.39Å; I452-L568 HydrophobicContact CG1-CD2 3.73Å
453	S	83.3	Confident	84.4	Confident	55 Å²	55	54.8 Å²	54.8	39%	0.385	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	145.6	-170.3	-59.2	0	0	0	0	110.3	L510 N512	S453-L510 VanDerWaalsContact CA-O 3.27Å; S453-L510 WeakPolarHBondContact CA-O 3.35Å; S453-N512 WeakPolarHBondContact OG-CA 3.34Å; S453-N512 PolarHBondContact OG-N 2.7Å; S453-N512 PolarHBondContact OG-OD1 2.84Å
454	G	82.3	Confident	84.6	Confident	9 Å²	9	53.4 Å²	53.4	9%	0.093	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	136.1	-169.6	-175.9	0	0	0	0	0	112.8	L510	G454-L510 PolarHBondContact N-O 3.03Å; G454-L510 WeakPolarHBondContact O-CB 3.48Å; G454-L510 PolarHBondContact O-N 3.21Å
455	L	84.5	Confident	84.6	Confident	43 Å²	43	49.9 Å²	49.9	23%	0.225	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	112.5	-178.8	-172.9	66.2	0	0	0	110	N507 M569	L455-N507 HydrophobicContact CD1-CB 4.25Å; L455-M569 HydrophobicContact CB-CB 4.45Å; L455-M569 PolarHBondContact N-O 3.14Å; L455-M569 VanDerWaalsContact N-O 3.17Å; L455-M569 WeakPolarHBondContact O-CA 3.18Å; L455-M569 WeakPolarHBondContact O-CB 3.2Å; L455-M569 PolarHBondContact O-N 3.47Å
456	M	91.7	Very high	84.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	120.3	175.4	-179.3	179.2	69.7	0	0	110.3	I508 L510 L516 L540 F544 L566 N567 L568	M456-I508 HydrophobicContact CE-CD1 4.46Å; M456-I508 PolarHBondContact N-O 3.39Å; M456-I508 PolarHBondContact O-N 2.99Å; M456-L510 HydrophobicContact CB-CD1 3.72Å; M456-L510 HydrophobicContact CB-CG 4.02Å; M456-L510 HydrophobicContact CE-CD1 4.45Å; M456-L510 HydrophobicContact CE-CD2 4.12Å; M456-L510 HydrophobicContact CG-CD1 4.5Å; M456-L510 HydrophobicContact SD-CD1 4.11Å; M456-L516 HydrophobicContact CE-CD1 3.95Å; M456-L516 HydrophobicContact CE-CD2 3.83Å; M456-L516 HydrophobicContact CE-CG 4.32Å; M456-L516 HydrophobicContact SD-CD2 4.43Å; M456-L540 HydrophobicContact CE-CD2 4.39Å; M456-L540 HydrophobicContact SD-CD2 3.72Å; M456-F544 HydrophobicContact CG-CZ 4.24Å; M456-F544 HydrophobicContact SD-CE2 3.96Å; M456-F544 HydrophobicContact SD-CZ 3.96Å; M456-L566 HydrophobicContact CE-CD2 4.43Å; M456-L566 HydrophobicContact SD-CD2 3.96Å; M456-N567 CarbonylContact C-O 3.6Å; M456-N567 WeakPolarHBondContact CA-O 3.26Å; M456-L568 HydrophobicContact CB-CD1 4.46Å
457	S	91.6	Very high	83.8	Confident	23 Å²	23	51.8 Å²	51.8	16%	0.161	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	127.6	165.9	-157.3	0	0	0	0	109.4	F506 N507 L566 N567	S457-F506 WeakPolarHBondContact CA-O 3.26Å; S457-N507 WeakPolarHBondContact CB-OD1 3.46Å; S457-N507 PolarHBondContact OG-OD1 3.31Å; S457-L566 WeakPolarHBondContact O-CA 3.15Å; S457-N567 PolarHBondContact N-O 3.26Å; S457-N567 PolarHBondContact O-N 2.96Å
458	L	94.1	Very high	83.2	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	110.4	176.8	160.7	58.7	0	0	0	108	F460 I480 F506 I508 L516 L518 V564 L566	L458-F460 HydrophobicContact CD1-CD2 4.08Å; L458-F460 HydrophobicContact CD1-CE2 3.9Å; L458-F460 HydrophobicContact CD1-CZ 4.42Å; L458-F460 HydrophobicContact CD2-CD2 4.48Å; L458-F460 HydrophobicContact CD2-CE2 3.6Å; L458-F460 HydrophobicContact CD2-CZ 4.06Å; L458-F460 HydrophobicContact CG-CD2 4.04Å; L458-F460 HydrophobicContact CG-CE2 3.64Å; L458-F460 HydrophobicContact CG-CZ 4.43Å; L458-I480 HydrophobicContact CD2-CD1 4.1Å; L458-I480 HydrophobicContact CD2-CG1 4.22Å; L458-I480 HydrophobicContact CD2-CG2 3.81Å; L458-F506 PolarHBondContact N-O 2.88Å; L458-F506 PolarHBondContact O-N 3.46Å; L458-I508 HydrophobicContact CB-CD1 4.27Å; L458-I508 HydrophobicContact CD2-CD1 3.94Å; L458-L516 HydrophobicContact CD2-CD1 4.36Å; L458-L516 HydrophobicContact CD2-CD2 4.36Å; L458-L518 HydrophobicContact CD2-CD2 4.05Å; L458-V564 HydrophobicContact CD1-CB 3.81Å; L458-V564 HydrophobicContact CD1-CG1 3.85Å; L458-L566 HydrophobicContact CB-CD2 4Å; L458-L566 HydrophobicContact CD1-CD2 3.65Å; L458-L566 HydrophobicContact CG-CD2 4.31Å
459	H	92.5	Very high	82.7	Confident	26 Å²	26	44.9 Å²	44.9	12%	0.12	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	133.2	170.6	-179.6	-65.2	0	0	0	109.5	Y461 D503 H504 T505 V564 K565	H459-Y461 HydrophobicContact CB-CE2 4.45Å; H459-Y461 AromaticContact CE1-CD1 3.52Å; H459-Y461 AromaticContact CE1-CD2 3.81Å; H459-Y461 AromaticContact CE1-CE1 3.49Å; H459-Y461 VanDerWaalsContact CE1-CE1 3.49Å; H459-Y461 WeakPolarHBondContact CE1-CE1 3.34Å; H459-Y461 AromaticContact CE1-CE2 3.77Å; H459-Y461 AromaticContact CE1-CG 3.69Å; H459-Y461 AromaticContact CE1-CZ 3.61Å; H459-Y461 AromaticContact CG-CE2 3.94Å; H459-Y461 AromaticContact ND1-CD1 3.87Å; H459-Y461 AromaticContact ND1-CD2 3.28Å; H459-Y461 VanDerWaalsContact ND1-CD2 3.28Å; H459-Y461 WeakPolarHBondContact ND1-CD2 3.26Å; H459-Y461 AromaticContact ND1-CE1 3.76Å; H459-Y461 AromaticContact ND1-CE2 3.13Å; H459-Y461 WeakPolarHBondContact ND1-CE2 3.3Å; H459-Y461 AromaticContact ND1-CG 3.65Å; H459-Y461 AromaticContact ND1-CZ 3.39Å; H459-D503 IonicContact CD2-OD1 2.63Å; H459-D503 IonicContact CE1-OD1 3.23Å; H459-D503 IonicContact NE2-OD1 2.64Å; H459-D503 PolarHBondContact NE2-OD1 2.9Å; H459-H504 WeakPolarHBondContact CA-O 3.24Å; H459-T505 PolarHBondContact CD2-OG1 2.98Å; H459-V564 CarbonylContact O-C 3.5Å; H459-V564 WeakPolarHBondContact O-CA 3.33Å; H459-V564 WeakPolarHBondContact O-CB 3.48Å; H459-K565 HydrophobicContact CB-CB 4.39Å; H459-K565 PolarHBondContact N-O 3.46Å; H459-K565 PolarHBondContact O-N 2.8Å
460	F	92.7	Very high	82	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	128.7	169.6	-70.2	-107.6	0	0	0	109.8	L458 C478 I480 M502 H504 F506 L518 I562 V564	L458-F460 HydrophobicContact CD1-CD2 4.08Å; L458-F460 HydrophobicContact CD1-CE2 3.9Å; L458-F460 HydrophobicContact CD1-CZ 4.42Å; L458-F460 HydrophobicContact CD2-CD2 4.48Å; L458-F460 HydrophobicContact CD2-CE2 3.6Å; L458-F460 HydrophobicContact CD2-CZ 4.06Å; L458-F460 HydrophobicContact CG-CD2 4.04Å; L458-F460 HydrophobicContact CG-CE2 3.64Å; L458-F460 HydrophobicContact CG-CZ 4.43Å; F460-C478 HydrophobicContact CE1-CB 4.32Å; F460-C478 HydrophobicContact CZ-CB 4.5Å; F460-I480 HydrophobicContact CE2-CD1 3.75Å; F460-I480 HydrophobicContact CE2-CG1 4.15Å; F460-I480 HydrophobicContact CZ-CD1 4.05Å; F460-I480 HydrophobicContact CZ-CG1 3.94Å; F460-M502 CarbonylContact C-O 3.55Å; F460-M502 HydrophobicContact CB-CB 4.09Å; F460-M502 HydrophobicContact CB-CE 3.75Å; F460-M502 HydrophobicContact CB-SD 4.36Å; F460-M502 HydrophobicContact CD1-CE 3.4Å; F460-M502 VanDerWaalsContact CD1-CE 3.4Å; F460-M502 HydrophobicContact CD1-SD 4.15Å; F460-M502 HydrophobicContact CE1-CE 4.07Å; F460-M502 HydrophobicContact CG-CE 3.7Å; F460-M502 CarbonylContact O-C 3.56Å; F460-H504 HydrophobicContact CB-CB 4.45Å; F460-H504 PolarHBondContact N-O 2.79Å; F460-H504 PolarHBondContact O-N 3.37Å; F460-F506 AromaticContact CD2-CD2 3.91Å; F460-F506 HydrophobicContact CD2-CD2 3.91Å; F460-F506 AromaticContact CD2-CE2 3.74Å; F460-F506 HydrophobicContact CD2-CE2 3.74Å; F460-F506 AromaticContact CE2-CD2 3.71Å; F460-F506 HydrophobicContact CE2-CD2 3.71Å; F460-F506 AromaticContact CE2-CE2 3.61Å; F460-F506 HydrophobicContact CE2-CE2 3.61Å; F460-L518 HydrophobicContact CE1-CD1 4.25Å; F460-L518 HydrophobicContact CZ-CD1 4.45Å; F460-L518 HydrophobicContact CZ-CD2 4.05Å; F460-I562 HydrophobicContact CD1-CG2 3.57Å; F460-I562 HydrophobicContact CE1-CG2 3.9Å; F460-V564 HydrophobicContact CD1-CG1 3.93Å; F460-V564 HydrophobicContact CE1-CG1 4.23Å; F460-V564 HydrophobicContact CG-CG1 4.24Å
461	Y	89.5	Confident	80.6	Confident	53 Å²	53	48.6 Å²	48.6	21%	0.208	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	-14.9	174.9	-69.7	-86.9	0	0	0	114.1	L432 F437 H459 M502 Y563 K565	L432-Y461 WeakPolarHBondContact CD1-O 3.35Å; L432-Y461 HydrophobicContact CD2-CD1 3.74Å; L432-Y461 HydrophobicContact CD2-CG 4.29Å; F437-Y461 AromaticContact CE1-CD2 3.74Å; F437-Y461 HydrophobicContact CE1-CD2 3.74Å; F437-Y461 HydrophobicContact CE1-CE2 4.22Å; F437-Y461 HydrophobicContact CE1-CG 4.39Å; F437-Y461 AromaticContact CZ-CD2 3.55Å; F437-Y461 HydrophobicContact CZ-CD2 3.55Å; F437-Y461 HydrophobicContact CZ-CE2 4.02Å; F437-Y461 AromaticContact CZ-CG 3.83Å; F437-Y461 HydrophobicContact CZ-CG 3.83Å; H459-Y461 HydrophobicContact CB-CE2 4.45Å; H459-Y461 AromaticContact CE1-CD1 3.52Å; H459-Y461 AromaticContact CE1-CD2 3.81Å; H459-Y461 AromaticContact CE1-CE1 3.49Å; H459-Y461 VanDerWaalsContact CE1-CE1 3.49Å; H459-Y461 WeakPolarHBondContact CE1-CE1 3.34Å; H459-Y461 AromaticContact CE1-CE2 3.77Å; H459-Y461 AromaticContact CE1-CG 3.69Å; H459-Y461 AromaticContact CE1-CZ 3.61Å; H459-Y461 AromaticContact CG-CE2 3.94Å; H459-Y461 AromaticContact ND1-CD1 3.87Å; H459-Y461 AromaticContact ND1-CD2 3.28Å; H459-Y461 VanDerWaalsContact ND1-CD2 3.28Å; H459-Y461 WeakPolarHBondContact ND1-CD2 3.26Å; H459-Y461 AromaticContact ND1-CE1 3.76Å; H459-Y461 AromaticContact ND1-CE2 3.13Å; H459-Y461 WeakPolarHBondContact ND1-CE2 3.3Å; H459-Y461 AromaticContact ND1-CG 3.65Å; H459-Y461 AromaticContact ND1-CZ 3.39Å; Y461-M502 CarbonylContact C-O 3.57Å; Y461-M502 WeakPolarHBondContact CA-O 3.46Å; Y461-Y563 PolarHBondContact N-O 2.72Å; Y461-K565 HydrophobicContact CE2-CB 3.61Å; Y461-K565 HydrophobicContact CE2-CD 4.37Å
462	G	89.6	Confident	79.1	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.4	-177.2	179.2	0	0	0	0	0	113.4	L500 I562 Y563	G462-L500 CarbonylContact C-O 3.51Å; G462-L500 WeakPolarHBondContact CA-O 3.25Å; G462-I562 WeakPolarHBondContact O-CG2 3.12Å; G462-Y563 PolarHBondContact O-N 3.38Å
463	A	89.8	Confident	78	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.008	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	148.5	-177.9	0	0	0	0	0	113.2	L466 F499 L500 M502 L561 I562	A463-L466 HydrophobicContact CB-CD1 3.45Å; A463-L466 VanDerWaalsContact CB-CD1 3.45Å; A463-L466 HydrophobicContact CB-CD2 4.34Å; A463-L466 HydrophobicContact CB-CG 3.8Å; A463-F499 CarbonylContact O-C 3.6Å; A463-F499 WeakPolarHBondContact O-CA 3.38Å; A463-L500 PolarHBondContact N-O 3.29Å; A463-L500 PolarHBondContact O-N 3.09Å; A463-M502 HydrophobicContact CB-SD 4.47Å; A463-L561 CarbonylContact C-O 3.57Å; A463-L561 WeakPolarHBondContact CA-O 3.3Å; A463-L561 VanDerWaalsContact CB-O 3.31Å; A463-L561 WeakPolarHBondContact CB-O 3.31Å; A463-I562 HydrophobicContact CB-CB 4.44Å; A463-I562 HydrophobicContact CB-CG1 3.99Å; A463-I562 HydrophobicContact CB-CG2 4.44Å
464	E	88.7	Confident	77.4	Confident	59 Å²	59	51.8 Å²	51.8	28%	0.276	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	153.7	-176.6	-78.9	-172.9	178.6	0	0	113.2	L466 F499 G560 L561 Y563	E464-L466 PolarHBondContact O-N 3.18Å; E464-F499 HydrophobicContact CG-CD2 3.47Å; E464-F499 VanDerWaalsContact CG-CD2 3.47Å; E464-F499 HydrophobicContact CG-CE2 4.05Å; E464-F499 HydrophobicContact CG-CG 4.4Å; E464-F499 WeakPolarHBondContact OE1-CD2 3.38Å; E464-G560 CarbonylContact O-C 3.58Å; E464-G560 WeakPolarHBondContact O-CA 3.3Å; E464-L561 HydrophobicContact CB-CB 4.46Å; E464-L561 PolarHBondContact N-O 2.89Å; E464-L561 PolarHBondContact O-N 3.5Å; E464-Y563 HydrophobicContact CB-CE2 4.39Å; E464-Y563 HydrophobicContact CG-CE2 3.94Å; E464-Y563 PolarHBondContact OE2-OH 2.77Å
465	D	81.7	Confident	77.5	Confident	49 Å²	49	53.7 Å²	53.7	26%	0.262	26%	0.259	S	S	.	.			trans	51.2	26.4	179.9	-160.8	46.7	0	0	0	114.3	K467 S498 R559	D465-K467 PolarHBondContact O-N 2.95Å; D465-K467 IonicContact OD1-NZ 2.72Å; D465-K467 PolarHBondContact OD1-NZ 3.02Å; D465-S498 PolarHBondContact N-O 3.36Å; D465-R559 IonicContact OD1-NH2 2.72Å; D465-R559 PolarHBondContact OD1-NH2 3.16Å; D465-R559 IonicContact OD2-CZ 2.67Å; D465-R559 IonicContact OD2-NE 3.56Å; D465-R559 PolarHBondContact OD2-NE 3.34Å; D465-R559 IonicContact OD2-NH2 2.82Å; D465-R559 PolarHBondContact OD2-NH2 2.93Å
466	L	75.9	Confident	77.7	Confident	21 Å²	21	51.9 Å²	51.9	11%	0.11	25%	0.25	C	C	.	.			trans	-67.8	65.6	169	-64.4	-169.8	0	0	0	111	A463 E464 P468 L500 V520 L556	A463-L466 HydrophobicContact CB-CD1 3.45Å; A463-L466 VanDerWaalsContact CB-CD1 3.45Å; A463-L466 HydrophobicContact CB-CD2 4.34Å; A463-L466 HydrophobicContact CB-CG 3.8Å; E464-L466 PolarHBondContact O-N 3.18Å; L466-P468 WeakPolarHBondContact O-CD 3.49Å; L466-L500 HydrophobicContact CD1-CB 4.43Å; L466-L500 HydrophobicContact CD1-CD2 3.82Å; L466-V520 HydrophobicContact CD2-CG2 4.4Å; L466-L556 HydrophobicContact CD2-CD1 3.59Å
467	K	65.4	Low	77.6	Confident	141 Å²	141	53.2 Å²	53.2	61%	0.613	26%	0.255	S	S	*	.			trans	-73.9	111.8	173.2	-71.3	-170.1	169.6	82.7	0	109	D465	D465-K467 PolarHBondContact O-N 2.95Å; D465-K467 IonicContact OD1-NZ 2.72Å; D465-K467 PolarHBondContact OD1-NZ 3.02Å
468	P	61.4	Low	77.6	Confident	36 Å²	36	52.3 Å²	52.3	23%	0.234	25%	0.249	C	C	.	.			trans	-62.8	148.5	176.7	25.6	-33.5	0	0	0	110.7	L466 R470 S473	L466-P468 WeakPolarHBondContact O-CD 3.49Å; P468-R470 WeakPolarHBondContact CG-O 3.43Å; P468-R470 PolarHBondContact O-N 3.29Å; P468-S473 VanDerWaalsContact CB-O 3.26Å; P468-S473 WeakPolarHBondContact CB-O 3.48Å; P468-S473 WeakPolarHBondContact CG-O 3.36Å
469	P	56	Low	77.5	Confident	57 Å²	57	52.6 Å²	52.6	37%	0.37	25%	0.251	S	S	.	.	S	Bend	trans	-64.2	-3	-178.7	-26.1	35.5	0	0	0	116.5	C533	P469-C533 WeakPolarHBondContact CD-SG 3.48Å; P469-C533 HydrophobicContact CG-CB 4.44Å
470	R	56.9	Low	77.6	Confident	132 Å²	132	51.4 Å²	51.4	50%	0.498	25%	0.246	S	C	.	.	S	Bend	trans	-142.8	154.1	174.6	-71.6	-176.1	175.1	155	0.3	108.5	P468 D472 E524	P468-R470 WeakPolarHBondContact CG-O 3.43Å; P468-R470 PolarHBondContact O-N 3.29Å; R470-D472 VanDerWaalsContact C-N 3.27Å; R470-D472 PolarHBondContact O-N 2.95Å; R470-E524 IonicContact CZ-OE1 3.93Å; R470-E524 IonicContact NH1-OE1 2.65Å; R470-E524 PolarHBondContact NH1-OE1 3.48Å; R470-E524 IonicContact NH1-OE2 3.52Å; R470-E524 PolarHBondContact NH1-OE2 2.91Å; R470-E524 VanDerWaalsContact NH1-OE2 3.16Å
471	I	54.8	Low	77.7	Confident	146 Å²	146	52.7 Å²	52.7	75%	0.749	25%	0.252	S	S	*	.	S	Bend	trans	-78.4	-13	-172.2	-157	158.9	0	0	0	113.7
472	D	53.2	Low	77.9	Confident	132 Å²	132	50.5 Å²	50.5	71%	0.706	24%	0.244	S	C	*	.	S	Bend	trans	-98.7	-34	-170.8	-43.8	-77.1	0	0	0	112.9	R470 R474	R470-D472 VanDerWaalsContact C-N 3.27Å; R470-D472 PolarHBondContact O-N 2.95Å; D472-R474 PolarHBondContact O-N 3.5Å
473	S	63.4	Low	78	Confident	13 Å²	13	53.1 Å²	53.1	9%	0.091	26%	0.258	C	S	.	.			trans	-77.9	80.6	178.4	-53.4	0	0	0	0	111.4	P468 D475	P468-S473 VanDerWaalsContact CB-O 3.26Å; P468-S473 WeakPolarHBondContact CB-O 3.48Å; P468-S473 WeakPolarHBondContact CG-O 3.36Å; S473-D475 VanDerWaalsContact C-N 3.35Å
474	R	70.1	Confident	77.9	Confident	147 Å²	147	57.7 Å²	57.7	56%	0.555	29%	0.29	S	S	*	.			trans	-77.8	-18.7	177.5	-63	-168.5	-178	-151.8	0.8	114.2	D472 T494 C495	D472-R474 PolarHBondContact O-N 3.5Å; R474-T494 HydrophobicContact CB-CG2 4.09Å; R474-C495 WeakPolarHBondContact O-CB 3.31Å; R474-C495 PolarHBondContact O-N 2.98Å
475	D	84.8	Confident	77.9	Confident	48 Å²	48	59.3 Å²	59.3	26%	0.257	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	128.7	-175.5	-62.4	-44.7	0	0	0	111.4	S473 L492 L493 T494 W523	S473-D475 VanDerWaalsContact C-N 3.35Å; D475-L492 HydrophobicContact CB-CD1 3.89Å; D475-L492 HydrophobicContact CB-CD2 3.95Å; D475-L492 HydrophobicContact CB-CG 3.87Å; D475-L493 WeakPolarHBondContact CA-O 3.47Å; D475-T494 VanDerWaalsContact OD1-CA 3.3Å; D475-T494 WeakPolarHBondContact OD1-CA 3.4Å; D475-T494 WeakPolarHBondContact OD1-CB 3.42Å; D475-T494 WeakPolarHBondContact OD1-CG2 3.41Å; D475-T494 PolarHBondContact OD1-OG1 3.03Å; D475-W523 HydrophobicContact CB-CB 4.3Å; D475-W523 PolarHBondContact O-N 2.82Å
476	V	87.7	Confident	78.2	Confident	5 Å²	5	62 Å²	62	3%	0.03	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	159.5	-179	-61	0	0	0	0	111.4	L493 L500 V520 F521	V476-L493 HydrophobicContact CG2-CB 4.3Å; V476-L493 WeakPolarHBondContact CG2-O 3.24Å; V476-L493 PolarHBondContact N-O 2.99Å; V476-L493 WeakPolarHBondContact O-CB 3.41Å; V476-L493 PolarHBondContact O-N 2.91Å; V476-L500 HydrophobicContact CG2-CD2 3.92Å; V476-V520 HydrophobicContact CB-CG1 3.92Å; V476-V520 HydrophobicContact CG1-CG1 4.31Å; V476-V520 HydrophobicContact CG2-CG1 4.27Å; V476-F521 CarbonylContact C-O 3.57Å; V476-F521 WeakPolarHBondContact CA-O 3.49Å; V476-F521 WeakPolarHBondContact CB-O 3.49Å
477	Y	89.9	Confident	78.8	Confident	28 Å²	28	64 Å²	64	11%	0.11	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	147.4	165.5	68.7	-93.6	0	0	0	110.4	A479 R489 L492 V520 F521 W523 N530	Y477-A479 HydrophobicContact CE2-CB 4.38Å; Y477-R489 HydrophobicContact CD2-CB 4.44Å; Y477-L492 HydrophobicContact CD1-CD1 4.43Å; Y477-V520 WeakPolarHBondContact O-CA 3.3Å; Y477-F521 HydrophobicContact CD1-CB 4.14Å; Y477-F521 HydrophobicContact CD2-CB 4.38Å; Y477-F521 HydrophobicContact CD2-CD2 4.35Å; Y477-F521 HydrophobicContact CE1-CB 3.64Å; Y477-F521 HydrophobicContact CE1-CG 4.34Å; Y477-F521 HydrophobicContact CE2-CB 3.89Å; Y477-F521 AromaticContact CE2-CD2 3.59Å; Y477-F521 HydrophobicContact CE2-CD2 3.59Å; Y477-F521 HydrophobicContact CE2-CE2 4.36Å; Y477-F521 AromaticContact CE2-CG 3.93Å; Y477-F521 HydrophobicContact CE2-CG 3.93Å; Y477-F521 HydrophobicContact CG-CB 4.48Å; Y477-F521 VanDerWaalsContact CZ-CB 3.48Å; Y477-F521 AromaticContact CZ-CD2 3.85Å; Y477-F521 AromaticContact CZ-CG 3.68Å; Y477-F521 PolarHBondContact N-O 3.21Å; Y477-F521 PolarHBondContact O-N 3.15Å; Y477-F521 WeakPolarHBondContact OH-CG 3.38Å; Y477-W523 HydrophobicContact CE1-CE3 4.4Å; Y477-N530 PolarHBondContact OH-ND2 2.67Å
478	C	91.1	Very high	79.9	Confident	5 Å²	5	58 Å²	58	3%	0.034	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	120	172.8	-168.4	0	0	0	0	109.6	F460 R489 T490 V519	F460-C478 HydrophobicContact CE1-CB 4.32Å; F460-C478 HydrophobicContact CZ-CB 4.5Å; C478-R489 CarbonylContact O-C 3.54Å; C478-R489 VanDerWaalsContact O-CA 3.24Å; C478-R489 WeakPolarHBondContact O-CA 3.45Å; C478-T490 HydrophobicContact CB-CG2 3.88Å; C478-T490 PolarHBondContact N-OG1 3.38Å; C478-T490 PolarHBondContact O-N 3.25Å; C478-V519 CarbonylContact C-O 3.6Å; C478-V519 WeakPolarHBondContact CA-O 3.39Å
479	A	92.1	Very high	81.3	Confident	6 Å²	6	64.8 Å²	64.8	5%	0.05	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	143.7	163.8	0	0	0	0	0	109.7	Y477 V519 F521	Y477-A479 HydrophobicContact CE2-CB 4.38Å; A479-V519 PolarHBondContact N-O 3.02Å; A479-V519 PolarHBondContact O-N 3.27Å; A479-F521 HydrophobicContact CB-CD2 4.12Å; A479-F521 HydrophobicContact CB-CE2 3.76Å
480	I	95.4	Very high	82.9	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	112.6	-176.5	-57.4	153.9	0	0	0	107.8	L458 F460 K487 A488 F506 I508 L516 L518	L458-I480 HydrophobicContact CD2-CD1 4.1Å; L458-I480 HydrophobicContact CD2-CG1 4.22Å; L458-I480 HydrophobicContact CD2-CG2 3.81Å; F460-I480 HydrophobicContact CE2-CD1 3.75Å; F460-I480 HydrophobicContact CE2-CG1 4.15Å; F460-I480 HydrophobicContact CZ-CD1 4.05Å; F460-I480 HydrophobicContact CZ-CG1 3.94Å; I480-K487 PolarHBondContact O-N 3.41Å; I480-A488 HydrophobicContact CB-CB 4.33Å; I480-A488 HydrophobicContact CD1-CB 3.9Å; I480-A488 PolarHBondContact N-O 2.92Å; I480-A488 PolarHBondContact O-N 2.84Å; I480-F506 HydrophobicContact CD1-CB 4.45Å; I480-F506 HydrophobicContact CD1-CD1 4.05Å; I480-F506 HydrophobicContact CD1-CD2 3.49Å; I480-F506 VanDerWaalsContact CD1-CD2 3.49Å; I480-F506 HydrophobicContact CD1-CE1 4.14Å; I480-F506 HydrophobicContact CD1-CE2 3.58Å; I480-F506 HydrophobicContact CD1-CG 3.72Å; I480-F506 HydrophobicContact CD1-CZ 3.92Å; I480-I508 HydrophobicContact CG2-CD1 3.56Å; I480-L516 HydrophobicContact CG2-CD1 3.57Å; I480-L518 HydrophobicContact CG1-CD2 4.33Å; I480-L518 HydrophobicContact CG2-CD2 4.2Å
481	Q	94.9	Very high	84.2	Confident	27 Å²	27	59 Å²	59	13%	0.126	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	138.6	-178.7	-69.9	170.6	-5.7	0	0	110.4	V485 N486 L516 K517	Q481-V485 CarbonylContact C-O 3.44Å; Q481-V485 VanDerWaalsContact CA-O 3.25Å; Q481-V485 WeakPolarHBondContact CA-O 3.5Å; Q481-N486 WeakPolarHBondContact CG-OD1 3.39Å; Q481-N486 PolarHBondContact NE2-OD1 3.45Å; Q481-L516 CarbonylContact O-C 3.45Å; Q481-L516 WeakPolarHBondContact O-CA 3.35Å; Q481-K517 HydrophobicContact CB-CB 4.12Å; Q481-K517 WeakPolarHBondContact CB-O 3.31Å; Q481-K517 PolarHBondContact N-O 2.78Å; Q481-K517 PolarHBondContact O-N 3.32Å
482	V	93.7	Very high	85.6	Confident	8 Å²	8	56.1 Å²	56.1	5%	0.048	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	118	166	177.1	0	0	0	0	107	S484 V485 K487 I508 L510 A513 H515 L516	V482-S484 VanDerWaalsContact C-N 3.27Å; V482-S484 PolarHBondContact O-N 3.14Å; V482-V485 PolarHBondContact N-O 3.45Å; V482-V485 WeakPolarHBondContact O-CB 3.26Å; V482-V485 PolarHBondContact O-N 3.23Å; V482-K487 HydrophobicContact CB-CG 3.97Å; V482-K487 HydrophobicContact CG2-CG 3.91Å; V482-I508 HydrophobicContact CG2-CG2 3.95Å; V482-L510 HydrophobicContact CB-CD2 4.49Å; V482-L510 HydrophobicContact CG1-CD2 3.82Å; V482-L510 HydrophobicContact CG2-CD2 3.85Å; V482-A513 HydrophobicContact CG1-CB 3.59Å; V482-H515 CarbonylContact C-O 3.58Å; V482-H515 WeakPolarHBondContact CA-O 3.44Å; V482-L516 HydrophobicContact CG2-CD1 4.26Å
483	D	91.1	Very high	87.1	Confident	55 Å²	55	51.1 Å²	51.1	29%	0.294	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.7	51.8	-174.2	-62.8	-67.7	0	0	0	113	V485 A513 Q514 H515	D483-V485 PolarHBondContact O-N 2.92Å; D483-A513 VanDerWaalsContact OD2-CA 3.25Å; D483-A513 WeakPolarHBondContact OD2-CA 3.13Å; D483-Q514 PolarHBondContact OD2-N 3.41Å; D483-H515 PolarHBondContact N-O 2.92Å; D483-H515 WeakPolarHBondContact OD1-CB 3.49Å; D483-H515 IonicContact OD1-CG 3.25Å; D483-H515 PolarHBondContact OD1-N 3.24Å; D483-H515 IonicContact OD1-ND1 3.78Å; D483-H515 PolarHBondContact OD1-ND1 3.42Å; D483-H515 PolarHBondContact OD2-N 3.01Å
484	S	87.8	Confident	88	Confident	97 Å²	97	53.1 Å²	53.1	68%	0.678	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	-6.3	-176.8	-45.1	0	0	0	0	116.4	V482	V482-S484 VanDerWaalsContact C-N 3.27Å; V482-S484 PolarHBondContact O-N 3.14Å
485	V	88.6	Confident	88.3	Confident	92 Å²	92	47 Å²	47	56%	0.558	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.6	120.2	174.6	-175.5	0	0	0	0	110.2	Q481 V482 D483 K487	Q481-V485 CarbonylContact C-O 3.44Å; Q481-V485 VanDerWaalsContact CA-O 3.25Å; Q481-V485 WeakPolarHBondContact CA-O 3.5Å; V482-V485 PolarHBondContact N-O 3.45Å; V482-V485 WeakPolarHBondContact O-CB 3.26Å; V482-V485 PolarHBondContact O-N 3.23Å; D483-V485 PolarHBondContact O-N 2.92Å; V485-K487 PolarHBondContact O-N 2.71Å; V485-K487 VanDerWaalsContact O-N 3.12Å
486	N	89.1	Confident	87.5	Confident	107 Å²	107	54.4 Å²	54.4	57%	0.572	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.8	111.1	173.1	-66.2	-54.6	0	0	0	110.4	Q481	Q481-N486 WeakPolarHBondContact CG-OD1 3.39Å; Q481-N486 PolarHBondContact NE2-OD1 3.45Å
487	K	86.9	Confident	86.8	Confident	61 Å²	61	59 Å²	59	27%	0.265	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	-37.4	178.1	-70.6	-91.6	-176.3	162.6	0	112.3	I480 V482 V485 I508 E509	I480-K487 PolarHBondContact O-N 3.41Å; V482-K487 HydrophobicContact CB-CG 3.97Å; V482-K487 HydrophobicContact CG2-CG 3.91Å; V485-K487 PolarHBondContact O-N 2.71Å; V485-K487 VanDerWaalsContact O-N 3.12Å; K487-I508 HydrophobicContact CB-CG2 4.1Å; K487-I508 HydrophobicContact CD-CG2 4.27Å; K487-I508 HydrophobicContact CG-CG2 4.17Å; K487-E509 PolarHBondContact NZ-O 2.73Å
488	A	90.1	Very high	86.1	Confident	15 Å²	15	62.9 Å²	62.9	12%	0.124	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	172.9	-179.6	0	0	0	0	0	112.5	I480 F506	I480-A488 HydrophobicContact CB-CB 4.33Å; I480-A488 HydrophobicContact CD1-CB 3.9Å; I480-A488 PolarHBondContact N-O 2.92Å; I480-A488 PolarHBondContact O-N 2.84Å; A488-F506 HydrophobicContact CB-CD1 3.81Å; A488-F506 HydrophobicContact CB-CE1 4.22Å; A488-F506 HydrophobicContact CB-CG 4.47Å
489	R	89.8	Confident	85.8	Confident	180 Å²	180	64.8 Å²	64.8	68%	0.679	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.8	154	168.3	67.7	177.6	-176.9	-172.1	0.9	110.9	Y477 C478 F506	Y477-R489 HydrophobicContact CD2-CB 4.44Å; C478-R489 CarbonylContact O-C 3.54Å; C478-R489 VanDerWaalsContact O-CA 3.24Å; C478-R489 WeakPolarHBondContact O-CA 3.45Å; R489-F506 WeakPolarHBondContact O-CE1 3.35Å
490	T	88.8	Confident	85.4	Confident	8 Å²	8	65.1 Å²	65.1	5%	0.049	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-70.8	167.5	169.2	64.8	0	0	0	0	111.8	C478 M502 F506	C478-T490 HydrophobicContact CB-CG2 3.88Å; C478-T490 PolarHBondContact N-OG1 3.38Å; C478-T490 PolarHBondContact O-N 3.25Å; T490-M502 HydrophobicContact CG2-CE 3.84Å; T490-F506 HydrophobicContact CG2-CE2 4.15Å; T490-F506 HydrophobicContact CG2-CZ 3.96Å
491	A	84.9	Confident	84.8	Confident	60 Å²	60	70.7 Å²	70.7	50%	0.496	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-60.3	171.1	155.5	0	0	0	0	0	111.2
492	L	84.8	Confident	84.2	Confident	84 Å²	84	69.9 Å²	69.9	44%	0.44	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-74	132.8	172.6	-167.9	68.2	0	0	0	109.9	D475 Y477 W523	D475-L492 HydrophobicContact CB-CD1 3.89Å; D475-L492 HydrophobicContact CB-CD2 3.95Å; D475-L492 HydrophobicContact CB-CG 3.87Å; Y477-L492 HydrophobicContact CD1-CD1 4.43Å; L492-W523 HydrophobicContact CD1-CB 3.58Å; L492-W523 HydrophobicContact CD1-CD2 4.42Å; L492-W523 HydrophobicContact CD1-CG 3.83Å; L492-W523 HydrophobicContact CD2-CG 4.22Å
493	L	84.1	Confident	83.8	Confident	27 Å²	27	73 Å²	73	14%	0.141	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	120.9	-169.7	-72.1	165.5	0	0	0	110.3	D475 V476 L500 M502	D475-L493 WeakPolarHBondContact CA-O 3.47Å; V476-L493 HydrophobicContact CG2-CB 4.3Å; V476-L493 WeakPolarHBondContact CG2-O 3.24Å; V476-L493 PolarHBondContact N-O 2.99Å; V476-L493 WeakPolarHBondContact O-CB 3.41Å; V476-L493 PolarHBondContact O-N 2.91Å; L493-L500 HydrophobicContact CB-CD1 4.22Å; L493-L500 HydrophobicContact CB-CD2 4.06Å; L493-L500 HydrophobicContact CD1-CD2 4.25Å; L493-M502 HydrophobicContact CD1-CE 3.8Å; L493-M502 HydrophobicContact CD1-CG 4.09Å; L493-M502 HydrophobicContact CD1-SD 4.21Å
494	T	83.1	Confident	83.5	Confident	55 Å²	55	72 Å²	72	34%	0.337	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	115	178.9	-48.7	0	0	0	0	111.4	R474 D475 R496	R474-T494 HydrophobicContact CB-CG2 4.09Å; D475-T494 VanDerWaalsContact OD1-CA 3.3Å; D475-T494 WeakPolarHBondContact OD1-CA 3.4Å; D475-T494 WeakPolarHBondContact OD1-CB 3.42Å; D475-T494 WeakPolarHBondContact OD1-CG2 3.41Å; D475-T494 PolarHBondContact OD1-OG1 3.03Å; T494-R496 HydrophobicContact CG2-CG 3.88Å; T494-R496 PolarHBondContact O-N 3.17Å
495	C	76	Confident	83.6	Confident	18 Å²	18	68.3 Å²	68.3	12%	0.122	36%	0.36	C	S	.	.			trans	-66.2	91.9	168.3	-68.6	0	0	0	0	110.7	R474	R474-C495 WeakPolarHBondContact O-CB 3.31Å; R474-C495 PolarHBondContact O-N 2.98Å
496	R	68.4	Low	83.6	Confident	204 Å²	204	64.3 Å²	64.3	77%	0.77	34%	0.335	S	S	*	.			trans	-91.7	-21.6	175.8	-64.1	-178.5	-177.5	-167.6	1	113.3	T494	T494-R496 HydrophobicContact CG2-CG 3.88Å; T494-R496 PolarHBondContact O-N 3.17Å
497	T	73.3	Confident	83.5	Confident	103 Å²	103	61 Å²	61	63%	0.632	32%	0.317	S	S	*	.	S	Bend	trans	-141.5	170	-166.6	31.4	0	0	0	0	110.6	F499	T497-F499 VanDerWaalsContact C-N 3.28Å; T497-F499 CarbonylContact C-O 3.5Å; T497-F499 VanDerWaalsContact CB-O 3.31Å; T497-F499 WeakPolarHBondContact CB-O 3.48Å; T497-F499 PolarHBondContact OG1-O 3.24Å
498	S	74.6	Confident	83.6	Confident	109 Å²	109	58.3 Å²	58.3	76%	0.762	31%	0.305	S	S	*	.	S	Bend	trans	-68.8	-27.3	176.4	49	0	0	0	0	113.7	D465	D465-S498 PolarHBondContact N-O 3.36Å
499	F	83.9	Confident	83.4	Confident	45 Å²	45	59.9 Å²	59.9	20%	0.197	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	133.1	163.8	-167.9	-88.8	0	0	0	108.4	L432 A463 E464 T497 D501 Y563	L432-F499 HydrophobicContact CD1-CE1 3.92Å; L432-F499 HydrophobicContact CD1-CE2 4.48Å; L432-F499 HydrophobicContact CD1-CZ 3.52Å; A463-F499 CarbonylContact O-C 3.6Å; A463-F499 WeakPolarHBondContact O-CA 3.38Å; E464-F499 HydrophobicContact CG-CD2 3.47Å; E464-F499 VanDerWaalsContact CG-CD2 3.47Å; E464-F499 HydrophobicContact CG-CE2 4.05Å; E464-F499 HydrophobicContact CG-CG 4.4Å; E464-F499 WeakPolarHBondContact OE1-CD2 3.38Å; T497-F499 VanDerWaalsContact C-N 3.28Å; T497-F499 CarbonylContact C-O 3.5Å; T497-F499 VanDerWaalsContact CB-O 3.31Å; T497-F499 WeakPolarHBondContact CB-O 3.48Å; T497-F499 PolarHBondContact OG1-O 3.24Å; F499-D501 HydrophobicContact CD1-CB 4.4Å; F499-D501 HydrophobicContact CE1-CB 4.33Å; F499-Y563 HydrophobicContact CE2-CD2 4.03Å; F499-Y563 HydrophobicContact CE2-CE2 4.06Å; F499-Y563 HydrophobicContact CZ-CD2 4.49Å
500	L	84.4	Confident	83.2	Confident	12 Å²	12	51.5 Å²	51.5	6%	0.063	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	111.2	168.3	177.1	66.8	0	0	0	108	G462 A463 L466 V476 L493 M502	G462-L500 CarbonylContact C-O 3.51Å; G462-L500 WeakPolarHBondContact CA-O 3.25Å; A463-L500 PolarHBondContact N-O 3.29Å; A463-L500 PolarHBondContact O-N 3.09Å; L466-L500 HydrophobicContact CD1-CB 4.43Å; L466-L500 HydrophobicContact CD1-CD2 3.82Å; V476-L500 HydrophobicContact CG2-CD2 3.92Å; L493-L500 HydrophobicContact CB-CD1 4.22Å; L493-L500 HydrophobicContact CB-CD2 4.06Å; L493-L500 HydrophobicContact CD1-CD2 4.25Å; L500-M502 HydrophobicContact CG-CG 4.39Å
501	D	81.9	Confident	83	Confident	117 Å²	117	58 Å²	58	63%	0.626	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.9	140.8	177.5	-168.4	13.8	0	0	0	111.6	F499	F499-D501 HydrophobicContact CD1-CB 4.4Å; F499-D501 HydrophobicContact CE1-CB 4.33Å
502	M	83.8	Confident	82.9	Confident	11 Å²	11	60.6 Å²	60.6	5%	0.054	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	133.9	-177.8	-58.8	174.9	67.3	0	0	109.5	F460 Y461 A463 T490 L493 L500	F460-M502 CarbonylContact C-O 3.55Å; F460-M502 HydrophobicContact CB-CB 4.09Å; F460-M502 HydrophobicContact CB-CE 3.75Å; F460-M502 HydrophobicContact CB-SD 4.36Å; F460-M502 HydrophobicContact CD1-CE 3.4Å; F460-M502 VanDerWaalsContact CD1-CE 3.4Å; F460-M502 HydrophobicContact CD1-SD 4.15Å; F460-M502 HydrophobicContact CE1-CE 4.07Å; F460-M502 HydrophobicContact CG-CE 3.7Å; F460-M502 CarbonylContact O-C 3.56Å; Y461-M502 CarbonylContact C-O 3.57Å; Y461-M502 WeakPolarHBondContact CA-O 3.46Å; A463-M502 HydrophobicContact CB-SD 4.47Å; T490-M502 HydrophobicContact CG2-CE 3.84Å; L493-M502 HydrophobicContact CD1-CE 3.8Å; L493-M502 HydrophobicContact CD1-CG 4.09Å; L493-M502 HydrophobicContact CD1-SD 4.21Å; L500-M502 HydrophobicContact CG-CG 4.39Å
503	D	84.3	Confident	83.1	Confident	72 Å²	72	56.6 Å²	56.6	39%	0.385	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	75	165.5	179.3	37.2	0	0	0	108.6	H459	H459-D503 IonicContact CD2-OD1 2.63Å; H459-D503 IonicContact CE1-OD1 3.23Å; H459-D503 IonicContact NE2-OD1 2.64Å; H459-D503 PolarHBondContact NE2-OD1 2.9Å
504	H	85	Confident	83.4	Confident	36 Å²	36	56.9 Å²	56.9	17%	0.167	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	118.9	-176.1	-72.6	141.1	0	0	0	110.9	H459 F460 F506	H459-H504 WeakPolarHBondContact CA-O 3.24Å; F460-H504 HydrophobicContact CB-CB 4.45Å; F460-H504 PolarHBondContact N-O 2.79Å; F460-H504 PolarHBondContact O-N 3.37Å; H504-F506 HydrophobicContact CB-CE2 3.65Å; H504-F506 HydrophobicContact CB-CZ 4.05Å
505	T	89.4	Confident	83.9	Confident	19 Å²	19	57 Å²	57	12%	0.117	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124.2	177.9	-52.4	0	0	0	0	111.6	I51 H459	I51-T505 PolarHBondContact N-O 3.15Å; I51-T505 VanDerWaalsContact N-O 3.15Å; H459-T505 PolarHBondContact CD2-OG1 2.98Å
506	F	88.4	Confident	84.8	Confident	7 Å²	7	56.2 Å²	56.2	3%	0.031	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	129.3	177.2	-57	-84.9	0	0	0	110.5	S457 L458 F460 I480 A488 R489 T490 H504 I508	S457-F506 WeakPolarHBondContact CA-O 3.26Å; L458-F506 PolarHBondContact N-O 2.88Å; L458-F506 PolarHBondContact O-N 3.46Å; F460-F506 AromaticContact CD2-CD2 3.91Å; F460-F506 HydrophobicContact CD2-CD2 3.91Å; F460-F506 AromaticContact CD2-CE2 3.74Å; F460-F506 HydrophobicContact CD2-CE2 3.74Å; F460-F506 AromaticContact CE2-CD2 3.71Å; F460-F506 HydrophobicContact CE2-CD2 3.71Å; F460-F506 AromaticContact CE2-CE2 3.61Å; F460-F506 HydrophobicContact CE2-CE2 3.61Å; I480-F506 HydrophobicContact CD1-CB 4.45Å; I480-F506 HydrophobicContact CD1-CD1 4.05Å; I480-F506 HydrophobicContact CD1-CD2 3.49Å; I480-F506 VanDerWaalsContact CD1-CD2 3.49Å; I480-F506 HydrophobicContact CD1-CE1 4.14Å; I480-F506 HydrophobicContact CD1-CE2 3.58Å; I480-F506 HydrophobicContact CD1-CG 3.72Å; I480-F506 HydrophobicContact CD1-CZ 3.92Å; A488-F506 HydrophobicContact CB-CD1 3.81Å; A488-F506 HydrophobicContact CB-CE1 4.22Å; A488-F506 HydrophobicContact CB-CG 4.47Å; R489-F506 WeakPolarHBondContact O-CE1 3.35Å; T490-F506 HydrophobicContact CG2-CE2 4.15Å; T490-F506 HydrophobicContact CG2-CZ 3.96Å; H504-F506 HydrophobicContact CB-CE2 3.65Å; H504-F506 HydrophobicContact CB-CZ 4.05Å; F506-I508 HydrophobicContact CB-CD1 4.15Å; F506-I508 HydrophobicContact CB-CG1 4.04Å
507	N	87.3	Confident	86	Confident	37 Å²	37	49.5 Å²	49.5	20%	0.198	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	117.7	168.9	-61.8	-41.2	0	0	0	108.8	I51 T52 L455 S457	I51-N507 PolarHBondContact O-N 3.06Å; T52-N507 HydrophobicContact CG2-CB 4.28Å; T52-N507 PolarHBondContact OG1-ND2 3.16Å; L455-N507 HydrophobicContact CD1-CB 4.25Å; S457-N507 WeakPolarHBondContact CB-OD1 3.46Å; S457-N507 PolarHBondContact OG-OD1 3.31Å
508	I	88.4	Confident	87.1	Confident	5 Å²	5	44.6 Å²	44.6	3%	0.026	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	120.4	-167.7	-56.1	177.3	0	0	0	109.4	M456 L458 I480 V482 K487 F506 L510	M456-I508 HydrophobicContact CE-CD1 4.46Å; M456-I508 PolarHBondContact N-O 3.39Å; M456-I508 PolarHBondContact O-N 2.99Å; L458-I508 HydrophobicContact CB-CD1 4.27Å; L458-I508 HydrophobicContact CD2-CD1 3.94Å; I480-I508 HydrophobicContact CG2-CD1 3.56Å; V482-I508 HydrophobicContact CG2-CG2 3.95Å; K487-I508 HydrophobicContact CB-CG2 4.1Å; K487-I508 HydrophobicContact CD-CG2 4.27Å; K487-I508 HydrophobicContact CG-CG2 4.17Å; F506-I508 HydrophobicContact CB-CD1 4.15Å; F506-I508 HydrophobicContact CB-CG1 4.04Å; I508-L510 HydrophobicContact CG2-CD2 4.25Å
509	E	85.8	Confident	88	Confident	48 Å²	48	39.6 Å²	39.6	22%	0.224	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	120.5	176.3	-172.1	165.6	-146.2	0	0	110.5	K487 W572	K487-E509 PolarHBondContact NZ-O 2.73Å; E509-W572 VanDerWaalsContact OE1-CH2 3.26Å; E509-W572 WeakPolarHBondContact OE1-CH2 3.41Å; E509-W572 VanDerWaalsContact OE1-CZ2 3.22Å; E509-W572 WeakPolarHBondContact OE1-CZ2 3.47Å
510	L	86.9	Confident	88.3	Confident	4 Å²	4	37.7 Å²	37.7	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	123.2	178.5	-57.5	-178	0	0	0	109.7	I452 S453 G454 M456 V482 I508 A513 L540 L568	I452-L510 HydrophobicContact CG2-CD1 4.16Å; S453-L510 VanDerWaalsContact CA-O 3.27Å; S453-L510 WeakPolarHBondContact CA-O 3.35Å; G454-L510 PolarHBondContact N-O 3.03Å; G454-L510 WeakPolarHBondContact O-CB 3.48Å; G454-L510 PolarHBondContact O-N 3.21Å; M456-L510 HydrophobicContact CB-CD1 3.72Å; M456-L510 HydrophobicContact CB-CG 4.02Å; M456-L510 HydrophobicContact CE-CD1 4.45Å; M456-L510 HydrophobicContact CE-CD2 4.12Å; M456-L510 HydrophobicContact CG-CD1 4.5Å; M456-L510 HydrophobicContact SD-CD1 4.11Å; V482-L510 HydrophobicContact CB-CD2 4.49Å; V482-L510 HydrophobicContact CG1-CD2 3.82Å; V482-L510 HydrophobicContact CG2-CD2 3.85Å; I508-L510 HydrophobicContact CG2-CD2 4.25Å; L510-A513 HydrophobicContact CB-CB 3.97Å; L510-A513 HydrophobicContact CD1-CB 4.43Å; L510-A513 HydrophobicContact CD2-CB 3.89Å; L510-A513 HydrophobicContact CG-CB 4.32Å; L510-L540 HydrophobicContact CD1-CD1 3.92Å; L510-L540 HydrophobicContact CD2-CD1 4.07Å; L510-L568 HydrophobicContact CD1-CD1 4.13Å
511	E	83.9	Confident	88.6	Confident	146 Å²	146	38.8 Å²	38.8	68%	0.682	19%	0.193	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-117.4	101.8	174.5	-66.5	173.7	160.9	0	0	107.3	A513	E511-A513 VanDerWaalsContact C-N 3.31Å; E511-A513 PolarHBondContact O-N 3.31Å
512	N	83.6	Confident	88.8	Confident	113 Å²	113	33.6 Å²	33.6	60%	0.604	17%	0.165	S	C	*	.	E	Extended strand (participates in β ladder)	trans	46.1	52.2	-176.6	-63.5	-24.6	0	0	0	112.8	Y451 S453	Y451-N512 HydrophobicContact CD1-CB 4.35Å; Y451-N512 WeakPolarHBondContact CD1-O 3.45Å; Y451-N512 HydrophobicContact CG-CB 4.38Å; S453-N512 WeakPolarHBondContact OG-CA 3.34Å; S453-N512 PolarHBondContact OG-N 2.7Å; S453-N512 PolarHBondContact OG-OD1 2.84Å
513	A	89.4	Confident	88.6	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.008	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	150.9	-175	0	0	0	0	0	112.8	Y451 I452 V482 D483 L510 E511 L540 P541	Y451-A513 WeakPolarHBondContact CA-O 3.29Å; I452-A513 PolarHBondContact N-O 3.49Å; I452-A513 PolarHBondContact O-N 2.86Å; V482-A513 HydrophobicContact CG1-CB 3.59Å; D483-A513 VanDerWaalsContact OD2-CA 3.25Å; D483-A513 WeakPolarHBondContact OD2-CA 3.13Å; L510-A513 HydrophobicContact CB-CB 3.97Å; L510-A513 HydrophobicContact CD1-CB 4.43Å; L510-A513 HydrophobicContact CD2-CB 3.89Å; L510-A513 HydrophobicContact CG-CB 4.32Å; E511-A513 VanDerWaalsContact C-N 3.31Å; E511-A513 PolarHBondContact O-N 3.31Å; A513-L540 HydrophobicContact CB-CD1 3.98Å; A513-P541 WeakPolarHBondContact O-CG 3.49Å
514	Q	90.4	Very high	88.2	Confident	33 Å²	33	38.1 Å²	38.1	15%	0.154	18%	0.18	C	C	.	.			trans	-120.7	-43.3	170.9	-58.5	-165.2	-48.9	0	0	112.4	Q450 Y451 D483 V539 L540 P541	Q450-Q514 PolarHBondContact O-NE2 3.2Å; Y451-Q514 HydrophobicContact CD1-CG 3.35Å; Y451-Q514 HydrophobicContact CE1-CG 3.48Å; Y451-Q514 VanDerWaalsContact CE1-CG 3.48Å; Y451-Q514 HydrophobicContact CG-CG 4.28Å; D483-Q514 PolarHBondContact OD2-N 3.41Å; Q514-V539 CarbonylContact O-C 3.58Å; Q514-V539 WeakPolarHBondContact O-CA 3.4Å; Q514-L540 PolarHBondContact O-N 3Å; Q514-P541 VanDerWaalsContact O-CD 3.22Å; Q514-P541 WeakPolarHBondContact O-CD 3.45Å
515	H	92.9	Very high	87.1	Confident	58 Å²	58	41.9 Å²	41.9	27%	0.269	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	120.5	-170.1	-53.8	90.1	0	0	0	112.8	V482 D483 T537 V538	V482-H515 CarbonylContact C-O 3.58Å; V482-H515 WeakPolarHBondContact CA-O 3.44Å; D483-H515 PolarHBondContact N-O 2.92Å; D483-H515 WeakPolarHBondContact OD1-CB 3.49Å; D483-H515 IonicContact OD1-CG 3.25Å; D483-H515 PolarHBondContact OD1-N 3.24Å; D483-H515 IonicContact OD1-ND1 3.78Å; D483-H515 PolarHBondContact OD1-ND1 3.42Å; D483-H515 PolarHBondContact OD2-N 3.01Å; H515-T537 HydrophobicContact CB-CG2 4.03Å; H515-V538 WeakPolarHBondContact CA-O 3.41Å
516	L	94.6	Very high	86	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	116.4	161.8	171.5	71	0	0	0	108.5	M456 L458 I480 Q481 V482 L518 T537 V538 L540 L566	M456-L516 HydrophobicContact CE-CD1 3.95Å; M456-L516 HydrophobicContact CE-CD2 3.83Å; M456-L516 HydrophobicContact CE-CG 4.32Å; M456-L516 HydrophobicContact SD-CD2 4.43Å; L458-L516 HydrophobicContact CD2-CD1 4.36Å; L458-L516 HydrophobicContact CD2-CD2 4.36Å; I480-L516 HydrophobicContact CG2-CD1 3.57Å; Q481-L516 CarbonylContact O-C 3.45Å; Q481-L516 WeakPolarHBondContact O-CA 3.35Å; V482-L516 HydrophobicContact CG2-CD1 4.26Å; L516-L518 HydrophobicContact CD1-CD2 4.08Å; L516-L518 HydrophobicContact CD2-CD2 4.27Å; L516-L518 HydrophobicContact CG-CD2 4.02Å; L516-T537 CarbonylContact O-C 3.48Å; L516-T537 WeakPolarHBondContact O-CA 3.39Å; L516-V538 HydrophobicContact CB-CB 4.33Å; L516-V538 PolarHBondContact N-O 3.39Å; L516-V538 PolarHBondContact O-N 3.13Å; L516-L540 HydrophobicContact CB-CD1 4.05Å; L516-L540 HydrophobicContact CB-CD2 3.69Å; L516-L540 HydrophobicContact CB-CG 4.04Å; L516-L540 HydrophobicContact CD2-CD2 4.35Å; L516-L566 HydrophobicContact CD2-CD1 4.15Å; L516-L566 HydrophobicContact CD2-CD2 3.65Å
517	K	94.7	Very high	84.4	Confident	64 Å²	64	51 Å²	51	28%	0.278	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	116.8	179.2	172.5	165.7	165.9	157.3	0	110.1	Q481 V519 H535 G536	Q481-K517 HydrophobicContact CB-CB 4.12Å; Q481-K517 WeakPolarHBondContact CB-O 3.31Å; Q481-K517 PolarHBondContact N-O 2.78Å; Q481-K517 PolarHBondContact O-N 3.32Å; K517-V519 HydrophobicContact CD-CG2 4.29Å; K517-V519 HydrophobicContact CG-CG2 3.69Å; K517-H535 VanDerWaalsContact CE-CD2 3.42Å; K517-H535 WeakPolarHBondContact CE-CD2 3.38Å; K517-H535 PolarHBondContact NZ-CD2 3.3Å; K517-G536 CarbonylContact C-O 3.57Å; K517-G536 WeakPolarHBondContact CA-O 3.47Å
518	L	94.9	Very high	82.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	120.4	176.3	-51.7	-176.4	0	0	0	107.7	L458 F460 I480 L516 H535 G536 I562 V564	L458-L518 HydrophobicContact CD2-CD2 4.05Å; F460-L518 HydrophobicContact CE1-CD1 4.25Å; F460-L518 HydrophobicContact CZ-CD1 4.45Å; F460-L518 HydrophobicContact CZ-CD2 4.05Å; I480-L518 HydrophobicContact CG1-CD2 4.33Å; I480-L518 HydrophobicContact CG2-CD2 4.2Å; L516-L518 HydrophobicContact CD1-CD2 4.08Å; L516-L518 HydrophobicContact CD2-CD2 4.27Å; L516-L518 HydrophobicContact CG-CD2 4.02Å; L518-H535 CarbonylContact O-C 3.49Å; L518-H535 WeakPolarHBondContact O-CA 3.22Å; L518-H535 WeakPolarHBondContact O-CB 3.43Å; L518-G536 PolarHBondContact N-O 3.02Å; L518-G536 PolarHBondContact O-N 3.37Å; L518-I562 HydrophobicContact CB-CD1 4.35Å; L518-I562 HydrophobicContact CD1-CD1 4.35Å; L518-V564 HydrophobicContact CD1-CG1 4.04Å
519	V	93.3	Very high	81.8	Confident	4 Å²	4	62 Å²	62	2%	0.024	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	114.7	-175.4	-171	0	0	0	0	109.7	C478 A479 K517 F521 V532 H535	C478-V519 CarbonylContact C-O 3.6Å; C478-V519 WeakPolarHBondContact CA-O 3.39Å; A479-V519 PolarHBondContact N-O 3.02Å; A479-V519 PolarHBondContact O-N 3.27Å; K517-V519 HydrophobicContact CD-CG2 4.29Å; K517-V519 HydrophobicContact CG-CG2 3.69Å; V519-F521 HydrophobicContact CB-CD2 4.45Å; V519-F521 HydrophobicContact CB-CE2 3.9Å; V519-F521 HydrophobicContact CG1-CD2 4.02Å; V519-F521 HydrophobicContact CG1-CE2 3.48Å; V519-F521 VanDerWaalsContact CG1-CE2 3.48Å; V519-F521 HydrophobicContact CG1-CZ 3.88Å; V519-V532 HydrophobicContact CG1-CB 4.46Å; V519-V532 HydrophobicContact CG1-CG1 3.8Å; V519-V532 HydrophobicContact CG1-CG2 3.88Å; V519-H535 HydrophobicContact CB-CB 4.45Å; V519-H535 HydrophobicContact CG1-CB 4.33Å; V519-H535 HydrophobicContact CG2-CB 4.21Å
520	V	91.2	Very high	81.4	Confident	5 Å²	5	63.4 Å²	63.4	3%	0.03	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	122.9	177	-175.1	0	0	0	0	109.1	L466 V476 Y477 C533 C534 L556 I562	L466-V520 HydrophobicContact CD2-CG2 4.4Å; V476-V520 HydrophobicContact CB-CG1 3.92Å; V476-V520 HydrophobicContact CG1-CG1 4.31Å; V476-V520 HydrophobicContact CG2-CG1 4.27Å; Y477-V520 WeakPolarHBondContact O-CA 3.3Å; V520-C533 HydrophobicContact CG1-CB 4.4Å; V520-C533 PolarHBondContact O-N 3.01Å; V520-C534 PolarHBondContact N-O 3.22Å; V520-L556 HydrophobicContact CG2-CD1 4.24Å; V520-I562 HydrophobicContact CG2-CD1 4.04Å
521	F	89.4	Confident	81.2	Confident	35 Å²	35	69.3 Å²	69.3	15%	0.154	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	139.2	174.3	-70.3	-96	0	0	0	110.3	V476 Y477 A479 V519 N530 R531 V532	V476-F521 CarbonylContact C-O 3.57Å; V476-F521 WeakPolarHBondContact CA-O 3.49Å; V476-F521 WeakPolarHBondContact CB-O 3.49Å; Y477-F521 HydrophobicContact CD1-CB 4.14Å; Y477-F521 HydrophobicContact CD2-CB 4.38Å; Y477-F521 HydrophobicContact CD2-CD2 4.35Å; Y477-F521 HydrophobicContact CE1-CB 3.64Å; Y477-F521 HydrophobicContact CE1-CG 4.34Å; Y477-F521 HydrophobicContact CE2-CB 3.89Å; Y477-F521 AromaticContact CE2-CD2 3.59Å; Y477-F521 HydrophobicContact CE2-CD2 3.59Å; Y477-F521 HydrophobicContact CE2-CE2 4.36Å; Y477-F521 AromaticContact CE2-CG 3.93Å; Y477-F521 HydrophobicContact CE2-CG 3.93Å; Y477-F521 HydrophobicContact CG-CB 4.48Å; Y477-F521 VanDerWaalsContact CZ-CB 3.48Å; Y477-F521 AromaticContact CZ-CD2 3.85Å; Y477-F521 AromaticContact CZ-CG 3.68Å; Y477-F521 PolarHBondContact N-O 3.21Å; Y477-F521 PolarHBondContact O-N 3.15Å; Y477-F521 WeakPolarHBondContact OH-CG 3.38Å; A479-F521 HydrophobicContact CB-CD2 4.12Å; A479-F521 HydrophobicContact CB-CE2 3.76Å; V519-F521 HydrophobicContact CB-CD2 4.45Å; V519-F521 HydrophobicContact CB-CE2 3.9Å; V519-F521 HydrophobicContact CG1-CD2 4.02Å; V519-F521 HydrophobicContact CG1-CE2 3.48Å; V519-F521 VanDerWaalsContact CG1-CE2 3.48Å; V519-F521 HydrophobicContact CG1-CZ 3.88Å; F521-N530 HydrophobicContact CD1-CB 3.97Å; F521-R531 CarbonylContact C-O 3.58Å; F521-R531 VanDerWaalsContact CA-O 3.26Å; F521-R531 WeakPolarHBondContact CA-O 3.46Å; F521-V532 HydrophobicContact CD1-CG2 3.93Å; F521-V532 HydrophobicContact CE1-CG2 3.46Å; F521-V532 VanDerWaalsContact CE1-CG2 3.46Å; F521-V532 HydrophobicContact CZ-CG2 3.84Å
522	S	87.4	Confident	81.3	Confident	7 Å²	7	65.7 Å²	65.7	5%	0.049	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	134.4	162.2	55.1	0	0	0	0	110	R531 C533	S522-R531 PolarHBondContact N-O 3.11Å; S522-R531 PolarHBondContact O-N 3.01Å; S522-R531 PolarHBondContact OG-O 3.2Å; S522-C533 WeakPolarHBondContact CB-SG 3.46Å; S522-C533 PolarHBondContact N-SG 3.48Å
523	W	78.6	Confident	81.4	Confident	112 Å²	112	61.2 Å²	61.2	42%	0.424	30%	0.304	S	S	.	.			trans	-85.2	133.7	170.4	-177.3	-106.7	0	0	0	109.8	D475 Y477 L492	D475-W523 HydrophobicContact CB-CB 4.3Å; D475-W523 PolarHBondContact O-N 2.82Å; Y477-W523 HydrophobicContact CE1-CE3 4.4Å; L492-W523 HydrophobicContact CD1-CB 3.58Å; L492-W523 HydrophobicContact CD1-CD2 4.42Å; L492-W523 HydrophobicContact CD1-CG 3.83Å; L492-W523 HydrophobicContact CD2-CG 4.22Å
524	E	76.4	Confident	81.4	Confident	67 Å²	67	61.5 Å²	61.5	31%	0.313	31%	0.306	S	S	.	.			trans	-125.8	118	174.8	-163.7	158.4	-137.7	0	0	106.8	R470 T526	R470-E524 IonicContact CZ-OE1 3.93Å; R470-E524 IonicContact NH1-OE1 2.65Å; R470-E524 PolarHBondContact NH1-OE1 3.48Å; R470-E524 IonicContact NH1-OE2 3.52Å; R470-E524 PolarHBondContact NH1-OE2 2.91Å; R470-E524 VanDerWaalsContact NH1-OE2 3.16Å; E524-T526 PolarHBondContact O-N 2.78Å
525	P	61.2	Low	81.5	Confident	114 Å²	114	62.2 Å²	62.2	74%	0.74	31%	0.309	S	S	*	.	S	Bend	trans	-68.6	-12	-173.6	-24.4	35.1	0	0	0	115.3
526	T	66.8	Low	81.6	Confident	96 Å²	96	59.6 Å²	59.6	59%	0.589	30%	0.298	S	S	*	.	S	Bend	trans	-96.7	150.5	176.7	43.4	0	0	0	0	110.6	E524	E524-T526 PolarHBondContact O-N 2.78Å
527	P	55.4	Low	81.5	Confident	122 Å²	122	60.5 Å²	60.5	79%	0.792	30%	0.303	S	S	*	.	S	Bend	trans	-76.6	147.3	-139.5	24.7	-35	0	0	0	117.4
528	K	55.4	Low	81.5	Confident	125 Å²	125	57.4 Å²	57.4	54%	0.543	29%	0.29	S	S	.	.	S	Bend	trans	81.9	-4.8	158.4	-65.2	-154.4	177	-159.7	0	122.3	E147 E149	E147-K528 WeakPolarHBondContact OE1-CD 3.4Å; E147-K528 IonicContact OE1-NZ 3.16Å; E147-K528 PolarHBondContact OE1-NZ 2.82Å; E147-K528 WeakPolarHBondContact OE2-CD 3.49Å; E147-K528 IonicContact OE2-NZ 3.89Å; E147-K528 PolarHBondContact OE2-NZ 3.11Å; E149-K528 IonicContact OE1-NZ 2.65Å; E149-K528 PolarHBondContact OE1-NZ 2.97Å
529	R	65.3	Low	81.4	Confident	147 Å²	147	57.7 Å²	57.7	56%	0.555	29%	0.292	S	S	*	.			trans	-133.5	99.5	174.3	-66	-166.3	-178.9	-150.4	-3.1	116.4	D145 D146 R531	D145-R529 IonicContact OD1-NH2 2.76Å; D145-R529 IonicContact OD2-CZ 3.68Å; D145-R529 VanDerWaalsContact OD2-CZ 3.25Å; D145-R529 IonicContact OD2-NH1 3.6Å; D145-R529 PolarHBondContact OD2-NH1 3.49Å; D145-R529 IonicContact OD2-NH2 2.84Å; D145-R529 PolarHBondContact OD2-NH2 3.04Å; D146-R529 IonicContact OD2-CZ 2.88Å; D146-R529 IonicContact OD2-NH2 3.57Å; D146-R529 PolarHBondContact OD2-NH2 2.68Å; R529-R531 PolarHBondContact O-N 2.84Å
530	N	77.9	Confident	81.4	Confident	78 Å²	78	57.5 Å²	57.5	42%	0.417	29%	0.29	S	S	.	.			trans	-63.9	123.7	160.2	-71.9	-50.2	0	0	0	109.5	Y477 F521	Y477-N530 PolarHBondContact OH-ND2 2.67Å; F521-N530 HydrophobicContact CD1-CB 3.97Å
531	R	82.5	Confident	81.2	Confident	129 Å²	129	57.5 Å²	57.5	49%	0.487	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	131.1	-176.7	-171.8	178.7	-178.9	-163.4	-1.4	111.4	F521 S522 R529 C533	F521-R531 CarbonylContact C-O 3.58Å; F521-R531 VanDerWaalsContact CA-O 3.26Å; F521-R531 WeakPolarHBondContact CA-O 3.46Å; S522-R531 PolarHBondContact N-O 3.11Å; S522-R531 PolarHBondContact O-N 3.01Å; S522-R531 PolarHBondContact OG-O 3.2Å; R529-R531 PolarHBondContact O-N 2.84Å; R531-C533 PolarHBondContact O-N 3.22Å
532	V	86	Confident	81.1	Confident	70 Å²	70	56.6 Å²	56.6	42%	0.424	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	123.8	170.8	179.5	0	0	0	0	109.3	V519 F521	V519-V532 HydrophobicContact CG1-CB 4.46Å; V519-V532 HydrophobicContact CG1-CG1 3.8Å; V519-V532 HydrophobicContact CG1-CG2 3.88Å; F521-V532 HydrophobicContact CD1-CG2 3.93Å; F521-V532 HydrophobicContact CE1-CG2 3.46Å; F521-V532 VanDerWaalsContact CE1-CG2 3.46Å; F521-V532 HydrophobicContact CZ-CG2 3.84Å
533	C	86.2	Confident	81.2	Confident	19 Å²	19	56.6 Å²	56.6	13%	0.128	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	-52.5	172.1	-64	0	0	0	0	110.7	P469 V520 S522 R531	P469-C533 WeakPolarHBondContact CD-SG 3.48Å; P469-C533 HydrophobicContact CG-CB 4.44Å; V520-C533 HydrophobicContact CG1-CB 4.4Å; V520-C533 PolarHBondContact O-N 3.01Å; S522-C533 WeakPolarHBondContact CB-SG 3.46Å; S522-C533 PolarHBondContact N-SG 3.48Å; R531-C533 PolarHBondContact O-N 3.22Å
534	C	89.6	Confident	81.6	Confident	7 Å²	7	51.9 Å²	51.9	5%	0.047	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.3	162	-172.7	49.6	0	0	0	0	110.2	V520 L556 E557 R559	V520-C534 PolarHBondContact N-O 3.22Å; C534-L556 HydrophobicContact CB-CB 4.05Å; C534-L556 HydrophobicContact CB-CD1 4.11Å; C534-L556 WeakPolarHBondContact SG-CD1 3.39Å; C534-E557 CarbonylContact C-O 3.59Å; C534-E557 WeakPolarHBondContact CA-O 3.47Å; C534-E557 WeakPolarHBondContact CB-O 3.45Å; C534-R559 WeakPolarHBondContact CB-O 3.3Å
535	H	92.6	Very high	81.8	Confident	47 Å²	47	55.7 Å²	55.7	22%	0.218	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	154.1	-179.8	75.2	-59.2	0	0	0	112.8	K517 L518 V519 L556 E557	K517-H535 VanDerWaalsContact CE-CD2 3.42Å; K517-H535 WeakPolarHBondContact CE-CD2 3.38Å; K517-H535 PolarHBondContact NZ-CD2 3.3Å; L518-H535 CarbonylContact O-C 3.49Å; L518-H535 WeakPolarHBondContact O-CA 3.22Å; L518-H535 WeakPolarHBondContact O-CB 3.43Å; V519-H535 HydrophobicContact CB-CB 4.45Å; V519-H535 HydrophobicContact CG1-CB 4.33Å; V519-H535 HydrophobicContact CG2-CB 4.21Å; H535-L556 CarbonylContact O-C 3.58Å; H535-L556 VanDerWaalsContact O-CA 3.28Å; H535-L556 WeakPolarHBondContact O-CA 3.28Å; H535-E557 PolarHBondContact N-O 2.92Å; H535-E557 PolarHBondContact ND1-O 3.08Å; H535-E557 PolarHBondContact O-N 2.64Å
536	G	93.8	Very high	82.3	Confident	4 Å²	4	56.3 Å²	56.3	4%	0.041	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	143.9	176.5	0	0	0	0	0	111.1	K517 L518	K517-G536 CarbonylContact C-O 3.57Å; K517-G536 WeakPolarHBondContact CA-O 3.47Å; L518-G536 PolarHBondContact N-O 3.02Å; L518-G536 PolarHBondContact O-N 3.37Å
537	T	93.6	Very high	83	Confident	18 Å²	18	55 Å²	55	11%	0.11	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	126.4	-174.3	-53.7	0	0	0	0	110.7	Y440 F442 H515 L516	Y440-T537 WeakPolarHBondContact CE1-O 3.39Å; F442-T537 WeakPolarHBondContact CB-O 3.33Å; F442-T537 HydrophobicContact CD2-CG2 3.82Å; F442-T537 WeakPolarHBondContact CD2-O 3.38Å; F442-T537 HydrophobicContact CE2-CG2 3.67Å; F442-T537 HydrophobicContact CZ-CG2 4.26Å; H515-T537 HydrophobicContact CB-CG2 4.03Å; L516-T537 CarbonylContact O-C 3.48Å; L516-T537 WeakPolarHBondContact O-CA 3.39Å
538	V	94	Very high	84.3	Confident	0 Å²	0	56 Å²	56	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	130.1	179.7	-178.5	0	0	0	0	109.6	Y440 H515 L516 L540 L543 L552 V554 L566	Y440-V538 HydrophobicContact CD1-CG2 4.26Å; Y440-V538 HydrophobicContact CE1-CB 4.27Å; Y440-V538 HydrophobicContact CE1-CG1 4.35Å; Y440-V538 HydrophobicContact CE1-CG2 4Å; Y440-V538 HydrophobicContact CE2-CG1 4.25Å; Y440-V538 WeakPolarHBondContact OH-CA 3.35Å; H515-V538 WeakPolarHBondContact CA-O 3.41Å; L516-V538 HydrophobicContact CB-CB 4.33Å; L516-V538 PolarHBondContact N-O 3.39Å; L516-V538 PolarHBondContact O-N 3.13Å; V538-L540 HydrophobicContact CG1-CD2 4.32Å; V538-L540 PolarHBondContact O-N 2.98Å; V538-L543 HydrophobicContact CG1-CD2 3.81Å; V538-L552 HydrophobicContact CG1-CD1 4.18Å; V538-V554 HydrophobicContact CG2-CG1 4.01Å; V538-V554 HydrophobicContact CG2-CG2 3.78Å; V538-L566 HydrophobicContact CG1-CD1 3.99Å
539	V	93.4	Very high	85.8	Confident	6 Å²	6	53.5 Å²	53.5	4%	0.036	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	94.6	-177.8	-176.9	0	0	0	0	108.3	Y440 F442 Q445 C448 Q514 A542 L543	Y440-V539 PolarHBondContact OH-N 2.72Å; F442-V539 HydrophobicContact CD2-CG2 3.97Å; F442-V539 HydrophobicContact CE2-CG2 3.76Å; Q445-V539 HydrophobicContact CB-CG2 4.33Å; Q445-V539 HydrophobicContact CG-CG2 4.48Å; C448-V539 HydrophobicContact CB-CG1 4.22Å; Q514-V539 CarbonylContact O-C 3.58Å; Q514-V539 WeakPolarHBondContact O-CA 3.4Å; V539-A542 HydrophobicContact CB-CB 4.03Å; V539-A542 HydrophobicContact CG1-CB 3.63Å; V539-A542 PolarHBondContact O-N 3.18Å; V539-A542 VanDerWaalsContact O-N 3.11Å; V539-L543 WeakPolarHBondContact O-CB 3.34Å; V539-L543 PolarHBondContact O-N 2.86Å
540	L	91.6	Very high	87.1	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59.6	-43.9	-170.2	-52.4	169	0	0	0	112.7	I452 M456 L510 A513 Q514 L516 V538 A542 L543 F544	I452-L540 HydrophobicContact CG2-CB 3.63Å; M456-L540 HydrophobicContact CE-CD2 4.39Å; M456-L540 HydrophobicContact SD-CD2 3.72Å; L510-L540 HydrophobicContact CD1-CD1 3.92Å; L510-L540 HydrophobicContact CD2-CD1 4.07Å; A513-L540 HydrophobicContact CB-CD1 3.98Å; Q514-L540 PolarHBondContact O-N 3Å; L516-L540 HydrophobicContact CB-CD1 4.05Å; L516-L540 HydrophobicContact CB-CD2 3.69Å; L516-L540 HydrophobicContact CB-CG 4.04Å; L516-L540 HydrophobicContact CD2-CD2 4.35Å; V538-L540 HydrophobicContact CG1-CD2 4.32Å; V538-L540 PolarHBondContact O-N 2.98Å; L540-A542 PolarHBondContact O-N 2.85Å; L540-L543 PolarHBondContact O-N 3.44Å; L540-F544 HydrophobicContact CB-CD2 4.24Å; L540-F544 HydrophobicContact CB-CE2 4.26Å; L540-F544 HydrophobicContact CD2-CE2 3.91Å; L540-F544 WeakPolarHBondContact O-CD2 3.41Å; L540-F544 PolarHBondContact O-N 3.15Å; L540-F544 VanDerWaalsContact O-N 3.09Å
541	P	88.8	Confident	87.8	Confident	5 Å²	5	47.5 Å²	47.5	3%	0.032	24%	0.235	C	C	.	.	H	α-helix	trans	-78.6	-0.4	178.8	-13.4	31.5	0	0	0	114.4	C448 Q450 I452 A513 Q514 R545	C448-P541 PolarHBondContact SG-O 3.31Å; C448-P541 VanDerWaalsContact SG-O 3.35Å; Q450-P541 HydrophobicContact CB-CB 3.9Å; Q450-P541 WeakPolarHBondContact O-CG 3.38Å; I452-P541 HydrophobicContact CB-CG 4.19Å; I452-P541 HydrophobicContact CG2-CG 4.16Å; A513-P541 WeakPolarHBondContact O-CG 3.49Å; Q514-P541 VanDerWaalsContact O-CD 3.22Å; Q514-P541 WeakPolarHBondContact O-CD 3.45Å; P541-R545 WeakPolarHBondContact O-CD 3.44Å; P541-R545 VanDerWaalsContact O-CG 3.27Å; P541-R545 WeakPolarHBondContact O-CG 3.42Å; P541-R545 PolarHBondContact O-NE 2.65Å
542	A	86.6	Confident	88.4	Confident	15 Å²	15	41.3 Å²	41.3	12%	0.124	21%	0.211	C	C	.	.	H	α-helix	trans	-99.3	-38.4	167.4	0	0	0	0	0	110.8	P446 C448 V539 L540	P446-A542 HydrophobicContact CG-CB 4.47Å; C448-A542 HydrophobicContact CB-CB 4.19Å; V539-A542 HydrophobicContact CB-CB 4.03Å; V539-A542 HydrophobicContact CG1-CB 3.63Å; V539-A542 PolarHBondContact O-N 3.18Å; V539-A542 VanDerWaalsContact O-N 3.11Å; L540-A542 PolarHBondContact O-N 2.85Å
543	L	88.6	Confident	88.8	Confident	7 Å²	7	38 Å²	38	4%	0.037	19%	0.191	C	C	.	.	H	α-helix	trans	-62.6	-65	178.1	179.8	67.7	0	0	0	111.9	Y440 V538 V539 L540 R545 H550 L552 L566	Y440-L543 HydrophobicContact CE2-CD1 4.47Å; V538-L543 HydrophobicContact CG1-CD2 3.81Å; V539-L543 WeakPolarHBondContact O-CB 3.34Å; V539-L543 PolarHBondContact O-N 2.86Å; L540-L543 PolarHBondContact O-N 3.44Å; L543-R545 PolarHBondContact O-N 3.45Å; L543-H550 HydrophobicContact CD1-CB 4.07Å; L543-H550 HydrophobicContact CD2-CB 4.44Å; L543-H550 HydrophobicContact CG-CB 4.5Å; L543-H550 VanDerWaalsContact CG-CD2 3.41Å; L543-H550 WeakPolarHBondContact CG-CD2 3.47Å; L543-H550 PolarHBondContact O-CE1 2.7Å; L543-H550 PolarHBondContact O-NE2 3.43Å; L543-H550 VanDerWaalsContact O-NE2 3.11Å; L543-L552 HydrophobicContact CD1-CD1 3.88Å; L543-L552 HydrophobicContact CD1-CD2 4.08Å; L543-L552 HydrophobicContact CD1-CG 4.48Å; L543-L552 HydrophobicContact CD2-CD1 3.91Å; L543-L566 HydrophobicContact CD2-CB 4.48Å; L543-L566 HydrophobicContact CD2-CD1 3.55Å
544	F	87.8	Confident	89.2	Confident	14 Å²	14	37.1 Å²	37.1	6%	0.061	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	11.2	-169.7	-63.6	-62.6	0	0	0	114.9	I452 M456 L540 V546 T547 R548 H550 L566 L568	I452-F544 HydrophobicContact CD1-CB 3.78Å; I452-F544 HydrophobicContact CD1-CD2 4.08Å; I452-F544 HydrophobicContact CD1-CG 4.38Å; M456-F544 HydrophobicContact CG-CZ 4.24Å; M456-F544 HydrophobicContact SD-CE2 3.96Å; M456-F544 HydrophobicContact SD-CZ 3.96Å; L540-F544 HydrophobicContact CB-CD2 4.24Å; L540-F544 HydrophobicContact CB-CE2 4.26Å; L540-F544 HydrophobicContact CD2-CE2 3.91Å; L540-F544 WeakPolarHBondContact O-CD2 3.41Å; L540-F544 PolarHBondContact O-N 3.15Å; L540-F544 VanDerWaalsContact O-N 3.09Å; F544-V546 PolarHBondContact O-N 2.82Å; F544-T547 WeakPolarHBondContact CA-O 3.43Å; F544-R548 WeakPolarHBondContact CD1-O 3.45Å; F544-R548 VanDerWaalsContact CE1-O 3.26Å; F544-R548 WeakPolarHBondContact CE1-O 3.12Å; F544-H550 AromaticContact CD1-CD2 3.64Å; F544-H550 AromaticContact CD1-NE2 3.98Å; F544-H550 AromaticContact CE1-CD2 3.89Å; F544-L566 HydrophobicContact CE1-CB 4.17Å; F544-L566 HydrophobicContact CZ-CB 3.91Å; F544-L568 HydrophobicContact CB-CD2 4.06Å; F544-L568 HydrophobicContact CD1-CB 3.78Å; F544-L568 HydrophobicContact CD2-CB 4.08Å; F544-L568 HydrophobicContact CD2-CD2 4.01Å; F544-L568 HydrophobicContact CE1-CB 3.67Å; F544-L568 HydrophobicContact CE2-CB 3.94Å; F544-L568 HydrophobicContact CG-CB 3.98Å; F544-L568 HydrophobicContact CG-CD2 4Å; F544-L568 HydrophobicContact CZ-CB 3.74Å
545	R	80.9	Confident	89.4	Confident	147 Å²	147	42 Å²	42	56%	0.555	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-21.2	176.1	-71.3	-179.2	164.9	-164.6	-7.9	113.9	C448 P541 L543	C448-R545 PolarHBondContact SG-NH2 2.71Å; P541-R545 WeakPolarHBondContact O-CD 3.44Å; P541-R545 VanDerWaalsContact O-CG 3.27Å; P541-R545 WeakPolarHBondContact O-CG 3.42Å; P541-R545 PolarHBondContact O-NE 2.65Å; L543-R545 PolarHBondContact O-N 3.45Å
546	V	71.4	Confident	89.4	Confident	127 Å²	127	39.9 Å²	39.9	77%	0.77	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.2	-42.6	-168.6	-171.8	0	0	0	0	111.8	F544	F544-V546 PolarHBondContact O-N 2.82Å
547	T	81.6	Confident	89.1	Confident	67 Å²	67	43.8 Å²	43.8	41%	0.411	21%	0.213	S	C	.	.			trans	-138.9	152.4	175.2	49.1	0	0	0	0	110	F544 T549 H550	F544-T547 WeakPolarHBondContact CA-O 3.43Å; T547-T549 VanDerWaalsContact C-N 3.34Å; T547-T549 WeakPolarHBondContact CB-O 3.48Å; T547-T549 PolarHBondContact OG1-O 3.34Å; T547-H550 PolarHBondContact O-NE2 3.46Å; T547-H550 PolarHBondContact OG1-CE1 3.3Å; T547-H550 PolarHBondContact OG1-ND1 3.47Å; T547-H550 PolarHBondContact OG1-NE2 2.79Å
548	R	81.8	Confident	88.7	Confident	145 Å²	145	48.2 Å²	48.2	55%	0.547	24%	0.242	S	C	.	.	S	Bend	trans	-78.3	-21.4	173.9	-68.7	-172.6	-173.7	123	-3.4	112.8	F544 N567 L568 E570	F544-R548 WeakPolarHBondContact CD1-O 3.45Å; F544-R548 VanDerWaalsContact CE1-O 3.26Å; F544-R548 WeakPolarHBondContact CE1-O 3.12Å; R548-N567 CarbonylContact O-C 3.12Å; R548-N567 WeakPolarHBondContact O-CA 3.36Å; R548-L568 PolarHBondContact O-N 3.18Å; R548-E570 IonicContact CZ-OE2 2.67Å; R548-E570 IonicContact NE-OE2 3.5Å; R548-E570 PolarHBondContact NE-OE2 3.17Å; R548-E570 IonicContact NH2-OE2 2.73Å; R548-E570 PolarHBondContact NH2-OE2 3.13Å
549	T	88.3	Confident	88.2	Confident	72 Å²	72	55.2 Å²	55.2	44%	0.442	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	141.5	175.9	44.5	0	0	0	0	111.3	T547 L566 N567	T547-T549 VanDerWaalsContact C-N 3.34Å; T547-T549 WeakPolarHBondContact CB-O 3.48Å; T547-T549 PolarHBondContact OG1-O 3.34Å; T549-L566 CarbonylContact C-O 3.36Å; T549-L566 WeakPolarHBondContact CA-O 3.41Å; T549-N567 HydrophobicContact CG2-CB 4.06Å; T549-N567 VanDerWaalsContact CG2-OD1 3.23Å; T549-N567 WeakPolarHBondContact CG2-OD1 3.33Å
550	H	91.8	Very high	88	Confident	25 Å²	25	55.5 Å²	55.5	12%	0.116	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	135.4	172.2	-64.7	-85.3	0	0	0	111.3	L543 F544 T547 L552 K565 L566	L543-H550 HydrophobicContact CD1-CB 4.07Å; L543-H550 HydrophobicContact CD2-CB 4.44Å; L543-H550 HydrophobicContact CG-CB 4.5Å; L543-H550 VanDerWaalsContact CG-CD2 3.41Å; L543-H550 WeakPolarHBondContact CG-CD2 3.47Å; L543-H550 PolarHBondContact O-CE1 2.7Å; L543-H550 PolarHBondContact O-NE2 3.43Å; L543-H550 VanDerWaalsContact O-NE2 3.11Å; F544-H550 AromaticContact CD1-CD2 3.64Å; F544-H550 AromaticContact CD1-NE2 3.98Å; F544-H550 AromaticContact CE1-CD2 3.89Å; T547-H550 PolarHBondContact O-NE2 3.46Å; T547-H550 PolarHBondContact OG1-CE1 3.3Å; T547-H550 PolarHBondContact OG1-ND1 3.47Å; T547-H550 PolarHBondContact OG1-NE2 2.79Å; H550-L552 HydrophobicContact CB-CD2 4.08Å; H550-L552 HydrophobicContact CB-CG 4.11Å; H550-K565 CarbonylContact O-C 3.5Å; H550-K565 VanDerWaalsContact O-CA 3.31Å; H550-K565 WeakPolarHBondContact O-CA 3.24Å; H550-L566 PolarHBondContact N-O 2.74Å; H550-L566 PolarHBondContact O-N 3.34Å
551	Q	93.3	Very high	88	Confident	73 Å²	73	57.1 Å²	57.1	34%	0.341	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	119.2	163.8	-77.3	163.8	-84.2	0	0	108.1	F437 R438 V564 K565	F437-Q551 HydrophobicContact CD1-CB 3.81Å; F437-Q551 HydrophobicContact CD1-CG 4.5Å; F437-Q551 HydrophobicContact CE1-CB 4.02Å; F437-Q551 HydrophobicContact CE1-CG 4.21Å; F437-Q551 HydrophobicContact CG-CB 4.33Å; R438-Q551 PolarHBondContact N-O 3.22Å; Q551-V564 WeakPolarHBondContact CA-O 3.44Å; Q551-K565 HydrophobicContact CG-CB 3.97Å; Q551-K565 HydrophobicContact CG-CD 4.02Å; Q551-K565 HydrophobicContact CG-CG 3.92Å
552	L	94.2	Very high	88.3	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	134	-173	-57.9	-177.9	0	0	0	111.5	R438 Y440 V538 L543 H550 V554 V564 L566	R438-L552 HydrophobicContact CB-CD2 4.24Å; R438-L552 CarbonylContact O-C 3.5Å; R438-L552 VanDerWaalsContact O-CA 3.3Å; R438-L552 WeakPolarHBondContact O-CA 3.33Å; Y440-L552 HydrophobicContact CD2-CD1 3.9Å; Y440-L552 HydrophobicContact CD2-CD2 4.18Å; Y440-L552 HydrophobicContact CE2-CD1 4.45Å; Y440-L552 HydrophobicContact CG-CD1 4.14Å; V538-L552 HydrophobicContact CG1-CD1 4.18Å; L543-L552 HydrophobicContact CD1-CD1 3.88Å; L543-L552 HydrophobicContact CD1-CD2 4.08Å; L543-L552 HydrophobicContact CD1-CG 4.48Å; L543-L552 HydrophobicContact CD2-CD1 3.91Å; H550-L552 HydrophobicContact CB-CD2 4.08Å; H550-L552 HydrophobicContact CB-CG 4.11Å; L552-V554 HydrophobicContact CB-CG2 3.85Å; L552-V554 HydrophobicContact CD1-CG2 4.34Å; L552-V564 HydrophobicContact CB-CG2 4.14Å; L552-V564 PolarHBondContact N-O 3.16Å; L552-V564 PolarHBondContact O-N 3.36Å; L552-L566 HydrophobicContact CD1-CD1 3.93Å
553	A	94.8	Very high	88.6	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	93.6	160.4	0	0	0	0	0	107.4	F437 R438 Y440 K555 L561 Y563	F437-A553 HydrophobicContact CB-CB 4.07Å; R438-A553 PolarHBondContact O-N 3.48Å; Y440-A553 PolarHBondContact N-O 2.74Å; A553-K555 PolarHBondContact O-N 3.08Å; A553-L561 HydrophobicContact CB-CD2 4.25Å; A553-Y563 HydrophobicContact CB-CD1 3.95Å; A553-Y563 HydrophobicContact CB-CE1 3.7Å
554	V	94.9	Very high	89	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	112.6	-174.9	179.1	0	0	0	0	109.3	V538 L552 L561 I562 V564	V538-V554 HydrophobicContact CG2-CG1 4.01Å; V538-V554 HydrophobicContact CG2-CG2 3.78Å; L552-V554 HydrophobicContact CB-CG2 3.85Å; L552-V554 HydrophobicContact CD1-CG2 4.34Å; V554-L561 WeakPolarHBondContact O-CA 3.42Å; V554-I562 PolarHBondContact N-O 3.43Å; V554-I562 PolarHBondContact O-N 3.41Å; V554-V564 HydrophobicContact CG2-CG2 3.77Å
555	K	93.9	Very high	89.3	Confident	110 Å²	110	59.2 Å²	59.2	48%	0.478	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	130.1	175.3	-179.2	176.7	163	-158.7	0	110.7	Y440 A553 L561	Y440-K555 WeakPolarHBondContact O-CB 3.44Å; Y440-K555 PolarHBondContact O-N 2.84Å; A553-K555 PolarHBondContact O-N 3.08Å; K555-L561 HydrophobicContact CB-CD2 4.16Å
556	L	92	Very high	89.8	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.01	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-99.9	147.3	177	-51	-176	0	0	0	111.7	L466 V520 C534 H535 P558 R559 G560 I562	L466-L556 HydrophobicContact CD2-CD1 3.59Å; V520-L556 HydrophobicContact CG2-CD1 4.24Å; C534-L556 HydrophobicContact CB-CB 4.05Å; C534-L556 HydrophobicContact CB-CD1 4.11Å; C534-L556 WeakPolarHBondContact SG-CD1 3.39Å; H535-L556 CarbonylContact O-C 3.58Å; H535-L556 VanDerWaalsContact O-CA 3.28Å; H535-L556 WeakPolarHBondContact O-CA 3.28Å; L556-P558 CarbonylContact O-C 3.57Å; L556-R559 WeakPolarHBondContact CB-O 3.49Å; L556-R559 CarbonylContact O-C 3.57Å; L556-R559 PolarHBondContact O-N 2.92Å; L556-G560 PolarHBondContact N-O 2.89Å; L556-I562 HydrophobicContact CD1-CD1 3.9Å; L556-I562 HydrophobicContact CD1-CG1 3.75Å; L556-I562 HydrophobicContact CD2-CD1 3.8Å; L556-I562 HydrophobicContact CD2-CG1 3.87Å; L556-I562 HydrophobicContact CG-CD1 4.35Å; L556-I562 HydrophobicContact CG-CG1 4.05Å
557	E	88.9	Confident	90.8	Very high	86 Å²	86	48.7 Å²	48.7	40%	0.402	24%	0.237	S	C	.	.	B	Isolated β-bridge	trans	-102.8	131.1	169.7	-64.1	-177.4	177.1	0	0	109.8	C534 H535	C534-E557 CarbonylContact C-O 3.59Å; C534-E557 WeakPolarHBondContact CA-O 3.47Å; C534-E557 WeakPolarHBondContact CB-O 3.45Å; H535-E557 PolarHBondContact N-O 2.92Å; H535-E557 PolarHBondContact ND1-O 3.08Å; H535-E557 PolarHBondContact O-N 2.64Å
558	P	84.3	Confident	91.1	Very high	111 Å²	111	45.6 Å²	45.6	72%	0.721	22%	0.218	S	C	*	.	S	Bend	cis	-82.6	-19.9	5.5	32.8	-36.4	0	0	0	114.8	L556	L556-P558 CarbonylContact O-C 3.57Å
559	R	83.6	Confident	90.9	Very high	147 Å²	147	42.9 Å²	42.9	56%	0.555	21%	0.212	S	C	*	.	S	Bend	trans	-150.3	155.4	-178.8	-67.1	179	67.1	129.9	2.1	110.9	D465 C534 L556	D465-R559 IonicContact OD1-NH2 2.72Å; D465-R559 PolarHBondContact OD1-NH2 3.16Å; D465-R559 IonicContact OD2-CZ 2.67Å; D465-R559 IonicContact OD2-NE 3.56Å; D465-R559 PolarHBondContact OD2-NE 3.34Å; D465-R559 IonicContact OD2-NH2 2.82Å; D465-R559 PolarHBondContact OD2-NH2 2.93Å; C534-R559 WeakPolarHBondContact CB-O 3.3Å; L556-R559 WeakPolarHBondContact CB-O 3.49Å; L556-R559 CarbonylContact O-C 3.57Å; L556-R559 PolarHBondContact O-N 2.92Å
560	G	88.8	Confident	89.6	Confident	12 Å²	12	43.7 Å²	43.7	12%	0.124	21%	0.211	C	C	.	.			trans	115.6	167	171	0	0	0	0	0	114	E464 L556	E464-G560 CarbonylContact O-C 3.58Å; E464-G560 WeakPolarHBondContact O-CA 3.3Å; L556-G560 PolarHBondContact N-O 2.89Å
561	L	92.5	Very high	87.5	Confident	35 Å²	35	49.6 Å²	49.6	18%	0.183	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	146.5	171.2	-73.6	163.7	0	0	0	109	A463 E464 A553 V554 K555 Y563	A463-L561 CarbonylContact C-O 3.57Å; A463-L561 WeakPolarHBondContact CA-O 3.3Å; A463-L561 VanDerWaalsContact CB-O 3.31Å; A463-L561 WeakPolarHBondContact CB-O 3.31Å; E464-L561 HydrophobicContact CB-CB 4.46Å; E464-L561 PolarHBondContact N-O 2.89Å; E464-L561 PolarHBondContact O-N 3.5Å; A553-L561 HydrophobicContact CB-CD2 4.25Å; V554-L561 WeakPolarHBondContact O-CA 3.42Å; K555-L561 HydrophobicContact CB-CD2 4.16Å; L561-Y563 HydrophobicContact CB-CE2 4.33Å
562	I	93.6	Very high	85.1	Confident	2 Å²	2	52 Å²	52	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	128.5	165	-52.3	-179.6	0	0	0	108.7	F460 G462 A463 L518 V520 V554 L556 V564	F460-I562 HydrophobicContact CD1-CG2 3.57Å; F460-I562 HydrophobicContact CE1-CG2 3.9Å; G462-I562 WeakPolarHBondContact O-CG2 3.12Å; A463-I562 HydrophobicContact CB-CB 4.44Å; A463-I562 HydrophobicContact CB-CG1 3.99Å; A463-I562 HydrophobicContact CB-CG2 4.44Å; L518-I562 HydrophobicContact CB-CD1 4.35Å; L518-I562 HydrophobicContact CD1-CD1 4.35Å; V520-I562 HydrophobicContact CG2-CD1 4.04Å; V554-I562 PolarHBondContact N-O 3.43Å; V554-I562 PolarHBondContact O-N 3.41Å; L556-I562 HydrophobicContact CD1-CD1 3.9Å; L556-I562 HydrophobicContact CD1-CG1 3.75Å; L556-I562 HydrophobicContact CD2-CD1 3.8Å; L556-I562 HydrophobicContact CD2-CG1 3.87Å; L556-I562 HydrophobicContact CG-CD1 4.35Å; L556-I562 HydrophobicContact CG-CG1 4.05Å; I562-V564 HydrophobicContact CB-CG1 4.49Å; I562-V564 HydrophobicContact CG2-CG1 3.68Å
563	Y	94.6	Very high	82.3	Confident	7 Å²	7	58.1 Å²	58.1	3%	0.027	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	111.8	176.1	-62.5	-85.2	0	0	0	108.9	I434 F437 Y461 G462 E464 F499 A553 L561	I434-Y563 HydrophobicContact CG2-CE1 4.02Å; F437-Y563 HydrophobicContact CB-CD1 3.85Å; F437-Y563 HydrophobicContact CB-CE1 4.22Å; F437-Y563 AromaticContact CD1-CD1 3.96Å; F437-Y563 HydrophobicContact CD1-CD1 3.96Å; F437-Y563 AromaticContact CD2-CD1 3.93Å; F437-Y563 HydrophobicContact CD2-CD1 3.93Å; F437-Y563 HydrophobicContact CE2-CD1 4.47Å; F437-Y563 AromaticContact CG-CD1 3.65Å; F437-Y563 HydrophobicContact CG-CD1 3.65Å; F437-Y563 HydrophobicContact CG-CE1 4.43Å; Y461-Y563 PolarHBondContact N-O 2.72Å; G462-Y563 PolarHBondContact O-N 3.38Å; E464-Y563 HydrophobicContact CB-CE2 4.39Å; E464-Y563 HydrophobicContact CG-CE2 3.94Å; E464-Y563 PolarHBondContact OE2-OH 2.77Å; F499-Y563 HydrophobicContact CE2-CD2 4.03Å; F499-Y563 HydrophobicContact CE2-CE2 4.06Å; F499-Y563 HydrophobicContact CZ-CD2 4.49Å; A553-Y563 HydrophobicContact CB-CD1 3.95Å; A553-Y563 HydrophobicContact CB-CE1 3.7Å; L561-Y563 HydrophobicContact CB-CE2 4.33Å
564	V	95.2	Very high	79.4	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	149.7	-178.4	-60.1	0	0	0	0	111.9	L458 H459 F460 L518 Q551 L552 V554 I562 L566	L458-V564 HydrophobicContact CD1-CB 3.81Å; L458-V564 HydrophobicContact CD1-CG1 3.85Å; H459-V564 CarbonylContact O-C 3.5Å; H459-V564 WeakPolarHBondContact O-CA 3.33Å; H459-V564 WeakPolarHBondContact O-CB 3.48Å; F460-V564 HydrophobicContact CD1-CG1 3.93Å; F460-V564 HydrophobicContact CE1-CG1 4.23Å; F460-V564 HydrophobicContact CG-CG1 4.24Å; L518-V564 HydrophobicContact CD1-CG1 4.04Å; Q551-V564 WeakPolarHBondContact CA-O 3.44Å; L552-V564 HydrophobicContact CB-CG2 4.14Å; L552-V564 PolarHBondContact N-O 3.16Å; L552-V564 PolarHBondContact O-N 3.36Å; V554-V564 HydrophobicContact CG2-CG2 3.77Å; I562-V564 HydrophobicContact CB-CG1 4.49Å; I562-V564 HydrophobicContact CG2-CG1 3.68Å; V564-L566 HydrophobicContact CG2-CG 4.36Å
565	K	94.1	Very high	76.9	Confident	76 Å²	76	66.3 Å²	66.3	33%	0.33	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122.1	164	179.5	174.9	-177.8	175.7	0	109.4	H459 Y461 H550 Q551	H459-K565 HydrophobicContact CB-CB 4.39Å; H459-K565 PolarHBondContact N-O 3.46Å; H459-K565 PolarHBondContact O-N 2.8Å; Y461-K565 HydrophobicContact CE2-CB 3.61Å; Y461-K565 HydrophobicContact CE2-CD 4.37Å; H550-K565 CarbonylContact O-C 3.5Å; H550-K565 VanDerWaalsContact O-CA 3.31Å; H550-K565 WeakPolarHBondContact O-CA 3.24Å; Q551-K565 HydrophobicContact CG-CB 3.97Å; Q551-K565 HydrophobicContact CG-CD 4.02Å; Q551-K565 HydrophobicContact CG-CG 3.92Å
566	L	93.3	Very high	74.3	Confident	0 Å²	0	69 Å²	69	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	130.5	176.3	-64.2	175.9	0	0	0	108.4	M456 S457 L458 L516 V538 L543 F544 T549 H550 L552 V564	M456-L566 HydrophobicContact CE-CD2 4.43Å; M456-L566 HydrophobicContact SD-CD2 3.96Å; S457-L566 WeakPolarHBondContact O-CA 3.15Å; L458-L566 HydrophobicContact CB-CD2 4Å; L458-L566 HydrophobicContact CD1-CD2 3.65Å; L458-L566 HydrophobicContact CG-CD2 4.31Å; L516-L566 HydrophobicContact CD2-CD1 4.15Å; L516-L566 HydrophobicContact CD2-CD2 3.65Å; V538-L566 HydrophobicContact CG1-CD1 3.99Å; L543-L566 HydrophobicContact CD2-CB 4.48Å; L543-L566 HydrophobicContact CD2-CD1 3.55Å; F544-L566 HydrophobicContact CE1-CB 4.17Å; F544-L566 HydrophobicContact CZ-CB 3.91Å; T549-L566 CarbonylContact C-O 3.36Å; T549-L566 WeakPolarHBondContact CA-O 3.41Å; H550-L566 PolarHBondContact N-O 2.74Å; H550-L566 PolarHBondContact O-N 3.34Å; L552-L566 HydrophobicContact CD1-CD1 3.93Å; V564-L566 HydrophobicContact CG2-CG 4.36Å
567	N	91.6	Very high	71.6	Confident	53 Å²	53	76.1 Å²	76.1	28%	0.283	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	110.9	175	-179.3	27.9	0	0	0	109.5	M456 S457 R548 T549	M456-N567 CarbonylContact C-O 3.6Å; M456-N567 WeakPolarHBondContact CA-O 3.26Å; S457-N567 PolarHBondContact N-O 3.26Å; S457-N567 PolarHBondContact O-N 2.96Å; R548-N567 CarbonylContact O-C 3.12Å; R548-N567 WeakPolarHBondContact O-CA 3.36Å; T549-N567 HydrophobicContact CG2-CB 4.06Å; T549-N567 VanDerWaalsContact CG2-OD1 3.23Å; T549-N567 WeakPolarHBondContact CG2-OD1 3.33Å
568	L	87.8	Confident	69.3	Low	1 Å²	1	75.2 Å²	75.2	1%	0.005	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	111.4	173.7	-178.5	70.1	0	0	0	110.3	I452 M456 L510 F544 R548 E570	I452-L568 HydrophobicContact CD1-CD2 3.39Å; I452-L568 HydrophobicContact CG1-CD2 3.73Å; M456-L568 HydrophobicContact CB-CD1 4.46Å; L510-L568 HydrophobicContact CD1-CD1 4.13Å; F544-L568 HydrophobicContact CB-CD2 4.06Å; F544-L568 HydrophobicContact CD1-CB 3.78Å; F544-L568 HydrophobicContact CD2-CB 4.08Å; F544-L568 HydrophobicContact CD2-CD2 4.01Å; F544-L568 HydrophobicContact CE1-CB 3.67Å; F544-L568 HydrophobicContact CE2-CB 3.94Å; F544-L568 HydrophobicContact CG-CB 3.98Å; F544-L568 HydrophobicContact CG-CD2 4Å; F544-L568 HydrophobicContact CZ-CB 3.74Å; R548-L568 PolarHBondContact O-N 3.18Å; L568-E570 HydrophobicContact CD2-CG 3.96Å; L568-E570 HydrophobicContact CG-CG 4.19Å; L568-E570 PolarHBondContact O-N 3.32Å
569	M	78.5	Confident	67	Low	88 Å²	88	72 Å²	72	43%	0.433	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	97.8	165.9	-57.4	-179.1	71.2	0	0	108.4	L455	L455-M569 HydrophobicContact CB-CB 4.45Å; L455-M569 PolarHBondContact N-O 3.14Å; L455-M569 VanDerWaalsContact N-O 3.17Å; L455-M569 WeakPolarHBondContact O-CA 3.18Å; L455-M569 WeakPolarHBondContact O-CB 3.2Å; L455-M569 PolarHBondContact O-N 3.47Å
570	E	59.5	Low	65	Low	89 Å²	89	72.2 Å²	72.2	42%	0.416	40%	0.402	S	S	.	.			trans	-63.1	152.7	165.7	-67.9	178.6	162.1	0	0	109.9	R548 L568	R548-E570 IonicContact CZ-OE2 2.67Å; R548-E570 IonicContact NE-OE2 3.5Å; R548-E570 PolarHBondContact NE-OE2 3.17Å; R548-E570 IonicContact NH2-OE2 2.73Å; R548-E570 PolarHBondContact NH2-OE2 3.13Å; L568-E570 HydrophobicContact CD2-CG 3.96Å; L568-E570 HydrophobicContact CG-CG 4.19Å; L568-E570 PolarHBondContact O-N 3.32Å
571	Q	48.8	Very low	62.9	Low	150 Å²	150	79.2 Å²	79.2	70%	0.701	44%	0.436	S	S	*	.			trans	68.3	69.1	-173.4	-59.7	-174.3	-32.9	0	0	116.4	Q573 K638	Q571-Q573 PolarHBondContact O-N 3.46Å; Q571-K638 PolarHBondContact O-NZ 3.49Å
572	W	41.7	Very low	60.7	Low	122 Å²	122	80.1 Å²	80.1	46%	0.462	45%	0.454	S	S	.	.			trans	-80.5	64.4	149.4	-156.1	87.8	0	0	0	109.6	E509 N574	E509-W572 VanDerWaalsContact OE1-CH2 3.26Å; E509-W572 WeakPolarHBondContact OE1-CH2 3.41Å; E509-W572 VanDerWaalsContact OE1-CZ2 3.22Å; E509-W572 WeakPolarHBondContact OE1-CZ2 3.47Å; W572-N574 HydrophobicContact CD2-CB 4.48Å; W572-N574 HydrophobicContact CE3-CB 3.79Å; W572-N574 HydrophobicContact CH2-CB 4.09Å; W572-N574 WeakPolarHBondContact CH2-ND2 3.43Å; W572-N574 WeakPolarHBondContact CZ2-ND2 3.31Å; W572-N574 HydrophobicContact CZ3-CB 3.57Å; W572-N574 WeakPolarHBondContact CZ3-ND2 3.38Å; W572-N574 PolarHBondContact O-N 2.78Å
573	Q	36.5	Very low	58.3	Low	130 Å²	130	87.9 Å²	87.9	61%	0.607	50%	0.495	S	S	*	.			trans	-78.5	68.2	-175.2	-166.2	68	32.6	0	0	111.9	Q571 S575	Q571-Q573 PolarHBondContact O-N 3.46Å; Q573-S575 PolarHBondContact O-N 3.31Å
574	N	33.5	Very low	56.4	Low	92 Å²	92	97.6 Å²	97.6	49%	0.492	53%	0.532	S	S	.	.			trans	-96.7	80.5	167.4	-72.1	-34.4	0	0	0	110	W572	W572-N574 HydrophobicContact CD2-CB 4.48Å; W572-N574 HydrophobicContact CE3-CB 3.79Å; W572-N574 HydrophobicContact CH2-CB 4.09Å; W572-N574 WeakPolarHBondContact CH2-ND2 3.43Å; W572-N574 WeakPolarHBondContact CZ2-ND2 3.31Å; W572-N574 HydrophobicContact CZ3-CB 3.57Å; W572-N574 WeakPolarHBondContact CZ3-ND2 3.38Å; W572-N574 PolarHBondContact O-N 2.78Å
575	S	42.1	Very low	55	Low	80 Å²	80	104 Å²	104	56%	0.559	56%	0.562	S	S	*	*	S	Bend	trans	77.5	143	160.5	-43.5	0	0	0	0	118.6	Q573	Q573-S575 PolarHBondContact O-N 3.31Å
576	L	40.3	Very low	54.1	Low	165 Å²	165	103.6 Å²	103.6	86%	0.864	57%	0.567	S	S	*	*			trans	68.4	50.4	145.4	-61.9	161	0	0	0	120.2
577	D	35.4	Very low	53.7	Low	153 Å²	153	108 Å²	108	82%	0.818	59%	0.588	S	S	*	*			trans	-148.7	149	138	-153.6	-2.1	0	0	0	112.1	G579	D577-G579 PolarHBondContact O-N 2.96Å
578	G	39.7	Very low	53.7	Low	66 Å²	66	105.5 Å²	105.5	68%	0.68	58%	0.575	S	S	*	*			trans	-91.9	94.8	-165.8	0	0	0	0	0	114.5
579	G	35.7	Very low	53.9	Low	44 Å²	44	105.8 Å²	105.8	45%	0.454	58%	0.576	S	S	.	*			trans	-68.4	154.3	155.5	0	0	0	0	0	111.1	D577 D581 G582	D577-G579 PolarHBondContact O-N 2.96Å; G579-D581 PolarHBondContact O-N 3.47Å; G579-G582 PolarHBondContact O-N 3.15Å
580	P	42.4	Very low	54.4	Low	152 Å²	152	103.2 Å²	103.2	99%	0.987	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	10.8	-173.9	31	-37.4	0	0	0	115.5
581	D	43.9	Very low	55.8	Low	159 Å²	159	99.5 Å²	99.5	85%	0.85	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.4	17.7	174.5	-158.4	22.4	0	0	0	110.4	G579	G579-D581 PolarHBondContact O-N 3.47Å
582	G	46	Very low	57.8	Low	54 Å²	54	94.4 Å²	94.4	56%	0.557	53%	0.531	S	S	*	.			trans	-90.6	11.2	-172	0	0	0	0	0	115.4	G579 R584	G579-G582 PolarHBondContact O-N 3.15Å; G582-R584 PolarHBondContact O-N 3.22Å
583	D	44.1	Very low	60.2	Low	164 Å²	164	88.8 Å²	88.8	88%	0.877	51%	0.511	S	S	*	.			trans	-86	40.4	-170.8	-156.2	33.5	0	0	0	113.1
584	R	55.1	Low	62.9	Low	211 Å²	211	87.1 Å²	87.1	80%	0.796	50%	0.499	S	S	*	.			trans	-98.8	100.2	169.9	-70.1	-168.6	-179.2	-146.5	-1	109	G582	G582-R584 PolarHBondContact O-N 3.22Å
585	E	65.9	Low	65.7	Low	135 Å²	135	88.1 Å²	88.1	63%	0.631	50%	0.496	S	S	*	.			trans	-48.8	144.4	163.4	-69.7	-167.4	155.1	0	0	110.4	Q587 R599	E585-Q587 PolarHBondContact O-N 3.03Å; E585-R599 IonicContact OE2-NH2 2.68Å; E585-R599 PolarHBondContact OE2-NH2 2.79Å; E585-R599 VanDerWaalsContact OE2-NH2 3.11Å
586	P	74.3	Confident	68.1	Low	68 Å²	68	84.4 Å²	84.4	44%	0.442	47%	0.47	S	S	.	.			trans	-57	137.7	167.9	25.5	-33.3	0	0	0	110.1	F589 V591 R599	P586-F589 VanDerWaalsContact CB-O 3.28Å; P586-F589 WeakPolarHBondContact CB-O 3.29Å; P586-V591 HydrophobicContact CB-CG2 4.06Å; P586-V591 HydrophobicContact CG-CG2 4.19Å; P586-V591 VanDerWaalsContact O-CG2 3.3Å; P586-V591 WeakPolarHBondContact O-CG2 3.15Å; P586-R599 PolarHBondContact O-NH1 2.9Å
587	Q	85.5	Confident	70.7	Confident	92 Å²	92	77 Å²	77	43%	0.43	43%	0.431	S	S	.	.	S	Bend	trans	-98.3	-32.1	-178.4	-57.7	-160.3	4	0	0	111.6	E585 E645	E585-Q587 PolarHBondContact O-N 3.03Å; Q587-E645 WeakPolarHBondContact CA-OE2 3.43Å; Q587-E645 PolarHBondContact N-OE2 3.48Å
588	V	90.4	Very high	73.4	Confident	1 Å²	1	76.2 Å²	76.2	1%	0.006	42%	0.423	C	S	.	.	S	Bend	trans	-126.1	-59.2	-174.4	-177.2	0	0	0	0	113.2	I609 F644 E645 S648 Y671	V588-I609 HydrophobicContact CG1-CB 4.38Å; V588-I609 HydrophobicContact CG1-CD1 4.25Å; V588-I609 HydrophobicContact CG1-CG2 3.92Å; V588-F644 WeakPolarHBondContact CG2-O 3.04Å; V588-E645 PolarHBondContact N-OE1 2.87Å; V588-E645 PolarHBondContact N-OE2 2.94Å; V588-E645 VanDerWaalsContact N-OE2 3.11Å; V588-S648 WeakPolarHBondContact CG2-OG 3.39Å; V588-Y671 HydrophobicContact CG1-CD2 3.97Å; V588-Y671 HydrophobicContact CG1-CE2 3.72Å; V588-Y671 WeakPolarHBondContact O-CE2 3.21Å
589	F	91.9	Very high	75.8	Confident	7 Å²	7	79.3 Å²	79.3	3%	0.031	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	136	-173.8	-62.8	-109.4	0	0	0	110.4	P586 V591 I609 R641 F644 E645 V667 Y671	P586-F589 VanDerWaalsContact CB-O 3.28Å; P586-F589 WeakPolarHBondContact CB-O 3.29Å; F589-V591 PolarHBondContact O-N 3.13Å; F589-I609 HydrophobicContact CE1-CD1 3.89Å; F589-I609 HydrophobicContact CE2-CD1 3.66Å; F589-I609 HydrophobicContact CZ-CD1 3.25Å; F589-R641 HydrophobicContact CD2-CG 4.14Å; F589-R641 HydrophobicContact CE1-CG 4.45Å; F589-R641 HydrophobicContact CE2-CB 4.2Å; F589-R641 HydrophobicContact CE2-CG 3.77Å; F589-R641 HydrophobicContact CZ-CB 3.99Å; F589-R641 HydrophobicContact CZ-CG 3.93Å; F589-F644 HydrophobicContact CE2-CB 4.02Å; F589-E645 WeakPolarHBondContact CB-OE1 3.49Å; F589-E645 HydrophobicContact CD2-CG 3.85Å; F589-E645 VanDerWaalsContact CD2-OE1 3.31Å; F589-E645 WeakPolarHBondContact CD2-OE1 3.36Å; F589-E645 HydrophobicContact CE2-CG 4.32Å; F589-E645 PolarHBondContact N-OE1 3.22Å; F589-V667 HydrophobicContact CE1-CG1 4.32Å; F589-V667 HydrophobicContact CZ-CG1 3.87Å; F589-Y671 HydrophobicContact CD1-CD2 4.08Å; F589-Y671 HydrophobicContact CE1-CD2 4.35Å; F589-Y671 HydrophobicContact CG-CD2 4.28Å
590	G	89	Confident	78.5	Confident	33 Å²	33	78 Å²	78	34%	0.34	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	83	-4	-171.6	0	0	0	0	0	114.3	E674	G590-E674 WeakPolarHBondContact CA-O 3.19Å; G590-E674 PolarHBondContact N-O 2.97Å
591	V	90	Very high	80.6	Confident	12 Å²	12	77.4 Å²	77.4	7%	0.073	38%	0.384	C	S	.	.	S	Bend	trans	-96.1	150.2	179.5	-172.3	0	0	0	0	109.9	P586 F589 R595 V596 P676	P586-V591 HydrophobicContact CB-CG2 4.06Å; P586-V591 HydrophobicContact CG-CG2 4.19Å; P586-V591 VanDerWaalsContact O-CG2 3.3Å; P586-V591 WeakPolarHBondContact O-CG2 3.15Å; F589-V591 PolarHBondContact O-N 3.13Å; V591-R595 HydrophobicContact CG1-CB 3.86Å; V591-V596 HydrophobicContact CB-CG2 3.79Å; V591-V596 HydrophobicContact CG1-CG2 3.78Å; V591-P676 WeakPolarHBondContact O-CD 3.39Å
592	E	91.1	Very high	82.6	Confident	43 Å²	43	72.1 Å²	72.1	20%	0.201	36%	0.358	C	S	.	.			trans	-64.6	135.3	172.1	-64.9	177.2	87.1	0	0	111	W594 R595 V596 P676 Y677	E592-W594 VanDerWaalsContact C-N 3.27Å; E592-W594 HydrophobicContact CB-CG 4.46Å; E592-W594 PolarHBondContact O-N 2.9Å; E592-W594 PolarHBondContact OE1-NE1 3.23Å; E592-R595 HydrophobicContact CB-CG 4.24Å; E592-R595 WeakPolarHBondContact O-CB 3.34Å; E592-R595 PolarHBondContact O-N 2.87Å; E592-R595 IonicContact OE2-CZ 2.82Å; E592-R595 IonicContact OE2-NE 2.68Å; E592-R595 PolarHBondContact OE2-NE 3.3Å; E592-R595 IonicContact OE2-NH2 3.12Å; E592-R595 PolarHBondContact OE2-NH2 3.37Å; E592-V596 PolarHBondContact O-N 2.73Å; E592-P676 HydrophobicContact CB-CG 4.36Å; E592-P676 HydrophobicContact CG-CG 3.58Å; E592-Y677 HydrophobicContact CG-CD2 4.49Å; E592-Y677 HydrophobicContact CG-CE2 4.37Å
593	A	92	Very high	84.5	Confident	4 Å²	4	72.7 Å²	72.7	3%	0.033	36%	0.364	C	S	.	.	H	α-helix	trans	-57.9	-37.7	-173.1	0	0	0	0	0	113.1	R595 V596 V597 P607 L675 V724	A593-R595 PolarHBondContact O-N 2.85Å; A593-V596 PolarHBondContact O-N 2.76Å; A593-V597 PolarHBondContact O-N 2.91Å; A593-P607 HydrophobicContact CB-CG 4.15Å; A593-L675 HydrophobicContact CB-CD2 4.26Å; A593-V724 HydrophobicContact CB-CG1 4.19Å
594	W	92.7	Very high	86.5	Confident	94 Å²	94	67.9 Å²	67.9	36%	0.356	34%	0.338	S	S	.	.	H	α-helix	trans	-62.3	-37.3	174.9	70	-97	0	0	0	113.6	E592 V597 E598 V724	E592-W594 VanDerWaalsContact C-N 3.27Å; E592-W594 HydrophobicContact CB-CG 4.46Å; E592-W594 PolarHBondContact O-N 2.9Å; E592-W594 PolarHBondContact OE1-NE1 3.23Å; W594-V597 PolarHBondContact O-N 3.29Å; W594-E598 WeakPolarHBondContact O-CB 3.37Å; W594-E598 PolarHBondContact O-N 3.24Å; W594-V724 HydrophobicContact CB-CB 4.16Å; W594-V724 HydrophobicContact CB-CG1 4.47Å; W594-V724 HydrophobicContact CB-CG2 4.14Å
595	R	92.6	Very high	88.3	Confident	113 Å²	113	61.6 Å²	61.6	43%	0.426	32%	0.319	S	S	.	.	H	α-helix	trans	-70	-35.8	175.7	-63.9	-175.5	-160.3	-124.1	3.9	112	V591 E592 A593 E598 R599	V591-R595 HydrophobicContact CG1-CB 3.86Å; E592-R595 HydrophobicContact CB-CG 4.24Å; E592-R595 WeakPolarHBondContact O-CB 3.34Å; E592-R595 PolarHBondContact O-N 2.87Å; E592-R595 IonicContact OE2-CZ 2.82Å; E592-R595 IonicContact OE2-NE 2.68Å; E592-R595 PolarHBondContact OE2-NE 3.3Å; E592-R595 IonicContact OE2-NH2 3.12Å; E592-R595 PolarHBondContact OE2-NH2 3.37Å; A593-R595 PolarHBondContact O-N 2.85Å; R595-E598 PolarHBondContact O-N 2.74Å; R595-R599 WeakPolarHBondContact O-CB 3.49Å; R595-R599 VanDerWaalsContact O-CG 3.26Å; R595-R599 WeakPolarHBondContact O-CG 3.35Å; R595-R599 PolarHBondContact O-N 2.95Å
596	V	92.8	Very high	89.7	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.012	29%	0.292	C	S	.	.	H	α-helix	trans	-63.7	-47.9	175.3	-179.2	0	0	0	0	109.4	V591 E592 A593 E598 R599 E600 P607	V591-V596 HydrophobicContact CB-CG2 3.79Å; V591-V596 HydrophobicContact CG1-CG2 3.78Å; E592-V596 PolarHBondContact O-N 2.73Å; A593-V596 PolarHBondContact O-N 2.76Å; V596-E598 PolarHBondContact O-N 3.21Å; V596-R599 PolarHBondContact O-N 3.28Å; V596-E600 HydrophobicContact CG1-CG 4.25Å; V596-E600 WeakPolarHBondContact O-CB 3.36Å; V596-E600 VanDerWaalsContact O-CG 3.26Å; V596-E600 WeakPolarHBondContact O-CG 3.39Å; V596-E600 PolarHBondContact O-N 3.49Å; V596-P607 HydrophobicContact CG1-CB 4.01Å
597	V	93.6	Very high	90.8	Very high	10 Å²	10	52.5 Å²	52.5	6%	0.061	27%	0.271	C	S	.	.	H	α-helix	trans	-59.4	-44	175.1	163.8	0	0	0	0	112.7	A593 W594 E600 N601 L604 M605 P607 V724	A593-V597 PolarHBondContact O-N 2.91Å; W594-V597 PolarHBondContact O-N 3.29Å; V597-E600 PolarHBondContact O-N 3.4Å; V597-N601 PolarHBondContact O-N 2.89Å; V597-L604 VanDerWaalsContact CG1-O 3.29Å; V597-L604 WeakPolarHBondContact CG1-O 3.43Å; V597-M605 HydrophobicContact CG1-CE 3.96Å; V597-P607 HydrophobicContact CG2-CG 3.96Å; V597-V724 HydrophobicContact CB-CG1 4.27Å; V597-V724 HydrophobicContact CB-CG2 4.41Å; V597-V724 HydrophobicContact CG1-CG2 4.22Å; V597-V724 HydrophobicContact CG2-CG1 3.73Å
598	E	92.4	Very high	91.3	Very high	137 Å²	137	48.6 Å²	48.6	64%	0.64	25%	0.253	S	S	*	.	H	α-helix	trans	-63.4	-42.6	177.5	-174.9	177.8	-138.2	0	0	112.1	W594 R595 V596	W594-E598 WeakPolarHBondContact O-CB 3.37Å; W594-E598 PolarHBondContact O-N 3.24Å; R595-E598 PolarHBondContact O-N 2.74Å; V596-E598 PolarHBondContact O-N 3.21Å
599	R	90.7	Very high	91.5	Very high	131 Å²	131	48.6 Å²	48.6	49%	0.494	25%	0.253	S	S	.	.	H	α-helix	trans	-67	-39.9	175.7	-74.9	174	171.4	-171.5	-4.7	112.5	E585 P586 R595 V596	E585-R599 IonicContact OE2-NH2 2.68Å; E585-R599 PolarHBondContact OE2-NH2 2.79Å; E585-R599 VanDerWaalsContact OE2-NH2 3.11Å; P586-R599 PolarHBondContact O-NH1 2.9Å; R595-R599 WeakPolarHBondContact O-CB 3.49Å; R595-R599 VanDerWaalsContact O-CG 3.26Å; R595-R599 WeakPolarHBondContact O-CG 3.35Å; R595-R599 PolarHBondContact O-N 2.95Å; V596-R599 PolarHBondContact O-N 3.28Å
600	E	91.4	Very high	91.8	Very high	17 Å²	17	48.2 Å²	48.2	8%	0.079	25%	0.252	C	S	.	.	H	α-helix	trans	-72.3	-30.5	179.8	-73.9	175.4	164.6	0	0	112.8	V596 V597 T602 P607 L608 Q649	V596-E600 HydrophobicContact CG1-CG 4.25Å; V596-E600 WeakPolarHBondContact O-CB 3.36Å; V596-E600 VanDerWaalsContact O-CG 3.26Å; V596-E600 WeakPolarHBondContact O-CG 3.39Å; V596-E600 PolarHBondContact O-N 3.49Å; V597-E600 PolarHBondContact O-N 3.4Å; E600-T602 VanDerWaalsContact C-N 3.26Å; E600-T602 HydrophobicContact CB-CG2 4.23Å; E600-T602 PolarHBondContact O-N 3.15Å; E600-T602 VanDerWaalsContact O-N 3.13Å; E600-P607 WeakPolarHBondContact OE2-CA 3.49Å; E600-L608 HydrophobicContact CB-CD1 4.32Å; E600-L608 HydrophobicContact CG-CD1 4.09Å; E600-L608 HydrophobicContact CG-CG 4.45Å; E600-L608 WeakPolarHBondContact OE1-CB 3.32Å; E600-L608 PolarHBondContact OE1-N 3.34Å; E600-L608 WeakPolarHBondContact OE2-CG 3.37Å; E600-L608 PolarHBondContact OE2-N 3.42Å; E600-Q649 PolarHBondContact O-NE2 2.99Å
601	N	87.8	Confident	92.1	Very high	138 Å²	138	51.2 Å²	51.2	74%	0.738	25%	0.253	S	S	*	.			trans	45.8	42.2	174.8	-164.6	19.3	0	0	0	114.9	V597 G603	V597-N601 PolarHBondContact O-N 2.89Å; N601-G603 VanDerWaalsContact C-N 3.33Å
602	T	85.6	Confident	92.4	Very high	48 Å²	48	52.7 Å²	52.7	29%	0.294	26%	0.259	S	S	.	.	S	Bend	trans	-83.3	-7.7	-177.4	53.7	0	0	0	0	114.1	E600 L604 L608	E600-T602 VanDerWaalsContact C-N 3.26Å; E600-T602 HydrophobicContact CB-CG2 4.23Å; E600-T602 PolarHBondContact O-N 3.15Å; E600-T602 VanDerWaalsContact O-N 3.13Å; T602-L604 PolarHBondContact O-N 3.08Å; T602-L604 WeakPolarHBondContact OG1-CB 3.46Å; T602-L604 PolarHBondContact OG1-N 2.64Å; T602-L608 HydrophobicContact CG2-CD1 3.82Å; T602-L608 HydrophobicContact CG2-CD2 3.94Å; T602-L608 HydrophobicContact CG2-CG 3.92Å
603	G	85.1	Confident	92.7	Very high	67 Å²	67	50.6 Å²	50.6	69%	0.691	25%	0.249	S	C	*	.	S	Bend	trans	74.4	0.2	-165.8	0	0	0	0	0	114.4	N601	N601-G603 VanDerWaalsContact C-N 3.33Å
604	L	87.3	Confident	92.9	Very high	63 Å²	63	50.4 Å²	50.4	33%	0.33	25%	0.247	S	C	.	.			trans	-91.3	130.7	173.2	-56.3	177	0	0	0	110	V597 T602 V606 Y611	V597-L604 VanDerWaalsContact CG1-O 3.29Å; V597-L604 WeakPolarHBondContact CG1-O 3.43Å; T602-L604 PolarHBondContact O-N 3.08Å; T602-L604 WeakPolarHBondContact OG1-CB 3.46Å; T602-L604 PolarHBondContact OG1-N 2.64Å; L604-V606 PolarHBondContact O-N 3.49Å; L604-Y611 HydrophobicContact CD1-CD1 4.26Å; L604-Y611 HydrophobicContact CD1-CD2 4.14Å; L604-Y611 HydrophobicContact CD1-CE1 4.38Å; L604-Y611 HydrophobicContact CD1-CE2 4.27Å; L604-Y611 HydrophobicContact CD1-CG 4.14Å
605	M	93.3	Very high	93.1	Very high	78 Å²	78	48.5 Å²	48.5	38%	0.384	24%	0.244	S	C	.	.	S	Bend	trans	-78.6	31.6	172.6	-61	-66.3	93.3	0	0	112.7	V597 E723 V724 M727	V597-M605 HydrophobicContact CG1-CE 3.96Å; M605-E723 HydrophobicContact CG-CG 4.19Å; M605-E723 HydrophobicContact SD-CG 4.3Å; M605-V724 HydrophobicContact SD-CG2 4.33Å; M605-M727 HydrophobicContact CB-CB 3.96Å; M605-M727 HydrophobicContact CB-CG 4.07Å; M605-M727 WeakPolarHBondContact O-CB 3.47Å
606	V	95.2	Very high	93.3	Very high	13 Å²	13	43.9 Å²	43.9	8%	0.079	23%	0.228	C	C	.	.	S	Bend	trans	-147.1	128.9	-175.7	-178.7	0	0	0	0	108.7	L604 I610 M727 K731	L604-V606 PolarHBondContact O-N 3.49Å; V606-I610 HydrophobicContact CG1-CB 3.87Å; V606-I610 HydrophobicContact CG1-CG2 3.71Å; V606-M727 HydrophobicContact CG2-CB 4.04Å; V606-K731 HydrophobicContact CG2-CB 4.44Å
607	P	96	Very high	93.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.227	C	C	.	.			trans	-56.3	141.9	179.3	-25.4	32.6	0	0	0	113.4	A593 V596 V597 E600 I609 I610 Y611 Y671 T728	A593-P607 HydrophobicContact CB-CG 4.15Å; V596-P607 HydrophobicContact CG1-CB 4.01Å; V597-P607 HydrophobicContact CG2-CG 3.96Å; E600-P607 WeakPolarHBondContact OE2-CA 3.49Å; P607-I609 HydrophobicContact CB-CG2 4.06Å; P607-I609 PolarHBondContact O-N 2.89Å; P607-I610 HydrophobicContact CB-CG1 4.23Å; P607-I610 HydrophobicContact CG-CG1 4.38Å; P607-I610 WeakPolarHBondContact O-CB 3.33Å; P607-I610 PolarHBondContact O-N 3.07Å; P607-Y611 PolarHBondContact O-N 2.87Å; P607-Y671 WeakPolarHBondContact CG-OH 3.47Å; P607-T728 VanDerWaalsContact CD-OG1 3.3Å; P607-T728 WeakPolarHBondContact CD-OG1 3.38Å
608	L	95.5	Very high	93.6	Very high	10 Å²	10	44.9 Å²	44.9	5%	0.052	23%	0.231	C	C	.	.	H	α-helix	trans	-59.9	-33.7	-178.1	-77.2	171.2	0	0	0	113	E600 T602 I610 Y611 K612 Q649	E600-L608 HydrophobicContact CB-CD1 4.32Å; E600-L608 HydrophobicContact CG-CD1 4.09Å; E600-L608 HydrophobicContact CG-CG 4.45Å; E600-L608 WeakPolarHBondContact OE1-CB 3.32Å; E600-L608 PolarHBondContact OE1-N 3.34Å; E600-L608 WeakPolarHBondContact OE2-CG 3.37Å; E600-L608 PolarHBondContact OE2-N 3.42Å; T602-L608 HydrophobicContact CG2-CD1 3.82Å; T602-L608 HydrophobicContact CG2-CD2 3.94Å; T602-L608 HydrophobicContact CG2-CG 3.92Å; L608-I610 VanDerWaalsContact C-N 3.33Å; L608-I610 PolarHBondContact O-N 3.05Å; L608-Y611 PolarHBondContact O-N 2.81Å; L608-K612 HydrophobicContact CB-CD 4.46Å; L608-K612 WeakPolarHBondContact O-CB 3.07Å; L608-K612 VanDerWaalsContact O-CG 3.31Å; L608-K612 WeakPolarHBondContact O-CG 3.27Å; L608-K612 PolarHBondContact O-N 3.34Å; L608-Q649 VanDerWaalsContact CD1-CD 3.41Å; L608-Q649 HydrophobicContact CD1-CG 4.17Å; L608-Q649 VanDerWaalsContact CD1-OE1 3.27Å
609	I	96.1	Very high	93.7	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.9	-42.9	174.8	-176	164.6	0	0	0	111.8	V588 F589 P607 C613 F644 V667 Y671	V588-I609 HydrophobicContact CG1-CB 4.38Å; V588-I609 HydrophobicContact CG1-CD1 4.25Å; V588-I609 HydrophobicContact CG1-CG2 3.92Å; F589-I609 HydrophobicContact CE1-CD1 3.89Å; F589-I609 HydrophobicContact CE2-CD1 3.66Å; F589-I609 HydrophobicContact CZ-CD1 3.25Å; P607-I609 HydrophobicContact CB-CG2 4.06Å; P607-I609 PolarHBondContact O-N 2.89Å; I609-C613 WeakPolarHBondContact O-CB 3.47Å; I609-C613 PolarHBondContact O-N 2.89Å; I609-C613 VanDerWaalsContact O-N 3.15Å; I609-C613 PolarHBondContact O-SG 2.79Å; I609-F644 HydrophobicContact CB-CD1 4.01Å; I609-F644 HydrophobicContact CB-CE1 3.99Å; I609-F644 HydrophobicContact CB-CG 4.42Å; I609-F644 HydrophobicContact CB-CZ 4.36Å; I609-F644 HydrophobicContact CD1-CB 4.27Å; I609-F644 HydrophobicContact CD1-CD1 4.39Å; I609-F644 HydrophobicContact CD1-CD2 3.86Å; I609-F644 HydrophobicContact CD1-CE2 4.25Å; I609-F644 HydrophobicContact CD1-CG 3.94Å; I609-F644 HydrophobicContact CG1-CD1 4.2Å; I609-F644 HydrophobicContact CG1-CD2 4.09Å; I609-F644 HydrophobicContact CG1-CE1 4.14Å; I609-F644 HydrophobicContact CG1-CE2 4.01Å; I609-F644 HydrophobicContact CG1-CG 4.19Å; I609-F644 HydrophobicContact CG1-CZ 4.04Å; I609-V667 HydrophobicContact CD1-CG1 4.19Å; I609-Y671 HydrophobicContact CD1-CD2 3.97Å; I609-Y671 HydrophobicContact CD1-CG 4.1Å; I609-Y671 HydrophobicContact CG2-CD1 4.11Å; I609-Y671 HydrophobicContact CG2-CD2 3.7Å; I609-Y671 HydrophobicContact CG2-CE1 4.05Å; I609-Y671 HydrophobicContact CG2-CE2 3.61Å; I609-Y671 HydrophobicContact CG2-CG 3.95Å
610	I	96.9	Very high	93.8	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-63.8	-52.7	173.6	-59.2	-62.6	0	0	0	109.7	V606 P607 L608 I614 L668 Y671 L672 T728	V606-I610 HydrophobicContact CG1-CB 3.87Å; V606-I610 HydrophobicContact CG1-CG2 3.71Å; P607-I610 HydrophobicContact CB-CG1 4.23Å; P607-I610 HydrophobicContact CG-CG1 4.38Å; P607-I610 WeakPolarHBondContact O-CB 3.33Å; P607-I610 PolarHBondContact O-N 3.07Å; L608-I610 VanDerWaalsContact C-N 3.33Å; L608-I610 PolarHBondContact O-N 3.05Å; I610-I614 HydrophobicContact CG2-CD1 3.61Å; I610-I614 HydrophobicContact CG2-CG1 4.46Å; I610-I614 VanDerWaalsContact O-CB 3.26Å; I610-I614 WeakPolarHBondContact O-CB 3.41Å; I610-I614 WeakPolarHBondContact O-CG1 3.21Å; I610-I614 PolarHBondContact O-N 3.42Å; I610-L668 HydrophobicContact CD1-CD1 3.44Å; I610-L668 VanDerWaalsContact CD1-CD1 3.44Å; I610-Y671 HydrophobicContact CD1-CD1 3.5Å; I610-Y671 VanDerWaalsContact CD1-CD1 3.5Å; I610-Y671 HydrophobicContact CD1-CE1 3.61Å; I610-Y671 HydrophobicContact CG1-CD1 4.18Å; I610-Y671 HydrophobicContact CG1-CE1 3.83Å; I610-L672 HydrophobicContact CD1-CD2 3.85Å; I610-L672 HydrophobicContact CD1-CG 4.1Å; I610-T728 HydrophobicContact CG1-CG2 4.03Å; I610-T728 HydrophobicContact CG2-CG2 4.37Å
611	Y	95.9	Very high	93.9	Very high	96 Å²	96	40.2 Å²	40.2	38%	0.376	21%	0.207	S	C	.	.	H	α-helix	trans	-60.9	-50.2	-174.8	-180	-98.5	0	0	0	113	L604 P607 L608 N615	L604-Y611 HydrophobicContact CD1-CD1 4.26Å; L604-Y611 HydrophobicContact CD1-CD2 4.14Å; L604-Y611 HydrophobicContact CD1-CE1 4.38Å; L604-Y611 HydrophobicContact CD1-CE2 4.27Å; L604-Y611 HydrophobicContact CD1-CG 4.14Å; P607-Y611 PolarHBondContact O-N 2.87Å; L608-Y611 PolarHBondContact O-N 2.81Å; Y611-N615 VanDerWaalsContact CE1-ND2 3.33Å; Y611-N615 WeakPolarHBondContact CE1-ND2 3.48Å; Y611-N615 WeakPolarHBondContact CE2-ND2 3.46Å; Y611-N615 WeakPolarHBondContact O-CB 3.43Å; Y611-N615 PolarHBondContact O-N 3.4Å; Y611-N615 PolarHBondContact OH-ND2 3.22Å
612	K	96.1	Very high	94.1	Very high	42 Å²	42	34 Å²	34	18%	0.183	17%	0.174	C	C	.	.	H	α-helix	trans	-64.2	-50.2	179.3	-72.2	175.5	166.9	-174.6	0	111.1	L608 I614 N615 E616 F644 S648 Q649 A651 L653	L608-K612 HydrophobicContact CB-CD 4.46Å; L608-K612 WeakPolarHBondContact O-CB 3.07Å; L608-K612 VanDerWaalsContact O-CG 3.31Å; L608-K612 WeakPolarHBondContact O-CG 3.27Å; L608-K612 PolarHBondContact O-N 3.34Å; K612-I614 PolarHBondContact O-N 3.25Å; K612-N615 PolarHBondContact O-N 2.87Å; K612-E616 WeakPolarHBondContact O-CB 3.44Å; K612-E616 PolarHBondContact O-N 2.95Å; K612-F644 HydrophobicContact CB-CZ 4.49Å; K612-F644 HydrophobicContact CD-CE1 4.01Å; K612-F644 HydrophobicContact CD-CZ 4.5Å; K612-S648 PolarHBondContact NZ-O 2.87Å; K612-Q649 PolarHBondContact NZ-O 3.21Å; K612-A651 PolarHBondContact NZ-O 3.18Å; K612-L653 VanDerWaalsContact C-CD1 3.44Å; K612-L653 HydrophobicContact CB-CD1 3.8Å; K612-L653 HydrophobicContact CB-CG 4.48Å; K612-L653 WeakPolarHBondContact O-CD1 3.45Å
613	C	97.4	Very high	94.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.9	-48	-179.4	-70.8	0	0	0	0	111.3	I609 N615 E616 I617 L653 I664 L668	I609-C613 WeakPolarHBondContact O-CB 3.47Å; I609-C613 PolarHBondContact O-N 2.89Å; I609-C613 VanDerWaalsContact O-N 3.15Å; I609-C613 PolarHBondContact O-SG 2.79Å; C613-N615 PolarHBondContact O-N 3.3Å; C613-E616 PolarHBondContact O-N 2.67Å; C613-I617 HydrophobicContact CB-CD1 4.34Å; C613-I617 WeakPolarHBondContact O-CB 3.49Å; C613-I617 VanDerWaalsContact O-CD1 3.22Å; C613-I617 WeakPolarHBondContact O-CD1 3.37Å; C613-I617 WeakPolarHBondContact O-CG1 3.45Å; C613-I617 PolarHBondContact O-N 3.31Å; C613-L653 HydrophobicContact CB-CD1 4.4Å; C613-I664 HydrophobicContact CB-CG2 3.82Å; C613-L668 HydrophobicContact CB-CB 4.08Å; C613-L668 HydrophobicContact CB-CD1 4.36Å; C613-L668 HydrophobicContact CB-CD2 4.12Å; C613-L668 HydrophobicContact CB-CG 4.42Å
614	I	97.6	Very high	94.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.8	-47.7	178.3	-76.5	177.5	0	0	0	111.4	I610 K612 E616 I617 E618 L668 K731 L732 H735	I610-I614 HydrophobicContact CG2-CD1 3.61Å; I610-I614 HydrophobicContact CG2-CG1 4.46Å; I610-I614 VanDerWaalsContact O-CB 3.26Å; I610-I614 WeakPolarHBondContact O-CB 3.41Å; I610-I614 WeakPolarHBondContact O-CG1 3.21Å; I610-I614 PolarHBondContact O-N 3.42Å; K612-I614 PolarHBondContact O-N 3.25Å; I614-E616 PolarHBondContact O-N 3.24Å; I614-I617 PolarHBondContact O-N 3.03Å; I614-E618 HydrophobicContact CG2-CG 4.49Å; I614-E618 WeakPolarHBondContact CG2-OE1 3.43Å; I614-E618 WeakPolarHBondContact O-CB 3.41Å; I614-E618 WeakPolarHBondContact O-CG 3.43Å; I614-E618 PolarHBondContact O-N 3.24Å; I614-L668 HydrophobicContact CG1-CD2 3.9Å; I614-K731 HydrophobicContact CD1-CG 4.17Å; I614-K731 HydrophobicContact CG2-CD 4.34Å; I614-K731 VanDerWaalsContact CG2-CE 3.47Å; I614-K731 VanDerWaalsContact CG2-NZ 3.31Å; I614-L732 HydrophobicContact CD1-CD1 4.2Å; I614-H735 HydrophobicContact CD1-CB 3.96Å; I614-H735 HydrophobicContact CG1-CB 4.18Å; I614-H735 HydrophobicContact CG2-CB 3.81Å
615	N	95.9	Very high	95.1	Very high	54 Å²	54	38 Å²	38	29%	0.289	18%	0.179	S	C	.	.	H	α-helix	trans	-64.6	-38.2	-178.3	-72.1	-4.2	0	0	0	112.7	Y611 K612 C613 E618 R619 K731	Y611-N615 VanDerWaalsContact CE1-ND2 3.33Å; Y611-N615 WeakPolarHBondContact CE1-ND2 3.48Å; Y611-N615 WeakPolarHBondContact CE2-ND2 3.46Å; Y611-N615 WeakPolarHBondContact O-CB 3.43Å; Y611-N615 PolarHBondContact O-N 3.4Å; Y611-N615 PolarHBondContact OH-ND2 3.22Å; K612-N615 PolarHBondContact O-N 2.87Å; C613-N615 PolarHBondContact O-N 3.3Å; N615-E618 PolarHBondContact O-N 3.43Å; N615-R619 WeakPolarHBondContact O-CB 3.38Å; N615-R619 PolarHBondContact O-N 3.5Å; N615-K731 PolarHBondContact OD1-NZ 2.84Å
616	E	96.1	Very high	94.9	Very high	16 Å²	16	34.7 Å²	34.7	8%	0.075	17%	0.165	C	C	.	.	H	α-helix	trans	-70.8	-36.9	176.4	177.1	63.7	-178.2	0	0	112.4	K612 C613 I614 E618 R619 R620 L653 I661 I664	K612-E616 WeakPolarHBondContact O-CB 3.44Å; K612-E616 PolarHBondContact O-N 2.95Å; C613-E616 PolarHBondContact O-N 2.67Å; I614-E616 PolarHBondContact O-N 3.24Å; E616-E618 VanDerWaalsContact C-N 3.34Å; E616-R619 VanDerWaalsContact CD-NH2 3.29Å; E616-R619 PolarHBondContact O-N 2.63Å; E616-R619 IonicContact OE1-CZ 3.94Å; E616-R619 IonicContact OE1-NE 3.73Å; E616-R619 IonicContact OE1-NH2 2.76Å; E616-R619 PolarHBondContact OE1-NH2 3.4Å; E616-R619 IonicContact OE2-CZ 3.91Å; E616-R619 VanDerWaalsContact OE2-CZ 3.29Å; E616-R619 IonicContact OE2-NE 2.71Å; E616-R619 PolarHBondContact OE2-NE 3.28Å; E616-R619 IonicContact OE2-NH2 3.88Å; E616-R619 PolarHBondContact OE2-NH2 3Å; E616-R620 PolarHBondContact O-N 2.91Å; E616-R620 IonicContact OE1-CZ 2.74Å; E616-R620 IonicContact OE1-NE 2.61Å; E616-R620 PolarHBondContact OE1-NE 3.14Å; E616-R620 IonicContact OE1-NH2 2.67Å; E616-R620 PolarHBondContact OE1-NH2 3.3Å; E616-L653 HydrophobicContact CB-CB 4.16Å; E616-L653 HydrophobicContact CB-CD1 4.05Å; E616-L653 VanDerWaalsContact CD-O 3.22Å; E616-L653 HydrophobicContact CG-CB 4Å; E616-I661 HydrophobicContact CG-CD1 4.45Å; E616-I664 HydrophobicContact CG-CD1 3.62Å
617	I	96.9	Very high	94.9	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.162	C	C	.	.	I	π-helix	trans	-67.6	-35.5	173.9	-63.8	160	0	0	0	110.7	C613 I614 G621 C622 L627 Y628 I661 I664 T665 L668	C613-I617 HydrophobicContact CB-CD1 4.34Å; C613-I617 WeakPolarHBondContact O-CB 3.49Å; C613-I617 VanDerWaalsContact O-CD1 3.22Å; C613-I617 WeakPolarHBondContact O-CD1 3.37Å; C613-I617 WeakPolarHBondContact O-CG1 3.45Å; C613-I617 PolarHBondContact O-N 3.31Å; I614-I617 PolarHBondContact O-N 3.03Å; I617-G621 CarbonylContact O-C 3.58Å; I617-G621 WeakPolarHBondContact O-CA 3.22Å; I617-G621 PolarHBondContact O-N 3.49Å; I617-C622 PolarHBondContact O-N 2.88Å; I617-L627 HydrophobicContact CG2-CD1 4.31Å; I617-L627 HydrophobicContact CG2-CD2 3.83Å; I617-L627 HydrophobicContact CG2-CG 4.48Å; I617-Y628 HydrophobicContact CD1-CE1 4.45Å; I617-Y628 WeakPolarHBondContact CD1-OH 3.48Å; I617-Y628 HydrophobicContact CG2-CE2 4.45Å; I617-I661 HydrophobicContact CG1-CD1 3.9Å; I617-I661 HydrophobicContact CG1-CG1 4.13Å; I617-I664 HydrophobicContact CD1-CG2 4.04Å; I617-I664 HydrophobicContact CG1-CB 4.45Å; I617-I664 HydrophobicContact CG1-CG2 4.09Å; I617-T665 HydrophobicContact CD1-CG2 3.66Å; I617-T665 HydrophobicContact CG1-CG2 3.96Å; I617-T665 HydrophobicContact CG2-CG2 4.15Å; I617-L668 HydrophobicContact CD1-CD2 3.92Å
618	E	95.8	Very high	94.9	Very high	32 Å²	32	34.1 Å²	34.1	15%	0.15	16%	0.162	C	C	.	.	I	π-helix	trans	-72.5	-31.5	173	-72.7	177.6	-153.8	0	0	113.3	I614 N615 E616 K731 H735 R738	I614-E618 HydrophobicContact CG2-CG 4.49Å; I614-E618 WeakPolarHBondContact CG2-OE1 3.43Å; I614-E618 WeakPolarHBondContact O-CB 3.41Å; I614-E618 WeakPolarHBondContact O-CG 3.43Å; I614-E618 PolarHBondContact O-N 3.24Å; N615-E618 PolarHBondContact O-N 3.43Å; E616-E618 VanDerWaalsContact C-N 3.34Å; E618-K731 IonicContact OE1-NZ 3.67Å; E618-H735 VanDerWaalsContact CG-ND1 3.29Å; E618-H735 WeakPolarHBondContact CG-ND1 3.11Å; E618-H735 IonicContact OE1-CE1 3.73Å; E618-H735 IonicContact OE1-CG 3.98Å; E618-H735 IonicContact OE1-ND1 2.76Å; E618-H735 PolarHBondContact OE1-ND1 3.08Å; E618-R738 IonicContact OE2-CZ 2.76Å; E618-R738 IonicContact OE2-NH1 3.2Å; E618-R738 PolarHBondContact OE2-NH1 3.33Å
619	R	94.8	Very high	94.9	Very high	136 Å²	136	42.2 Å²	42.2	51%	0.513	19%	0.192	S	C	.	.	I	π-helix	trans	-65.3	-38.2	-179.9	-171.2	-175.8	65	77.6	-1.8	113.1	N615 E616 E655	N615-R619 WeakPolarHBondContact O-CB 3.38Å; N615-R619 PolarHBondContact O-N 3.5Å; E616-R619 VanDerWaalsContact CD-NH2 3.29Å; E616-R619 PolarHBondContact O-N 2.63Å; E616-R619 IonicContact OE1-CZ 3.94Å; E616-R619 IonicContact OE1-NE 3.73Å; E616-R619 IonicContact OE1-NH2 2.76Å; E616-R619 PolarHBondContact OE1-NH2 3.4Å; E616-R619 IonicContact OE2-CZ 3.91Å; E616-R619 VanDerWaalsContact OE2-CZ 3.29Å; E616-R619 IonicContact OE2-NE 2.71Å; E616-R619 PolarHBondContact OE2-NE 3.28Å; E616-R619 IonicContact OE2-NH2 3.88Å; E616-R619 PolarHBondContact OE2-NH2 3Å; R619-E655 IonicContact CZ-OE2 2.68Å; R619-E655 VanDerWaalsContact CZ-OE2 3.23Å; R619-E655 IonicContact NH1-OE2 3.94Å; R619-E655 PolarHBondContact NH1-OE2 3.48Å; R619-E655 IonicContact NH2-OE2 2.89Å; R619-E655 PolarHBondContact NH2-OE2 2.91Å
620	R	94.2	Very high	94.5	Very high	52 Å²	52	46.3 Å²	46.3	20%	0.196	21%	0.213	C	C	.	.	I	π-helix	trans	-143.1	-15.5	-174.9	59.5	163.9	169.7	126.4	0.1	116.5	E616 E655 F658 P659 I661	E616-R620 PolarHBondContact O-N 2.91Å; E616-R620 IonicContact OE1-CZ 2.74Å; E616-R620 IonicContact OE1-NE 2.61Å; E616-R620 PolarHBondContact OE1-NE 3.14Å; E616-R620 IonicContact OE1-NH2 2.67Å; E616-R620 PolarHBondContact OE1-NH2 3.3Å; R620-E655 IonicContact NE-OE2 3.16Å; R620-F658 PolarHBondContact NH1-O 2.99Å; R620-F658 VanDerWaalsContact NH1-O 3.13Å; R620-F658 PolarHBondContact NH2-O 3.26Å; R620-P659 PolarHBondContact NH1-O 3.4Å; R620-I661 HydrophobicContact CG-CD1 4.4Å
621	G	91.6	Very high	94	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.245	C	C	.	.	I	π-helix	trans	-82.9	-27	-174	0	0	0	0	0	115	I617 Q623 V624	I617-G621 CarbonylContact O-C 3.58Å; I617-G621 WeakPolarHBondContact O-CA 3.22Å; I617-G621 PolarHBondContact O-N 3.49Å; G621-Q623 PolarHBondContact O-N 2.82Å; G621-V624 WeakPolarHBondContact O-CB 3.48Å; G621-V624 PolarHBondContact O-N 3.37Å
622	C	93.9	Very high	93.2	Very high	7 Å²	7	46.9 Å²	46.9	5%	0.047	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-27.7	-170.3	-79.4	0	0	0	0	116.3	I617 Y742 N746	I617-C622 PolarHBondContact O-N 2.88Å; C622-Y742 HydrophobicContact CB-CD2 3.56Å; C622-Y742 HydrophobicContact CB-CE2 3.76Å; C622-Y742 HydrophobicContact CB-CG 4.13Å; C622-Y742 VanDerWaalsContact O-CB 3.31Å; C622-Y742 WeakPolarHBondContact O-CB 3.5Å; C622-N746 WeakPolarHBondContact O-CB 3.16Å; C622-N746 PolarHBondContact O-ND2 3.37Å
623	Q	93.1	Very high	92.5	Very high	116 Å²	116	47.9 Å²	47.9	54%	0.542	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-1.9	-179.8	-63	-178.2	2.5	0	0	114	G621 V625 Y742 M745	G621-Q623 PolarHBondContact O-N 2.82Å; Q623-V625 PolarHBondContact O-N 2.76Å; Q623-Y742 HydrophobicContact CG-CD1 4.3Å; Q623-M745 HydrophobicContact CB-CB 4.22Å; Q623-M745 HydrophobicContact CG-CB 4.36Å
624	V	91.3	Very high	91.5	Very high	52 Å²	52	51.1 Å²	51.1	32%	0.315	27%	0.271	S	S	.	.	S	Bend	trans	-75.6	122.6	-175.4	178.1	0	0	0	0	110.9	G621 G626 L627 I661 N746	G621-V624 WeakPolarHBondContact O-CB 3.48Å; G621-V624 PolarHBondContact O-N 3.37Å; V624-G626 PolarHBondContact O-N 2.97Å; V624-L627 HydrophobicContact CB-CD1 4.42Å; V624-L627 PolarHBondContact O-N 3.18Å; V624-I661 HydrophobicContact CB-CG2 4.22Å; V624-I661 HydrophobicContact CG1-CG2 4.06Å; V624-I661 HydrophobicContact CG2-CG2 4.08Å; V624-N746 VanDerWaalsContact O-CB 3.28Å; V624-N746 WeakPolarHBondContact O-CB 3.38Å
625	V	93	Very high	90.6	Very high	93 Å²	93	53.8 Å²	53.8	56%	0.564	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	126.9	-178.6	-175.9	0	0	0	0	111.2	Q623 L630 N746 K747	Q623-V625 PolarHBondContact O-N 2.76Å; V625-L630 WeakPolarHBondContact O-CD1 3.48Å; V625-N746 WeakPolarHBondContact CA-O 3.39Å; V625-K747 HydrophobicContact CG1-CG 4.23Å
626	G	90.7	Very high	89.9	Confident	9 Å²	9	53.1 Å²	53.1	9%	0.093	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	20.9	177.6	0	0	0	0	0	114.9	V624 Y628 R629 L630 N746	V624-G626 PolarHBondContact O-N 2.97Å; G626-Y628 PolarHBondContact O-N 3.31Å; G626-R629 WeakPolarHBondContact O-CA 3.29Å; G626-R629 WeakPolarHBondContact O-CB 3.33Å; G626-R629 PolarHBondContact O-N 3.31Å; G626-L630 PolarHBondContact O-N 2.98Å; G626-N746 PolarHBondContact N-O 3.33Å
627	L	94.3	Very high	89.4	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.9	137.1	172.8	-164.8	73.4	0	0	0	111.2	I617 V624 R629 I661 T665 V739 M748	I617-L627 HydrophobicContact CG2-CD1 4.31Å; I617-L627 HydrophobicContact CG2-CD2 3.83Å; I617-L627 HydrophobicContact CG2-CG 4.48Å; V624-L627 HydrophobicContact CB-CD1 4.42Å; V624-L627 PolarHBondContact O-N 3.18Å; L627-R629 PolarHBondContact O-N 3.47Å; L627-I661 HydrophobicContact CD1-CG1 4.25Å; L627-I661 HydrophobicContact CD1-CG2 3.76Å; L627-T665 HydrophobicContact CD1-CG2 3.63Å; L627-T665 HydrophobicContact CG-CG2 4.01Å; L627-V739 HydrophobicContact CD2-CG1 3.86Å; L627-V739 HydrophobicContact CD2-CG2 3.88Å; L627-M748 WeakPolarHBondContact O-CE 3.35Å; L627-M748 WeakPolarHBondContact O-CG 3.47Å
628	Y	96.8	Very high	88.6	Confident	1 Å²	1	57.7 Å²	57.7	0%	0.004	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	-22	-171.1	-63	-72.8	0	0	0	117.6	I617 G626 T665 L668 K669 H735 L736 V739 L753 F757	I617-Y628 HydrophobicContact CD1-CE1 4.45Å; I617-Y628 WeakPolarHBondContact CD1-OH 3.48Å; I617-Y628 HydrophobicContact CG2-CE2 4.45Å; G626-Y628 PolarHBondContact O-N 3.31Å; Y628-T665 VanDerWaalsContact CD1-CB 3.47Å; Y628-T665 HydrophobicContact CD1-CG2 3.84Å; Y628-T665 HydrophobicContact CD2-CG2 4.44Å; Y628-T665 VanDerWaalsContact CE1-CB 3.48Å; Y628-T665 HydrophobicContact CE1-CG2 3.62Å; Y628-T665 HydrophobicContact CE2-CG2 4.28Å; Y628-T665 HydrophobicContact CG-CG2 4.23Å; Y628-L668 HydrophobicContact CE1-CD2 4.14Å; Y628-L668 WeakPolarHBondContact OH-CD2 3.22Å; Y628-K669 HydrophobicContact CD1-CD 4.15Å; Y628-K669 HydrophobicContact CD1-CG 4.19Å; Y628-K669 PolarHBondContact O-NZ 3.34Å; Y628-H735 AromaticContact CE2-NE2 3.43Å; Y628-H735 WeakPolarHBondContact CE2-NE2 3.47Å; Y628-H735 AromaticContact CZ-CD2 3.97Å; Y628-H735 AromaticContact CZ-NE2 3.5Å; Y628-H735 PolarHBondContact OH-CD2 3.24Å; Y628-H735 PolarHBondContact OH-NE2 3.21Å; Y628-L736 HydrophobicContact CD2-CD2 4.37Å; Y628-L736 HydrophobicContact CE2-CD2 4.12Å; Y628-V739 HydrophobicContact CE2-CG2 4.34Å; Y628-L753 HydrophobicContact CD2-CD2 4.07Å; Y628-F757 AromaticContact CD1-CE2 3.49Å; Y628-F757 HydrophobicContact CD1-CE2 3.49Å; Y628-F757 VanDerWaalsContact CD1-CE2 3.49Å; Y628-F757 AromaticContact CD1-CZ 3.44Å; Y628-F757 HydrophobicContact CD1-CZ 3.44Å; Y628-F757 VanDerWaalsContact CD1-CZ 3.44Å; Y628-F757 AromaticContact CD2-CE2 3.96Å; Y628-F757 HydrophobicContact CD2-CE2 3.96Å; Y628-F757 HydrophobicContact CD2-CZ 4.46Å; Y628-F757 AromaticContact CE1-CE2 3.92Å; Y628-F757 HydrophobicContact CE1-CE2 3.92Å; Y628-F757 AromaticContact CE1-CZ 3.48Å; Y628-F757 HydrophobicContact CE1-CZ 3.48Å; Y628-F757 VanDerWaalsContact CE1-CZ 3.48Å; Y628-F757 HydrophobicContact CE2-CE2 4.32Å; Y628-F757 HydrophobicContact CE2-CZ 4.47Å; Y628-F757 AromaticContact CG-CE2 3.52Å; Y628-F757 HydrophobicContact CG-CE2 3.52Å; Y628-F757 AromaticContact CG-CZ 3.98Å; Y628-F757 HydrophobicContact CG-CZ 3.98Å
629	R	93.9	Very high	88.2	Confident	180 Å²	180	60.7 Å²	60.7	68%	0.679	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-40.1	171.6	-179.8	178.7	173.9	-176.5	-1.2	111.7	G626 L627 M748	G626-R629 WeakPolarHBondContact O-CA 3.29Å; G626-R629 WeakPolarHBondContact O-CB 3.33Å; G626-R629 PolarHBondContact O-N 3.31Å; L627-R629 PolarHBondContact O-N 3.47Å; R629-M748 HydrophobicContact CB-CE 3.96Å; R629-M748 HydrophobicContact CB-SD 3.93Å
630	L	88.2	Confident	87.9	Confident	87 Å²	87	54.3 Å²	54.3	46%	0.455	30%	0.3	S	S	.	.	S	Bend	trans	-75.7	164.5	175	-61.5	179.2	0	0	0	111.5	V625 G626	V625-L630 WeakPolarHBondContact O-CD1 3.48Å; G626-L630 PolarHBondContact O-N 2.98Å
631	C	85.8	Confident	87.8	Confident	97 Å²	97	54.4 Å²	54.4	66%	0.655	30%	0.301	S	S	*	.			trans	-129.3	125.7	179.5	-70.7	0	0	0	0	109.9
632	G	79.9	Confident	87.6	Confident	10 Å²	10	58 Å²	58	10%	0.103	32%	0.317	C	S	.	.			trans	-79.5	175	174.2	0	0	0	0	0	113.5	A634 D660 N662	G632-A634 PolarHBondContact O-N 3.46Å; G632-D660 WeakPolarHBondContact CA-OD2 3.48Å; G632-N662 VanDerWaalsContact N-CB 3.32Å; G632-N662 PolarHBondContact N-O 2.86Å
633	S	80.5	Confident	87.4	Confident	63 Å²	63	58.7 Å²	58.7	44%	0.441	32%	0.324	S	S	.	.			trans	-53.1	118.7	-175.8	-179.9	0	0	0	0	112.6	A635 V636 K637	S633-A635 PolarHBondContact O-N 2.92Å; S633-V636 PolarHBondContact O-N 2.95Å; S633-V636 VanDerWaalsContact O-N 3.13Å; S633-K637 WeakPolarHBondContact O-CG 3.45Å; S633-K637 PolarHBondContact O-N 3.37Å
634	A	78.1	Confident	87.4	Confident	69 Å²	69	53.2 Å²	53.2	57%	0.57	30%	0.298	S	S	*	.	H	α-helix	trans	-60.9	-31.9	-176	0	0	0	0	0	113.3	G632 K638	G632-A634 PolarHBondContact O-N 3.46Å; A634-K638 PolarHBondContact O-N 3.46Å; A634-K638 VanDerWaalsContact O-N 3.09Å
635	A	78.9	Confident	87.4	Confident	55 Å²	55	52.9 Å²	52.9	46%	0.455	29%	0.293	S	S	.	.	H	α-helix	trans	-66.5	-46.5	175.2	0	0	0	0	0	111.6	S633 K637 K638 E639	S633-A635 PolarHBondContact O-N 2.92Å; A635-K637 VanDerWaalsContact C-N 3.32Å; A635-K637 PolarHBondContact O-N 3.27Å; A635-K638 WeakPolarHBondContact O-CB 3.33Å; A635-K638 PolarHBondContact O-N 3.34Å; A635-K638 VanDerWaalsContact O-N 3.11Å; A635-E639 PolarHBondContact O-N 2.85Å
636	V	80.4	Confident	87.2	Confident	40 Å²	40	56 Å²	56	24%	0.242	30%	0.295	C	S	.	.	H	α-helix	trans	-69.6	-31.6	179.3	-169.1	0	0	0	0	111	S633 E639 L640 F658 V663	S633-V636 PolarHBondContact O-N 2.95Å; S633-V636 VanDerWaalsContact O-N 3.13Å; V636-E639 PolarHBondContact O-N 3.3Å; V636-L640 WeakPolarHBondContact O-CB 3.45Å; V636-L640 PolarHBondContact O-N 2.84Å; V636-F658 HydrophobicContact CG1-CD1 3.65Å; V636-F658 HydrophobicContact CG1-CE1 3.75Å; V636-V663 HydrophobicContact CB-CG1 4.24Å; V636-V663 HydrophobicContact CB-CG2 4.09Å; V636-V663 HydrophobicContact CG1-CG1 3.94Å; V636-V663 HydrophobicContact CG1-CG2 4.17Å
637	K	85.4	Confident	87	Confident	36 Å²	36	59.4 Å²	59.4	16%	0.157	31%	0.311	C	S	.	.	H	α-helix	trans	-62.8	-39.2	169	-68.8	-157	-54.8	150.4	0	112.7	S633 A635 R641 V663 V667 D670	S633-K637 WeakPolarHBondContact O-CG 3.45Å; S633-K637 PolarHBondContact O-N 3.37Å; A635-K637 VanDerWaalsContact C-N 3.32Å; A635-K637 PolarHBondContact O-N 3.27Å; K637-R641 WeakPolarHBondContact O-CB 3.49Å; K637-R641 PolarHBondContact O-N 2.97Å; K637-V663 HydrophobicContact CG-CB 4.3Å; K637-V663 HydrophobicContact CG-CG1 3.9Å; K637-V667 HydrophobicContact CB-CG2 3.9Å; K637-V667 HydrophobicContact CD-CG2 4.44Å; K637-V667 HydrophobicContact CG-CG2 4.13Å; K637-V667 WeakPolarHBondContact O-CG2 3.35Å; K637-D670 IonicContact NZ-OD1 2.67Å; K637-D670 IonicContact NZ-OD2 2.66Å; K637-D670 PolarHBondContact NZ-OD2 2.84Å
638	K	80.9	Confident	86.7	Confident	76 Å²	76	60.1 Å²	60.1	33%	0.33	32%	0.316	S	S	.	.	H	α-helix	trans	-65.9	-45.5	176.3	-175.7	175.9	-174.9	-77.9	0	110.7	Q571 A634 A635 L640 R641 E642	Q571-K638 PolarHBondContact O-NZ 3.49Å; A634-K638 PolarHBondContact O-N 3.46Å; A634-K638 VanDerWaalsContact O-N 3.09Å; A635-K638 WeakPolarHBondContact O-CB 3.33Å; A635-K638 PolarHBondContact O-N 3.34Å; A635-K638 VanDerWaalsContact O-N 3.11Å; K638-L640 PolarHBondContact O-N 3.04Å; K638-R641 WeakPolarHBondContact O-CB 3.47Å; K638-R641 PolarHBondContact O-N 3.37Å; K638-E642 WeakPolarHBondContact CE-OE1 3.32Å; K638-E642 WeakPolarHBondContact CG-OE1 3.46Å; K638-E642 IonicContact NZ-OE1 3.53Å; K638-E642 PolarHBondContact NZ-OE1 3.42Å; K638-E642 WeakPolarHBondContact O-CB 3.43Å; K638-E642 WeakPolarHBondContact O-CG 3.44Å; K638-E642 PolarHBondContact O-N 3.23Å
639	E	85.7	Confident	86.3	Confident	96 Å²	96	65 Å²	65	45%	0.449	34%	0.338	S	S	.	.	H	α-helix	trans	-57	-46.9	174.2	-176	-178.4	173.8	0	0	112.3	A635 V636 E642 A643 M657	A635-E639 PolarHBondContact O-N 2.85Å; V636-E639 PolarHBondContact O-N 3.3Å; E639-E642 CarbonylContact O-C 3.56Å; E639-E642 PolarHBondContact O-N 2.91Å; E639-A643 PolarHBondContact O-N 2.97Å; E639-M657 WeakPolarHBondContact OE1-CE 3.08Å
640	L	89.1	Confident	85.9	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-67.4	-38.1	178.4	178.3	56.1	0	0	0	112.8	V636 K638 E642 A643 F644 L653 F658 V663 I664 V667	V636-L640 WeakPolarHBondContact O-CB 3.45Å; V636-L640 PolarHBondContact O-N 2.84Å; K638-L640 PolarHBondContact O-N 3.04Å; L640-E642 VanDerWaalsContact C-N 3.34Å; L640-A643 WeakPolarHBondContact O-CB 2.93Å; L640-A643 PolarHBondContact O-N 2.96Å; L640-F644 HydrophobicContact CD1-CD2 3.98Å; L640-F644 HydrophobicContact CD1-CE2 3.68Å; L640-F644 HydrophobicContact CG-CD2 4.19Å; L640-F644 HydrophobicContact CG-CE2 3.99Å; L640-F644 WeakPolarHBondContact O-CD2 3.34Å; L640-F644 PolarHBondContact O-N 3.25Å; L640-F644 VanDerWaalsContact O-N 3.17Å; L640-L653 HydrophobicContact CD1-CD2 3.46Å; L640-L653 VanDerWaalsContact CD1-CD2 3.46Å; L640-L653 HydrophobicContact CD2-CD2 3.76Å; L640-L653 HydrophobicContact CG-CD2 4.23Å; L640-F658 HydrophobicContact CB-CD1 4.49Å; L640-F658 HydrophobicContact CB-CE1 3.79Å; L640-F658 HydrophobicContact CB-CZ 3.94Å; L640-F658 HydrophobicContact CD1-CD2 4.47Å; L640-F658 HydrophobicContact CD1-CE1 4.35Å; L640-F658 HydrophobicContact CD1-CE2 3.81Å; L640-F658 HydrophobicContact CD1-CZ 3.73Å; L640-F658 HydrophobicContact CD2-CD1 4.44Å; L640-F658 HydrophobicContact CD2-CE1 4.45Å; L640-F658 HydrophobicContact CG-CE1 4.41Å; L640-F658 HydrophobicContact CG-CZ 4.27Å; L640-V663 HydrophobicContact CD2-CG1 4.2Å; L640-I664 HydrophobicContact CD2-CG1 4.13Å; L640-V667 HydrophobicContact CB-CG2 4.18Å; L640-V667 HydrophobicContact CD2-CB 4.29Å; L640-V667 HydrophobicContact CD2-CG2 4Å; L640-V667 HydrophobicContact CG-CG1 4.41Å; L640-V667 HydrophobicContact CG-CG2 4.16Å
641	R	91.6	Very high	86	Confident	55 Å²	55	54.6 Å²	54.6	21%	0.208	31%	0.308	C	S	.	.	H	α-helix	trans	-57.1	-48.6	169.1	162.3	-179.1	-68.4	-114.6	8.1	111.1	F589 K637 K638 A643 F644 E645 E674	F589-R641 HydrophobicContact CD2-CG 4.14Å; F589-R641 HydrophobicContact CE1-CG 4.45Å; F589-R641 HydrophobicContact CE2-CB 4.2Å; F589-R641 HydrophobicContact CE2-CG 3.77Å; F589-R641 HydrophobicContact CZ-CB 3.99Å; F589-R641 HydrophobicContact CZ-CG 3.93Å; K637-R641 WeakPolarHBondContact O-CB 3.49Å; K637-R641 PolarHBondContact O-N 2.97Å; K638-R641 WeakPolarHBondContact O-CB 3.47Å; K638-R641 PolarHBondContact O-N 3.37Å; R641-A643 PolarHBondContact O-N 3.29Å; R641-F644 PolarHBondContact O-N 2.72Å; R641-F644 VanDerWaalsContact O-N 3.13Å; R641-E645 PolarHBondContact O-N 3.16Å; R641-E674 IonicContact CZ-OE1 3.36Å; R641-E674 IonicContact CZ-OE2 3.86Å; R641-E674 IonicContact NH1-OE2 2.79Å; R641-E674 PolarHBondContact NH1-OE2 3.03Å; R641-E674 IonicContact NH2-OE1 2.74Å; R641-E674 PolarHBondContact NH2-OE1 3.04Å; R641-E674 IonicContact NH2-OE2 2.84Å; R641-E674 PolarHBondContact NH2-OE2 3.25Å
642	E	87.8	Confident	86	Confident	75 Å²	75	57 Å²	57	35%	0.35	31%	0.31	S	S	.	.	H	α-helix	trans	-66.1	-24.5	-179.9	-73.9	174.2	-160.2	0	0	112.6	K638 E639 L640 R646	K638-E642 WeakPolarHBondContact CE-OE1 3.32Å; K638-E642 WeakPolarHBondContact CG-OE1 3.46Å; K638-E642 IonicContact NZ-OE1 3.53Å; K638-E642 PolarHBondContact NZ-OE1 3.42Å; K638-E642 WeakPolarHBondContact O-CB 3.43Å; K638-E642 WeakPolarHBondContact O-CG 3.44Å; K638-E642 PolarHBondContact O-N 3.23Å; E639-E642 CarbonylContact O-C 3.56Å; E639-E642 PolarHBondContact O-N 2.91Å; L640-E642 VanDerWaalsContact C-N 3.34Å; E642-R646 WeakPolarHBondContact O-CB 3.37Å; E642-R646 VanDerWaalsContact O-CZ 3.3Å; E642-R646 PolarHBondContact O-N 3.25Å; E642-R646 PolarHBondContact O-NH1 3.3Å; E642-R646 VanDerWaalsContact O-NH1 3.14Å; E642-R646 PolarHBondContact O-NH2 3.46Å
643	A	89.9	Confident	86.4	Confident	22 Å²	22	57.4 Å²	57.4	18%	0.182	31%	0.31	C	S	.	.	H	α-helix	trans	-66.3	-51	167.4	0	0	0	0	0	111.4	E639 L640 R641 E645 R646 D647 A651	E639-A643 PolarHBondContact O-N 2.97Å; L640-A643 WeakPolarHBondContact O-CB 2.93Å; L640-A643 PolarHBondContact O-N 2.96Å; R641-A643 PolarHBondContact O-N 3.29Å; A643-E645 PolarHBondContact O-N 2.99Å; A643-R646 PolarHBondContact O-N 2.65Å; A643-D647 CarbonylContact O-C 3.51Å; A643-D647 PolarHBondContact O-N 3.19Å; A643-A651 HydrophobicContact CB-CB 4.25Å
644	F	93.6	Very high	86.5	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.9	-38.6	179.2	-80.5	-67.8	0	0	0	114.1	V588 F589 I609 K612 L640 R641 R646 S648 A651 L653 V667	V588-F644 WeakPolarHBondContact CG2-O 3.04Å; F589-F644 HydrophobicContact CE2-CB 4.02Å; I609-F644 HydrophobicContact CB-CD1 4.01Å; I609-F644 HydrophobicContact CB-CE1 3.99Å; I609-F644 HydrophobicContact CB-CG 4.42Å; I609-F644 HydrophobicContact CB-CZ 4.36Å; I609-F644 HydrophobicContact CD1-CB 4.27Å; I609-F644 HydrophobicContact CD1-CD1 4.39Å; I609-F644 HydrophobicContact CD1-CD2 3.86Å; I609-F644 HydrophobicContact CD1-CE2 4.25Å; I609-F644 HydrophobicContact CD1-CG 3.94Å; I609-F644 HydrophobicContact CG1-CD1 4.2Å; I609-F644 HydrophobicContact CG1-CD2 4.09Å; I609-F644 HydrophobicContact CG1-CE1 4.14Å; I609-F644 HydrophobicContact CG1-CE2 4.01Å; I609-F644 HydrophobicContact CG1-CG 4.19Å; I609-F644 HydrophobicContact CG1-CZ 4.04Å; K612-F644 HydrophobicContact CB-CZ 4.49Å; K612-F644 HydrophobicContact CD-CE1 4.01Å; K612-F644 HydrophobicContact CD-CZ 4.5Å; L640-F644 HydrophobicContact CD1-CD2 3.98Å; L640-F644 HydrophobicContact CD1-CE2 3.68Å; L640-F644 HydrophobicContact CG-CD2 4.19Å; L640-F644 HydrophobicContact CG-CE2 3.99Å; L640-F644 WeakPolarHBondContact O-CD2 3.34Å; L640-F644 PolarHBondContact O-N 3.25Å; L640-F644 VanDerWaalsContact O-N 3.17Å; R641-F644 PolarHBondContact O-N 2.72Å; R641-F644 VanDerWaalsContact O-N 3.13Å; F644-R646 VanDerWaalsContact C-N 3.31Å; F644-S648 PolarHBondContact O-N 3.17Å; F644-S648 PolarHBondContact O-OG 2.91Å; F644-A651 HydrophobicContact CD1-CB 3.7Å; F644-A651 HydrophobicContact CE1-CB 3.86Å; F644-A651 HydrophobicContact CG-CB 4.1Å; F644-A651 HydrophobicContact CZ-CB 4.4Å; F644-L653 HydrophobicContact CE2-CD2 4.18Å; F644-L653 HydrophobicContact CZ-CD1 4.39Å; F644-L653 HydrophobicContact CZ-CD2 4.18Å; F644-L653 HydrophobicContact CZ-CG 4.41Å; F644-V667 HydrophobicContact CD2-CG1 4.37Å; F644-V667 HydrophobicContact CE2-CG1 4.47Å
645	E	90.3	Very high	86.8	Confident	46 Å²	46	57.8 Å²	57.8	22%	0.215	30%	0.297	C	S	.	.	H	α-helix	trans	-71.7	-21.5	175	-76.8	-69.5	177.8	0	0	113.8	Q587 V588 F589 R641 A643	Q587-E645 WeakPolarHBondContact CA-OE2 3.43Å; Q587-E645 PolarHBondContact N-OE2 3.48Å; V588-E645 PolarHBondContact N-OE1 2.87Å; V588-E645 PolarHBondContact N-OE2 2.94Å; V588-E645 VanDerWaalsContact N-OE2 3.11Å; F589-E645 WeakPolarHBondContact CB-OE1 3.49Å; F589-E645 HydrophobicContact CD2-CG 3.85Å; F589-E645 VanDerWaalsContact CD2-OE1 3.31Å; F589-E645 WeakPolarHBondContact CD2-OE1 3.36Å; F589-E645 HydrophobicContact CE2-CG 4.32Å; F589-E645 PolarHBondContact N-OE1 3.22Å; R641-E645 PolarHBondContact O-N 3.16Å; A643-E645 PolarHBondContact O-N 2.99Å
646	R	88.3	Confident	86.6	Confident	158 Å²	158	60.5 Å²	60.5	60%	0.596	31%	0.312	S	S	*	.	H	α-helix	trans	-88.1	-42.1	179.1	-174.7	-173.9	-54.5	102.5	5	111.9	E642 A643 F644	E642-R646 WeakPolarHBondContact O-CB 3.37Å; E642-R646 VanDerWaalsContact O-CZ 3.3Å; E642-R646 PolarHBondContact O-N 3.25Å; E642-R646 PolarHBondContact O-NH1 3.3Å; E642-R646 VanDerWaalsContact O-NH1 3.14Å; E642-R646 PolarHBondContact O-NH2 3.46Å; A643-R646 PolarHBondContact O-N 2.65Å; F644-R646 VanDerWaalsContact C-N 3.31Å
647	D	86.8	Confident	86.5	Confident	81 Å²	81	63 Å²	63	43%	0.433	32%	0.323	S	S	.	.			trans	-160.6	103.9	175.5	-179.8	-0.6	0	0	0	110.1	A643 Q649 G650 A651	A643-D647 CarbonylContact O-C 3.51Å; A643-D647 PolarHBondContact O-N 3.19Å; D647-Q649 VanDerWaalsContact C-N 3.26Å; D647-Q649 PolarHBondContact O-N 3.26Å; D647-Q649 WeakPolarHBondContact OD1-CA 3.36Å; D647-Q649 WeakPolarHBondContact OD1-CB 3.29Å; D647-Q649 PolarHBondContact OD1-N 3.47Å; D647-G650 PolarHBondContact O-N 2.94Å; D647-G650 PolarHBondContact OD1-N 3.49Å; D647-G650 VanDerWaalsContact OD2-CA 3.3Å; D647-G650 WeakPolarHBondContact OD2-CA 3.47Å; D647-G650 PolarHBondContact OD2-N 2.67Å; D647-G650 VanDerWaalsContact OD2-N 3.16Å; D647-A651 VanDerWaalsContact O-CB 3.3Å; D647-A651 WeakPolarHBondContact O-CB 3.41Å; D647-A651 PolarHBondContact O-N 2.95Å
648	S	89.4	Confident	86.7	Confident	15 Å²	15	61.4 Å²	61.4	11%	0.105	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-23.4	-179.9	-32.8	0	0	0	0	112.7	V588 K612 F644	V588-S648 WeakPolarHBondContact CG2-OG 3.39Å; K612-S648 PolarHBondContact NZ-O 2.87Å; F644-S648 PolarHBondContact O-N 3.17Å; F644-S648 PolarHBondContact O-OG 2.91Å
649	Q	88.3	Confident	86.7	Confident	102 Å²	102	62.3 Å²	62.3	48%	0.477	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-48.3	175.2	-63.7	-75.2	4.9	0	0	110.8	E600 L608 K612 D647	E600-Q649 PolarHBondContact O-NE2 2.99Å; L608-Q649 VanDerWaalsContact CD1-CD 3.41Å; L608-Q649 HydrophobicContact CD1-CG 4.17Å; L608-Q649 VanDerWaalsContact CD1-OE1 3.27Å; K612-Q649 PolarHBondContact NZ-O 3.21Å; D647-Q649 VanDerWaalsContact C-N 3.26Å; D647-Q649 PolarHBondContact O-N 3.26Å; D647-Q649 WeakPolarHBondContact OD1-CA 3.36Å; D647-Q649 WeakPolarHBondContact OD1-CB 3.29Å; D647-Q649 PolarHBondContact OD1-N 3.47Å
650	G	85.6	Confident	86.7	Confident	45 Å²	45	60.5 Å²	60.5	46%	0.464	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-13.4	179	0	0	0	0	0	115.9	D647 E652	D647-G650 PolarHBondContact O-N 2.94Å; D647-G650 PolarHBondContact OD1-N 3.49Å; D647-G650 VanDerWaalsContact OD2-CA 3.3Å; D647-G650 WeakPolarHBondContact OD2-CA 3.47Å; D647-G650 PolarHBondContact OD2-N 2.67Å; D647-G650 VanDerWaalsContact OD2-N 3.16Å; G650-E652 PolarHBondContact O-N 3.17Å
651	A	89.7	Confident	87	Confident	5 Å²	5	60.8 Å²	60.8	4%	0.041	32%	0.324	C	S	.	.			trans	-64	100.6	174.2	0	0	0	0	0	111.8	K612 A643 F644 D647	K612-A651 PolarHBondContact NZ-O 3.18Å; A643-A651 HydrophobicContact CB-CB 4.25Å; F644-A651 HydrophobicContact CD1-CB 3.7Å; F644-A651 HydrophobicContact CE1-CB 3.86Å; F644-A651 HydrophobicContact CG-CB 4.1Å; F644-A651 HydrophobicContact CZ-CB 4.4Å; D647-A651 VanDerWaalsContact O-CB 3.3Å; D647-A651 WeakPolarHBondContact O-CB 3.41Å; D647-A651 PolarHBondContact O-N 2.95Å
652	E	85	Confident	87.1	Confident	146 Å²	146	58.9 Å²	58.9	68%	0.682	32%	0.318	S	S	*	.			trans	-87	139.8	175.1	-68.5	-168.5	175.6	0	0	112.3	G650	G650-E652 PolarHBondContact O-N 3.17Å
653	L	89.6	Confident	87.4	Confident	20 Å²	20	55.5 Å²	55.5	11%	0.105	30%	0.303	C	S	.	.			trans	-108.1	64.3	175.2	-63.5	-177.4	0	0	0	110.7	K612 C613 E616 L640 F644 F658 I664	K612-L653 VanDerWaalsContact C-CD1 3.44Å; K612-L653 HydrophobicContact CB-CD1 3.8Å; K612-L653 HydrophobicContact CB-CG 4.48Å; K612-L653 WeakPolarHBondContact O-CD1 3.45Å; C613-L653 HydrophobicContact CB-CD1 4.4Å; E616-L653 HydrophobicContact CB-CB 4.16Å; E616-L653 HydrophobicContact CB-CD1 4.05Å; E616-L653 VanDerWaalsContact CD-O 3.22Å; E616-L653 HydrophobicContact CG-CB 4Å; L640-L653 HydrophobicContact CD1-CD2 3.46Å; L640-L653 VanDerWaalsContact CD1-CD2 3.46Å; L640-L653 HydrophobicContact CD2-CD2 3.76Å; L640-L653 HydrophobicContact CG-CD2 4.23Å; F644-L653 HydrophobicContact CE2-CD2 4.18Å; F644-L653 HydrophobicContact CZ-CD1 4.39Å; F644-L653 HydrophobicContact CZ-CD2 4.18Å; F644-L653 HydrophobicContact CZ-CG 4.41Å; L653-F658 HydrophobicContact CD2-CD2 4.43Å; L653-I664 HydrophobicContact CB-CD1 4.33Å; L653-I664 HydrophobicContact CD1-CG2 4.05Å; L653-I664 HydrophobicContact CD2-CD1 4.24Å
654	C	81	Confident	87.7	Confident	41 Å²	41	54.5 Å²	54.5	28%	0.277	29%	0.294	S	S	.	.			trans	-87.3	144.2	-178.7	67.3	0	0	0	0	112.7	S656 M657 F658	C654-S656 PolarHBondContact O-N 3.34Å; C654-S656 PolarHBondContact SG-OG 2.72Å; C654-M657 PolarHBondContact O-N 3.45Å; C654-M657 VanDerWaalsContact O-N 3.09Å; C654-M657 WeakPolarHBondContact SG-CB 3.15Å; C654-F658 PolarHBondContact O-N 2.82Å
655	E	84.3	Confident	87.8	Confident	99 Å²	99	54.5 Å²	54.5	46%	0.463	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-26.6	-175.6	-163.1	164	157.1	0	0	113.4	R619 R620 P659	R619-E655 IonicContact CZ-OE2 2.68Å; R619-E655 VanDerWaalsContact CZ-OE2 3.23Å; R619-E655 IonicContact NH1-OE2 3.94Å; R619-E655 PolarHBondContact NH1-OE2 3.48Å; R619-E655 IonicContact NH2-OE2 2.89Å; R619-E655 PolarHBondContact NH2-OE2 2.91Å; R620-E655 IonicContact NE-OE2 3.16Å; E655-P659 VanDerWaalsContact O-CA 3.32Å; E655-P659 WeakPolarHBondContact O-CA 3.17Å
656	S	75.8	Confident	88.1	Confident	111 Å²	111	52.4 Å²	52.4	78%	0.776	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-27.3	175.2	45.6	0	0	0	0	114.2	C654	C654-S656 PolarHBondContact O-N 3.34Å; C654-S656 PolarHBondContact SG-OG 2.72Å
657	M	79.1	Confident	88.4	Confident	93 Å²	93	44.9 Å²	44.9	46%	0.458	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-36.4	178	-170.8	173.7	-177.6	0	0	111.6	E639 C654 P659	E639-M657 WeakPolarHBondContact OE1-CE 3.08Å; C654-M657 PolarHBondContact O-N 3.45Å; C654-M657 VanDerWaalsContact O-N 3.09Å; C654-M657 WeakPolarHBondContact SG-CB 3.15Å; M657-P659 VanDerWaalsContact O-CD 3.32Å; M657-P659 WeakPolarHBondContact O-CD 3.37Å
658	F	88	Confident	88.9	Confident	3 Å²	3	41 Å²	41	1%	0.013	24%	0.236	C	C	.	.			trans	-122.5	64.7	-178.3	-56.7	-66.7	0	0	0	112	R620 V636 L640 L653 C654 D660 V663 I664	R620-F658 PolarHBondContact NH1-O 2.99Å; R620-F658 VanDerWaalsContact NH1-O 3.13Å; R620-F658 PolarHBondContact NH2-O 3.26Å; V636-F658 HydrophobicContact CG1-CD1 3.65Å; V636-F658 HydrophobicContact CG1-CE1 3.75Å; L640-F658 HydrophobicContact CB-CD1 4.49Å; L640-F658 HydrophobicContact CB-CE1 3.79Å; L640-F658 HydrophobicContact CB-CZ 3.94Å; L640-F658 HydrophobicContact CD1-CD2 4.47Å; L640-F658 HydrophobicContact CD1-CE1 4.35Å; L640-F658 HydrophobicContact CD1-CE2 3.81Å; L640-F658 HydrophobicContact CD1-CZ 3.73Å; L640-F658 HydrophobicContact CD2-CD1 4.44Å; L640-F658 HydrophobicContact CD2-CE1 4.45Å; L640-F658 HydrophobicContact CG-CE1 4.41Å; L640-F658 HydrophobicContact CG-CZ 4.27Å; L653-F658 HydrophobicContact CD2-CD2 4.43Å; C654-F658 PolarHBondContact O-N 2.82Å; F658-D660 VanDerWaalsContact C-N 3.34Å; F658-D660 PolarHBondContact O-N 2.86Å; F658-V663 HydrophobicContact CD1-CG1 4.22Å; F658-I664 HydrophobicContact CB-CD1 4.02Å; F658-I664 HydrophobicContact CB-CG1 4.23Å
659	P	81.8	Confident	89.2	Confident	94 Å²	94	41.7 Å²	41.7	61%	0.61	24%	0.237	S	C	*	.			trans	-63.6	-36.2	-175.8	24.8	-34.4	0	0	0	112.8	R620 E655 M657 I661	R620-P659 PolarHBondContact NH1-O 3.4Å; E655-P659 VanDerWaalsContact O-CA 3.32Å; E655-P659 WeakPolarHBondContact O-CA 3.17Å; M657-P659 VanDerWaalsContact O-CD 3.32Å; M657-P659 WeakPolarHBondContact O-CD 3.37Å; P659-I661 PolarHBondContact O-N 3.41Å
660	D	86.6	Confident	89.4	Confident	58 Å²	58	37.8 Å²	37.8	31%	0.31	22%	0.219	S	C	.	.			trans	-78.9	111	172.8	173.9	28.8	0	0	0	111.7	G632 F658 N662 V663	G632-D660 WeakPolarHBondContact CA-OD2 3.48Å; F658-D660 VanDerWaalsContact C-N 3.34Å; F658-D660 PolarHBondContact O-N 2.86Å; D660-N662 PolarHBondContact O-N 3.38Å; D660-N662 VanDerWaalsContact OD1-CB 3.25Å; D660-N662 WeakPolarHBondContact OD1-CB 3.5Å; D660-N662 PolarHBondContact OD1-N 3.03Å; D660-N662 PolarHBondContact OD1-ND2 2.81Å; D660-V663 HydrophobicContact CB-CG2 4.17Å; D660-V663 WeakPolarHBondContact O-CB 3.47Å; D660-V663 PolarHBondContact O-N 3.44Å; D660-V663 VanDerWaalsContact O-N 3.14Å
661	I	94.4	Very high	89.9	Confident	7 Å²	7	35.7 Å²	35.7	4%	0.036	20%	0.197	C	C	.	.	H	α-helix	trans	-65.1	-18.5	177.3	-159.5	65.6	0	0	0	113	E616 I617 R620 V624 L627 P659 V663 I664 T665	E616-I661 HydrophobicContact CG-CD1 4.45Å; I617-I661 HydrophobicContact CG1-CD1 3.9Å; I617-I661 HydrophobicContact CG1-CG1 4.13Å; R620-I661 HydrophobicContact CG-CD1 4.4Å; V624-I661 HydrophobicContact CB-CG2 4.22Å; V624-I661 HydrophobicContact CG1-CG2 4.06Å; V624-I661 HydrophobicContact CG2-CG2 4.08Å; L627-I661 HydrophobicContact CD1-CG1 4.25Å; L627-I661 HydrophobicContact CD1-CG2 3.76Å; P659-I661 PolarHBondContact O-N 3.41Å; I661-V663 PolarHBondContact O-N 3.23Å; I661-I664 HydrophobicContact CD1-CB 4.33Å; I661-I664 HydrophobicContact CD1-CD1 4.11Å; I661-I664 HydrophobicContact CD1-CG1 4.48Å; I661-I664 PolarHBondContact O-N 3.27Å; I661-I664 VanDerWaalsContact O-N 3.15Å; I661-T665 PolarHBondContact O-N 3.14Å; I661-T665 PolarHBondContact O-OG1 2.91Å
662	N	94.1	Very high	90.1	Very high	16 Å²	16	35.6 Å²	35.6	9%	0.086	20%	0.196	C	C	.	.	H	α-helix	trans	-73.4	-12.6	177.4	-54.1	-74.1	0	0	0	112.7	G632 D660 T665 G666	G632-N662 VanDerWaalsContact N-CB 3.32Å; G632-N662 PolarHBondContact N-O 2.86Å; D660-N662 PolarHBondContact O-N 3.38Å; D660-N662 VanDerWaalsContact OD1-CB 3.25Å; D660-N662 WeakPolarHBondContact OD1-CB 3.5Å; D660-N662 PolarHBondContact OD1-N 3.03Å; D660-N662 PolarHBondContact OD1-ND2 2.81Å; N662-T665 WeakPolarHBondContact CA-OG1 3.23Å; N662-G666 PolarHBondContact O-N 2.97Å
663	V	93.2	Very high	90.4	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.024	18%	0.183	C	C	.	.	H	α-helix	trans	-68.4	-53.9	164	175.4	0	0	0	0	109.7	V636 K637 L640 F658 D660 I661 G666 V667	V636-V663 HydrophobicContact CB-CG1 4.24Å; V636-V663 HydrophobicContact CB-CG2 4.09Å; V636-V663 HydrophobicContact CG1-CG1 3.94Å; V636-V663 HydrophobicContact CG1-CG2 4.17Å; K637-V663 HydrophobicContact CG-CB 4.3Å; K637-V663 HydrophobicContact CG-CG1 3.9Å; L640-V663 HydrophobicContact CD2-CG1 4.2Å; F658-V663 HydrophobicContact CD1-CG1 4.22Å; D660-V663 HydrophobicContact CB-CG2 4.17Å; D660-V663 WeakPolarHBondContact O-CB 3.47Å; D660-V663 PolarHBondContact O-N 3.44Å; D660-V663 VanDerWaalsContact O-N 3.14Å; I661-V663 PolarHBondContact O-N 3.23Å; V663-G666 WeakPolarHBondContact O-CA 3.32Å; V663-G666 PolarHBondContact O-N 2.94Å; V663-G666 VanDerWaalsContact O-N 3.12Å; V663-V667 PolarHBondContact O-N 3.21Å
664	I	96.5	Very high	90.3	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-68.1	-46.1	-173.3	-51.3	-172.1	0	0	0	111.3	C613 E616 I617 L640 L653 F658 I661 G666 V667 L668	C613-I664 HydrophobicContact CB-CG2 3.82Å; E616-I664 HydrophobicContact CG-CD1 3.62Å; I617-I664 HydrophobicContact CD1-CG2 4.04Å; I617-I664 HydrophobicContact CG1-CB 4.45Å; I617-I664 HydrophobicContact CG1-CG2 4.09Å; L640-I664 HydrophobicContact CD2-CG1 4.13Å; L653-I664 HydrophobicContact CB-CD1 4.33Å; L653-I664 HydrophobicContact CD1-CG2 4.05Å; L653-I664 HydrophobicContact CD2-CD1 4.24Å; F658-I664 HydrophobicContact CB-CD1 4.02Å; F658-I664 HydrophobicContact CB-CG1 4.23Å; I661-I664 HydrophobicContact CD1-CB 4.33Å; I661-I664 HydrophobicContact CD1-CD1 4.11Å; I661-I664 HydrophobicContact CD1-CG1 4.48Å; I661-I664 PolarHBondContact O-N 3.27Å; I661-I664 VanDerWaalsContact O-N 3.15Å; I664-G666 PolarHBondContact O-N 2.92Å; I664-V667 PolarHBondContact O-N 3.49Å; I664-L668 WeakPolarHBondContact O-CB 3.27Å; I664-L668 PolarHBondContact O-N 3.3Å
665	T	96.8	Very high	90.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.2	-30.4	172.3	58	0	0	0	0	112.4	I617 L627 Y628 I661 N662 K669	I617-T665 HydrophobicContact CD1-CG2 3.66Å; I617-T665 HydrophobicContact CG1-CG2 3.96Å; I617-T665 HydrophobicContact CG2-CG2 4.15Å; L627-T665 HydrophobicContact CD1-CG2 3.63Å; L627-T665 HydrophobicContact CG-CG2 4.01Å; Y628-T665 VanDerWaalsContact CD1-CB 3.47Å; Y628-T665 HydrophobicContact CD1-CG2 3.84Å; Y628-T665 HydrophobicContact CD2-CG2 4.44Å; Y628-T665 VanDerWaalsContact CE1-CB 3.48Å; Y628-T665 HydrophobicContact CE1-CG2 3.62Å; Y628-T665 HydrophobicContact CE2-CG2 4.28Å; Y628-T665 HydrophobicContact CG-CG2 4.23Å; I661-T665 PolarHBondContact O-N 3.14Å; I661-T665 PolarHBondContact O-OG1 2.91Å; N662-T665 WeakPolarHBondContact CA-OG1 3.23Å; T665-K669 WeakPolarHBondContact O-CE 3.31Å; T665-K669 WeakPolarHBondContact O-CG 3.26Å; T665-K669 PolarHBondContact O-N 3.04Å
666	G	94.9	Very high	90.8	Very high	2 Å²	2	30.2 Å²	30.2	2%	0.021	17%	0.166	C	C	.	.	H	α-helix	trans	-67.5	-49.8	174	0	0	0	0	0	112.2	N662 V663 I664 L668 K669 D670	N662-G666 PolarHBondContact O-N 2.97Å; V663-G666 WeakPolarHBondContact O-CA 3.32Å; V663-G666 PolarHBondContact O-N 2.94Å; V663-G666 VanDerWaalsContact O-N 3.12Å; I664-G666 PolarHBondContact O-N 2.92Å; G666-L668 VanDerWaalsContact C-N 3.34Å; G666-L668 PolarHBondContact O-N 3.03Å; G666-K669 PolarHBondContact O-N 3.38Å; G666-D670 WeakPolarHBondContact O-CB 3.27Å; G666-D670 PolarHBondContact O-N 3.01Å; G666-D670 VanDerWaalsContact O-OD2 3.12Å
667	V	96.1	Very high	91.2	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	16%	0.157	C	C	.	.	H	α-helix	trans	-63	-39.5	178.5	172.9	0	0	0	0	111.7	F589 I609 K637 L640 F644 V663 I664 D670 Y671	F589-V667 HydrophobicContact CE1-CG1 4.32Å; F589-V667 HydrophobicContact CZ-CG1 3.87Å; I609-V667 HydrophobicContact CD1-CG1 4.19Å; K637-V667 HydrophobicContact CB-CG2 3.9Å; K637-V667 HydrophobicContact CD-CG2 4.44Å; K637-V667 HydrophobicContact CG-CG2 4.13Å; K637-V667 WeakPolarHBondContact O-CG2 3.35Å; L640-V667 HydrophobicContact CB-CG2 4.18Å; L640-V667 HydrophobicContact CD2-CB 4.29Å; L640-V667 HydrophobicContact CD2-CG2 4Å; L640-V667 HydrophobicContact CG-CG1 4.41Å; L640-V667 HydrophobicContact CG-CG2 4.16Å; F644-V667 HydrophobicContact CD2-CG1 4.37Å; F644-V667 HydrophobicContact CE2-CG1 4.47Å; V663-V667 PolarHBondContact O-N 3.21Å; I664-V667 PolarHBondContact O-N 3.49Å; V667-D670 PolarHBondContact O-N 2.98Å; V667-Y671 PolarHBondContact O-N 2.94Å
668	L	97	Very high	91.5	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60	-45.3	174.1	178	55	0	0	0	112.4	I610 C613 I614 I617 Y628 I664 G666 Y671 L672	I610-L668 HydrophobicContact CD1-CD1 3.44Å; I610-L668 VanDerWaalsContact CD1-CD1 3.44Å; C613-L668 HydrophobicContact CB-CB 4.08Å; C613-L668 HydrophobicContact CB-CD1 4.36Å; C613-L668 HydrophobicContact CB-CD2 4.12Å; C613-L668 HydrophobicContact CB-CG 4.42Å; I614-L668 HydrophobicContact CG1-CD2 3.9Å; I617-L668 HydrophobicContact CD1-CD2 3.92Å; Y628-L668 HydrophobicContact CE1-CD2 4.14Å; Y628-L668 WeakPolarHBondContact OH-CD2 3.22Å; I664-L668 WeakPolarHBondContact O-CB 3.27Å; I664-L668 PolarHBondContact O-N 3.3Å; G666-L668 VanDerWaalsContact C-N 3.34Å; G666-L668 PolarHBondContact O-N 3.03Å; L668-Y671 PolarHBondContact O-N 3.11Å; L668-L672 HydrophobicContact CD1-CD1 4.11Å; L668-L672 HydrophobicContact CG-CD1 4.27Å; L668-L672 WeakPolarHBondContact O-CD1 3.41Å; L668-L672 WeakPolarHBondContact O-CG 3.33Å; L668-L672 PolarHBondContact O-N 2.69Å; L668-L672 VanDerWaalsContact O-N 3.15Å
669	K	94.9	Very high	91.6	Very high	28 Å²	28	29 Å²	29	12%	0.122	14%	0.143	C	C	.	.	H	α-helix	trans	-66.2	-35.6	172.9	-72.7	-178.3	-63.3	173.8	0	112.7	Y628 T665 G666 R673 F757	Y628-K669 HydrophobicContact CD1-CD 4.15Å; Y628-K669 HydrophobicContact CD1-CG 4.19Å; Y628-K669 PolarHBondContact O-NZ 3.34Å; T665-K669 WeakPolarHBondContact O-CE 3.31Å; T665-K669 WeakPolarHBondContact O-CG 3.26Å; T665-K669 PolarHBondContact O-N 3.04Å; G666-K669 PolarHBondContact O-N 3.38Å; K669-R673 WeakPolarHBondContact O-CB 3.44Å; K669-R673 PolarHBondContact O-N 2.97Å; K669-R673 VanDerWaalsContact O-N 3.07Å; K669-F757 HydrophobicContact CG-CE1 4.03Å; K669-F757 HydrophobicContact CG-CZ 3.94Å
670	D	93.4	Very high	92	Very high	21 Å²	21	24.5 Å²	24.5	11%	0.112	12%	0.115	C	C	.	.	H	α-helix	trans	-67.6	-37.8	178.6	-66.9	-35.7	0	0	0	111.6	K637 G666 V667 R673 E674	K637-D670 IonicContact NZ-OD1 2.67Å; K637-D670 IonicContact NZ-OD2 2.66Å; K637-D670 PolarHBondContact NZ-OD2 2.84Å; G666-D670 WeakPolarHBondContact O-CB 3.27Å; G666-D670 PolarHBondContact O-N 3.01Å; G666-D670 VanDerWaalsContact O-OD2 3.12Å; V667-D670 PolarHBondContact O-N 2.98Å; D670-R673 IonicContact OD1-CZ 2.85Å; D670-R673 VanDerWaalsContact OD1-CZ 3.23Å; D670-R673 IonicContact OD1-NH1 2.7Å; D670-R673 PolarHBondContact OD1-NH1 3.32Å; D670-R673 IonicContact OD1-NH2 3.11Å; D670-R673 PolarHBondContact OD1-NH2 3.14Å; D670-E674 WeakPolarHBondContact O-CB 3.49Å; D670-E674 VanDerWaalsContact O-CD 3.31Å; D670-E674 WeakPolarHBondContact O-CG 3.36Å; D670-E674 PolarHBondContact O-N 2.83Å
671	Y	95.2	Very high	92.2	Very high	1 Å²	1	23.5 Å²	23.5	0%	0.004	11%	0.111	C	C	.	.	H	α-helix	trans	-62.7	-53.8	171.1	175.1	-95.5	0	0	0	111.8	V588 F589 P607 I609 I610 V667 L668 R673 E674 L675	V588-Y671 HydrophobicContact CG1-CD2 3.97Å; V588-Y671 HydrophobicContact CG1-CE2 3.72Å; V588-Y671 WeakPolarHBondContact O-CE2 3.21Å; F589-Y671 HydrophobicContact CD1-CD2 4.08Å; F589-Y671 HydrophobicContact CE1-CD2 4.35Å; F589-Y671 HydrophobicContact CG-CD2 4.28Å; P607-Y671 WeakPolarHBondContact CG-OH 3.47Å; I609-Y671 HydrophobicContact CD1-CD2 3.97Å; I609-Y671 HydrophobicContact CD1-CG 4.1Å; I609-Y671 HydrophobicContact CG2-CD1 4.11Å; I609-Y671 HydrophobicContact CG2-CD2 3.7Å; I609-Y671 HydrophobicContact CG2-CE1 4.05Å; I609-Y671 HydrophobicContact CG2-CE2 3.61Å; I609-Y671 HydrophobicContact CG2-CG 3.95Å; I610-Y671 HydrophobicContact CD1-CD1 3.5Å; I610-Y671 VanDerWaalsContact CD1-CD1 3.5Å; I610-Y671 HydrophobicContact CD1-CE1 3.61Å; I610-Y671 HydrophobicContact CG1-CD1 4.18Å; I610-Y671 HydrophobicContact CG1-CE1 3.83Å; V667-Y671 PolarHBondContact O-N 2.94Å; L668-Y671 PolarHBondContact O-N 3.11Å; Y671-R673 VanDerWaalsContact C-N 3.29Å; Y671-R673 PolarHBondContact O-N 3.41Å; Y671-E674 PolarHBondContact O-N 2.86Å; Y671-L675 HydrophobicContact CE1-CD2 3.91Å; Y671-L675 HydrophobicContact CE1-CG 4.39Å; Y671-L675 HydrophobicContact CE2-CD2 4.47Å; Y671-L675 PolarHBondContact O-N 3.12Å
672	L	94.1	Very high	91.8	Very high	3 Å²	3	29.5 Å²	29.5	2%	0.016	14%	0.136	C	C	.	.	H	α-helix	trans	-59.8	-37.4	-176.5	-71.8	163.8	0	0	0	112.9	I610 L668 E674 L675 L679 L732 F757 V760 L761	I610-L672 HydrophobicContact CD1-CD2 3.85Å; I610-L672 HydrophobicContact CD1-CG 4.1Å; L668-L672 HydrophobicContact CD1-CD1 4.11Å; L668-L672 HydrophobicContact CG-CD1 4.27Å; L668-L672 WeakPolarHBondContact O-CD1 3.41Å; L668-L672 WeakPolarHBondContact O-CG 3.33Å; L668-L672 PolarHBondContact O-N 2.69Å; L668-L672 VanDerWaalsContact O-N 3.15Å; L672-E674 VanDerWaalsContact C-N 3.26Å; L672-E674 PolarHBondContact O-N 2.84Å; L672-L675 HydrophobicContact CD2-CD1 4.3Å; L672-L679 HydrophobicContact CD2-CD2 3.82Å; L672-L732 HydrophobicContact CD1-CD1 4.26Å; L672-L732 HydrophobicContact CD1-CD2 3.76Å; L672-L732 HydrophobicContact CD2-CD2 4.17Å; L672-F757 HydrophobicContact CD1-CD1 4.41Å; L672-F757 HydrophobicContact CD1-CE1 3.81Å; L672-V760 HydrophobicContact CB-CG1 3.68Å; L672-L761 HydrophobicContact CB-CD2 4.28Å; L672-L761 HydrophobicContact CD1-CD2 4.21Å; L672-L761 HydrophobicContact CD2-CD2 4.07Å; L672-L761 HydrophobicContact CG-CD2 4.43Å
673	R	90.8	Very high	91.6	Very high	109 Å²	109	35 Å²	35	41%	0.411	16%	0.162	S	C	.	.	H	α-helix	trans	-68.6	-23.1	175.5	-174.8	-172.1	61.8	-120	-6.9	113.2	K669 D670 Y671 V760	K669-R673 WeakPolarHBondContact O-CB 3.44Å; K669-R673 PolarHBondContact O-N 2.97Å; K669-R673 VanDerWaalsContact O-N 3.07Å; D670-R673 IonicContact OD1-CZ 2.85Å; D670-R673 VanDerWaalsContact OD1-CZ 3.23Å; D670-R673 IonicContact OD1-NH1 2.7Å; D670-R673 PolarHBondContact OD1-NH1 3.32Å; D670-R673 IonicContact OD1-NH2 3.11Å; D670-R673 PolarHBondContact OD1-NH2 3.14Å; Y671-R673 VanDerWaalsContact C-N 3.29Å; Y671-R673 PolarHBondContact O-N 3.41Å; R673-V760 HydrophobicContact CB-CG1 4.21Å
674	E	89.1	Confident	91.6	Very high	29 Å²	29	34.8 Å²	34.8	14%	0.136	16%	0.16	C	C	.	.	H	α-helix	trans	-105	1.2	-172.4	-72.8	167.7	-142.4	0	0	113.7	G590 R641 D670 Y671 L672	G590-E674 WeakPolarHBondContact CA-O 3.19Å; G590-E674 PolarHBondContact N-O 2.97Å; R641-E674 IonicContact CZ-OE1 3.36Å; R641-E674 IonicContact CZ-OE2 3.86Å; R641-E674 IonicContact NH1-OE2 2.79Å; R641-E674 PolarHBondContact NH1-OE2 3.03Å; R641-E674 IonicContact NH2-OE1 2.74Å; R641-E674 PolarHBondContact NH2-OE1 3.04Å; R641-E674 IonicContact NH2-OE2 2.84Å; R641-E674 PolarHBondContact NH2-OE2 3.25Å; D670-E674 WeakPolarHBondContact O-CB 3.49Å; D670-E674 VanDerWaalsContact O-CD 3.31Å; D670-E674 WeakPolarHBondContact O-CG 3.36Å; D670-E674 PolarHBondContact O-N 2.83Å; Y671-E674 PolarHBondContact O-N 2.86Å; L672-E674 VanDerWaalsContact C-N 3.26Å; L672-E674 PolarHBondContact O-N 2.84Å
675	L	88.6	Confident	91.3	Very high	11 Å²	11	36.4 Å²	36.4	6%	0.058	17%	0.167	C	C	.	.	S	Bend	trans	-53.7	139	163.6	-67.3	172.3	0	0	0	110.1	A593 Y671 L672 Y677 L679	A593-L675 HydrophobicContact CB-CD2 4.26Å; Y671-L675 HydrophobicContact CE1-CD2 3.91Å; Y671-L675 HydrophobicContact CE1-CG 4.39Å; Y671-L675 HydrophobicContact CE2-CD2 4.47Å; Y671-L675 PolarHBondContact O-N 3.12Å; L672-L675 HydrophobicContact CD2-CD1 4.3Å; L675-Y677 WeakPolarHBondContact CB-O 3.34Å; L675-Y677 PolarHBondContact O-N 3.44Å; L675-L679 HydrophobicContact CD1-CB 4.21Å
676	P	86.1	Confident	91	Very high	44 Å²	44	40.9 Å²	40.9	29%	0.286	19%	0.188	S	C	.	.	S	Bend	trans	-66	-23.3	-178.6	26.1	-34.5	0	0	0	112.9	V591 E592	V591-P676 WeakPolarHBondContact O-CD 3.39Å; E592-P676 HydrophobicContact CB-CG 4.36Å; E592-P676 HydrophobicContact CG-CG 3.58Å
677	Y	84.3	Confident	90.9	Very high	150 Å²	150	41.7 Å²	41.7	59%	0.588	19%	0.194	S	C	*	.	S	Bend	trans	-126.5	142.8	173.5	-55.6	-66.4	0	0	0	109.6	E592 L675	E592-Y677 HydrophobicContact CG-CD2 4.49Å; E592-Y677 HydrophobicContact CG-CE2 4.37Å; L675-Y677 WeakPolarHBondContact CB-O 3.34Å; L675-Y677 PolarHBondContact O-N 3.44Å
678	P	86.6	Confident	90.7	Very high	24 Å²	24	41.6 Å²	41.6	16%	0.156	19%	0.194	C	C	.	.			trans	-63.7	136	177.2	26.8	-33.8	0	0	0	110.9	I680 L761 Q764	P678-I680 CarbonylContact O-C 3.54Å; P678-I680 PolarHBondContact O-N 2.93Å; P678-L761 WeakPolarHBondContact CB-O 3.45Å; P678-Q764 HydrophobicContact CG-CB 4.34Å
679	L	89.5	Confident	90.4	Very high	6 Å²	6	44.5 Å²	44.5	3%	0.031	21%	0.208	C	C	.	.	S	Bend	trans	-63.6	-28.6	-176.6	-176.2	63.7	0	0	0	112.6	L672 L675 E725 T728 L729 L732 L761	L672-L679 HydrophobicContact CD2-CD2 3.82Å; L675-L679 HydrophobicContact CD1-CB 4.21Å; L679-E725 HydrophobicContact CD1-CB 4.18Å; L679-E725 HydrophobicContact CD1-CG 4.39Å; L679-T728 HydrophobicContact CD1-CG2 4.18Å; L679-T728 HydrophobicContact CD2-CG2 4.04Å; L679-L729 HydrophobicContact CD1-CB 4.43Å; L679-L729 HydrophobicContact CD2-CB 4.15Å; L679-L729 HydrophobicContact CD2-CD1 4.05Å; L679-L729 HydrophobicContact CG-CB 4.09Å; L679-L729 HydrophobicContact CG-CD1 4.23Å; L679-L732 HydrophobicContact CD2-CD2 4.22Å; L679-L761 HydrophobicContact CB-CD2 4.32Å; L679-L761 HydrophobicContact CD2-CD2 4.26Å; L679-L761 PolarHBondContact N-O 2.93Å
680	I	90.4	Very high	90.2	Very high	1 Å²	1	50 Å²	50	1%	0.005	24%	0.235	C	C	.	.	S	Bend	trans	-94.1	103.9	164	-57.3	172.8	0	0	0	107	P678 L684 L729 L761 L762 L795 L798	P678-I680 CarbonylContact O-C 3.54Å; P678-I680 PolarHBondContact O-N 2.93Å; I680-L684 HydrophobicContact CG2-CB 4.21Å; I680-L684 HydrophobicContact CG2-CD2 3.98Å; I680-L684 HydrophobicContact CG2-CG 3.99Å; I680-L729 HydrophobicContact CD1-CD1 4.49Å; I680-L729 HydrophobicContact CG1-CD1 4.04Å; I680-L729 HydrophobicContact CG1-CD2 3.86Å; I680-L761 HydrophobicContact CD1-CB 3.9Å; I680-L761 HydrophobicContact CD1-CD1 4.2Å; I680-L761 HydrophobicContact CG1-CB 4.15Å; I680-L761 PolarHBondContact N-O 3.09Å; I680-L761 VanDerWaalsContact N-O 3.15Å; I680-L762 HydrophobicContact CB-CD2 3.62Å; I680-L762 HydrophobicContact CB-CG 3.98Å; I680-L762 HydrophobicContact CD1-CD1 4.32Å; I680-L762 HydrophobicContact CD1-CG 4.16Å; I680-L762 HydrophobicContact CG2-CD2 3.46Å; I680-L762 VanDerWaalsContact CG2-CD2 3.46Å; I680-L762 HydrophobicContact CG2-CG 4.24Å; I680-L795 HydrophobicContact CD1-CD1 4.32Å; I680-L798 HydrophobicContact CD1-CD1 4.28Å
681	T	89.4	Confident	90.1	Very high	37 Å²	37	49.2 Å²	49.2	23%	0.227	23%	0.231	C	C	.	.			trans	-69.6	161.3	-178.6	66.1	0	0	0	0	111.7	Q683 L684 Y685 L721	T681-Q683 PolarHBondContact O-N 3.33Å; T681-L684 PolarHBondContact O-N 2.95Å; T681-L684 VanDerWaalsContact O-N 3.14Å; T681-L684 PolarHBondContact OG1-N 3.2Å; T681-Y685 WeakPolarHBondContact O-CB 3.45Å; T681-Y685 PolarHBondContact O-N 3.46Å; T681-L721 HydrophobicContact CG2-CD2 3.62Å; T681-L721 VanDerWaalsContact OG1-CD2 3.31Å; T681-L721 WeakPolarHBondContact OG1-CD2 3.25Å
682	K	87.4	Confident	89.9	Confident	132 Å²	132	51.3 Å²	51.3	57%	0.574	24%	0.241	S	C	*	.	H	α-helix	trans	-52.2	-41.8	175.6	179.4	172.3	175.1	173.5	0	112.3	Y685 E686	K682-Y685 PolarHBondContact O-N 3.45Å; K682-E686 VanDerWaalsContact CE-CD 3.46Å; K682-E686 WeakPolarHBondContact CE-OE1 3.42Å; K682-E686 HydrophobicContact CG-CG 4.37Å; K682-E686 IonicContact NZ-OE1 2.78Å; K682-E686 WeakPolarHBondContact O-CB 3.5Å; K682-E686 WeakPolarHBondContact O-CG 3.47Å; K682-E686 PolarHBondContact O-N 3.48Å
683	Q	89.8	Confident	89.7	Confident	132 Å²	132	55.2 Å²	55.2	62%	0.617	27%	0.274	S	S	*	.	H	α-helix	trans	-62.6	-45.4	178.9	-68.2	174.4	-20.5	0	0	112.5	T681 A687 I720	T681-Q683 PolarHBondContact O-N 3.33Å; Q683-A687 WeakPolarHBondContact O-CB 3.19Å; Q683-A687 PolarHBondContact O-N 2.89Å; Q683-I720 HydrophobicContact CB-CG2 4.04Å
684	L	91.6	Very high	89.6	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-67.5	-40	176.3	177.6	58.1	0	0	0	111.3	I680 T681 A687 V688 L717 L718 L721 L729	I680-L684 HydrophobicContact CG2-CB 4.21Å; I680-L684 HydrophobicContact CG2-CD2 3.98Å; I680-L684 HydrophobicContact CG2-CG 3.99Å; T681-L684 PolarHBondContact O-N 2.95Å; T681-L684 VanDerWaalsContact O-N 3.14Å; T681-L684 PolarHBondContact OG1-N 3.2Å; L684-A687 PolarHBondContact O-N 3.09Å; L684-V688 HydrophobicContact CD1-CG2 3.99Å; L684-V688 HydrophobicContact CG-CG2 4.43Å; L684-V688 VanDerWaalsContact O-CG2 3.26Å; L684-V688 WeakPolarHBondContact O-CG2 3.34Å; L684-V688 PolarHBondContact O-N 2.95Å; L684-L717 HydrophobicContact CD1-CB 3.93Å; L684-L717 WeakPolarHBondContact CD1-O 3.45Å; L684-L718 HydrophobicContact CD1-CD2 4.19Å; L684-L718 HydrophobicContact CD2-CD2 3.66Å; L684-L721 HydrophobicContact CB-CD2 4.15Å; L684-L721 HydrophobicContact CD2-CD1 3.72Å; L684-L721 HydrophobicContact CD2-CD2 4.17Å; L684-L721 HydrophobicContact CD2-CG 3.97Å; L684-L729 HydrophobicContact CD2-CD2 3.61Å
685	Y	90.8	Very high	89.4	Confident	33 Å²	33	58.1 Å²	58.1	13%	0.129	30%	0.295	C	S	.	.	H	α-helix	trans	-60.5	-44.9	176.3	176.1	-104.1	0	0	0	112.3	T681 K682 V688 L689 L762 K790 H791 V794	T681-Y685 WeakPolarHBondContact O-CB 3.45Å; T681-Y685 PolarHBondContact O-N 3.46Å; K682-Y685 PolarHBondContact O-N 3.45Å; Y685-V688 PolarHBondContact O-N 3.41Å; Y685-L689 HydrophobicContact CD1-CD1 4.03Å; Y685-L689 HydrophobicContact CE1-CD1 3.52Å; Y685-L689 HydrophobicContact CE1-CG 4.47Å; Y685-L689 HydrophobicContact CE2-CD1 4.35Å; Y685-L689 WeakPolarHBondContact O-CG 3.35Å; Y685-L689 PolarHBondContact O-N 3Å; Y685-L762 HydrophobicContact CD2-CD1 4.14Å; Y685-L762 HydrophobicContact CD2-CD2 3.47Å; Y685-L762 VanDerWaalsContact CD2-CD2 3.47Å; Y685-L762 HydrophobicContact CD2-CG 4.45Å; Y685-L762 HydrophobicContact CE2-CD1 4.37Å; Y685-L762 HydrophobicContact CE2-CD2 4.28Å; Y685-L762 HydrophobicContact CG-CD2 3.94Å; Y685-K790 WeakPolarHBondContact OH-CB 3.27Å; Y685-H791 AromaticContact CE2-CD2 3.66Å; Y685-H791 AromaticContact CZ-CD2 3.78Å; Y685-V794 HydrophobicContact CD2-CB 4.23Å; Y685-V794 HydrophobicContact CD2-CG1 3.96Å; Y685-V794 HydrophobicContact CD2-CG2 3.96Å; Y685-V794 HydrophobicContact CE2-CB 4.14Å; Y685-V794 HydrophobicContact CE2-CG1 4.38Å; Y685-V794 HydrophobicContact CE2-CG2 3.68Å
686	E	90.8	Very high	89.2	Confident	95 Å²	95	61.7 Å²	61.7	44%	0.444	32%	0.319	S	S	.	.	H	α-helix	trans	-65.5	-44.5	176.6	-72.6	172.6	155.5	0	0	111.9	K682 V688 L689 E690	K682-E686 VanDerWaalsContact CE-CD 3.46Å; K682-E686 WeakPolarHBondContact CE-OE1 3.42Å; K682-E686 HydrophobicContact CG-CG 4.37Å; K682-E686 IonicContact NZ-OE1 2.78Å; K682-E686 WeakPolarHBondContact O-CB 3.5Å; K682-E686 WeakPolarHBondContact O-CG 3.47Å; K682-E686 PolarHBondContact O-N 3.48Å; E686-V688 VanDerWaalsContact C-N 3.34Å; E686-V688 PolarHBondContact O-N 2.88Å; E686-L689 PolarHBondContact O-N 3.47Å; E686-E690 PolarHBondContact O-N 3.06Å
687	A	92	Very high	89.2	Confident	18 Å²	18	61.6 Å²	61.6	15%	0.149	32%	0.316	C	S	.	.	H	α-helix	trans	-62.4	-37.4	176.1	0	0	0	0	0	112.9	Q683 L684 T691 L717 I720	Q683-A687 WeakPolarHBondContact O-CB 3.19Å; Q683-A687 PolarHBondContact O-N 2.89Å; L684-A687 PolarHBondContact O-N 3.09Å; A687-T691 WeakPolarHBondContact O-CB 3.49Å; A687-T691 PolarHBondContact O-N 3.28Å; A687-T691 PolarHBondContact O-OG1 3.18Å; A687-L717 HydrophobicContact CB-CD2 4.43Å; A687-I720 HydrophobicContact CB-CD1 3.65Å
688	V	92.1	Very high	89	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-69.3	-38.4	174.1	178.3	0	0	0	0	111.1	L684 Y685 E686 T691 M692 L717 V794 Y797 L798	L684-V688 HydrophobicContact CD1-CG2 3.99Å; L684-V688 HydrophobicContact CG-CG2 4.43Å; L684-V688 VanDerWaalsContact O-CG2 3.26Å; L684-V688 WeakPolarHBondContact O-CG2 3.34Å; L684-V688 PolarHBondContact O-N 2.95Å; Y685-V688 PolarHBondContact O-N 3.41Å; E686-V688 VanDerWaalsContact C-N 3.34Å; E686-V688 PolarHBondContact O-N 2.88Å; V688-T691 CarbonylContact O-C 3.58Å; V688-T691 WeakPolarHBondContact O-CB 3.37Å; V688-T691 PolarHBondContact O-N 3.29Å; V688-M692 HydrophobicContact CG1-CG 4.23Å; V688-M692 HydrophobicContact CG1-SD 4.08Å; V688-M692 WeakPolarHBondContact O-CB 3.08Å; V688-M692 VanDerWaalsContact O-CG 3.24Å; V688-M692 WeakPolarHBondContact O-CG 3.17Å; V688-M692 PolarHBondContact O-N 3.29Å; V688-L717 HydrophobicContact CG2-CD1 3.82Å; V688-V794 HydrophobicContact CB-CG1 4.1Å; V688-V794 HydrophobicContact CG1-CB 4.45Å; V688-V794 HydrophobicContact CG1-CG1 3.8Å; V688-V794 HydrophobicContact CG1-CG2 4.37Å; V688-Y797 HydrophobicContact CG1-CD1 3.76Å; V688-Y797 HydrophobicContact CG1-CE1 4.36Å; V688-L798 HydrophobicContact CG1-CD2 4.37Å; V688-L798 HydrophobicContact CG1-CG 4.34Å; V688-L798 HydrophobicContact CG2-CD1 4.44Å; V688-L798 HydrophobicContact CG2-CD2 3.79Å; V688-L798 HydrophobicContact CG2-CG 4.28Å
689	L	90.8	Very high	88.4	Confident	60 Å²	60	64 Å²	64	31%	0.314	33%	0.331	S	S	.	.	H	α-helix	trans	-63.4	-41.5	175.1	-74.8	175.1	0	0	0	112.8	Y685 E686 T691 M692 A693 V794	Y685-L689 HydrophobicContact CD1-CD1 4.03Å; Y685-L689 HydrophobicContact CE1-CD1 3.52Å; Y685-L689 HydrophobicContact CE1-CG 4.47Å; Y685-L689 HydrophobicContact CE2-CD1 4.35Å; Y685-L689 WeakPolarHBondContact O-CG 3.35Å; Y685-L689 PolarHBondContact O-N 3Å; E686-L689 PolarHBondContact O-N 3.47Å; L689-T691 VanDerWaalsContact C-N 3.33Å; L689-M692 HydrophobicContact CD2-SD 4.25Å; L689-M692 PolarHBondContact O-N 3.45Å; L689-A693 PolarHBondContact O-N 3.49Å; L689-A693 VanDerWaalsContact O-N 3.15Å; L689-V794 HydrophobicContact CD2-CG2 3.58Å; L689-V794 HydrophobicContact CG-CG2 3.95Å
690	E	91.8	Very high	87.2	Confident	143 Å²	143	65.5 Å²	65.5	67%	0.668	34%	0.344	S	S	*	.	H	α-helix	trans	-63.6	-40.2	172.9	-176.4	175	-161.5	0	0	111.4	E686 A693 T694	E686-E690 PolarHBondContact O-N 3.06Å; E690-A693 PolarHBondContact O-N 2.75Å; E690-T694 WeakPolarHBondContact O-CB 3.42Å; E690-T694 PolarHBondContact O-N 3.49Å; E690-T694 PolarHBondContact O-OG1 3.05Å
691	T	91.5	Very high	85.4	Confident	5 Å²	5	71.2 Å²	71.2	3%	0.031	39%	0.391	C	S	.	.	H	α-helix	trans	-64.2	-42.5	175.1	-54.6	0	0	0	0	111.5	A687 V688 L689 A693 T694 R695 Y713 L717 Y797	A687-T691 WeakPolarHBondContact O-CB 3.49Å; A687-T691 PolarHBondContact O-N 3.28Å; A687-T691 PolarHBondContact O-OG1 3.18Å; V688-T691 CarbonylContact O-C 3.58Å; V688-T691 WeakPolarHBondContact O-CB 3.37Å; V688-T691 PolarHBondContact O-N 3.29Å; L689-T691 VanDerWaalsContact C-N 3.33Å; T691-A693 VanDerWaalsContact C-N 3.28Å; T691-A693 PolarHBondContact O-N 2.97Å; T691-T694 PolarHBondContact O-N 2.72Å; T691-T694 VanDerWaalsContact O-N 3.16Å; T691-R695 HydrophobicContact CG2-CB 4.48Å; T691-R695 WeakPolarHBondContact O-CA 3.49Å; T691-R695 PolarHBondContact O-N 2.94Å; T691-Y713 HydrophobicContact CG2-CD1 3.9Å; T691-Y713 HydrophobicContact CG2-CE1 3.53Å; T691-L717 HydrophobicContact CG2-CD1 4.28Å; T691-Y797 HydrophobicContact CG2-CE1 4.05Å; T691-Y797 WeakPolarHBondContact CG2-OH 3.33Å
692	M	90.9	Very high	83.7	Confident	46 Å²	46	74.4 Å²	74.4	23%	0.227	42%	0.422	C	S	.	.	H	α-helix	trans	-60.9	-35	176.3	-75.5	172.3	74	0	0	112.8	V688 L689 P696 E793 V794 Y797	V688-M692 HydrophobicContact CG1-CG 4.23Å; V688-M692 HydrophobicContact CG1-SD 4.08Å; V688-M692 WeakPolarHBondContact O-CB 3.08Å; V688-M692 VanDerWaalsContact O-CG 3.24Å; V688-M692 WeakPolarHBondContact O-CG 3.17Å; V688-M692 PolarHBondContact O-N 3.29Å; L689-M692 HydrophobicContact CD2-SD 4.25Å; L689-M692 PolarHBondContact O-N 3.45Å; M692-P696 WeakPolarHBondContact O-CA 3.35Å; M692-E793 HydrophobicContact CE-CB 4.11Å; M692-V794 HydrophobicContact SD-CB 4.42Å; M692-V794 HydrophobicContact SD-CG2 3.7Å; M692-Y797 HydrophobicContact CB-CD2 4.46Å; M692-Y797 HydrophobicContact CB-CE2 4.41Å; M692-Y797 HydrophobicContact CG-CD1 3.7Å; M692-Y797 HydrophobicContact CG-CD2 3.46Å; M692-Y797 VanDerWaalsContact CG-CD2 3.46Å; M692-Y797 HydrophobicContact CG-CE1 3.98Å; M692-Y797 HydrophobicContact CG-CE2 3.76Å; M692-Y797 HydrophobicContact CG-CG 3.43Å; M692-Y797 VanDerWaalsContact CG-CG 3.43Å; M692-Y797 HydrophobicContact SD-CD1 4.48Å; M692-Y797 HydrophobicContact SD-CD2 4.43Å; M692-Y797 HydrophobicContact SD-CG 4.04Å
693	A	89.3	Confident	82.6	Confident	84 Å²	84	69.8 Å²	69.8	69%	0.694	41%	0.411	S	S	*	.	H	α-helix	trans	-74	-33.8	175.9	0	0	0	0	0	112.7	L689 E690 T691	L689-A693 PolarHBondContact O-N 3.49Å; L689-A693 VanDerWaalsContact O-N 3.15Å; E690-A693 PolarHBondContact O-N 2.75Å; T691-A693 VanDerWaalsContact C-N 3.28Å; T691-A693 PolarHBondContact O-N 2.97Å
694	T	88.3	Confident	81.5	Confident	104 Å²	104	65 Å²	65	64%	0.638	39%	0.392	S	S	*	.	H	α-helix	trans	-88.7	-32.8	-175.7	-52	0	0	0	0	113.1	E690 T691	E690-T694 WeakPolarHBondContact O-CB 3.42Å; E690-T694 PolarHBondContact O-N 3.49Å; E690-T694 PolarHBondContact O-OG1 3.05Å; T691-T694 PolarHBondContact O-N 2.72Å; T691-T694 VanDerWaalsContact O-N 3.16Å
695	R	86.4	Confident	80.3	Confident	95 Å²	95	71.5 Å²	71.5	36%	0.358	42%	0.422	S	S	.	.	S	Bend	trans	-131.7	70	-179.3	-68.9	-177.2	170	116	-3.7	110.1	T691 D710 Y713 Y797	T691-R695 HydrophobicContact CG2-CB 4.48Å; T691-R695 WeakPolarHBondContact O-CA 3.49Å; T691-R695 PolarHBondContact O-N 2.94Å; R695-D710 WeakPolarHBondContact CD-OD1 3.27Å; R695-D710 IonicContact NE-OD1 2.78Å; R695-Y713 VanDerWaalsContact NH1-CE1 3.25Å; R695-Y797 WeakPolarHBondContact O-CE2 3.39Å; R695-Y797 PolarHBondContact O-OH 2.83Å
696	P	84.2	Confident	79.4	Confident	87 Å²	87	71.5 Å²	71.5	57%	0.565	42%	0.424	S	S	*	.			trans	-62.3	150.6	175.5	27.6	-35.5	0	0	0	111.3	M692 K698	M692-P696 WeakPolarHBondContact O-CA 3.35Å; P696-K698 PolarHBondContact O-N 2.68Å
697	L	84.9	Confident	78.8	Confident	42 Å²	42	71.7 Å²	71.7	22%	0.22	43%	0.428	C	S	.	.			trans	-62	122.8	179.3	-66.5	172.5	0	0	0	111.2	M699 Y797 Q800 L801	L697-M699 HydrophobicContact CB-CG 4.34Å; L697-M699 PolarHBondContact O-N 3.43Å; L697-M699 VanDerWaalsContact O-N 3.14Å; L697-Y797 HydrophobicContact CD1-CD2 4.02Å; L697-Y797 HydrophobicContact CD2-CD2 3.7Å; L697-Y797 HydrophobicContact CD2-CE2 3.81Å; L697-Y797 HydrophobicContact CG-CD2 3.59Å; L697-Y797 HydrophobicContact CG-CE2 3.86Å; L697-Q800 HydrophobicContact CD1-CB 4.19Å; L697-Q800 HydrophobicContact CD1-CG 4.14Å; L697-Q800 HydrophobicContact CD2-CB 4.14Å; L697-Q800 HydrophobicContact CD2-CG 4.02Å; L697-L801 HydrophobicContact CD2-CD1 3.76Å; L697-L801 HydrophobicContact CD2-CG 3.81Å
698	K	80.3	Confident	78.4	Confident	91 Å²	91	77.6 Å²	77.6	40%	0.396	46%	0.457	S	S	.	.			trans	-77.9	93.3	172.7	-62	155.7	-174.2	154.1	0	108.5	P696 C704 E705 N706 D707 D710	P696-K698 PolarHBondContact O-N 2.68Å; K698-C704 CarbonylContact O-C 3.51Å; K698-C704 WeakPolarHBondContact O-CA 3.33Å; K698-C704 PolarHBondContact O-SG 2.92Å; K698-E705 WeakPolarHBondContact CB-O 3.49Å; K698-E705 WeakPolarHBondContact CD-O 3.41Å; K698-E705 PolarHBondContact O-N 2.78Å; K698-N706 PolarHBondContact N-OD1 3.32Å; K698-D707 IonicContact NZ-OD2 3.59Å; K698-D707 PolarHBondContact NZ-OD2 2.78Å; K698-D710 IonicContact NZ-OD2 2.67Å; K698-D710 PolarHBondContact NZ-OD2 3Å
699	M	73.5	Confident	78	Confident	133 Å²	133	80.5 Å²	80.5	66%	0.655	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	120.8	177.2	-62.9	-150.5	75.5	0	0	111.3	L697	L697-M699 HydrophobicContact CB-CG 4.34Å; L697-M699 PolarHBondContact O-N 3.43Å; L697-M699 VanDerWaalsContact O-N 3.14Å
700	A	65.4	Low	77.8	Confident	37 Å²	37	78.5 Å²	78.5	31%	0.306	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	170.3	177.1	0	0	0	0	0	110.6	A702 G703 E705	A700-A702 PolarHBondContact O-N 2.8Å; A700-A702 VanDerWaalsContact O-N 3.08Å; A700-G703 PolarHBondContact N-O 3.22Å; A700-G703 PolarHBondContact O-N 3.18Å; A700-G703 VanDerWaalsContact O-N 3.13Å; A700-E705 HydrophobicContact CB-CG 3.88Å; A700-E705 WeakPolarHBondContact CB-OE2 3.35Å
701	A	52.5	Low	77.6	Confident	122 Å²	122	72.5 Å²	72.5	100%	1.008	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-19.7	-177.8	0	0	0	0	0	114.4
702	A	54	Low	77.4	Confident	104 Å²	104	79 Å²	79	86%	0.86	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-3.5	179.1	0	0	0	0	0	114.4	A700	A700-A702 PolarHBondContact O-N 2.8Å; A700-A702 VanDerWaalsContact O-N 3.08Å
703	G	64.4	Low	77.4	Confident	34 Å²	34	81 Å²	81	35%	0.351	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	141	-145.4	-175	0	0	0	0	0	112.9	A700	A700-G703 PolarHBondContact N-O 3.22Å; A700-G703 PolarHBondContact O-N 3.18Å; A700-G703 VanDerWaalsContact O-N 3.13Å
704	C	65.6	Low	77.4	Confident	31 Å²	31	77 Å²	77	21%	0.209	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	111.2	178.2	-137.4	0	0	0	0	110.4	K698 N706 Q800	K698-C704 CarbonylContact O-C 3.51Å; K698-C704 WeakPolarHBondContact O-CA 3.33Å; K698-C704 PolarHBondContact O-SG 2.92Å; C704-N706 VanDerWaalsContact C-N 3.28Å; C704-N706 PolarHBondContact O-N 3.31Å; C704-N706 VanDerWaalsContact O-N 3.17Å; C704-N706 PolarHBondContact SG-ND2 2.71Å; C704-Q800 HydrophobicContact CB-CG 3.81Å
705	E	66.2	Low	77.6	Confident	138 Å²	138	72.9 Å²	72.9	65%	0.645	42%	0.421	S	S	*	.			trans	-89.9	62.4	178.9	-68.2	-172.3	134.5	0	0	110.4	K698 A700	K698-E705 WeakPolarHBondContact CB-O 3.49Å; K698-E705 WeakPolarHBondContact CD-O 3.41Å; K698-E705 PolarHBondContact O-N 2.78Å; A700-E705 HydrophobicContact CB-CG 3.88Å; A700-E705 WeakPolarHBondContact CB-OE2 3.35Å
706	N	72.1	Confident	77.9	Confident	33 Å²	33	71 Å²	71	18%	0.176	42%	0.423	C	S	.	.			trans	-91	148	171.5	-53.4	-47.4	0	0	0	110.4	K698 C704 D710 L801	K698-N706 PolarHBondContact N-OD1 3.32Å; C704-N706 VanDerWaalsContact C-N 3.28Å; C704-N706 PolarHBondContact O-N 3.31Å; C704-N706 VanDerWaalsContact O-N 3.17Å; C704-N706 PolarHBondContact SG-ND2 2.71Å; N706-D710 HydrophobicContact CB-CB 4.21Å; N706-L801 HydrophobicContact CB-CD2 3.44Å; N706-L801 VanDerWaalsContact CB-CD2 3.44Å; N706-L801 WeakPolarHBondContact ND2-CD2 3.16Å
707	D	79.1	Confident	78.3	Confident	98 Å²	98	67.2 Å²	67.2	52%	0.524	40%	0.398	S	S	.	.			trans	-76.6	155.5	-177.3	-64.8	-76.3	0	0	0	111.2	K698 A709 D710 S711	K698-D707 IonicContact NZ-OD2 3.59Å; K698-D707 PolarHBondContact NZ-OD2 2.78Å; D707-A709 PolarHBondContact O-N 3.46Å; D707-A709 VanDerWaalsContact O-N 3.13Å; D707-D710 PolarHBondContact N-OD2 3.23Å; D707-D710 WeakPolarHBondContact O-CA 3.18Å; D707-D710 WeakPolarHBondContact O-CB 3.23Å; D707-D710 PolarHBondContact O-N 3.15Å; D707-S711 PolarHBondContact O-N 3.33Å
708	L	82.5	Confident	78.7	Confident	142 Å²	142	65.2 Å²	65.2	74%	0.743	39%	0.388	S	S	*	.	H	α-helix	trans	-54.3	-35.7	175.1	-70.4	173.9	0	0	0	111.6	D710 S711 E712	L708-D710 VanDerWaalsContact C-N 3.3Å; L708-D710 PolarHBondContact O-N 3.21Å; L708-S711 WeakPolarHBondContact O-CB 3.37Å; L708-S711 PolarHBondContact O-N 3.39Å; L708-S711 VanDerWaalsContact O-N 3.08Å; L708-S711 PolarHBondContact O-OG 3Å; L708-E712 PolarHBondContact O-N 3.39Å
709	A	84.4	Confident	79.4	Confident	61 Å²	61	65.8 Å²	65.8	50%	0.504	39%	0.391	S	S	.	.	H	α-helix	trans	-62.6	-31.5	174.5	0	0	0	0	0	113.9	D707 S711 Y713	D707-A709 PolarHBondContact O-N 3.46Å; D707-A709 VanDerWaalsContact O-N 3.13Å; A709-S711 VanDerWaalsContact C-N 3.33Å; A709-Y713 VanDerWaalsContact O-CB 3.24Å; A709-Y713 WeakPolarHBondContact O-CB 3.49Å; A709-Y713 PolarHBondContact O-N 2.83Å
710	D	86	Confident	80.3	Confident	19 Å²	19	62.9 Å²	62.9	10%	0.102	38%	0.378	C	S	.	.	H	α-helix	trans	-70.1	-34.3	174.3	-63.5	-40.4	0	0	0	110.2	R695 K698 N706 D707 L708 T714 L801	R695-D710 WeakPolarHBondContact CD-OD1 3.27Å; R695-D710 IonicContact NE-OD1 2.78Å; K698-D710 IonicContact NZ-OD2 2.67Å; K698-D710 PolarHBondContact NZ-OD2 3Å; N706-D710 HydrophobicContact CB-CB 4.21Å; D707-D710 PolarHBondContact N-OD2 3.23Å; D707-D710 WeakPolarHBondContact O-CA 3.18Å; D707-D710 WeakPolarHBondContact O-CB 3.23Å; D707-D710 PolarHBondContact O-N 3.15Å; L708-D710 VanDerWaalsContact C-N 3.3Å; L708-D710 PolarHBondContact O-N 3.21Å; D710-T714 WeakPolarHBondContact O-CB 3.46Å; D710-T714 PolarHBondContact O-N 2.67Å; D710-T714 PolarHBondContact O-OG1 2.78Å; D710-L801 HydrophobicContact CB-CD2 3.6Å
711	S	87.5	Confident	81.6	Confident	17 Å²	17	61.7 Å²	61.7	12%	0.119	37%	0.366	C	S	.	.	H	α-helix	trans	-71.8	-44.5	175.4	78	0	0	0	0	113.1	D707 L708 A709 Y713 T714 V715 L801	D707-S711 PolarHBondContact O-N 3.33Å; L708-S711 WeakPolarHBondContact O-CB 3.37Å; L708-S711 PolarHBondContact O-N 3.39Å; L708-S711 VanDerWaalsContact O-N 3.08Å; L708-S711 PolarHBondContact O-OG 3Å; A709-S711 VanDerWaalsContact C-N 3.33Å; S711-Y713 VanDerWaalsContact C-N 3.33Å; S711-Y713 PolarHBondContact O-N 3.25Å; S711-T714 PolarHBondContact O-N 3.36Å; S711-V715 WeakPolarHBondContact O-CG2 3.22Å; S711-V715 PolarHBondContact O-N 2.97Å; S711-L801 WeakPolarHBondContact CA-O 3.49Å; S711-L801 WeakPolarHBondContact CB-O 3.38Å
712	E	88.2	Confident	83.5	Confident	140 Å²	140	59.6 Å²	59.6	65%	0.654	34%	0.343	S	S	*	.	H	α-helix	trans	-62.2	-42.5	174.4	-70.4	-176.6	156.3	0	0	110.8	L708 T714 V715 S716	L708-E712 PolarHBondContact O-N 3.39Å; E712-T714 PolarHBondContact O-N 2.98Å; E712-V715 PolarHBondContact O-N 3.1Å; E712-S716 PolarHBondContact O-N 3.09Å
713	Y	90.1	Very high	85.4	Confident	88 Å²	88	58.7 Å²	58.7	35%	0.345	32%	0.321	S	S	.	.	H	α-helix	trans	-61.5	-43.4	174.5	-174.5	-94.5	0	0	0	111.7	T691 R695 A709 S711 V715 S716 L717	T691-Y713 HydrophobicContact CG2-CD1 3.9Å; T691-Y713 HydrophobicContact CG2-CE1 3.53Å; R695-Y713 VanDerWaalsContact NH1-CE1 3.25Å; A709-Y713 VanDerWaalsContact O-CB 3.24Å; A709-Y713 WeakPolarHBondContact O-CB 3.49Å; A709-Y713 PolarHBondContact O-N 2.83Å; S711-Y713 VanDerWaalsContact C-N 3.33Å; S711-Y713 PolarHBondContact O-N 3.25Å; Y713-V715 VanDerWaalsContact C-N 3.31Å; Y713-V715 PolarHBondContact O-N 3.07Å; Y713-S716 WeakPolarHBondContact CA-OG 3.25Å; Y713-S716 WeakPolarHBondContact O-CA 3.38Å; Y713-S716 WeakPolarHBondContact O-CB 3.36Å; Y713-S716 PolarHBondContact O-N 2.95Å; Y713-S716 PolarHBondContact O-OG 3.13Å; Y713-L717 HydrophobicContact CD1-CG 4.46Å; Y713-L717 HydrophobicContact CE1-CD1 4.37Å; Y713-L717 HydrophobicContact CE1-CD2 3.8Å; Y713-L717 HydrophobicContact CE1-CG 4.13Å; Y713-L717 PolarHBondContact O-N 3.24Å; Y713-L717 VanDerWaalsContact O-N 3.15Å
714	T	89.8	Confident	86.9	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.006	31%	0.308	C	S	.	.	H	α-helix	trans	-60.9	-38.5	177.3	-60	0	0	0	0	112.1	D710 S711 E712 L798 L801	D710-T714 WeakPolarHBondContact O-CB 3.46Å; D710-T714 PolarHBondContact O-N 2.67Å; D710-T714 PolarHBondContact O-OG1 2.78Å; S711-T714 PolarHBondContact O-N 3.36Å; E712-T714 PolarHBondContact O-N 2.98Å; T714-L798 HydrophobicContact CG2-CD2 3.79Å; T714-L801 HydrophobicContact CG2-CB 3.89Å; T714-L801 WeakPolarHBondContact OG1-CB 3.35Å
715	V	91.9	Very high	88.2	Confident	17 Å²	17	57.9 Å²	57.9	10%	0.103	31%	0.306	C	S	.	.	H	α-helix	trans	-67.9	-36	172.6	176.3	0	0	0	0	111.5	S711 E712 Y713 L717 L718 W802 P803	S711-V715 WeakPolarHBondContact O-CG2 3.22Å; S711-V715 PolarHBondContact O-N 2.97Å; E712-V715 PolarHBondContact O-N 3.1Å; Y713-V715 VanDerWaalsContact C-N 3.31Å; Y713-V715 PolarHBondContact O-N 3.07Å; V715-L717 VanDerWaalsContact C-N 3.28Å; V715-L717 PolarHBondContact O-N 3.11Å; V715-L718 WeakPolarHBondContact O-CB 3.33Å; V715-L718 PolarHBondContact O-N 3.46Å; V715-W802 HydrophobicContact CG1-CH2 4.49Å; V715-W802 HydrophobicContact CG2-CE3 4.29Å; V715-W802 HydrophobicContact CG2-CH2 3.98Å; V715-W802 HydrophobicContact CG2-CZ2 4.36Å; V715-W802 HydrophobicContact CG2-CZ3 3.95Å; V715-P803 HydrophobicContact CG2-CG 3.79Å
716	S	93.3	Very high	89.6	Confident	55 Å²	55	53 Å²	53	39%	0.385	28%	0.281	S	S	.	.	H	α-helix	trans	-66.4	-24.7	179	81.4	0	0	0	0	114	E712 Y713 L718 E719	E712-S716 PolarHBondContact O-N 3.09Å; Y713-S716 WeakPolarHBondContact CA-OG 3.25Å; Y713-S716 WeakPolarHBondContact O-CA 3.38Å; Y713-S716 WeakPolarHBondContact O-CB 3.36Å; Y713-S716 PolarHBondContact O-N 2.95Å; Y713-S716 PolarHBondContact O-OG 3.13Å; S716-L718 PolarHBondContact O-N 3.12Å; S716-E719 WeakPolarHBondContact O-CB 3.47Å; S716-E719 WeakPolarHBondContact O-CG 3.5Å; S716-E719 PolarHBondContact O-N 2.98Å; S716-E719 VanDerWaalsContact O-N 3.09Å
717	L	93	Very high	90.7	Very high	9 Å²	9	54.3 Å²	54.3	5%	0.047	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-59.7	-28	173.2	-65.6	177.1	0	0	0	112.2	L684 A687 V688 T691 Y713 V715 E719 I720	L684-L717 HydrophobicContact CD1-CB 3.93Å; L684-L717 WeakPolarHBondContact CD1-O 3.45Å; A687-L717 HydrophobicContact CB-CD2 4.43Å; V688-L717 HydrophobicContact CG2-CD1 3.82Å; T691-L717 HydrophobicContact CG2-CD1 4.28Å; Y713-L717 HydrophobicContact CD1-CG 4.46Å; Y713-L717 HydrophobicContact CE1-CD1 4.37Å; Y713-L717 HydrophobicContact CE1-CD2 3.8Å; Y713-L717 HydrophobicContact CE1-CG 4.13Å; Y713-L717 PolarHBondContact O-N 3.24Å; Y713-L717 VanDerWaalsContact O-N 3.15Å; V715-L717 VanDerWaalsContact C-N 3.28Å; V715-L717 PolarHBondContact O-N 3.11Å; L717-E719 PolarHBondContact O-N 3.31Å; L717-I720 WeakPolarHBondContact O-CB 3.49Å; L717-I720 WeakPolarHBondContact O-CD1 3.46Å; L717-I720 WeakPolarHBondContact O-CG1 3.32Å; L717-I720 PolarHBondContact O-N 3.45Å
718	L	93.5	Very high	91.5	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-69.8	-16.7	178.3	-59.3	-158.2	0	0	0	113.5	L684 V715 S716 I720 L721 R726 L729 R730 L733 W802	L684-L718 HydrophobicContact CD1-CD2 4.19Å; L684-L718 HydrophobicContact CD2-CD2 3.66Å; V715-L718 WeakPolarHBondContact O-CB 3.33Å; V715-L718 PolarHBondContact O-N 3.46Å; S716-L718 PolarHBondContact O-N 3.12Å; L718-I720 PolarHBondContact O-N 2.88Å; L718-I720 VanDerWaalsContact O-N 3.13Å; L718-L721 WeakPolarHBondContact O-CB 3.32Å; L718-L721 PolarHBondContact O-N 2.98Å; L718-R726 HydrophobicContact CB-CG 4.19Å; L718-R726 WeakPolarHBondContact O-CG 3.44Å; L718-L729 HydrophobicContact CD1-CG 4.36Å; L718-L729 HydrophobicContact CD2-CD2 3.81Å; L718-L729 HydrophobicContact CD2-CG 4.44Å; L718-R730 HydrophobicContact CD1-CB 4.1Å; L718-L733 HydrophobicContact CD1-CD1 4.29Å; L718-W802 HydrophobicContact CD1-CH2 3.56Å; L718-W802 HydrophobicContact CD1-CZ3 4.05Å; L718-W802 HydrophobicContact CG-CH2 4.24Å; L718-W802 HydrophobicContact CG-CZ3 4.34Å
719	E	93.6	Very high	92.1	Very high	102 Å²	102	42.9 Å²	42.9	48%	0.477	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-71.2	-2.3	177.3	-49.5	-58.5	135.4	0	0	112.6	S716 L717 L721 R726 R730	S716-E719 WeakPolarHBondContact O-CB 3.47Å; S716-E719 WeakPolarHBondContact O-CG 3.5Å; S716-E719 PolarHBondContact O-N 2.98Å; S716-E719 VanDerWaalsContact O-N 3.09Å; L717-E719 PolarHBondContact O-N 3.31Å; E719-L721 VanDerWaalsContact C-N 3.34Å; E719-R726 IonicContact OE1-CZ 3.14Å; E719-R726 IonicContact OE1-NH1 3.61Å; E719-R726 PolarHBondContact OE1-NH1 2.84Å; E719-R726 WeakPolarHBondContact OE2-CD 3.36Å; E719-R726 IonicContact OE2-CZ 2.7Å; E719-R726 IonicContact OE2-NE 3.18Å; E719-R726 IonicContact OE2-NH1 2.74Å; E719-R726 PolarHBondContact OE2-NH1 3.13Å; E719-R730 IonicContact OE1-CZ 2.73Å; E719-R730 IonicContact OE1-NH1 3.58Å; E719-R730 IonicContact OE1-NH2 3.86Å; E719-R730 PolarHBondContact OE1-NH2 2.87Å
720	I	92.8	Very high	92.7	Very high	73 Å²	73	42.2 Å²	42.2	37%	0.374	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-74.6	-24	166.2	-59.3	171	0	0	0	111.4	Q683 A687 L717 L718	Q683-I720 HydrophobicContact CB-CG2 4.04Å; A687-I720 HydrophobicContact CB-CD1 3.65Å; L717-I720 WeakPolarHBondContact O-CB 3.49Å; L717-I720 WeakPolarHBondContact O-CD1 3.46Å; L717-I720 WeakPolarHBondContact O-CG1 3.32Å; L717-I720 PolarHBondContact O-N 3.45Å; L718-I720 PolarHBondContact O-N 2.88Å; L718-I720 VanDerWaalsContact O-N 3.13Å
721	L	93	Very high	93.2	Very high	11 Å²	11	43.5 Å²	43.5	6%	0.058	22%	0.216	C	C	.	.	S	Bend	trans	-84.6	150.4	-178.1	-63.5	-176.3	0	0	0	112.8	T681 L684 L718 E719 E725 R726 L729	T681-L721 HydrophobicContact CG2-CD2 3.62Å; T681-L721 VanDerWaalsContact OG1-CD2 3.31Å; T681-L721 WeakPolarHBondContact OG1-CD2 3.25Å; L684-L721 HydrophobicContact CB-CD2 4.15Å; L684-L721 HydrophobicContact CD2-CD1 3.72Å; L684-L721 HydrophobicContact CD2-CD2 4.17Å; L684-L721 HydrophobicContact CD2-CG 3.97Å; L718-L721 WeakPolarHBondContact O-CB 3.32Å; L718-L721 PolarHBondContact O-N 2.98Å; E719-L721 VanDerWaalsContact C-N 3.34Å; L721-E725 HydrophobicContact CB-CB 4.45Å; L721-R726 HydrophobicContact CB-CB 3.94Å; L721-L729 HydrophobicContact CD1-CB 4.31Å; L721-L729 HydrophobicContact CD1-CD2 3.63Å
722	P	93.4	Very high	93.6	Very high	79 Å²	79	42.8 Å²	42.8	51%	0.513	21%	0.21	S	C	.	.			trans	-60.8	157.4	167	-15.4	28.9	0	0	0	111.8	V724 E725 R726	P722-V724 PolarHBondContact O-N 3.38Å; P722-E725 PolarHBondContact O-N 3.17Å; P722-R726 VanDerWaalsContact O-CB 3.23Å; P722-R726 WeakPolarHBondContact O-CB 3.39Å; P722-R726 PolarHBondContact O-N 2.84Å
723	E	93.9	Very high	94	Very high	85 Å²	85	36.1 Å²	36.1	40%	0.397	18%	0.179	S	C	.	.	H	α-helix	trans	-58	-41.9	-163.3	-176.1	58	-160.6	0	0	115.1	M605 R726 M727	M605-E723 HydrophobicContact CG-CG 4.19Å; M605-E723 HydrophobicContact SD-CG 4.3Å; E723-R726 IonicContact OE1-CZ 3.12Å; E723-R726 IonicContact OE1-NE 2.71Å; E723-R726 IonicContact OE1-NH2 3.11Å; E723-R726 PolarHBondContact OE1-NH2 3.08Å; E723-R726 IonicContact OE2-CZ 3.05Å; E723-R726 IonicContact OE2-NE 3.29Å; E723-R726 PolarHBondContact OE2-NE 2.7Å; E723-R726 IonicContact OE2-NH2 3.92Å; E723-R726 PolarHBondContact OE2-NH2 3.17Å; E723-M727 WeakPolarHBondContact O-CB 3.23Å; E723-M727 VanDerWaalsContact O-CG 3.26Å; E723-M727 WeakPolarHBondContact O-CG 2.97Å; E723-M727 PolarHBondContact O-N 3.22Å; E723-M727 VanDerWaalsContact OE1-CG 3.24Å; E723-M727 WeakPolarHBondContact OE1-CG 3.42Å
724	V	94.4	Very high	94.3	Very high	15 Å²	15	34.3 Å²	34.3	9%	0.091	18%	0.175	C	C	.	.	H	α-helix	trans	-72.2	-43.9	-178.4	175.7	0	0	0	0	110.8	A593 W594 V597 M605 P722 M727 T728	A593-V724 HydrophobicContact CB-CG1 4.19Å; W594-V724 HydrophobicContact CB-CB 4.16Å; W594-V724 HydrophobicContact CB-CG1 4.47Å; W594-V724 HydrophobicContact CB-CG2 4.14Å; V597-V724 HydrophobicContact CB-CG1 4.27Å; V597-V724 HydrophobicContact CB-CG2 4.41Å; V597-V724 HydrophobicContact CG1-CG2 4.22Å; V597-V724 HydrophobicContact CG2-CG1 3.73Å; M605-V724 HydrophobicContact SD-CG2 4.33Å; P722-V724 PolarHBondContact O-N 3.38Å; V724-M727 PolarHBondContact O-N 3.42Å; V724-T728 WeakPolarHBondContact O-CB 3.49Å; V724-T728 PolarHBondContact O-N 2.96Å; V724-T728 PolarHBondContact O-OG1 3.11Å
725	E	94.1	Very high	94.6	Very high	33 Å²	33	34.2 Å²	34.2	15%	0.154	18%	0.175	C	C	.	.	H	α-helix	trans	-64.3	-42.7	176.4	-70	65.7	-150	0	0	110.9	L679 L721 P722 T728 L729	L679-E725 HydrophobicContact CD1-CB 4.18Å; L679-E725 HydrophobicContact CD1-CG 4.39Å; L721-E725 HydrophobicContact CB-CB 4.45Å; P722-E725 PolarHBondContact O-N 3.17Å; E725-T728 PolarHBondContact O-N 3.03Å; E725-L729 VanDerWaalsContact O-CB 3.25Å; E725-L729 WeakPolarHBondContact O-CB 3.45Å; E725-L729 PolarHBondContact O-N 3.43Å
726	R	94.7	Very high	94.9	Very high	36 Å²	36	33.4 Å²	33.4	14%	0.136	17%	0.17	C	C	.	.	H	α-helix	trans	-56.3	-53.2	173.5	-177.3	179	78.8	105.6	2.4	111.8	L718 E719 L721 P722 E723 R730	L718-R726 HydrophobicContact CB-CG 4.19Å; L718-R726 WeakPolarHBondContact O-CG 3.44Å; E719-R726 IonicContact OE1-CZ 3.14Å; E719-R726 IonicContact OE1-NH1 3.61Å; E719-R726 PolarHBondContact OE1-NH1 2.84Å; E719-R726 WeakPolarHBondContact OE2-CD 3.36Å; E719-R726 IonicContact OE2-CZ 2.7Å; E719-R726 IonicContact OE2-NE 3.18Å; E719-R726 IonicContact OE2-NH1 2.74Å; E719-R726 PolarHBondContact OE2-NH1 3.13Å; L721-R726 HydrophobicContact CB-CB 3.94Å; P722-R726 VanDerWaalsContact O-CB 3.23Å; P722-R726 WeakPolarHBondContact O-CB 3.39Å; P722-R726 PolarHBondContact O-N 2.84Å; E723-R726 IonicContact OE1-CZ 3.12Å; E723-R726 IonicContact OE1-NE 2.71Å; E723-R726 IonicContact OE1-NH2 3.11Å; E723-R726 PolarHBondContact OE1-NH2 3.08Å; E723-R726 IonicContact OE2-CZ 3.05Å; E723-R726 IonicContact OE2-NE 3.29Å; E723-R726 PolarHBondContact OE2-NE 2.7Å; E723-R726 IonicContact OE2-NH2 3.92Å; E723-R726 PolarHBondContact OE2-NH2 3.17Å; R726-R730 VanDerWaalsContact O-CB 3.3Å; R726-R730 WeakPolarHBondContact O-CB 3.31Å; R726-R730 PolarHBondContact O-N 3.19Å
727	M	95.8	Very high	95	Very high	59 Å²	59	31.5 Å²	31.5	29%	0.291	16%	0.155	S	C	.	.	H	α-helix	trans	-72.5	-34.4	-177	-70.2	-63.6	-73.8	0	0	112.3	M605 V606 E723 V724 K731	M605-M727 HydrophobicContact CB-CB 3.96Å; M605-M727 HydrophobicContact CB-CG 4.07Å; M605-M727 WeakPolarHBondContact O-CB 3.47Å; V606-M727 HydrophobicContact CG2-CB 4.04Å; E723-M727 WeakPolarHBondContact O-CB 3.23Å; E723-M727 VanDerWaalsContact O-CG 3.26Å; E723-M727 WeakPolarHBondContact O-CG 2.97Å; E723-M727 PolarHBondContact O-N 3.22Å; E723-M727 VanDerWaalsContact OE1-CG 3.24Å; E723-M727 WeakPolarHBondContact OE1-CG 3.42Å; V724-M727 PolarHBondContact O-N 3.42Å; M727-K731 WeakPolarHBondContact O-CB 3.35Å; M727-K731 PolarHBondContact O-N 2.87Å
728	T	95.9	Very high	95.1	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-66.2	-44.3	173.9	-61.2	0	0	0	0	111.3	P607 I610 L679 V724 E725 L732	P607-T728 VanDerWaalsContact CD-OG1 3.3Å; P607-T728 WeakPolarHBondContact CD-OG1 3.38Å; I610-T728 HydrophobicContact CG1-CG2 4.03Å; I610-T728 HydrophobicContact CG2-CG2 4.37Å; L679-T728 HydrophobicContact CD1-CG2 4.18Å; L679-T728 HydrophobicContact CD2-CG2 4.04Å; V724-T728 WeakPolarHBondContact O-CB 3.49Å; V724-T728 PolarHBondContact O-N 2.96Å; V724-T728 PolarHBondContact O-OG1 3.11Å; E725-T728 PolarHBondContact O-N 3.03Å; T728-L732 WeakPolarHBondContact O-CB 3.47Å; T728-L732 PolarHBondContact O-N 3.01Å
729	L	95.8	Very high	95.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-69.2	-41.4	177.1	-175.7	58.6	0	0	0	111.8	L679 I680 L684 L718 L721 E725 L732 L733	L679-L729 HydrophobicContact CD1-CB 4.43Å; L679-L729 HydrophobicContact CD2-CB 4.15Å; L679-L729 HydrophobicContact CD2-CD1 4.05Å; L679-L729 HydrophobicContact CG-CB 4.09Å; L679-L729 HydrophobicContact CG-CD1 4.23Å; I680-L729 HydrophobicContact CD1-CD1 4.49Å; I680-L729 HydrophobicContact CG1-CD1 4.04Å; I680-L729 HydrophobicContact CG1-CD2 3.86Å; L684-L729 HydrophobicContact CD2-CD2 3.61Å; L718-L729 HydrophobicContact CD1-CG 4.36Å; L718-L729 HydrophobicContact CD2-CD2 3.81Å; L718-L729 HydrophobicContact CD2-CG 4.44Å; L721-L729 HydrophobicContact CD1-CB 4.31Å; L721-L729 HydrophobicContact CD1-CD2 3.63Å; E725-L729 VanDerWaalsContact O-CB 3.25Å; E725-L729 WeakPolarHBondContact O-CB 3.45Å; E725-L729 PolarHBondContact O-N 3.43Å; L729-L732 PolarHBondContact O-N 3.35Å; L729-L733 HydrophobicContact CD1-CD1 4.11Å; L729-L733 HydrophobicContact CD1-CG 4.03Å; L729-L733 HydrophobicContact CG-CD1 3.93Å; L729-L733 HydrophobicContact CG-CG 4.29Å; L729-L733 WeakPolarHBondContact O-CG 3.28Å; L729-L733 PolarHBondContact O-N 2.89Å
730	R	95.5	Very high	95.3	Very high	48 Å²	48	29.9 Å²	29.9	18%	0.181	15%	0.145	C	C	.	.	H	α-helix	trans	-54.5	-54.5	172.6	177.5	171.3	-77.4	134.9	-0.1	110.8	L718 E719 R726 L732 L733 D734 W802	L718-R730 HydrophobicContact CD1-CB 4.1Å; E719-R730 IonicContact OE1-CZ 2.73Å; E719-R730 IonicContact OE1-NH1 3.58Å; E719-R730 IonicContact OE1-NH2 3.86Å; E719-R730 PolarHBondContact OE1-NH2 2.87Å; R726-R730 VanDerWaalsContact O-CB 3.3Å; R726-R730 WeakPolarHBondContact O-CB 3.31Å; R726-R730 PolarHBondContact O-N 3.19Å; R730-L732 VanDerWaalsContact C-N 3.26Å; R730-L732 PolarHBondContact O-N 2.9Å; R730-L733 PolarHBondContact O-N 2.98Å; R730-L733 VanDerWaalsContact O-N 3.13Å; R730-D734 WeakPolarHBondContact O-CB 3.47Å; R730-D734 PolarHBondContact O-N 2.85Å; R730-D734 VanDerWaalsContact O-OD2 3.13Å; R730-W802 HydrophobicContact CG-CZ2 4.1Å
731	K	96.1	Very high	95.4	Very high	46 Å²	46	28.7 Å²	28.7	20%	0.2	14%	0.144	C	C	.	.	H	α-helix	trans	-61.2	-31	178.6	179.1	54	175	159.1	0	113.1	V606 I614 N615 E618 M727 H735	V606-K731 HydrophobicContact CG2-CB 4.44Å; I614-K731 HydrophobicContact CD1-CG 4.17Å; I614-K731 HydrophobicContact CG2-CD 4.34Å; I614-K731 VanDerWaalsContact CG2-CE 3.47Å; I614-K731 VanDerWaalsContact CG2-NZ 3.31Å; N615-K731 PolarHBondContact OD1-NZ 2.84Å; E618-K731 IonicContact OE1-NZ 3.67Å; M727-K731 WeakPolarHBondContact O-CB 3.35Å; M727-K731 PolarHBondContact O-N 2.87Å; K731-H735 WeakPolarHBondContact O-CB 3.47Å; K731-H735 PolarHBondContact O-N 3.02Å
732	L	97.2	Very high	95.5	Very high	1 Å²	1	31 Å²	31	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-74.1	-41.9	173.7	-177.5	63.1	0	0	0	112.6	I614 L672 L679 T728 L729 R730 H735 L736 F757 L761	I614-L732 HydrophobicContact CD1-CD1 4.2Å; L672-L732 HydrophobicContact CD1-CD1 4.26Å; L672-L732 HydrophobicContact CD1-CD2 3.76Å; L672-L732 HydrophobicContact CD2-CD2 4.17Å; L679-L732 HydrophobicContact CD2-CD2 4.22Å; T728-L732 WeakPolarHBondContact O-CB 3.47Å; T728-L732 PolarHBondContact O-N 3.01Å; L729-L732 PolarHBondContact O-N 3.35Å; R730-L732 VanDerWaalsContact C-N 3.26Å; R730-L732 PolarHBondContact O-N 2.9Å; L732-H735 WeakPolarHBondContact O-CB 3.18Å; L732-H735 PolarHBondContact O-N 2.75Å; L732-L736 HydrophobicContact CD1-CD1 4.32Å; L732-L736 HydrophobicContact CD1-CG 4.26Å; L732-L736 HydrophobicContact CG-CD1 4.12Å; L732-L736 HydrophobicContact CG-CG 4.44Å; L732-L736 VanDerWaalsContact O-CG 3.31Å; L732-L736 WeakPolarHBondContact O-CG 3.33Å; L732-L736 PolarHBondContact O-N 2.8Å; L732-F757 HydrophobicContact CD1-CE1 4.26Å; L732-L761 HydrophobicContact CD2-CD1 3.83Å; L732-L761 HydrophobicContact CD2-CD2 3.68Å; L732-L761 HydrophobicContact CD2-CG 4.39Å
733	L	96.6	Very high	95.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-69	-40.4	178.2	-69	173.5	0	0	0	111.4	L718 L729 R730 H735 L736 K737 L795 L799 W802	L718-L733 HydrophobicContact CD1-CD1 4.29Å; L729-L733 HydrophobicContact CD1-CD1 4.11Å; L729-L733 HydrophobicContact CD1-CG 4.03Å; L729-L733 HydrophobicContact CG-CD1 3.93Å; L729-L733 HydrophobicContact CG-CG 4.29Å; L729-L733 WeakPolarHBondContact O-CG 3.28Å; L729-L733 PolarHBondContact O-N 2.89Å; R730-L733 PolarHBondContact O-N 2.98Å; R730-L733 VanDerWaalsContact O-N 3.13Å; L733-H735 VanDerWaalsContact C-N 3.27Å; L733-H735 PolarHBondContact O-N 3.21Å; L733-L736 PolarHBondContact O-N 2.97Å; L733-K737 VanDerWaalsContact O-CB 3.29Å; L733-K737 WeakPolarHBondContact O-CB 3.41Å; L733-K737 PolarHBondContact O-N 3.45Å; L733-L795 HydrophobicContact CD2-CD1 3.75Å; L733-L799 HydrophobicContact CD2-CD2 3.76Å; L733-L799 HydrophobicContact CD2-CG 4.33Å; L733-W802 HydrophobicContact CB-CD2 3.76Å; L733-W802 HydrophobicContact CB-CE3 4.05Å; L733-W802 HydrophobicContact CB-CG 4.34Å; L733-W802 HydrophobicContact CB-CH2 4.15Å; L733-W802 HydrophobicContact CB-CZ2 3.83Å; L733-W802 HydrophobicContact CB-CZ3 4.24Å; L733-W802 HydrophobicContact CD1-CD2 4.41Å; L733-W802 HydrophobicContact CD1-CE3 3.82Å; L733-W802 HydrophobicContact CD1-CH2 3.9Å; L733-W802 HydrophobicContact CD1-CZ2 4.44Å; L733-W802 HydrophobicContact CD1-CZ3 3.55Å
734	D	96	Very high	95.6	Very high	50 Å²	50	35 Å²	35	27%	0.267	16%	0.164	S	C	.	.	H	α-helix	trans	-53.2	-47	169.3	-67.9	-33.1	0	0	0	111	R730 R738 W802	R730-D734 WeakPolarHBondContact O-CB 3.47Å; R730-D734 PolarHBondContact O-N 2.85Å; R730-D734 VanDerWaalsContact O-OD2 3.13Å; D734-R738 WeakPolarHBondContact O-CB 3.38Å; D734-R738 PolarHBondContact O-N 3.37Å; D734-W802 PolarHBondContact OD1-NE1 3Å
735	H	97.1	Very high	95.5	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64.3	-48.7	178.6	177	65.3	0	0	0	112.7	I614 E618 Y628 K731 L732 L733 K737 R738 V739	I614-H735 HydrophobicContact CD1-CB 3.96Å; I614-H735 HydrophobicContact CG1-CB 4.18Å; I614-H735 HydrophobicContact CG2-CB 3.81Å; E618-H735 VanDerWaalsContact CG-ND1 3.29Å; E618-H735 WeakPolarHBondContact CG-ND1 3.11Å; E618-H735 IonicContact OE1-CE1 3.73Å; E618-H735 IonicContact OE1-CG 3.98Å; E618-H735 IonicContact OE1-ND1 2.76Å; E618-H735 PolarHBondContact OE1-ND1 3.08Å; Y628-H735 AromaticContact CE2-NE2 3.43Å; Y628-H735 WeakPolarHBondContact CE2-NE2 3.47Å; Y628-H735 AromaticContact CZ-CD2 3.97Å; Y628-H735 AromaticContact CZ-NE2 3.5Å; Y628-H735 PolarHBondContact OH-CD2 3.24Å; Y628-H735 PolarHBondContact OH-NE2 3.21Å; K731-H735 WeakPolarHBondContact O-CB 3.47Å; K731-H735 PolarHBondContact O-N 3.02Å; L732-H735 WeakPolarHBondContact O-CB 3.18Å; L732-H735 PolarHBondContact O-N 2.75Å; L733-H735 VanDerWaalsContact C-N 3.27Å; L733-H735 PolarHBondContact O-N 3.21Å; H735-K737 VanDerWaalsContact C-N 3.34Å; H735-K737 PolarHBondContact O-N 2.99Å; H735-R738 CarbonylContact O-C 3.59Å; H735-R738 WeakPolarHBondContact O-CB 3.45Å; H735-R738 PolarHBondContact O-N 3.18Å; H735-V739 WeakPolarHBondContact O-CG2 3.26Å; H735-V739 PolarHBondContact O-N 2.75Å
736	L	97.1	Very high	95.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.1	-37.5	-179	-68.5	177.2	0	0	0	111.6	Y628 L732 L733 V739 A740 L753 F757 L799	Y628-L736 HydrophobicContact CD2-CD2 4.37Å; Y628-L736 HydrophobicContact CE2-CD2 4.12Å; L732-L736 HydrophobicContact CD1-CD1 4.32Å; L732-L736 HydrophobicContact CD1-CG 4.26Å; L732-L736 HydrophobicContact CG-CD1 4.12Å; L732-L736 HydrophobicContact CG-CG 4.44Å; L732-L736 VanDerWaalsContact O-CG 3.31Å; L732-L736 WeakPolarHBondContact O-CG 3.33Å; L732-L736 PolarHBondContact O-N 2.8Å; L733-L736 PolarHBondContact O-N 2.97Å; L736-V739 PolarHBondContact O-N 2.98Å; L736-A740 PolarHBondContact O-N 2.98Å; L736-L753 HydrophobicContact CB-CD1 4.39Å; L736-L753 HydrophobicContact CD2-CD1 4.49Å; L736-L753 HydrophobicContact CD2-CD2 4.29Å; L736-L753 WeakPolarHBondContact O-CD1 3.39Å; L736-F757 HydrophobicContact CD1-CB 4.39Å; L736-F757 HydrophobicContact CD1-CD1 4.31Å; L736-F757 HydrophobicContact CD1-CD2 4.01Å; L736-F757 HydrophobicContact CD1-CE2 4.32Å; L736-F757 HydrophobicContact CD1-CG 3.99Å; L736-F757 HydrophobicContact CD2-CD2 3.75Å; L736-F757 HydrophobicContact CD2-CE2 3.38Å; L736-F757 HydrophobicContact CD2-CG 4.49Å; L736-F757 HydrophobicContact CD2-CZ 3.85Å; L736-F757 HydrophobicContact CG-CE2 4.48Å; L736-L799 HydrophobicContact CB-CD1 4.44Å; L736-L799 HydrophobicContact CB-CD2 3.62Å; L736-L799 HydrophobicContact CD1-CD2 4.48Å
737	K	95.4	Very high	95.6	Very high	14 Å²	14	42 Å²	42	6%	0.061	20%	0.196	C	C	.	.	H	α-helix	trans	-62.7	-44.9	171.7	-173.2	65.3	175.7	-133.9	0	111.3	L733 H735 V739 A740 S741 L799 Q800 W802 D804	L733-K737 VanDerWaalsContact O-CB 3.29Å; L733-K737 WeakPolarHBondContact O-CB 3.41Å; L733-K737 PolarHBondContact O-N 3.45Å; H735-K737 VanDerWaalsContact C-N 3.34Å; H735-K737 PolarHBondContact O-N 2.99Å; K737-V739 VanDerWaalsContact C-N 3.29Å; K737-V739 PolarHBondContact O-N 3.35Å; K737-A740 WeakPolarHBondContact O-CA 3.42Å; K737-A740 WeakPolarHBondContact O-CB 3.41Å; K737-A740 PolarHBondContact O-N 3.46Å; K737-A740 VanDerWaalsContact O-N 3.07Å; K737-S741 PolarHBondContact O-N 3.38Å; K737-L799 WeakPolarHBondContact CD-O 3.41Å; K737-L799 PolarHBondContact NZ-O 2.9Å; K737-Q800 PolarHBondContact NZ-O 3.43Å; K737-W802 HydrophobicContact CB-CB 4.33Å; K737-W802 HydrophobicContact CB-CG 4.33Å; K737-W802 HydrophobicContact CD-CB 4.15Å; K737-W802 WeakPolarHBondContact CE-O 3.47Å; K737-W802 HydrophobicContact CG-CB 4.22Å; K737-W802 PolarHBondContact NZ-O 2.61Å; K737-D804 WeakPolarHBondContact CE-OD1 3.36Å; K737-D804 WeakPolarHBondContact CE-OD2 3.49Å; K737-D804 WeakPolarHBondContact CG-OD1 3.48Å; K737-D804 IonicContact NZ-OD2 2.75Å
738	R	95.1	Very high	95.6	Very high	71 Å²	71	39.3 Å²	39.3	27%	0.268	18%	0.183	S	C	.	.	H	α-helix	trans	-60.9	-34.3	173.5	-171.5	176.8	-174.3	-174.6	2.6	112.8	E618 D734 H735 S741 Y742	E618-R738 IonicContact OE2-CZ 2.76Å; E618-R738 IonicContact OE2-NH1 3.2Å; E618-R738 PolarHBondContact OE2-NH1 3.33Å; D734-R738 WeakPolarHBondContact O-CB 3.38Å; D734-R738 PolarHBondContact O-N 3.37Å; H735-R738 CarbonylContact O-C 3.59Å; H735-R738 WeakPolarHBondContact O-CB 3.45Å; H735-R738 PolarHBondContact O-N 3.18Å; R738-S741 PolarHBondContact O-OG 3.26Å; R738-Y742 HydrophobicContact CG-CE2 4.35Å; R738-Y742 WeakPolarHBondContact O-CD2 3.4Å
739	V	96.4	Very high	95.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-69.4	-40.2	172.5	171.8	0	0	0	0	111	L627 Y628 H735 L736 K737 S741 Y742 N746 M748 L753	L627-V739 HydrophobicContact CD2-CG1 3.86Å; L627-V739 HydrophobicContact CD2-CG2 3.88Å; Y628-V739 HydrophobicContact CE2-CG2 4.34Å; H735-V739 WeakPolarHBondContact O-CG2 3.26Å; H735-V739 PolarHBondContact O-N 2.75Å; L736-V739 PolarHBondContact O-N 2.98Å; K737-V739 VanDerWaalsContact C-N 3.29Å; K737-V739 PolarHBondContact O-N 3.35Å; V739-S741 VanDerWaalsContact C-N 3.3Å; V739-S741 PolarHBondContact O-N 3.12Å; V739-Y742 PolarHBondContact O-N 2.95Å; V739-Y742 VanDerWaalsContact O-N 3.1Å; V739-N746 PolarHBondContact O-ND2 3.18Å; V739-M748 HydrophobicContact CG1-CB 4.4Å; V739-L753 HydrophobicContact CB-CD1 4.09Å; V739-L753 HydrophobicContact CG1-CD1 3.96Å; V739-L753 HydrophobicContact CG1-CD2 4.01Å
740	A	95.3	Very high	95.5	Very high	6 Å²	6	42.1 Å²	42.1	5%	0.05	20%	0.2	C	C	.	.	H	α-helix	trans	-63.2	-31.7	175.7	0	0	0	0	0	113.1	L736 K737 Y742 Q743 L753	L736-A740 PolarHBondContact O-N 2.98Å; K737-A740 WeakPolarHBondContact O-CA 3.42Å; K737-A740 WeakPolarHBondContact O-CB 3.41Å; K737-A740 PolarHBondContact O-N 3.46Å; K737-A740 VanDerWaalsContact O-N 3.07Å; A740-Y742 PolarHBondContact O-N 3.09Å; A740-Y742 VanDerWaalsContact O-N 3.15Å; A740-Q743 WeakPolarHBondContact O-CB 3.44Å; A740-Q743 VanDerWaalsContact O-CG 3.23Å; A740-Q743 WeakPolarHBondContact O-CG 3.35Å; A740-Q743 PolarHBondContact O-N 3.38Å; A740-L753 HydrophobicContact CB-CD1 4.08Å
741	S	94.5	Very high	95.5	Very high	49 Å²	49	43.4 Å²	43.4	34%	0.343	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-12.9	174.7	79.7	0	0	0	0	113.8	K737 R738 V739	K737-S741 PolarHBondContact O-N 3.38Å; R738-S741 PolarHBondContact O-OG 3.26Å; V739-S741 VanDerWaalsContact C-N 3.3Å; V739-S741 PolarHBondContact O-N 3.12Å
742	Y	94.6	Very high	95.5	Very high	59 Å²	59	43.9 Å²	43.9	23%	0.231	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	17.8	170.7	-64.4	-79.2	0	0	0	113.2	C622 Q623 R738 V739 A740 E744 M745 N746	C622-Y742 HydrophobicContact CB-CD2 3.56Å; C622-Y742 HydrophobicContact CB-CE2 3.76Å; C622-Y742 HydrophobicContact CB-CG 4.13Å; C622-Y742 VanDerWaalsContact O-CB 3.31Å; C622-Y742 WeakPolarHBondContact O-CB 3.5Å; Q623-Y742 HydrophobicContact CG-CD1 4.3Å; R738-Y742 HydrophobicContact CG-CE2 4.35Å; R738-Y742 WeakPolarHBondContact O-CD2 3.4Å; V739-Y742 PolarHBondContact O-N 2.95Å; V739-Y742 VanDerWaalsContact O-N 3.1Å; A740-Y742 PolarHBondContact O-N 3.09Å; A740-Y742 VanDerWaalsContact O-N 3.15Å; Y742-E744 PolarHBondContact O-N 3.23Å; Y742-M745 PolarHBondContact O-N 2.96Å; Y742-N746 WeakPolarHBondContact CB-ND2 3.25Å; Y742-N746 VanDerWaalsContact O-CG 3.27Å; Y742-N746 PolarHBondContact O-N 2.76Å; Y742-N746 PolarHBondContact O-ND2 2.84Å; Y742-N746 PolarHBondContact O-OD1 2.76Å
743	Q	94.4	Very high	95.5	Very high	87 Å²	87	43.9 Å²	43.9	41%	0.407	21%	0.213	S	C	.	.	H	α-helix	trans	-53.3	-29.2	-178.3	63.3	-177.1	-0.5	0	0	114.5	A740 M745 N746 K747 T749	A740-Q743 WeakPolarHBondContact O-CB 3.44Å; A740-Q743 VanDerWaalsContact O-CG 3.23Å; A740-Q743 WeakPolarHBondContact O-CG 3.35Å; A740-Q743 PolarHBondContact O-N 3.38Å; Q743-M745 VanDerWaalsContact C-N 3.28Å; Q743-M745 PolarHBondContact O-N 2.75Å; Q743-N746 WeakPolarHBondContact CA-OD1 3.21Å; Q743-K747 WeakPolarHBondContact O-CA 3.37Å; Q743-K747 PolarHBondContact O-N 3.38Å; Q743-T749 HydrophobicContact CB-CG2 4.47Å
744	E	94.8	Very high	95.5	Very high	161 Å²	161	43.9 Å²	43.9	75%	0.752	21%	0.213	S	C	*	.	H	α-helix	trans	-61.4	-36	174.8	-63.8	-176.1	178.1	0	0	112.7	Y742 K747	Y742-E744 PolarHBondContact O-N 3.23Å; E744-K747 WeakPolarHBondContact O-CE 3.39Å; E744-K747 PolarHBondContact O-NZ 3.14Å
745	M	93.4	Very high	95.4	Very high	105 Å²	105	45.1 Å²	45.1	52%	0.517	22%	0.222	S	C	.	.	H	α-helix	trans	-91.1	-56.4	178.7	-65	-64.7	-73	0	0	110.9	Q623 Y742 Q743 K747	Q623-M745 HydrophobicContact CB-CB 4.22Å; Q623-M745 HydrophobicContact CG-CB 4.36Å; Y742-M745 PolarHBondContact O-N 2.96Å; Q743-M745 VanDerWaalsContact C-N 3.28Å; Q743-M745 PolarHBondContact O-N 2.75Å; M745-K747 PolarHBondContact O-N 2.77Å
746	N	94.6	Very high	95.3	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-82.7	-11.4	-170.7	68.6	30	0	0	0	114.4	C622 V624 V625 G626 V739 Y742 Q743 M748	C622-N746 WeakPolarHBondContact O-CB 3.16Å; C622-N746 PolarHBondContact O-ND2 3.37Å; V624-N746 VanDerWaalsContact O-CB 3.28Å; V624-N746 WeakPolarHBondContact O-CB 3.38Å; V625-N746 WeakPolarHBondContact CA-O 3.39Å; G626-N746 PolarHBondContact N-O 3.33Å; V739-N746 PolarHBondContact O-ND2 3.18Å; Y742-N746 WeakPolarHBondContact CB-ND2 3.25Å; Y742-N746 VanDerWaalsContact O-CG 3.27Å; Y742-N746 PolarHBondContact O-N 2.76Å; Y742-N746 PolarHBondContact O-ND2 2.84Å; Y742-N746 PolarHBondContact O-OD1 2.76Å; Q743-N746 WeakPolarHBondContact CA-OD1 3.21Å; N746-M748 PolarHBondContact O-N 3.19Å; N746-M748 WeakPolarHBondContact OD1-CA 3.36Å; N746-M748 WeakPolarHBondContact OD1-CB 3.41Å; N746-M748 PolarHBondContact OD1-N 2.9Å
747	K	95.3	Very high	95.2	Very high	127 Å²	127	46.3 Å²	46.3	55%	0.552	23%	0.231	S	C	*	.			trans	61.1	20.8	-177.7	-45.7	-53.9	-175.7	-176.2	0	114.9	V625 Q743 E744 M745 N752	V625-K747 HydrophobicContact CG1-CG 4.23Å; Q743-K747 WeakPolarHBondContact O-CA 3.37Å; Q743-K747 PolarHBondContact O-N 3.38Å; E744-K747 WeakPolarHBondContact O-CE 3.39Å; E744-K747 PolarHBondContact O-NZ 3.14Å; M745-K747 PolarHBondContact O-N 2.77Å; K747-N752 PolarHBondContact O-ND2 3.13Å
748	M	95.4	Very high	95	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.01	23%	0.228	C	C	.	.			trans	-107.6	87.8	179	-63	-57.8	-62.6	0	0	110.8	L627 R629 V739 N746 N752 L753	L627-M748 WeakPolarHBondContact O-CE 3.35Å; L627-M748 WeakPolarHBondContact O-CG 3.47Å; R629-M748 HydrophobicContact CB-CE 3.96Å; R629-M748 HydrophobicContact CB-SD 3.93Å; V739-M748 HydrophobicContact CG1-CB 4.4Å; N746-M748 PolarHBondContact O-N 3.19Å; N746-M748 WeakPolarHBondContact OD1-CA 3.36Å; N746-M748 WeakPolarHBondContact OD1-CB 3.41Å; N746-M748 PolarHBondContact OD1-N 2.9Å; M748-N752 HydrophobicContact CE-CB 3.69Å; M748-N752 HydrophobicContact SD-CB 4.08Å; M748-L753 HydrophobicContact CB-CD2 4Å; M748-L753 HydrophobicContact CB-CG 4.15Å; M748-L753 HydrophobicContact CE-CD2 3.83Å; M748-L753 HydrophobicContact CE-CG 4.35Å
749	T	95.8	Very high	94.7	Very high	46 Å²	46	44.8 Å²	44.8	28%	0.282	23%	0.231	S	C	.	.			trans	-65.9	167.1	170.3	67.6	0	0	0	0	111.6	Q743 Q751 N752 L753	Q743-T749 HydrophobicContact CB-CG2 4.47Å; T749-Q751 PolarHBondContact O-N 2.93Å; T749-Q751 PolarHBondContact OG1-N 2.96Å; T749-N752 PolarHBondContact O-N 2.82Å; T749-N752 PolarHBondContact OG1-N 3.46Å; T749-N752 VanDerWaalsContact OG1-N 3.11Å; T749-L753 PolarHBondContact O-N 2.9Å
750	C	95.3	Very high	94.4	Very high	12 Å²	12	45.8 Å²	45.8	8%	0.081	24%	0.237	C	C	.	.	H	α-helix	trans	-49.5	-41.9	170.5	-65.4	0	0	0	0	112.2	L753 A754 L799	C750-L753 PolarHBondContact O-N 2.79Å; C750-A754 VanDerWaalsContact O-CB 3.31Å; C750-A754 WeakPolarHBondContact O-CB 3.49Å; C750-A754 PolarHBondContact O-N 3.33Å; C750-L799 HydrophobicContact CB-CB 4.11Å
751	Q	95.4	Very high	94.1	Very high	76 Å²	76	45.5 Å²	45.5	36%	0.355	24%	0.235	S	C	.	.	H	α-helix	trans	-67.1	-42.1	177.5	-179.4	63.7	-2.6	0	0	112.3	T749 L753 A754 V755 H796	T749-Q751 PolarHBondContact O-N 2.93Å; T749-Q751 PolarHBondContact OG1-N 2.96Å; Q751-L753 VanDerWaalsContact C-N 3.3Å; Q751-L753 PolarHBondContact O-N 3.06Å; Q751-A754 PolarHBondContact O-N 3.15Å; Q751-V755 WeakPolarHBondContact O-CG2 3.44Å; Q751-V755 PolarHBondContact O-N 3.18Å; Q751-H796 PolarHBondContact N-CD2 2.88Å; Q751-H796 PolarHBondContact OE1-CD2 3.37Å; Q751-H796 VanDerWaalsContact OE1-CG 3.25Å
752	N	95.9	Very high	93.3	Very high	56 Å²	56	44 Å²	44	30%	0.299	22%	0.223	S	C	.	.	H	α-helix	trans	-65.2	-35.4	177.7	-69.7	-9.9	0	0	0	111.7	K747 M748 T749 C756	K747-N752 PolarHBondContact O-ND2 3.13Å; M748-N752 HydrophobicContact CE-CB 3.69Å; M748-N752 HydrophobicContact SD-CB 4.08Å; T749-N752 PolarHBondContact O-N 2.82Å; T749-N752 PolarHBondContact OG1-N 3.46Å; T749-N752 VanDerWaalsContact OG1-N 3.11Å; N752-C756 PolarHBondContact O-N 3.23Å; N752-C756 PolarHBondContact O-SG 3.33Å
753	L	97.1	Very high	92.2	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-71.6	-40.6	173	-65.8	172.7	0	0	0	111.7	Y628 L736 V739 A740 M748 T749 C750 Q751 V755 C756 F757 L799	Y628-L753 HydrophobicContact CD2-CD2 4.07Å; L736-L753 HydrophobicContact CB-CD1 4.39Å; L736-L753 HydrophobicContact CD2-CD1 4.49Å; L736-L753 HydrophobicContact CD2-CD2 4.29Å; L736-L753 WeakPolarHBondContact O-CD1 3.39Å; V739-L753 HydrophobicContact CB-CD1 4.09Å; V739-L753 HydrophobicContact CG1-CD1 3.96Å; V739-L753 HydrophobicContact CG1-CD2 4.01Å; A740-L753 HydrophobicContact CB-CD1 4.08Å; M748-L753 HydrophobicContact CB-CD2 4Å; M748-L753 HydrophobicContact CB-CG 4.15Å; M748-L753 HydrophobicContact CE-CD2 3.83Å; M748-L753 HydrophobicContact CE-CG 4.35Å; T749-L753 PolarHBondContact O-N 2.9Å; C750-L753 PolarHBondContact O-N 2.79Å; Q751-L753 VanDerWaalsContact C-N 3.3Å; Q751-L753 PolarHBondContact O-N 3.06Å; L753-V755 VanDerWaalsContact C-N 3.31Å; L753-V755 PolarHBondContact O-N 2.94Å; L753-C756 WeakPolarHBondContact O-CA 3.38Å; L753-C756 WeakPolarHBondContact O-CB 3.31Å; L753-C756 PolarHBondContact O-N 2.97Å; L753-F757 PolarHBondContact O-N 2.86Å; L753-L799 HydrophobicContact CB-CD1 4.26Å
754	A	95.9	Very high	90.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60.8	-38.1	175.3	0	0	0	0	0	112.3	C750 Q751 C756 F757 G758 I792 L795 H796	C750-A754 VanDerWaalsContact O-CB 3.31Å; C750-A754 WeakPolarHBondContact O-CB 3.49Å; C750-A754 PolarHBondContact O-N 3.33Å; Q751-A754 PolarHBondContact O-N 3.15Å; A754-C756 VanDerWaalsContact C-N 3.31Å; A754-C756 PolarHBondContact O-N 2.9Å; A754-F757 PolarHBondContact O-N 2.8Å; A754-G758 WeakPolarHBondContact O-CA 3.45Å; A754-G758 PolarHBondContact O-N 3.48Å; A754-I792 HydrophobicContact CB-CG2 4.03Å; A754-L795 HydrophobicContact CB-CB 4.29Å; A754-L795 HydrophobicContact CB-CG 4.34Å; A754-H796 HydrophobicContact CB-CB 3.86Å
755	V	94.6	Very high	88.4	Confident	76 Å²	76	42.3 Å²	42.3	46%	0.461	22%	0.22	S	C	.	.	H	α-helix	trans	-61.4	-37.3	170.6	171.5	0	0	0	0	112	Q751 L753 I792	Q751-V755 WeakPolarHBondContact O-CG2 3.44Å; Q751-V755 PolarHBondContact O-N 3.18Å; L753-V755 VanDerWaalsContact C-N 3.31Å; L753-V755 PolarHBondContact O-N 2.94Å; V755-I792 HydrophobicContact CG2-CD1 4.25Å; V755-I792 HydrophobicContact CG2-CG2 3.9Å
756	C	94.4	Very high	86	Confident	26 Å²	26	45 Å²	45	18%	0.176	23%	0.231	C	C	.	.	H	α-helix	trans	-77.7	-31	-179.5	-64.3	0	0	0	0	113.9	N752 L753 A754 V760	N752-C756 PolarHBondContact O-N 3.23Å; N752-C756 PolarHBondContact O-SG 3.33Å; L753-C756 WeakPolarHBondContact O-CA 3.38Å; L753-C756 WeakPolarHBondContact O-CB 3.31Å; L753-C756 PolarHBondContact O-N 2.97Å; A754-C756 VanDerWaalsContact C-N 3.31Å; A754-C756 PolarHBondContact O-N 2.9Å; C756-V760 WeakPolarHBondContact O-CG2 3.36Å
757	F	95.7	Very high	83.2	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-111.8	-23.4	-172	-83.5	-88.8	0	0	0	115.3	Y628 K669 L672 L732 L736 L753 A754 V760 L761 L795	Y628-F757 AromaticContact CD1-CE2 3.49Å; Y628-F757 HydrophobicContact CD1-CE2 3.49Å; Y628-F757 VanDerWaalsContact CD1-CE2 3.49Å; Y628-F757 AromaticContact CD1-CZ 3.44Å; Y628-F757 HydrophobicContact CD1-CZ 3.44Å; Y628-F757 VanDerWaalsContact CD1-CZ 3.44Å; Y628-F757 AromaticContact CD2-CE2 3.96Å; Y628-F757 HydrophobicContact CD2-CE2 3.96Å; Y628-F757 HydrophobicContact CD2-CZ 4.46Å; Y628-F757 AromaticContact CE1-CE2 3.92Å; Y628-F757 HydrophobicContact CE1-CE2 3.92Å; Y628-F757 AromaticContact CE1-CZ 3.48Å; Y628-F757 HydrophobicContact CE1-CZ 3.48Å; Y628-F757 VanDerWaalsContact CE1-CZ 3.48Å; Y628-F757 HydrophobicContact CE2-CE2 4.32Å; Y628-F757 HydrophobicContact CE2-CZ 4.47Å; Y628-F757 AromaticContact CG-CE2 3.52Å; Y628-F757 HydrophobicContact CG-CE2 3.52Å; Y628-F757 AromaticContact CG-CZ 3.98Å; Y628-F757 HydrophobicContact CG-CZ 3.98Å; K669-F757 HydrophobicContact CG-CE1 4.03Å; K669-F757 HydrophobicContact CG-CZ 3.94Å; L672-F757 HydrophobicContact CD1-CD1 4.41Å; L672-F757 HydrophobicContact CD1-CE1 3.81Å; L732-F757 HydrophobicContact CD1-CE1 4.26Å; L736-F757 HydrophobicContact CD1-CB 4.39Å; L736-F757 HydrophobicContact CD1-CD1 4.31Å; L736-F757 HydrophobicContact CD1-CD2 4.01Å; L736-F757 HydrophobicContact CD1-CE2 4.32Å; L736-F757 HydrophobicContact CD1-CG 3.99Å; L736-F757 HydrophobicContact CD2-CD2 3.75Å; L736-F757 HydrophobicContact CD2-CE2 3.38Å; L736-F757 HydrophobicContact CD2-CG 4.49Å; L736-F757 HydrophobicContact CD2-CZ 3.85Å; L736-F757 HydrophobicContact CG-CE2 4.48Å; L753-F757 PolarHBondContact O-N 2.86Å; A754-F757 PolarHBondContact O-N 2.8Å; F757-V760 CarbonylContact O-C 3.49Å; F757-V760 WeakPolarHBondContact O-CA 3.4Å; F757-V760 WeakPolarHBondContact O-CB 3.46Å; F757-V760 PolarHBondContact O-N 3.28Å; F757-L761 HydrophobicContact CB-CD1 4.2Å; F757-L761 HydrophobicContact CB-CG 4.38Å; F757-L761 HydrophobicContact CD1-CD1 4.29Å; F757-L761 HydrophobicContact CD1-CD2 4.48Å; F757-L761 HydrophobicContact CD1-CG 4.24Å; F757-L761 WeakPolarHBondContact O-CG 3.44Å; F757-L761 PolarHBondContact O-N 3.34Å; F757-L795 HydrophobicContact CB-CD2 3.4Å
758	G	91.9	Very high	80.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-54.5	-49.6	179.2	0	0	0	0	0	112	A754 V760 L762	A754-G758 WeakPolarHBondContact O-CA 3.45Å; A754-G758 PolarHBondContact O-N 3.48Å; G758-V760 VanDerWaalsContact C-N 3.26Å; G758-V760 PolarHBondContact O-N 2.94Å; G758-L762 WeakPolarHBondContact O-CB 3.48Å; G758-L762 PolarHBondContact O-N 3.45Å
759	P	87.7	Confident	77.5	Confident	52 Å²	52	51.9 Å²	51.9	34%	0.338	29%	0.292	S	S	.	.	H	α-helix	trans	-63.4	-26.4	172.6	-24.1	35.4	0	0	0	114.6	S763	P759-S763 WeakPolarHBondContact CA-OG 3.42Å; P759-S763 WeakPolarHBondContact O-CB 3.24Å; P759-S763 PolarHBondContact O-N 3.11Å; P759-S763 PolarHBondContact O-OG 3.01Å
760	V	89.3	Confident	74.5	Confident	21 Å²	21	54.6 Å²	54.6	13%	0.127	31%	0.311	C	S	.	.	H	α-helix	trans	-83.1	-35.2	-176.3	175.8	0	0	0	0	112.3	L672 R673 C756 F757 G758	L672-V760 HydrophobicContact CB-CG1 3.68Å; R673-V760 HydrophobicContact CB-CG1 4.21Å; C756-V760 WeakPolarHBondContact O-CG2 3.36Å; F757-V760 CarbonylContact O-C 3.49Å; F757-V760 WeakPolarHBondContact O-CA 3.4Å; F757-V760 WeakPolarHBondContact O-CB 3.46Å; F757-V760 PolarHBondContact O-N 3.28Å; G758-V760 VanDerWaalsContact C-N 3.26Å; G758-V760 PolarHBondContact O-N 2.94Å
761	L	89.4	Confident	71.5	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-95	-18.2	-173.5	-61.9	-178.5	0	0	0	114.5	L672 P678 L679 I680 L732 F757 L795	L672-L761 HydrophobicContact CB-CD2 4.28Å; L672-L761 HydrophobicContact CD1-CD2 4.21Å; L672-L761 HydrophobicContact CD2-CD2 4.07Å; L672-L761 HydrophobicContact CG-CD2 4.43Å; P678-L761 WeakPolarHBondContact CB-O 3.45Å; L679-L761 HydrophobicContact CB-CD2 4.32Å; L679-L761 HydrophobicContact CD2-CD2 4.26Å; L679-L761 PolarHBondContact N-O 2.93Å; I680-L761 HydrophobicContact CD1-CB 3.9Å; I680-L761 HydrophobicContact CD1-CD1 4.2Å; I680-L761 HydrophobicContact CG1-CB 4.15Å; I680-L761 PolarHBondContact N-O 3.09Å; I680-L761 VanDerWaalsContact N-O 3.15Å; L732-L761 HydrophobicContact CD2-CD1 3.83Å; L732-L761 HydrophobicContact CD2-CD2 3.68Å; L732-L761 HydrophobicContact CD2-CG 4.39Å; F757-L761 HydrophobicContact CB-CD1 4.2Å; F757-L761 HydrophobicContact CB-CG 4.38Å; F757-L761 HydrophobicContact CD1-CD1 4.29Å; F757-L761 HydrophobicContact CD1-CD2 4.48Å; F757-L761 HydrophobicContact CD1-CG 4.24Å; F757-L761 WeakPolarHBondContact O-CG 3.44Å; F757-L761 PolarHBondContact O-N 3.34Å; L761-L795 HydrophobicContact CD1-CD1 4.26Å; L761-L795 HydrophobicContact CD1-CD2 4.03Å
762	L	79.1	Confident	68.8	Low	17 Å²	17	65 Å²	65	9%	0.089	37%	0.368	C	S	.	.	H	α-helix	trans	-120.6	-20.5	-173.8	-75.7	158	0	0	0	114.4	I680 Y685 G758 Q764 H791 V794	I680-L762 HydrophobicContact CB-CD2 3.62Å; I680-L762 HydrophobicContact CB-CG 3.98Å; I680-L762 HydrophobicContact CD1-CD1 4.32Å; I680-L762 HydrophobicContact CD1-CG 4.16Å; I680-L762 HydrophobicContact CG2-CD2 3.46Å; I680-L762 VanDerWaalsContact CG2-CD2 3.46Å; I680-L762 HydrophobicContact CG2-CG 4.24Å; Y685-L762 HydrophobicContact CD2-CD1 4.14Å; Y685-L762 HydrophobicContact CD2-CD2 3.47Å; Y685-L762 VanDerWaalsContact CD2-CD2 3.47Å; Y685-L762 HydrophobicContact CD2-CG 4.45Å; Y685-L762 HydrophobicContact CE2-CD1 4.37Å; Y685-L762 HydrophobicContact CE2-CD2 4.28Å; Y685-L762 HydrophobicContact CG-CD2 3.94Å; G758-L762 WeakPolarHBondContact O-CB 3.48Å; G758-L762 PolarHBondContact O-N 3.45Å; L762-Q764 PolarHBondContact O-N 2.86Å; L762-H791 HydrophobicContact CB-CB 4.07Å; L762-H791 WeakPolarHBondContact CB-ND1 3.45Å; L762-H791 HydrophobicContact CD1-CB 3.65Å; L762-H791 WeakPolarHBondContact CD1-O 3.41Å; L762-H791 HydrophobicContact CG-CB 4.5Å; L762-V794 HydrophobicContact CD1-CG1 4.38Å
763	S	71.2	Confident	65.8	Low	58 Å²	58	68.3 Å²	68.3	41%	0.406	39%	0.386	S	S	.	.	S	Bend	trans	-83.6	108.5	175.3	-38.3	0	0	0	0	108.8	P759 R765	P759-S763 WeakPolarHBondContact CA-OG 3.42Å; P759-S763 WeakPolarHBondContact O-CB 3.24Å; P759-S763 PolarHBondContact O-N 3.11Å; P759-S763 PolarHBondContact O-OG 3.01Å; S763-R765 PolarHBondContact O-N 2.84Å
764	Q	60.3	Low	63.5	Low	118 Å²	118	80.6 Å²	80.6	55%	0.551	43%	0.432	S	S	*	.			trans	-58.1	138.8	171.2	-175.2	170.4	-2.5	0	0	110	P678 L762 Q766	P678-Q764 HydrophobicContact CG-CB 4.34Å; L762-Q764 PolarHBondContact O-N 2.86Å; Q764-Q766 VanDerWaalsContact C-N 3.28Å; Q764-Q766 PolarHBondContact O-N 2.9Å
765	R	49.5	Very low	60.8	Low	97 Å²	97	85.8 Å²	85.8	37%	0.366	46%	0.464	S	S	.	.			trans	-63.7	91	168.4	176.7	173.8	163.3	168.7	-6.8	108.3	S763 E767	S763-R765 PolarHBondContact O-N 2.84Å; R765-E767 VanDerWaalsContact C-N 3.25Å; R765-E767 IonicContact CZ-OE1 3.68Å; R765-E767 IonicContact NE-OE1 2.98Å; R765-E767 PolarHBondContact NE-OE1 2.95Å; R765-E767 IonicContact NH2-OE1 3.7Å; R765-E767 PolarHBondContact NH2-OE1 3.39Å; R765-E767 PolarHBondContact O-N 2.78Å
766	Q	43	Very low	58.3	Low	160 Å²	160	91.9 Å²	91.9	75%	0.748	48%	0.484	S	S	*	.			trans	-71.3	85.6	177.8	-166.2	172.9	57.6	0	0	108.7	Q764 A768	Q764-Q766 VanDerWaalsContact C-N 3.28Å; Q764-Q766 PolarHBondContact O-N 2.9Å; Q766-A768 PolarHBondContact O-N 3.34Å
767	E	35.2	Very low	55.8	Low	93 Å²	93	97 Å²	97	44%	0.435	51%	0.509	S	S	.	.			trans	-51.7	130.8	173.7	-84.8	-60.6	154.9	0	0	110.3	R765 S769	R765-E767 VanDerWaalsContact C-N 3.25Å; R765-E767 IonicContact CZ-OE1 3.68Å; R765-E767 IonicContact NE-OE1 2.98Å; R765-E767 PolarHBondContact NE-OE1 2.95Å; R765-E767 IonicContact NH2-OE1 3.7Å; R765-E767 PolarHBondContact NH2-OE1 3.39Å; R765-E767 PolarHBondContact O-N 2.78Å; E767-S769 PolarHBondContact O-N 3.11Å
768	A	33.7	Very low	53.1	Low	109 Å²	109	103.3 Å²	103.3	90%	0.901	54%	0.542	S	S	*	.			trans	-79.7	23.8	-179.1	0	0	0	0	0	112.5	Q766	Q766-A768 PolarHBondContact O-N 3.34Å
769	S	37.3	Very low	51.3	Low	73 Å²	73	107.9 Å²	107.9	51%	0.51	57%	0.574	S	S	.	*			trans	-97.2	113.9	-179.7	59	0	0	0	0	110.7	E767	E767-S769 PolarHBondContact O-N 3.11Å
770	C	32.5	Very low	49.6	Very low	103 Å²	103	112.4 Å²	112.4	70%	0.696	59%	0.591	S	S	*	*			trans	51.2	130.7	175.3	53.7	0	0	0	0	116.9
771	H	31.9	Very low	47.6	Very low	163 Å²	163	116.9 Å²	116.9	76%	0.755	61%	0.61	S	S	*	*			cis	-132	128.9	49.5	-73.7	58.3	0	0	0	114.6	N773	H771-N773 PolarHBondContact O-N 3.29Å
772	T	38.6	Very low	45.8	Very low	142 Å²	142	122.6 Å²	122.6	87%	0.871	64%	0.641	S	S	*	*			trans	-75	65.7	158.8	52	0	0	0	0	110.8
773	N	33.4	Very low	44.4	Very low	127 Å²	127	123.7 Å²	123.7	68%	0.679	65%	0.652	S	S	*	*			trans	-145.6	118.2	167.1	-97.5	-39.6	0	0	0	110.1	H771 V775	H771-N773 PolarHBondContact O-N 3.29Å; N773-V775 VanDerWaalsContact C-N 3.28Å; N773-V775 PolarHBondContact O-N 2.82Å
774	R	48.3	Very low	43.5	Very low	258 Å²	258	123.8 Å²	123.8	97%	0.974	65%	0.652	S	S	*	*			trans	-79	80.2	172.4	-78.7	179.5	164.7	-176.4	-5.7	109.5
775	V	39.4	Very low	43	Very low	108 Å²	108	121.6 Å²	121.6	66%	0.655	66%	0.655	S	S	*	*	S	Bend	trans	-124.1	143.1	161.5	-172.5	0	0	0	0	106.6	N773 I777	N773-V775 VanDerWaalsContact C-N 3.28Å; N773-V775 PolarHBondContact O-N 2.82Å; V775-I777 PolarHBondContact O-N 3.44Å; V775-I777 VanDerWaalsContact O-N 3.08Å
776	F	42.9	Very low	43	Very low	205 Å²	205	122.9 Å²	122.9	90%	0.899	67%	0.668	S	S	*	*			trans	-46.4	111.9	-173.1	-61.4	-96.6	0	0	0	112.1
777	I	42	Very low	44.1	Very low	134 Å²	134	118.5 Å²	118.5	69%	0.687	65%	0.648	S	S	*	*			trans	-73.8	131.1	164.5	-62.6	175.4	0	0	0	106.4	V775 E781	V775-I777 PolarHBondContact O-N 3.44Å; V775-I777 VanDerWaalsContact O-N 3.08Å; I777-E781 HydrophobicContact CG2-CB 4.48Å; I777-E781 WeakPolarHBondContact CG2-OE2 3.39Å
778	D	39.5	Very low	46.1	Very low	132 Å²	132	120.3 Å²	120.3	71%	0.706	65%	0.654	S	S	*	*			trans	-66.9	144.6	-172.9	-116.5	-45.7	0	0	0	112.2	E780 E781	D778-E780 PolarHBondContact O-N 3.49Å; D778-E781 PolarHBondContact O-N 2.87Å
779	S	52.6	Low	48.6	Very low	96 Å²	96	121.4 Å²	121.4	67%	0.671	64%	0.639	S	S	*	*	H	α-helix	trans	-67.2	-11.8	-173.2	-168.5	0	0	0	0	113.4	A783	S779-A783 WeakPolarHBondContact O-CB 3.46Å; S779-A783 PolarHBondContact O-N 3.31Å
780	E	52.4	Low	51	Low	146 Å²	146	121.7 Å²	121.7	68%	0.682	63%	0.631	S	S	*	*	H	α-helix	trans	-74	-40.5	177.5	-169.3	171.4	-121.9	0	0	112.2	D778 L782 A783 S784	D778-E780 PolarHBondContact O-N 3.49Å; E780-L782 VanDerWaalsContact C-N 3.34Å; E780-L782 PolarHBondContact O-N 2.91Å; E780-A783 WeakPolarHBondContact O-CA 3.15Å; E780-A783 WeakPolarHBondContact O-CB 3.44Å; E780-A783 PolarHBondContact O-N 2.9Å; E780-S784 PolarHBondContact O-N 3.42Å; E780-S784 PolarHBondContact O-OG 3.25Å
781	E	48.3	Very low	53.6	Low	115 Å²	115	117.7 Å²	117.7	54%	0.537	60%	0.602	S	S	.	*	H	α-helix	trans	-68.3	-35.3	-177.3	-165.6	175.3	-142.2	0	0	111.6	I777 D778 S784	I777-E781 HydrophobicContact CG2-CB 4.48Å; I777-E781 WeakPolarHBondContact CG2-OE2 3.39Å; D778-E781 PolarHBondContact O-N 2.87Å; E781-S784 WeakPolarHBondContact CA-OG 3.48Å; E781-S784 PolarHBondContact O-OG 2.9Å
782	L	50.1	Low	56.5	Low	121 Å²	121	110.9 Å²	110.9	63%	0.634	57%	0.571	S	S	*	*	H	α-helix	trans	-72.3	-28.3	171.4	-168.4	64.9	0	0	0	112.4	E780 A785	E780-L782 VanDerWaalsContact C-N 3.34Å; E780-L782 PolarHBondContact O-N 2.91Å; L782-A785 PolarHBondContact O-N 2.8Å
783	A	51.5	Low	59	Low	40 Å²	40	107.4 Å²	107.4	33%	0.331	55%	0.545	S	S	.	.	H	α-helix	trans	-71.6	-35.3	175.3	0	0	0	0	0	112.2	S779 E780 A785 L786	S779-A783 WeakPolarHBondContact O-CB 3.46Å; S779-A783 PolarHBondContact O-N 3.31Å; E780-A783 WeakPolarHBondContact O-CA 3.15Å; E780-A783 WeakPolarHBondContact O-CB 3.44Å; E780-A783 PolarHBondContact O-N 2.9Å; A783-A785 VanDerWaalsContact C-N 3.3Å; A783-A785 PolarHBondContact O-N 3.12Å; A783-L786 PolarHBondContact O-N 2.85Å; A783-L786 VanDerWaalsContact O-N 3.08Å
784	S	50.9	Low	61.8	Low	59 Å²	59	101.4 Å²	101.4	41%	0.413	51%	0.512	S	S	.	.	H	α-helix	trans	-58.9	-39.3	170.8	23.2	0	0	0	0	112.7	E780 E781 L786 H787	E780-S784 PolarHBondContact O-N 3.42Å; E780-S784 PolarHBondContact O-OG 3.25Å; E781-S784 WeakPolarHBondContact CA-OG 3.48Å; E781-S784 PolarHBondContact O-OG 2.9Å; S784-L786 PolarHBondContact O-N 2.85Å; S784-H787 PolarHBondContact O-N 2.9Å; S784-H787 VanDerWaalsContact O-N 3.16Å
785	A	50	Low	64	Low	73 Å²	73	89.1 Å²	89.1	60%	0.603	47%	0.466	S	S	*	.	H	α-helix	trans	-64.8	-21.2	175.9	0	0	0	0	0	113.7	L782 A783 H787	L782-A785 PolarHBondContact O-N 2.8Å; A783-A785 VanDerWaalsContact C-N 3.3Å; A783-A785 PolarHBondContact O-N 3.12Å; A785-H787 VanDerWaalsContact C-N 3.34Å
786	L	49.1	Very low	66.7	Low	124 Å²	124	85.5 Å²	85.5	65%	0.649	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	7.7	177.6	-74.3	164.2	0	0	0	113.6	A783 S784	A783-L786 PolarHBondContact O-N 2.85Å; A783-L786 VanDerWaalsContact O-N 3.08Å; S784-L786 PolarHBondContact O-N 2.85Å
787	H	67.6	Low	69.1	Low	68 Å²	68	76 Å²	76	32%	0.315	40%	0.4	S	S	.	.			trans	-120.1	28.9	-170.4	-79.8	-10.1	0	0	0	115.4	S784 A785 K789 K790 H791	S784-H787 PolarHBondContact O-N 2.9Å; S784-H787 VanDerWaalsContact O-N 3.16Å; A785-H787 VanDerWaalsContact C-N 3.34Å; H787-K789 PolarHBondContact O-N 3.37Å; H787-K789 VanDerWaalsContact O-N 3.08Å; H787-K790 HydrophobicContact CB-CB 4.24Å; H787-K790 HydrophobicContact CB-CD 4.19Å; H787-K790 HydrophobicContact CB-CG 4.3Å; H787-K790 PolarHBondContact CD2-NZ 3.31Å; H787-K790 VanDerWaalsContact CD2-NZ 3.34Å; H787-K790 WeakPolarHBondContact NE2-CE 3.49Å; H787-K790 PolarHBondContact NE2-NZ 3.46Å; H787-K790 WeakPolarHBondContact O-CA 3.13Å; H787-K790 WeakPolarHBondContact O-CB 3.3Å; H787-K790 PolarHBondContact O-N 3.26Å; H787-H791 PolarHBondContact O-CD2 3.39Å; H787-H791 PolarHBondContact O-N 2.66Å
788	F	77.4	Confident	71.6	Confident	130 Å²	130	69.6 Å²	69.6	57%	0.57	37%	0.368	S	S	*	.	H	α-helix	trans	-51.7	-31.9	168	69.8	-90.5	0	0	0	113.2	H791 I792	F788-H791 PolarHBondContact O-N 2.67Å; F788-I792 HydrophobicContact CD2-CD1 4.29Å; F788-I792 WeakPolarHBondContact O-CD1 3.28Å; F788-I792 VanDerWaalsContact O-CG1 3.27Å; F788-I792 WeakPolarHBondContact O-CG1 3.41Å; F788-I792 PolarHBondContact O-N 2.95Å
789	K	85.2	Confident	74.2	Confident	132 Å²	132	63.3 Å²	63.3	57%	0.574	33%	0.334	S	S	*	.	H	α-helix	trans	-60.6	-46.2	172	-171.9	177	-174.4	-81	0	111.9	H787 H791 I792 E793	H787-K789 PolarHBondContact O-N 3.37Å; H787-K789 VanDerWaalsContact O-N 3.08Å; K789-H791 VanDerWaalsContact C-N 3.34Å; K789-H791 PolarHBondContact O-N 3.44Å; K789-I792 WeakPolarHBondContact O-CB 3.19Å; K789-I792 PolarHBondContact O-N 3.4Å; K789-E793 IonicContact NZ-OE1 3.23Å; K789-E793 PolarHBondContact NZ-OE1 2.86Å; K789-E793 VanDerWaalsContact O-CG 3.27Å; K789-E793 WeakPolarHBondContact O-CG 3.44Å; K789-E793 PolarHBondContact O-N 2.82Å
790	K	86.8	Confident	76.1	Confident	79 Å²	79	61.1 Å²	61.1	34%	0.343	31%	0.313	S	S	.	.	H	α-helix	trans	-66.2	-34.9	175	-64.8	-174.7	178.9	168.3	0	112.2	Y685 H787 I792 E793 V794	Y685-K790 WeakPolarHBondContact OH-CB 3.27Å; H787-K790 HydrophobicContact CB-CB 4.24Å; H787-K790 HydrophobicContact CB-CD 4.19Å; H787-K790 HydrophobicContact CB-CG 4.3Å; H787-K790 PolarHBondContact CD2-NZ 3.31Å; H787-K790 VanDerWaalsContact CD2-NZ 3.34Å; H787-K790 WeakPolarHBondContact NE2-CE 3.49Å; H787-K790 PolarHBondContact NE2-NZ 3.46Å; H787-K790 WeakPolarHBondContact O-CA 3.13Å; H787-K790 WeakPolarHBondContact O-CB 3.3Å; H787-K790 PolarHBondContact O-N 3.26Å; K790-I792 VanDerWaalsContact C-N 3.28Å; K790-I792 PolarHBondContact O-N 3.3Å; K790-E793 WeakPolarHBondContact CA-OE2 3.28Å; K790-E793 PolarHBondContact O-N 2.71Å; K790-V794 WeakPolarHBondContact O-CB 3.15Å; K790-V794 WeakPolarHBondContact O-CG2 3.4Å; K790-V794 PolarHBondContact O-N 2.87Å
791	H	87.9	Confident	77.9	Confident	19 Å²	19	54.5 Å²	54.5	9%	0.088	28%	0.282	C	S	.	.	H	α-helix	trans	-63.6	-37	175.1	-65	-170.7	0	0	0	111.7	Y685 L762 H787 F788 K789 L795	Y685-H791 AromaticContact CE2-CD2 3.66Å; Y685-H791 AromaticContact CZ-CD2 3.78Å; L762-H791 HydrophobicContact CB-CB 4.07Å; L762-H791 WeakPolarHBondContact CB-ND1 3.45Å; L762-H791 HydrophobicContact CD1-CB 3.65Å; L762-H791 WeakPolarHBondContact CD1-O 3.41Å; L762-H791 HydrophobicContact CG-CB 4.5Å; H787-H791 PolarHBondContact O-CD2 3.39Å; H787-H791 PolarHBondContact O-N 2.66Å; F788-H791 PolarHBondContact O-N 2.67Å; K789-H791 VanDerWaalsContact C-N 3.34Å; K789-H791 PolarHBondContact O-N 3.44Å; H791-L795 PolarHBondContact O-N 3.26Å
792	I	92.4	Very high	80.1	Confident	21 Å²	21	49.2 Å²	49.2	11%	0.108	26%	0.257	C	S	.	.	H	α-helix	trans	-69.6	-44.7	172.7	-64.9	163.5	0	0	0	110.3	A754 V755 F788 K789 K790 V794 L795 H796	A754-I792 HydrophobicContact CB-CG2 4.03Å; V755-I792 HydrophobicContact CG2-CD1 4.25Å; V755-I792 HydrophobicContact CG2-CG2 3.9Å; F788-I792 HydrophobicContact CD2-CD1 4.29Å; F788-I792 WeakPolarHBondContact O-CD1 3.28Å; F788-I792 VanDerWaalsContact O-CG1 3.27Å; F788-I792 WeakPolarHBondContact O-CG1 3.41Å; F788-I792 PolarHBondContact O-N 2.95Å; K789-I792 WeakPolarHBondContact O-CB 3.19Å; K789-I792 PolarHBondContact O-N 3.4Å; K790-I792 VanDerWaalsContact C-N 3.28Å; K790-I792 PolarHBondContact O-N 3.3Å; I792-V794 PolarHBondContact O-N 2.89Å; I792-L795 PolarHBondContact O-N 2.83Å; I792-H796 WeakPolarHBondContact O-CB 3.45Å; I792-H796 PolarHBondContact O-N 2.84Å
793	E	91.4	Very high	81.9	Confident	69 Å²	69	44.6 Å²	44.6	32%	0.322	24%	0.235	S	C	.	.	H	α-helix	trans	-62.5	-42	179.1	-70.3	162.1	166.9	0	0	112.9	M692 K789 K790 H796 Y797	M692-E793 HydrophobicContact CE-CB 4.11Å; K789-E793 IonicContact NZ-OE1 3.23Å; K789-E793 PolarHBondContact NZ-OE1 2.86Å; K789-E793 VanDerWaalsContact O-CG 3.27Å; K789-E793 WeakPolarHBondContact O-CG 3.44Å; K789-E793 PolarHBondContact O-N 2.82Å; K790-E793 WeakPolarHBondContact CA-OE2 3.28Å; K790-E793 PolarHBondContact O-N 2.71Å; E793-H796 PolarHBondContact O-N 3.15Å; E793-Y797 WeakPolarHBondContact O-CB 3.49Å; E793-Y797 PolarHBondContact O-N 2.89Å
794	V	92.6	Very high	83.1	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.6	-46	175.7	161.7	0	0	0	0	111.6	Y685 V688 L689 M692 L762 K790 I792 H796 Y797 L798	Y685-V794 HydrophobicContact CD2-CB 4.23Å; Y685-V794 HydrophobicContact CD2-CG1 3.96Å; Y685-V794 HydrophobicContact CD2-CG2 3.96Å; Y685-V794 HydrophobicContact CE2-CB 4.14Å; Y685-V794 HydrophobicContact CE2-CG1 4.38Å; Y685-V794 HydrophobicContact CE2-CG2 3.68Å; V688-V794 HydrophobicContact CB-CG1 4.1Å; V688-V794 HydrophobicContact CG1-CB 4.45Å; V688-V794 HydrophobicContact CG1-CG1 3.8Å; V688-V794 HydrophobicContact CG1-CG2 4.37Å; L689-V794 HydrophobicContact CD2-CG2 3.58Å; L689-V794 HydrophobicContact CG-CG2 3.95Å; M692-V794 HydrophobicContact SD-CB 4.42Å; M692-V794 HydrophobicContact SD-CG2 3.7Å; L762-V794 HydrophobicContact CD1-CG1 4.38Å; K790-V794 WeakPolarHBondContact O-CB 3.15Å; K790-V794 WeakPolarHBondContact O-CG2 3.4Å; K790-V794 PolarHBondContact O-N 2.87Å; I792-V794 PolarHBondContact O-N 2.89Å; V794-H796 VanDerWaalsContact C-N 3.34Å; V794-Y797 WeakPolarHBondContact O-CB 3.37Å; V794-Y797 PolarHBondContact O-N 2.92Å; V794-L798 WeakPolarHBondContact O-CG 3.17Å; V794-L798 PolarHBondContact O-N 2.86Å
795	L	94.8	Very high	83.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-70	-33.7	177.4	-175.5	57.9	0	0	0	112	I680 L733 A754 F757 L761 H791 I792 L799	I680-L795 HydrophobicContact CD1-CD1 4.32Å; L733-L795 HydrophobicContact CD2-CD1 3.75Å; A754-L795 HydrophobicContact CB-CB 4.29Å; A754-L795 HydrophobicContact CB-CG 4.34Å; F757-L795 HydrophobicContact CB-CD2 3.4Å; L761-L795 HydrophobicContact CD1-CD1 4.26Å; L761-L795 HydrophobicContact CD1-CD2 4.03Å; H791-L795 PolarHBondContact O-N 3.26Å; I792-L795 PolarHBondContact O-N 2.83Å; L795-L799 HydrophobicContact CD1-CD1 4.35Å; L795-L799 HydrophobicContact CD1-CG 4.27Å; L795-L799 HydrophobicContact CG-CD1 4.11Å; L795-L799 HydrophobicContact CG-CG 4.47Å; L795-L799 WeakPolarHBondContact O-CB 3.05Å; L795-L799 VanDerWaalsContact O-CG 3.29Å; L795-L799 WeakPolarHBondContact O-CG 3.41Å; L795-L799 PolarHBondContact O-N 2.84Å
796	H	94.6	Very high	84.1	Confident	33 Å²	33	49.3 Å²	49.3	15%	0.153	23%	0.227	C	C	.	.	H	α-helix	trans	-62.8	-44	172.2	-178.2	-113.6	0	0	0	111.4	Q751 A754 I792 E793 V794 L799 Q800	Q751-H796 PolarHBondContact N-CD2 2.88Å; Q751-H796 PolarHBondContact OE1-CD2 3.37Å; Q751-H796 VanDerWaalsContact OE1-CG 3.25Å; A754-H796 HydrophobicContact CB-CB 3.86Å; I792-H796 WeakPolarHBondContact O-CB 3.45Å; I792-H796 PolarHBondContact O-N 2.84Å; E793-H796 PolarHBondContact O-N 3.15Å; V794-H796 VanDerWaalsContact C-N 3.34Å; H796-L799 PolarHBondContact O-N 2.9Å; H796-Q800 VanDerWaalsContact O-CB 3.23Å; H796-Q800 WeakPolarHBondContact O-CB 3.31Å; H796-Q800 PolarHBondContact O-N 3.38Å
797	Y	93.8	Very high	84.2	Confident	5 Å²	5	46.7 Å²	46.7	2%	0.02	21%	0.214	C	C	.	.	H	α-helix	trans	-57.8	-51.7	175.4	-175.6	-95.6	0	0	0	111.7	V688 T691 M692 R695 L697 E793 V794 L799 Q800 L801	V688-Y797 HydrophobicContact CG1-CD1 3.76Å; V688-Y797 HydrophobicContact CG1-CE1 4.36Å; T691-Y797 HydrophobicContact CG2-CE1 4.05Å; T691-Y797 WeakPolarHBondContact CG2-OH 3.33Å; M692-Y797 HydrophobicContact CB-CD2 4.46Å; M692-Y797 HydrophobicContact CB-CE2 4.41Å; M692-Y797 HydrophobicContact CG-CD1 3.7Å; M692-Y797 HydrophobicContact CG-CD2 3.46Å; M692-Y797 VanDerWaalsContact CG-CD2 3.46Å; M692-Y797 HydrophobicContact CG-CE1 3.98Å; M692-Y797 HydrophobicContact CG-CE2 3.76Å; M692-Y797 HydrophobicContact CG-CG 3.43Å; M692-Y797 VanDerWaalsContact CG-CG 3.43Å; M692-Y797 HydrophobicContact SD-CD1 4.48Å; M692-Y797 HydrophobicContact SD-CD2 4.43Å; M692-Y797 HydrophobicContact SD-CG 4.04Å; R695-Y797 WeakPolarHBondContact O-CE2 3.39Å; R695-Y797 PolarHBondContact O-OH 2.83Å; L697-Y797 HydrophobicContact CD1-CD2 4.02Å; L697-Y797 HydrophobicContact CD2-CD2 3.7Å; L697-Y797 HydrophobicContact CD2-CE2 3.81Å; L697-Y797 HydrophobicContact CG-CD2 3.59Å; L697-Y797 HydrophobicContact CG-CE2 3.86Å; E793-Y797 WeakPolarHBondContact O-CB 3.49Å; E793-Y797 PolarHBondContact O-N 2.89Å; V794-Y797 WeakPolarHBondContact O-CB 3.37Å; V794-Y797 PolarHBondContact O-N 2.92Å; Y797-L799 PolarHBondContact O-N 3.41Å; Y797-Q800 PolarHBondContact O-N 2.77Å; Y797-L801 HydrophobicContact CD1-CD1 4.03Å; Y797-L801 HydrophobicContact CD2-CD1 4.14Å; Y797-L801 HydrophobicContact CE1-CD1 3.46Å; Y797-L801 VanDerWaalsContact CE1-CD1 3.46Å; Y797-L801 HydrophobicContact CE2-CD1 3.59Å; Y797-L801 HydrophobicContact CG-CD1 4.33Å; Y797-L801 PolarHBondContact O-N 2.74Å; Y797-L801 VanDerWaalsContact O-N 3.08Å; Y797-L801 WeakPolarHBondContact OH-CD1 3.45Å
798	L	94.3	Very high	83.4	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-54.9	-49.3	175.7	-72.2	175.2	0	0	0	111.8	I680 V688 T714 V794 W802	I680-L798 HydrophobicContact CD1-CD1 4.28Å; V688-L798 HydrophobicContact CG1-CD2 4.37Å; V688-L798 HydrophobicContact CG1-CG 4.34Å; V688-L798 HydrophobicContact CG2-CD1 4.44Å; V688-L798 HydrophobicContact CG2-CD2 3.79Å; V688-L798 HydrophobicContact CG2-CG 4.28Å; T714-L798 HydrophobicContact CG2-CD2 3.79Å; V794-L798 WeakPolarHBondContact O-CG 3.17Å; V794-L798 PolarHBondContact O-N 2.86Å; L798-W802 WeakPolarHBondContact O-CB 3.48Å; L798-W802 PolarHBondContact O-N 2.67Å
799	L	94.3	Very high	82	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-69.5	-32.3	-179.7	-69.1	173.2	0	0	0	113.4	L733 L736 K737 C750 L753 L795 H796 Y797	L733-L799 HydrophobicContact CD2-CD2 3.76Å; L733-L799 HydrophobicContact CD2-CG 4.33Å; L736-L799 HydrophobicContact CB-CD1 4.44Å; L736-L799 HydrophobicContact CB-CD2 3.62Å; L736-L799 HydrophobicContact CD1-CD2 4.48Å; K737-L799 WeakPolarHBondContact CD-O 3.41Å; K737-L799 PolarHBondContact NZ-O 2.9Å; C750-L799 HydrophobicContact CB-CB 4.11Å; L753-L799 HydrophobicContact CB-CD1 4.26Å; L795-L799 HydrophobicContact CD1-CD1 4.35Å; L795-L799 HydrophobicContact CD1-CG 4.27Å; L795-L799 HydrophobicContact CG-CD1 4.11Å; L795-L799 HydrophobicContact CG-CG 4.47Å; L795-L799 WeakPolarHBondContact O-CB 3.05Å; L795-L799 VanDerWaalsContact O-CG 3.29Å; L795-L799 WeakPolarHBondContact O-CG 3.41Å; L795-L799 PolarHBondContact O-N 2.84Å; H796-L799 PolarHBondContact O-N 2.9Å; Y797-L799 PolarHBondContact O-N 3.41Å
800	Q	92.4	Very high	79.9	Confident	49 Å²	49	44 Å²	44	23%	0.229	22%	0.216	C	C	.	.	H	α-helix	trans	-72.3	-34.8	180	-171.1	54.5	77.5	0	0	111.7	L697 C704 K737 H796 Y797	L697-Q800 HydrophobicContact CD1-CB 4.19Å; L697-Q800 HydrophobicContact CD1-CG 4.14Å; L697-Q800 HydrophobicContact CD2-CB 4.14Å; L697-Q800 HydrophobicContact CD2-CG 4.02Å; C704-Q800 HydrophobicContact CB-CG 3.81Å; K737-Q800 PolarHBondContact NZ-O 3.43Å; H796-Q800 VanDerWaalsContact O-CB 3.23Å; H796-Q800 WeakPolarHBondContact O-CB 3.31Å; H796-Q800 PolarHBondContact O-N 3.38Å; Y797-Q800 PolarHBondContact O-N 2.77Å
801	L	91.5	Very high	77.4	Confident	8 Å²	8	46.8 Å²	46.8	4%	0.042	23%	0.23	C	C	.	.	H	α-helix	trans	-89.9	-10.4	174.5	-79.9	160.4	0	0	0	114.5	L697 N706 D710 S711 T714 Y797	L697-L801 HydrophobicContact CD2-CD1 3.76Å; L697-L801 HydrophobicContact CD2-CG 3.81Å; N706-L801 HydrophobicContact CB-CD2 3.44Å; N706-L801 VanDerWaalsContact CB-CD2 3.44Å; N706-L801 WeakPolarHBondContact ND2-CD2 3.16Å; D710-L801 HydrophobicContact CB-CD2 3.6Å; S711-L801 WeakPolarHBondContact CA-O 3.49Å; S711-L801 WeakPolarHBondContact CB-O 3.38Å; T714-L801 HydrophobicContact CG2-CB 3.89Å; T714-L801 WeakPolarHBondContact OG1-CB 3.35Å; Y797-L801 HydrophobicContact CD1-CD1 4.03Å; Y797-L801 HydrophobicContact CD2-CD1 4.14Å; Y797-L801 HydrophobicContact CE1-CD1 3.46Å; Y797-L801 VanDerWaalsContact CE1-CD1 3.46Å; Y797-L801 HydrophobicContact CE2-CD1 3.59Å; Y797-L801 HydrophobicContact CG-CD1 4.33Å; Y797-L801 PolarHBondContact O-N 2.74Å; Y797-L801 VanDerWaalsContact O-N 3.08Å; Y797-L801 WeakPolarHBondContact OH-CD1 3.45Å
802	W	93.1	Very high	75	Confident	3 Å²	3	50.3 Å²	50.3	1%	0.011	25%	0.253	C	S	.	.	S	Bend	trans	-61.1	132.6	-179.9	-156.3	-101.1	0	0	0	111.6	V715 L718 R730 L733 D734 K737 L798	V715-W802 HydrophobicContact CG1-CH2 4.49Å; V715-W802 HydrophobicContact CG2-CE3 4.29Å; V715-W802 HydrophobicContact CG2-CH2 3.98Å; V715-W802 HydrophobicContact CG2-CZ2 4.36Å; V715-W802 HydrophobicContact CG2-CZ3 3.95Å; L718-W802 HydrophobicContact CD1-CH2 3.56Å; L718-W802 HydrophobicContact CD1-CZ3 4.05Å; L718-W802 HydrophobicContact CG-CH2 4.24Å; L718-W802 HydrophobicContact CG-CZ3 4.34Å; R730-W802 HydrophobicContact CG-CZ2 4.1Å; L733-W802 HydrophobicContact CB-CD2 3.76Å; L733-W802 HydrophobicContact CB-CE3 4.05Å; L733-W802 HydrophobicContact CB-CG 4.34Å; L733-W802 HydrophobicContact CB-CH2 4.15Å; L733-W802 HydrophobicContact CB-CZ2 3.83Å; L733-W802 HydrophobicContact CB-CZ3 4.24Å; L733-W802 HydrophobicContact CD1-CD2 4.41Å; L733-W802 HydrophobicContact CD1-CE3 3.82Å; L733-W802 HydrophobicContact CD1-CH2 3.9Å; L733-W802 HydrophobicContact CD1-CZ2 4.44Å; L733-W802 HydrophobicContact CD1-CZ3 3.55Å; D734-W802 PolarHBondContact OD1-NE1 3Å; K737-W802 HydrophobicContact CB-CB 4.33Å; K737-W802 HydrophobicContact CB-CG 4.33Å; K737-W802 HydrophobicContact CD-CB 4.15Å; K737-W802 WeakPolarHBondContact CE-O 3.47Å; K737-W802 HydrophobicContact CG-CB 4.22Å; K737-W802 PolarHBondContact NZ-O 2.61Å; L798-W802 WeakPolarHBondContact O-CB 3.48Å; L798-W802 PolarHBondContact O-N 2.67Å
803	P	88.6	Confident	72.4	Confident	24 Å²	24	53.4 Å²	53.4	16%	0.156	28%	0.277	C	S	.	.			trans	-68.8	132.7	-176.9	25.5	-34.9	0	0	0	113.5	V715 Y805	V715-P803 HydrophobicContact CG2-CG 3.79Å; P803-Y805 VanDerWaalsContact C-N 3.32Å; P803-Y805 HydrophobicContact CB-CE1 4.23Å; P803-Y805 HydrophobicContact CB-CE2 4.21Å; P803-Y805 HydrophobicContact CG-CD2 4.24Å; P803-Y805 HydrophobicContact CG-CE1 4.21Å; P803-Y805 HydrophobicContact CG-CE2 3.54Å; P803-Y805 PolarHBondContact O-N 3.48Å
804	D	76.3	Confident	69.8	Low	59 Å²	59	58.6 Å²	58.6	32%	0.316	30%	0.301	S	S	.	.			trans	-81.7	69.8	174.8	-76.9	-61.5	0	0	0	112.1	K737 F806 N807 L808	K737-D804 WeakPolarHBondContact CE-OD1 3.36Å; K737-D804 WeakPolarHBondContact CE-OD2 3.49Å; K737-D804 WeakPolarHBondContact CG-OD1 3.48Å; K737-D804 IonicContact NZ-OD2 2.75Å; D804-F806 PolarHBondContact O-N 2.84Å; D804-N807 HydrophobicContact CB-CB 3.98Å; D804-N807 WeakPolarHBondContact CB-ND2 3.47Å; D804-N807 PolarHBondContact O-N 2.97Å; D804-L808 PolarHBondContact O-N 2.67Å
805	Y	66.5	Low	67.2	Low	125 Å²	125	61.4 Å²	61.4	49%	0.49	32%	0.324	S	S	.	.	H	α-helix	trans	-53.3	-28	177.8	-65.4	-61.8	0	0	0	113.7	P803 I809	P803-Y805 VanDerWaalsContact C-N 3.32Å; P803-Y805 HydrophobicContact CB-CE1 4.23Å; P803-Y805 HydrophobicContact CB-CE2 4.21Å; P803-Y805 HydrophobicContact CG-CD2 4.24Å; P803-Y805 HydrophobicContact CG-CE1 4.21Å; P803-Y805 HydrophobicContact CG-CE2 3.54Å; P803-Y805 PolarHBondContact O-N 3.48Å; Y805-I809 WeakPolarHBondContact O-CG1 3.14Å; Y805-I809 PolarHBondContact O-N 3.07Å
806	F	56.2	Low	64.2	Low	87 Å²	87	69.2 Å²	69.2	38%	0.382	37%	0.366	S	S	.	.	H	α-helix	trans	-70.7	-36.2	176.5	-167.9	-94	0	0	0	113.4	D804 S810	D804-F806 PolarHBondContact O-N 2.84Å; F806-S810 WeakPolarHBondContact O-CB 3.45Å; F806-S810 PolarHBondContact O-N 3.46Å; F806-S810 PolarHBondContact O-OG 2.91Å
807	N	50.4	Low	61.4	Low	69 Å²	69	75.2 Å²	75.2	37%	0.369	40%	0.398	S	S	.	.	H	α-helix	trans	-71.3	-38.2	176.4	-72.6	-22.9	0	0	0	110.9	D804 I809 S810 Q811	D804-N807 HydrophobicContact CB-CB 3.98Å; D804-N807 WeakPolarHBondContact CB-ND2 3.47Å; D804-N807 PolarHBondContact O-N 2.97Å; N807-I809 PolarHBondContact O-N 3.2Å; N807-S810 PolarHBondContact O-N 3.36Å; N807-Q811 WeakPolarHBondContact O-CG 3.16Å; N807-Q811 PolarHBondContact O-N 2.93Å
808	L	51.2	Low	58.4	Low	108 Å²	108	84.4 Å²	84.4	57%	0.565	44%	0.439	S	S	*	.	H	α-helix	trans	-59.3	-47.9	177.4	-160.5	73.9	0	0	0	111.3	D804 S810 Q811 T812	D804-L808 PolarHBondContact O-N 2.67Å; L808-S810 PolarHBondContact O-N 2.86Å; L808-Q811 PolarHBondContact O-N 2.73Å; L808-T812 WeakPolarHBondContact O-CG2 3.48Å; L808-T812 PolarHBondContact O-N 2.92Å; L808-T812 PolarHBondContact O-OG1 3.2Å
809	I	47.7	Very low	55.3	Low	116 Å²	116	91.7 Å²	91.7	60%	0.595	48%	0.483	S	S	*	.	H	α-helix	trans	-59.4	-47.6	175.6	-65.4	165.1	0	0	0	110.6	Y805 N807 Q811 T812 S813	Y805-I809 WeakPolarHBondContact O-CG1 3.14Å; Y805-I809 PolarHBondContact O-N 3.07Å; N807-I809 PolarHBondContact O-N 3.2Å; I809-Q811 VanDerWaalsContact C-N 3.28Å; I809-Q811 PolarHBondContact O-N 2.94Å; I809-T812 WeakPolarHBondContact CA-OG1 3.45Å; I809-T812 PolarHBondContact O-N 3.35Å; I809-T812 PolarHBondContact O-OG1 2.91Å; I809-S813 PolarHBondContact O-N 2.9Å; I809-S813 PolarHBondContact O-OG 2.88Å
810	S	40.6	Very low	52.2	Low	50 Å²	50	99 Å²	99	35%	0.35	52%	0.522	S	S	.	.	H	α-helix	trans	-61.6	-33.7	-178.9	-56.4	0	0	0	0	113.1	F806 N807 L808 S813	F806-S810 WeakPolarHBondContact O-CB 3.45Å; F806-S810 PolarHBondContact O-N 3.46Å; F806-S810 PolarHBondContact O-OG 2.91Å; N807-S810 PolarHBondContact O-N 3.36Å; L808-S810 PolarHBondContact O-N 2.86Å; S810-S813 PolarHBondContact O-OG 2.8Å
811	Q	35.7	Very low	49.5	Very low	137 Å²	137	102.2 Å²	102.2	64%	0.64	55%	0.547	S	S	*	.	H	α-helix	trans	-76.6	-38.4	175.1	-70.7	175.6	5.1	0	0	112.2	N807 L808 I809 S813 H814	N807-Q811 WeakPolarHBondContact O-CG 3.16Å; N807-Q811 PolarHBondContact O-N 2.93Å; L808-Q811 PolarHBondContact O-N 2.73Å; I809-Q811 VanDerWaalsContact C-N 3.28Å; I809-Q811 PolarHBondContact O-N 2.94Å; Q811-S813 PolarHBondContact O-N 2.78Å; Q811-H814 PolarHBondContact O-N 2.88Å
812	T	35.9	Very low	46.8	Very low	93 Å²	93	109.1 Å²	109.1	57%	0.571	58%	0.584	S	S	*	*	H	α-helix	trans	-62.4	-21.8	175.9	55.2	0	0	0	0	113.9	L808 I809 H814	L808-T812 WeakPolarHBondContact O-CG2 3.48Å; L808-T812 PolarHBondContact O-N 2.92Å; L808-T812 PolarHBondContact O-OG1 3.2Å; I809-T812 WeakPolarHBondContact CA-OG1 3.45Å; I809-T812 PolarHBondContact O-N 3.35Å; I809-T812 PolarHBondContact O-OG1 2.91Å; T812-H814 PolarHBondContact O-N 3.16Å
813	S	38.4	Very low	43.7	Very low	87 Å²	87	116 Å²	116	61%	0.608	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	-8.5	170.6	19.8	0	0	0	0	115.4	I809 S810 Q811	I809-S813 PolarHBondContact O-N 2.9Å; I809-S813 PolarHBondContact O-OG 2.88Å; S810-S813 PolarHBondContact O-OG 2.8Å; Q811-S813 PolarHBondContact O-N 2.78Å
814	H	37.8	Very low	40.9	Very low	177 Å²	177	124.3 Å²	124.3	82%	0.819	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.6	-0.7	-177.7	-79	-74.3	0	0	0	115	Q811 T812	Q811-H814 PolarHBondContact O-N 2.88Å; T812-H814 PolarHBondContact O-N 3.16Å
815	A	37.7	Very low	38.6	Very low	60 Å²	60	127.2 Å²	127.2	50%	0.496	68%	0.683	S	S	.	*	S	Bend	trans	-129.9	138	175.4	0	0	0	0	0	111.1
816	N	30.9	Very low	36.8	Very low	163 Å²	163	126.4 Å²	126.4	87%	0.872	70%	0.695	S	S	*	*			trans	74.4	88.7	179.3	-50.8	-27	0	0	0	116.3
817	L	35.8	Very low	35.6	Very low	160 Å²	160	129.9 Å²	129.9	84%	0.838	72%	0.717	S	S	*	*			trans	-93.1	161.3	145.4	-80.2	168.5	0	0	0	109.5
818	F	30.9	Very low	34.4	Very low	198 Å²	198	138.5 Å²	138.5	87%	0.868	74%	0.744	S	S	*	*			trans	73.4	93	179	-59.6	-81.7	0	0	0	118
819	V	30.2	Very low	33.4	Very low	152 Å²	152	142.2 Å²	142.2	92%	0.921	76%	0.756	S	S	*	*				-142.3	157.4	115	174.7	0	0	0	0	107.4
820	D	27.5	Very low	32.7	Very low	154 Å²	154	142.9 Å²	142.9	82%	0.824	77%	0.768	S	S	*	*			trans	-64.1	160	-169.5	-94	-55.6	0	0	0	117.5
821	P	37.2	Very low	32.1	Very low	116 Å²	116	145.4 Å²	145.4	75%	0.753	79%	0.792	S	S	*	*			trans	-94.8	119.2	-173.2	35.5	-31.8	0	0	0	114.4
822	N	33.4	Very low	32	Very low	154 Å²	154	143.3 Å²	143.3	82%	0.824	80%	0.798	S	S	*	*			trans	-152.6	163.9	147.1	-141.3	-13	0	0	0	111.7
823	D	29.1	Very low	32.1	Very low	148 Å²	148	144.6 Å²	144.6	79%	0.791	81%	0.808	S	S	*	*			trans	53.8	88.7	-179.8	-73.2	-29.1	0	0	0	117
824	Q	29.5	Very low	32.2	Very low	198 Å²	198	146.4 Å²	146.4	93%	0.925	82%	0.818	S	S	*	*			trans	-116	120.4	153.9	-73.3	-168	4.6	0	0	110.7
825	S	27.7	Very low	31.8	Very low	119 Å²	119	146.2 Å²	146.2	83%	0.832	82%	0.822	S	S	*	*			trans	-138.4	74.2	176.9	56.5	0	0	0	0	112.6
826	S	29.7	Very low	31.5	Very low	108 Å²	108	155.1 Å²	155.1	76%	0.755	84%	0.843	S	S	*	*			trans	-148.5	126	171.4	47.3	0	0	0	0	114.1
827	L	30.6	Very low	31.5	Very low	160 Å²	160	159.2 Å²	159.2	84%	0.838	85%	0.846	S	S	*	*			trans	16.5	106.8	150.3	-54.6	175.4	0	0	0	118.2
828	R	24.8	Very low	31.2	Very low	251 Å²	251	163.7 Å²	163.7	95%	0.947	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-80.8	129.2	162.3	-68.7	-177.3	-179	173	0.3	111.1
829	F	30.1	Very low	31.1	Very low	185 Å²	185	163.9 Å²	163.9	81%	0.811	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-95.3	149.3	150.8	-72.7	-86	0	0	0	109.6
830	P	33.8	Very low	30.9	Very low	130 Å²	130	165.1 Å²	165.1	84%	0.844	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-77.4	131.4	-177.1	30.3	-33.9	0	0	0	112.2
831	A	28.1	Very low	30.9	Very low	103 Å²	103	169 Å²	169	85%	0.851	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-90.1	150	175.7	0	0	0	0	0	112.6
832	A	33	Very low	30.7	Very low	93 Å²	93	169.2 Å²	169.2	77%	0.769	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-86.2	161.7	177	0	0	0	0	0	112.4
833	P	38.9	Very low	30.5	Very low	120 Å²	120	170.5 Å²	170.5	78%	0.779	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-80.6	165.4	-163.8	31.7	-36	0	0	0	115.5
834	P	38.9	Very low	30.3	Very low	125 Å²	125	173.8 Å²	173.8	81%	0.812	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-87.1	147	-160.3	33.3	-37	0	0	0	115.9
835	L	30.7	Very low	30.3	Very low	174 Å²	174	171.4 Å²	171.4	91%	0.911	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-74.2	144.1	166.1	-70.2	172.2	0	0	0	111.6
836	R	30.9	Very low	30.3	Very low	247 Å²	247	173.6 Å²	173.6	93%	0.932	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-73.4	133.4	-179.3	-72.8	-178.4	168	119.8	-3.8	111.7	R838	R836-R838 PolarHBondContact O-N 2.93Å
837	R	30.2	Very low	30.5	Very low	248 Å²	248	176 Å²	176	94%	0.936	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-57.2	133.5	167	-72.8	-178.2	171.7	-178.9	-4.3	110.5
838	R	29.4	Very low	30.4	Very low	254 Å²	254	173.6 Å²	173.6	96%	0.958	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-78.6	133.7	166.5	-140	178.1	-170.4	-163.4	3	108.2	R836	R836-R838 PolarHBondContact O-N 2.93Å
839	K	29.7	Very low	30.5	Very low	203 Å²	203	170.8 Å²	170.8	88%	0.883	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-91	140.4	-178.9	-171.2	176	177.2	-179.9	0	110.9
840	E	25.9	Very low	30.6	Very low	178 Å²	178	166.1 Å²	166.1	83%	0.832	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-68.9	161	177.3	-168.3	162.9	-146.3	0	0	113.1
841	R	28.2	Very low	30.4	Very low	235 Å²	235	168.9 Å²	168.9	89%	0.887	85%	0.851	S	S	*	*			trans	-102	114.9	-173.7	-144.6	-177.1	-164.1	175	2.7	109.1
842	P	31.8	Very low	30.6	Very low	120 Å²	120	172.8 Å²	172.8	78%	0.779	85%	0.854	S	S	*	*			trans	-72.2	142.1	174.7	30.2	-33.7	0	0	0	110.7
843	Q	30.4	Very low	30.5	Very low	181 Å²	181	173 Å²	173	85%	0.846	86%	0.856	S	S	*	*			trans	-93.9	145.1	160.2	-66.8	179.2	-16.1	0	0	109
844	F	25	Very low	30.1	Very low	218 Å²	218	170.6 Å²	170.6	96%	0.956	85%	0.852	S	S	*	*			trans	-155.5	152.3	148.6	-104.1	-71.6	0	0	0	108.8
845	L	29.1	Very low	29.6	Very low	147 Å²	147	171.1 Å²	171.1	77%	0.77	85%	0.853	S	S	*	*			trans	-92.3	162.9	-168	-69.7	161.4	0	0	0	113.2
846	N	28	Very low	29.6	Very low	166 Å²	166	170.7 Å²	170.7	89%	0.888	85%	0.851	S	S	*	*			trans	-160.5	151.6	131.3	-101.8	-49.4	0	0	0	110.4
847	L	33.2	Very low	29.8	Very low	159 Å²	159	169.6 Å²	169.6	83%	0.832	85%	0.847	S	S	*	*			trans	-128.3	142.8	-175.8	-72.2	170.4	0	0	0	111.5
848	S	27.2	Very low	30.4	Very low	108 Å²	108	164.1 Å²	164.1	76%	0.755	84%	0.843	S	S	*	*			trans	-165.1	107.3	147.3	51.6	0	0	0	0	106.8
849	E	28.6	Very low	30.6	Very low	192 Å²	192	161 Å²	161	90%	0.897	84%	0.837	S	S	*	*				77.4	111.8	74.1	-175.1	179	-152.8	0	0	112.9
850	A	31.3	Very low	31.1	Very low	87 Å²	87	157.5 Å²	157.5	72%	0.719	83%	0.834	S	S	*	*			trans	173.4	128.6	140.2	0	0	0	0	0	113.4
851	E	30.6	Very low	31.3	Very low	189 Å²	189	152.9 Å²	152.9	88%	0.883	83%	0.834	S	S	*	*			trans	63.8	90.7	142.2	-58.6	-172.4	141.8	0	0	123.7
852	M	31.9	Very low	31.3	Very low	185 Å²	185	153.3 Å²	153.3	91%	0.911	84%	0.836	S	S	*	*				58.7	133.1	109.5	-117.9	64.8	163.5	0	0	125.5
853	A	31.7	Very low	31.3	Very low	98 Å²	98	156 Å²	156	81%	0.81	84%	0.843	S	S	*	*				98.7	132.3	129.3	0	0	0	0	0	123.7
854	G	30.1	Very low	31.3	Very low	68 Å²	68	154.6 Å²	154.6	70%	0.701	84%	0.841	S	S	*	*			trans	82.2	105.2	156.6	0	0	0	0	0	117.1
855	V	28	Very low	31.8	Very low	136 Å²	136	148.9 Å²	148.9	82%	0.824	83%	0.828	S	S	*	*			cis	62.7	107.7	41	-165.8	0	0	0	0	111.3
856	L	30.5	Very low	32.2	Very low	166 Å²	166	147.6 Å²	147.6	87%	0.869	83%	0.829	S	S	*	*				-149.7	165.1	73.6	-81.2	163.9	0	0	0	114.7
857	R	35.2	Very low	32.4	Very low	224 Å²	224	144 Å²	144	85%	0.845	82%	0.817	S	S	*	*			trans	-124.1	156.7	166.1	-96.8	-177.3	176.7	151.1	-1.6	109.9
858	P	42.9	Very low	32.5	Very low	132 Å²	132	143.5 Å²	143.5	86%	0.857	82%	0.815	S	S	*	*				-126.5	173.8	103.7	-1.5	23	0	0	0	116.4
859	K	33.5	Very low	33	Very low	190 Å²	190	148.4 Å²	148.4	83%	0.826	82%	0.817	S	S	*	*			trans	-84.8	179.5	178.5	-86.2	178.9	178.5	174.8	0	112.7
860	P	40	Very low	33.1	Very low	128 Å²	128	151 Å²	151	83%	0.831	82%	0.82	S	S	*	*			cis	-128.3	157.1	-12.7	25.7	-5.1	0	0	0	115
861	G	30.4	Very low	33.1	Very low	81 Å²	81	150.8 Å²	150.8	84%	0.835	82%	0.818	S	S	*	*			trans	-159.2	115.2	165.3	0	0	0	0	0	111.6
862	R	28.8	Very low	33.1	Very low	244 Å²	244	145.4 Å²	145.4	92%	0.921	81%	0.813	S	S	*	*			trans	-106.4	106	-175.3	174.4	-164.8	174.3	-163.2	0.7	110.3
863	L	31.6	Very low	33.1	Very low	178 Å²	178	143.5 Å²	143.5	93%	0.932	81%	0.807	S	S	*	*			trans	-143.1	125.9	158.6	-75.3	178.9	0	0	0	109
864	D	30.3	Very low	33.1	Very low	151 Å²	151	150.8 Å²	150.8	81%	0.807	81%	0.814	S	S	*	*			trans	-136.9	168.8	160.8	-165.8	6.6	0	0	0	107.8
865	S	35.2	Very low	33.2	Very low	97 Å²	97	153 Å²	153	68%	0.678	82%	0.818	S	S	*	*			trans	-74	137.9	-148.8	-52.6	0	0	0	0	113.9	S867	S865-S867 PolarHBondContact O-N 3.33Å
866	P	38	Very low	33.3	Very low	121 Å²	121	149.5 Å²	149.5	79%	0.786	81%	0.81	S	S	*	*			trans	-74.5	92	173.8	30.7	-33.7	0	0	0	111.1
867	S	31.2	Very low	33.3	Very low	90 Å²	90	148 Å²	148	63%	0.629	81%	0.812	S	S	*	*			trans	-74.4	120.7	157.2	178	0	0	0	0	109.4	S865 R869	S865-S867 PolarHBondContact O-N 3.33Å; S867-R869 WeakPolarHBondContact O-CG 3.26Å
868	N	35.3	Very low	33.1	Very low	148 Å²	148	140.6 Å²	140.6	79%	0.791	81%	0.805	S	S	*	*			trans	-100.6	110.3	164.2	-66.8	-20.6	0	0	0	106.4
869	R	36.8	Very low	32.4	Very low	211 Å²	211	143.9 Å²	143.9	80%	0.796	81%	0.809	S	S	*	*				56.5	93.3	50.9	-59	-178	177.3	-139.2	-1.2	113.2	S867	S867-R869 WeakPolarHBondContact O-CG 3.26Å
870	Y	31.2	Very low	32	Very low	247 Å²	247	139.3 Å²	139.3	97%	0.969	80%	0.801	S	S	*	*			trans	-134.3	62.2	136	-154.5	-92.8	0	0	0	109.9
871	A	32	Very low	31.5	Very low	82 Å²	82	144.3 Å²	144.3	68%	0.678	81%	0.805	S	S	*	*			trans	-133.6	129.9	162.1	0	0	0	0	0	105.6
872	G	30.5	Very low	31.4	Very low	76 Å²	76	150 Å²	150	78%	0.784	81%	0.807	S	S	*	*			trans	-112	92.9	-176.1	0	0	0	0	0	110.8
873	D	32.7	Very low	31.4	Very low	145 Å²	145	144 Å²	144	78%	0.775	80%	0.8	S	S	*	*			trans	-71.9	132.3	170.4	-63.4	-50.5	0	0	0	110.6
874	W	31.2	Very low	31.3	Very low	252 Å²	252	141.1 Å²	141.1	96%	0.955	79%	0.794	S	S	*	*			trans	-126	93.5	159.1	-84	90.1	0	0	0	109.2
875	S	31.3	Very low	31.2	Very low	113 Å²	113	142.2 Å²	142.2	79%	0.79	80%	0.795	S	S	*	*			trans	-145.1	126.3	167.2	61.5	0	0	0	0	109.2
876	G	31.1	Very low	31	Very low	64 Å²	64	144.1 Å²	144.1	66%	0.66	80%	0.797	S	S	*	*			trans	122.3	124.1	-170.9	0	0	0	0	0	110.9
877	C	29.2	Very low	30.5	Very low	135 Å²	135	145.7 Å²	145.7	91%	0.912	80%	0.797	S	S	*	*			cis	-135.2	157.4	3.4	-64.9	0	0	0	0	111.3
878	G	31.8	Very low	30.3	Very low	67 Å²	67	149 Å²	149	69%	0.691	81%	0.807	S	S	*	*			trans	-87.1	-158.8	161.5	0	0	0	0	0	111.8
879	E	28.8	Very low	30.5	Very low	201 Å²	201	147.2 Å²	147.2	94%	0.939	80%	0.804	S	S	*	*			trans	72.2	143.2	-175.8	-56.4	-171.1	179.8	0	0	115.1
880	S	25.6	Very low	30.7	Very low	94 Å²	94	142.7 Å²	142.7	66%	0.657	80%	0.802	S	S	*	*			cis	-142.6	146.1	2.2	50.3	0	0	0	0	112.4
881	Y	27.8	Very low	30.5	Very low	234 Å²	234	136.2 Å²	136.2	92%	0.918	79%	0.793	S	S	*	*			trans	-156.1	92	154.3	-97.7	-66.5	0	0	0	110
882	F	29.5	Very low	30.4	Very low	199 Å²	199	140 Å²	140	87%	0.873	79%	0.794	S	S	*	*			trans	-108.6	136.7	160	-82.4	-75.3	0	0	0	109
883	P	27.5	Very low	30.4	Very low	119 Å²	119	142.6 Å²	142.6	77%	0.773	79%	0.785	S	S	*	*			trans	-104.9	124.1	152.6	-0.8	21.5	0	0	0	110
884	S	29.4	Very low	30.3	Very low	117 Å²	117	144.3 Å²	144.3	82%	0.818	79%	0.789	S	S	*	*			trans	-148.3	153.9	158	-73.7	0	0	0	0	107.3
885	E	29.1	Very low	30.3	Very low	174 Å²	174	136.9 Å²	136.9	81%	0.813	78%	0.781	S	S	*	*			trans	-84.8	169	-150.2	-49.3	-169.7	119.3	0	0	116.3
886	L	30.4	Very low	30.5	Very low	138 Å²	138	138.2 Å²	138.2	72%	0.723	78%	0.779	S	S	*	*			trans	69.4	104.2	151.3	-67.5	157.3	0	0	0	120.5
887	L	28.7	Very low	30.6	Very low	153 Å²	153	144.3 Å²	144.3	80%	0.801	78%	0.784	S	S	*	*			trans	65.7	113.3	131.3	-58.3	175.1	0	0	0	122.5
888	L	26.8	Very low	30.9	Very low	160 Å²	160	144.2 Å²	144.2	84%	0.838	77%	0.774	S	S	*	*			trans	-14.2	161	137.4	-67.3	171.3	0	0	0	119.6
889	P	38.9	Very low	31.2	Very low	111 Å²	111	148.9 Å²	148.9	72%	0.721	78%	0.783	S	S	*	*			cis	-139	-135.5	-22.2	40	-16	0	0	0	113.2
890	P	40.3	Very low	31.3	Very low	116 Å²	116	145 Å²	145	75%	0.753	77%	0.773	S	S	*	*				-132.7	169.9	-125	41.3	-20.4	0	0	0	118.3
891	S	28.3	Very low	32.2	Very low	111 Å²	111	145.7 Å²	145.7	78%	0.776	78%	0.776	S	S	*	*			trans	-176.7	151.7	141.2	49	0	0	0	0	115.1
892	K	29	Very low	32.4	Very low	161 Å²	161	138.6 Å²	138.6	70%	0.7	76%	0.76	S	S	*	*			trans	14.8	156.5	134.1	-62.2	177.7	156.8	-75	0	120.4
893	E	30.4	Very low	32.5	Very low	130 Å²	130	137.4 Å²	137.4	61%	0.607	76%	0.757	S	S	*	*			cis	-176.5	154.6	-12.6	-106.7	155.7	-174.6	0	0	107.6
894	E	31.7	Very low	32.6	Very low	182 Å²	182	138.7 Å²	138.7	85%	0.85	76%	0.757	S	S	*	*			trans	60.9	172.7	150.1	-65.5	-178.2	159.4	0	0	121.5
895	A	31.3	Very low	32.6	Very low	96 Å²	96	138.4 Å²	138.4	79%	0.793	75%	0.751	S	S	*	*			trans	65.1	113.2	178.8	0	0	0	0	0	117.1
896	D	35.1	Very low	32.7	Very low	140 Å²	140	139 Å²	139	75%	0.749	75%	0.754	S	S	*	*			cis	95.2	147.6	17.1	-154	20.5	0	0	0	116.1
897	Y	32.5	Very low	32.6	Very low	193 Å²	193	136.6 Å²	136.6	76%	0.757	75%	0.754	S	S	*	*			trans	74.6	120.3	179.6	-85.1	-85.5	0	0	0	122.2
898	D	35.4	Very low	32.6	Very low	133 Å²	133	133.4 Å²	133.4	71%	0.711	75%	0.75	S	S	*	*			trans	-56.1	163.1	149.3	-48.7	-89.5	0	0	0	112.3
899	D	38.1	Very low	32.7	Very low	164 Å²	164	134.7 Å²	134.7	88%	0.877	75%	0.751	S	S	*	*			trans	-144.9	157.1	131.8	-142.4	-28.6	0	0	0	110.3
900	V	32.6	Very low	32.1	Very low	120 Å²	120	137.8 Å²	137.8	73%	0.727	76%	0.757	S	S	*	*			trans	-115.8	-121.9	-160.3	-153.5	0	0	0	0	114.6
901	P	44.3	Very low	31.5	Very low	109 Å²	109	135.8 Å²	135.8	71%	0.708	75%	0.75	S	S	*	*				-88.5	-177.6	-121.8	40.7	-28.8	0	0	0	112.6
902	S	31.3	Very low	31.4	Very low	85 Å²	85	139.2 Å²	139.2	59%	0.594	75%	0.753	S	S	*	*			cis	-175.4	166.8	40.2	43.2	0	0	0	0	110.5
903	E	30.8	Very low	31.4	Very low	174 Å²	174	138.5 Å²	138.5	81%	0.813	75%	0.752	S	S	*	*			trans	50.2	149.9	137.5	-68	153.3	-171.2	0	0	120.4
904	D	29.6	Very low	31.5	Very low	145 Å²	145	139.4 Å²	139.4	78%	0.775	75%	0.754	S	S	*	*			cis	-148.6	-153	10.6	-148.1	-32.5	0	0	0	112.4
905	T	31.1	Very low	31.2	Very low	112 Å²	112	137.5 Å²	137.5	69%	0.687	75%	0.75	S	S	*	*			trans	-115	171.5	-154	-46.6	0	0	0	0	114.3
906	E	30	Very low	31.1	Very low	185 Å²	185	137.5 Å²	137.5	86%	0.864	75%	0.749	S	S	*	*			trans	77.3	154.6	168.6	-54.2	-168.3	168.5	0	0	117.7
907	A	29.2	Very low	30.9	Very low	89 Å²	89	134.7 Å²	134.7	74%	0.736	75%	0.746	S	S	*	*			cis	-168.1	153.9	-32.5	0	0	0	0	0	111.4
908	A	28.2	Very low	30.9	Very low	86 Å²	86	134.4 Å²	134.4	71%	0.711	75%	0.751	S	S	*	*			trans	65	148.1	155.6	0	0	0	0	0	122.4
909	E	29.3	Very low	30.8	Very low	186 Å²	186	137.1 Å²	137.1	87%	0.869	76%	0.76	S	S	*	*			trans	60.3	153.8	153.9	-70.6	164.9	-141.1	0	0	120.2
910	E	26.2	Very low	30.4	Very low	177 Å²	177	136.8 Å²	136.8	83%	0.827	76%	0.758	S	S	*	*			cis	-156.7	158.3	-39.3	-148.9	-173	-141	0	0	109.9
911	A	27.8	Very low	30.2	Very low	74 Å²	74	136.9 Å²	136.9	61%	0.612	75%	0.754	S	S	*	*			trans	51.6	117.8	152	0	0	0	0	0	124.7
912	H	26.5	Very low	29.4	Very low	183 Å²	183	139.1 Å²	139.1	85%	0.847	76%	0.756	S	S	*	*				75.1	154.5	128.6	-93.8	-94.2	0	0	0	125.3
913	E	28.5	Very low	29.2	Very low	146 Å²	146	141.7 Å²	141.7	68%	0.682	76%	0.761	S	S	*	*			trans	71.8	150.3	171.4	-53	-147.8	144.4	0	0	116.7
914	K	31.3	Very low	29	Very low	149 Å²	149	140.7 Å²	140.7	65%	0.648	76%	0.761	S	S	*	*			cis	-158.3	163	-15.2	-109.4	170.9	-171.3	146.3	0	107.1
915	D	27.2	Very low	30.2	Very low	142 Å²	142	138.6 Å²	138.6	76%	0.759	76%	0.755	S	S	*	*				176	146.7	82	-92.3	-44.2	0	0	0	107.5
916	A	29.1	Very low	29.9	Very low	95 Å²	95	141.6 Å²	141.6	79%	0.785	76%	0.759	S	S	*	*				58.5	134.9	87.1	0	0	0	0	0	115.6
917	A	29.9	Very low	29.9	Very low	82 Å²	82	140.4 Å²	140.4	68%	0.678	75%	0.753	S	S	*	*			cis	-156.7	174.8	6.8	0	0	0	0	0	113.7
918	E	32.5	Very low	30	Very low	186 Å²	186	143.8 Å²	143.8	87%	0.869	75%	0.753	S	S	*	*			trans	28.4	139	145.6	-68.9	151.8	-161.2	0	0	122.5
919	E	33.7	Very low	30	Very low	191 Å²	191	146.6 Å²	146.6	89%	0.893	76%	0.761	S	S	*	*			cis	-127.6	-107.6	0.4	-152.3	169.9	178.4	0	0	115.7
920	D	29.3	Very low	29.8	Very low	157 Å²	157	147.3 Å²	147.3	84%	0.84	76%	0.758	S	S	*	*			cis	-157.7	179.5	3.6	-172.6	11.5	0	0	0	109.7
921	D	29.5	Very low	29.9	Very low	121 Å²	121	147.4 Å²	147.4	65%	0.647	76%	0.758	S	S	*	*			trans	-84	121.3	-157.3	-131.1	9.2	0	0	0	120.4
922	Q	26.8	Very low	29.8	Very low	157 Å²	157	148.2 Å²	148.2	73%	0.734	77%	0.765	S	S	*	*				42.6	151	123.2	-71.8	-173.4	89.5	0	0	127.8
923	I	27.4	Very low	29.7	Very low	138 Å²	138	150.7 Å²	150.7	71%	0.708	77%	0.768	S	S	*	*			trans	91.6	92.5	150.5	-65.7	144.9	0	0	0	122
924	L	26.1	Very low	29.9	Very low	154 Å²	154	151.5 Å²	151.5	81%	0.806	77%	0.774	S	S	*	*				16.9	161.6	114.7	-70.3	149.5	0	0	0	121.5
925	P	54.1	Low	29.8	Very low	100 Å²	100	152.6 Å²	152.6	65%	0.649	78%	0.779	S	S	*	*				-145.2	-154.9	-51.5	39.9	-17.8	0	0	0	113.4
926	K	25.9	Very low	30	Very low	176 Å²	176	154.1 Å²	154.1	77%	0.765	79%	0.785	S	S	*	*			trans	112.4	105.1	152	-59.8	-168.3	-177.8	177.6	0	120.8
927	E	29.9	Very low	29.9	Very low	159 Å²	159	156.6 Å²	156.6	74%	0.743	78%	0.78	S	S	*	*				28.2	127.9	113.3	-66.4	-179.9	131.8	0	0	122.8
928	H	30.4	Very low	29.8	Very low	161 Å²	161	159.4 Å²	159.4	75%	0.745	78%	0.784	S	S	*	*			trans	53.3	115.4	135.9	-57.3	-51.9	0	0	0	122
929	T	28.7	Very low	29.6	Very low	144 Å²	144	158.2 Å²	158.2	88%	0.883	78%	0.782	S	S	*	*			trans	-148.7	150.8	133.3	-31.4	0	0	0	0	113.7
930	Y	25.5	Very low	29.4	Very low	201 Å²	201	153.8 Å²	153.8	79%	0.788	77%	0.772	S	S	*	*			trans	-65.3	155.9	-163.1	-75.2	-107.6	0	0	0	119.3
931	Q	28.3	Very low	29.9	Very low	179 Å²	179	151.9 Å²	151.9	84%	0.836	77%	0.768	S	S	*	*			trans	-1	123	139.9	-61	173.5	-19.3	0	0	117.9
932	A	25.1	Very low	30	Very low	91 Å²	91	151.8 Å²	151.8	75%	0.752	77%	0.772	S	S	*	*				-175.1	116.2	122.8	0	0	0	0	0	112.1
933	Y	25.2	Very low	30.2	Very low	236 Å²	236	151.9 Å²	151.9	93%	0.925	78%	0.777	S	S	*	*				-166.9	136.4	119.9	-121.4	-86	0	0	0	110.4
934	M	31.2	Very low	30.3	Very low	162 Å²	162	150.4 Å²	150.4	80%	0.798	78%	0.779	S	S	*	*			trans	-112.4	143.4	179.5	-105.5	-78.7	-170.4	0	0	109.6
935	K	30.4	Very low	30.9	Very low	173 Å²	173	151 Å²	151	75%	0.752	78%	0.783	S	S	*	*			trans	62.3	110.4	169.1	-56.2	177.5	-179.9	-177.3	0	117.8
936	I	30.1	Very low	30.2	Very low	174 Å²	174	157.4 Å²	157.4	89%	0.892	79%	0.794	S	S	*	*				-127.5	143.6	115.1	-75.7	-176.3	0	0	0	106.7
937	Q	28.2	Very low	31.3	Very low	146 Å²	146	155.1 Å²	155.1	68%	0.682	79%	0.794	S	S	*	*			trans	-100.8	143.9	167	-62.4	168.3	-119.3	0	0	106.7
938	D	28.2	Very low	32.3	Very low	141 Å²	141	151.5 Å²	151.5	75%	0.754	78%	0.78	S	S	*	*				179.1	-171.4	74.4	-105.3	-44.5	0	0	0	110.7
939	I	27.8	Very low	33.9	Very low	161 Å²	161	150.2 Å²	150.2	83%	0.826	78%	0.778	S	S	*	*			trans	83.9	106.6	171.9	-49.9	176.9	0	0	0	114.9
940	S	28.2	Very low	35.3	Very low	98 Å²	98	152.3 Å²	152.3	69%	0.685	77%	0.77	S	S	*	*			trans	-91.9	160.2	159.1	-170.5	0	0	0	0	109.4	V942	S940-V942 PolarHBondContact OG-N 2.91Å
941	P	41.1	Very low	37.1	Very low	117 Å²	117	147.3 Å²	147.3	76%	0.76	76%	0.756	S	S	*	*				-142.4	134.3	100.6	35.7	-21.5	0	0	0	115.8
942	V	30.5	Very low	39	Very low	120 Å²	120	143.6 Å²	143.6	73%	0.727	74%	0.742	S	S	*	*				33.9	111.3	126.9	-170.8	0	0	0	0	118	S940	S940-V942 PolarHBondContact OG-N 2.91Å
943	L	30.9	Very low	41.5	Very low	158 Å²	158	143.9 Å²	143.9	83%	0.827	73%	0.728	S	S	*	*				-165.3	119	113.4	-102.4	173.2	0	0	0	110.5
944	S	31.4	Very low	43.8	Very low	108 Å²	108	138.7 Å²	138.7	76%	0.755	71%	0.712	S	S	*	*			trans	-143	133.1	168.8	-62.3	0	0	0	0	108.6	R946	S944-R946 PolarHBondContact O-N 2.68Å
945	N	36.8	Very low	46.1	Very low	166 Å²	166	134.6 Å²	134.6	89%	0.888	70%	0.699	S	S	*	*			trans	-67.2	97.3	-174.4	-71.8	-15.5	0	0	0	111.1	V947	N945-V947 PolarHBondContact O-N 3.47Å
946	R	39.3	Very low	48.7	Very low	235 Å²	235	129.9 Å²	129.9	89%	0.887	68%	0.681	S	S	*	*			trans	-81.3	110.4	163.3	-74.6	-173.7	172.1	-170.7	-2.4	108.8	S944 N948	S944-R946 PolarHBondContact O-N 2.68Å; R946-N948 PolarHBondContact O-N 3.43Å
947	V	49.3	Very low	51.1	Low	128 Å²	128	125.5 Å²	125.5	78%	0.776	66%	0.66	S	S	*	*			trans	-61	123.9	161.2	-180	0	0	0	0	107.3	N945 L949	N945-V947 PolarHBondContact O-N 3.47Å; V947-L949 PolarHBondContact O-N 2.89Å; V947-L949 VanDerWaalsContact O-N 3.14Å
948	N	52.2	Low	53.9	Low	82 Å²	82	122.3 Å²	122.3	44%	0.439	65%	0.651	S	S	.	*			trans	-83.8	96.4	-167.4	-172.2	21.4	0	0	0	110.6	R946 R950 D951	R946-N948 PolarHBondContact O-N 3.43Å; N948-R950 PolarHBondContact O-N 3.33Å; N948-D951 WeakPolarHBondContact CB-OD2 3.35Å; N948-D951 PolarHBondContact ND2-OD1 3.39Å; N948-D951 PolarHBondContact ND2-OD2 3.2Å; N948-D951 PolarHBondContact O-N 3.16Å
949	L	62.4	Low	56.5	Low	135 Å²	135	120.7 Å²	120.7	71%	0.707	64%	0.641	S	S	*	*	H	α-helix	trans	-56.7	-19.5	-174.2	-70.4	167.4	0	0	0	114.7	V947 Q953	V947-L949 PolarHBondContact O-N 2.89Å; V947-L949 VanDerWaalsContact O-N 3.14Å; L949-Q953 PolarHBondContact O-N 2.88Å
950	R	58.7	Low	59.4	Low	188 Å²	188	116.8 Å²	116.8	71%	0.709	62%	0.621	S	S	*	*	H	α-helix	trans	-68.6	-42.5	174.2	-63.3	-170.5	-173.9	-153.4	2.4	112.4	N948 L952 Q953 E954	N948-R950 PolarHBondContact O-N 3.33Å; R950-L952 PolarHBondContact O-N 3.13Å; R950-Q953 WeakPolarHBondContact O-CB 3.48Å; R950-Q953 PolarHBondContact O-N 2.86Å; R950-E954 PolarHBondContact O-N 2.97Å
951	D	63.1	Low	62	Low	95 Å²	95	113.1 Å²	113.1	51%	0.508	60%	0.599	S	S	.	*	H	α-helix	trans	-68.6	-30.8	-175.4	-49.5	-14.3	0	0	0	110.3	N948 S955	N948-D951 WeakPolarHBondContact CB-OD2 3.35Å; N948-D951 PolarHBondContact ND2-OD1 3.39Å; N948-D951 PolarHBondContact ND2-OD2 3.2Å; N948-D951 PolarHBondContact O-N 3.16Å; D951-S955 WeakPolarHBondContact O-CB 3.48Å; D951-S955 PolarHBondContact O-N 2.86Å; D951-S955 VanDerWaalsContact O-N 3.14Å
952	L	69.6	Low	63.9	Low	102 Å²	102	111.1 Å²	111.1	53%	0.534	58%	0.582	S	S	.	*	H	α-helix	trans	-68.3	-42.8	169.7	-174.6	65.4	0	0	0	112	R950 S955 I956	R950-L952 PolarHBondContact O-N 3.13Å; L952-S955 WeakPolarHBondContact O-CB 3.5Å; L952-S955 PolarHBondContact O-N 2.84Å; L952-I956 HydrophobicContact CG-CD1 4.18Å; L952-I956 WeakPolarHBondContact O-CG1 3.2Å; L952-I956 PolarHBondContact O-N 3.39Å
953	Q	75.8	Confident	66.2	Low	96 Å²	96	110.8 Å²	110.8	45%	0.449	58%	0.575	S	S	.	*	H	α-helix	trans	-66	-46	177.7	-172.1	62.8	53.4	0	0	111.7	L949 R950 S955 I956 D957	L949-Q953 PolarHBondContact O-N 2.88Å; R950-Q953 WeakPolarHBondContact O-CB 3.48Å; R950-Q953 PolarHBondContact O-N 2.86Å; Q953-S955 PolarHBondContact O-N 2.86Å; Q953-I956 PolarHBondContact O-N 2.93Å; Q953-I956 VanDerWaalsContact O-N 3.12Å; Q953-D957 PolarHBondContact NE2-OD1 2.85Å; Q953-D957 PolarHBondContact NE2-OD2 2.9Å; Q953-D957 VanDerWaalsContact O-CG 3.26Å; Q953-D957 PolarHBondContact O-N 3.31Å
954	E	73.6	Confident	68.5	Low	128 Å²	128	109.1 Å²	109.1	60%	0.598	56%	0.563	S	S	*	*	H	α-helix	trans	-62	-33.1	176.1	-71.4	-174.8	-176	0	0	112	R950 T958	R950-E954 PolarHBondContact O-N 2.97Å; E954-T958 WeakPolarHBondContact O-CB 3.13Å; E954-T958 PolarHBondContact O-N 2.87Å; E954-T958 PolarHBondContact O-OG1 3.31Å
955	S	80.5	Confident	70.7	Confident	75 Å²	75	111 Å²	111	52%	0.524	55%	0.554	S	S	.	*	H	α-helix	trans	-65.1	-45.6	171.8	-172.9	0	0	0	0	112.3	D951 L952 Q953 T958 L959	D951-S955 WeakPolarHBondContact O-CB 3.48Å; D951-S955 PolarHBondContact O-N 2.86Å; D951-S955 VanDerWaalsContact O-N 3.14Å; L952-S955 WeakPolarHBondContact O-CB 3.5Å; L952-S955 PolarHBondContact O-N 2.84Å; Q953-S955 PolarHBondContact O-N 2.86Å; S955-T958 PolarHBondContact O-N 2.8Å; S955-L959 WeakPolarHBondContact O-CB 3.48Å; S955-L959 PolarHBondContact O-N 3.33Å
956	I	84.4	Confident	72.5	Confident	74 Å²	74	107.5 Å²	107.5	38%	0.379	53%	0.532	S	S	.	.	H	α-helix	trans	-63.2	-48	176.6	-70	164.4	0	0	0	110.9	L952 Q953 T958 L959 I960	L952-I956 HydrophobicContact CG-CD1 4.18Å; L952-I956 WeakPolarHBondContact O-CG1 3.2Å; L952-I956 PolarHBondContact O-N 3.39Å; Q953-I956 PolarHBondContact O-N 2.93Å; Q953-I956 VanDerWaalsContact O-N 3.12Å; I956-T958 VanDerWaalsContact C-N 3.31Å; I956-T958 PolarHBondContact O-N 3.34Å; I956-L959 WeakPolarHBondContact O-CB 3.43Å; I956-L959 PolarHBondContact O-N 2.81Å; I956-L959 VanDerWaalsContact O-N 3.11Å; I956-I960 HydrophobicContact CG2-CD1 3.86Å; I956-I960 WeakPolarHBondContact O-CG1 3.3Å; I956-I960 PolarHBondContact O-N 3.43Å
957	D	81.6	Confident	74	Confident	83 Å²	83	101 Å²	101	44%	0.444	52%	0.515	S	S	.	.	H	α-helix	trans	-65.6	-36	-179.1	-63.6	-19.9	0	0	0	111.3	Q953 G961	Q953-D957 PolarHBondContact NE2-OD1 2.85Å; Q953-D957 PolarHBondContact NE2-OD2 2.9Å; Q953-D957 VanDerWaalsContact O-CG 3.26Å; Q953-D957 PolarHBondContact O-N 3.31Å; D957-G961 PolarHBondContact O-N 3.4Å
958	T	86.3	Confident	75	Confident	79 Å²	79	99 Å²	99	49%	0.485	50%	0.499	S	S	.	.	H	α-helix	trans	-65	-39.7	172.1	-62.5	0	0	0	0	112	E954 S955 I956 N962	E954-T958 WeakPolarHBondContact O-CB 3.13Å; E954-T958 PolarHBondContact O-N 2.87Å; E954-T958 PolarHBondContact O-OG1 3.31Å; S955-T958 PolarHBondContact O-N 2.8Å; I956-T958 VanDerWaalsContact C-N 3.31Å; I956-T958 PolarHBondContact O-N 3.34Å; T958-N962 WeakPolarHBondContact O-CB 3.38Å; T958-N962 PolarHBondContact O-N 3.35Å; T958-N962 PolarHBondContact O-ND2 3.46Å
959	L	82.7	Confident	75.8	Confident	106 Å²	106	100.2 Å²	100.2	56%	0.555	50%	0.501	S	S	*	.	H	α-helix	trans	-66.8	-43	177.2	-177.2	62.3	0	0	0	111.8	S955 I956 N962 L963	S955-L959 WeakPolarHBondContact O-CB 3.48Å; S955-L959 PolarHBondContact O-N 3.33Å; I956-L959 WeakPolarHBondContact O-CB 3.43Å; I956-L959 PolarHBondContact O-N 2.81Å; I956-L959 VanDerWaalsContact O-N 3.11Å; L959-N962 WeakPolarHBondContact O-CB 3.21Å; L959-N962 PolarHBondContact O-N 3.17Å; L959-L963 HydrophobicContact CG-CD1 4.42Å; L959-L963 PolarHBondContact O-N 3.39Å
960	I	87.9	Confident	75.4	Confident	80 Å²	80	98.5 Å²	98.5	41%	0.41	49%	0.492	S	S	.	.	H	α-helix	trans	-60.9	-49.7	174.4	-66.5	166.3	0	0	0	110	I956 N962 L963 E964	I956-I960 HydrophobicContact CG2-CD1 3.86Å; I956-I960 WeakPolarHBondContact O-CG1 3.3Å; I956-I960 PolarHBondContact O-N 3.43Å; I960-N962 PolarHBondContact O-N 3.43Å; I960-L963 PolarHBondContact O-N 3.2Å; I960-L963 VanDerWaalsContact O-N 3.09Å; I960-E964 HydrophobicContact CG2-CG 4.49Å; I960-E964 PolarHBondContact O-N 2.77Å
961	G	84.3	Confident	75.4	Confident	21 Å²	21	96.1 Å²	96.1	22%	0.216	49%	0.487	C	S	.	.	H	α-helix	trans	-62.9	-22.8	176.6	0	0	0	0	0	114.4	D957 R965	D957-G961 PolarHBondContact O-N 3.4Å; G961-R965 WeakPolarHBondContact O-CB 3.46Å; G961-R965 VanDerWaalsContact O-CG 3.27Å; G961-R965 WeakPolarHBondContact O-CG 3.44Å; G961-R965 PolarHBondContact O-N 2.86Å; G961-R965 PolarHBondContact O-NE 3.23Å
962	N	80.8	Confident	74.9	Confident	74 Å²	74	98 Å²	98	40%	0.396	50%	0.497	S	S	.	.	H	α-helix	trans	-75.5	-46.9	169.6	-73.2	-23.6	0	0	0	111.7	T958 L959 I960 E964 R965 E966	T958-N962 WeakPolarHBondContact O-CB 3.38Å; T958-N962 PolarHBondContact O-N 3.35Å; T958-N962 PolarHBondContact O-ND2 3.46Å; L959-N962 WeakPolarHBondContact O-CB 3.21Å; L959-N962 PolarHBondContact O-N 3.17Å; I960-N962 PolarHBondContact O-N 3.43Å; N962-E964 PolarHBondContact O-N 2.79Å; N962-R965 PolarHBondContact O-N 3.05Å; N962-R965 PolarHBondContact OD1-NH2 3.02Å; N962-E966 PolarHBondContact O-N 2.9Å
963	L	78.1	Confident	74.1	Confident	114 Å²	114	99.8 Å²	99.8	60%	0.597	51%	0.507	S	S	*	.	H	α-helix	trans	-60.5	-42	177.5	-75.2	164.1	0	0	0	112.3	L959 I960 R965 E966 L967	L959-L963 HydrophobicContact CG-CD1 4.42Å; L959-L963 PolarHBondContact O-N 3.39Å; I960-L963 PolarHBondContact O-N 3.2Å; I960-L963 VanDerWaalsContact O-N 3.09Å; L963-R965 VanDerWaalsContact C-N 3.35Å; L963-R965 PolarHBondContact O-N 3.04Å; L963-E966 PolarHBondContact O-N 2.78Å; L963-L967 WeakPolarHBondContact O-CB 3.26Å; L963-L967 PolarHBondContact O-N 2.89Å
964	E	80.3	Confident	73	Confident	122 Å²	122	101.6 Å²	101.6	57%	0.57	52%	0.524	S	S	*	.	H	α-helix	trans	-65.2	-36.4	175.5	-69.4	-168.8	151.8	0	0	112.7	I960 N962 N968	I960-E964 HydrophobicContact CG2-CG 4.49Å; I960-E964 PolarHBondContact O-N 2.77Å; N962-E964 PolarHBondContact O-N 2.79Å; E964-N968 WeakPolarHBondContact O-CB 3.4Å; E964-N968 VanDerWaalsContact O-CG 3.31Å; E964-N968 PolarHBondContact O-N 2.65Å; E964-N968 PolarHBondContact O-ND2 2.65Å
965	R	77.1	Confident	71.8	Confident	147 Å²	147	98 Å²	98	56%	0.555	52%	0.521	S	S	*	.	H	α-helix	trans	-66.7	-40.7	174.5	-78.4	-178.4	-72.1	-145.9	3.3	111.7	G961 N962 L963 N968 K969	G961-R965 WeakPolarHBondContact O-CB 3.46Å; G961-R965 VanDerWaalsContact O-CG 3.27Å; G961-R965 WeakPolarHBondContact O-CG 3.44Å; G961-R965 PolarHBondContact O-N 2.86Å; G961-R965 PolarHBondContact O-NE 3.23Å; N962-R965 PolarHBondContact O-N 3.05Å; N962-R965 PolarHBondContact OD1-NH2 3.02Å; L963-R965 VanDerWaalsContact C-N 3.35Å; L963-R965 PolarHBondContact O-N 3.04Å; R965-N968 PolarHBondContact O-N 2.82Å; R965-K969 WeakPolarHBondContact O-CG 3.42Å; R965-K969 PolarHBondContact O-N 2.62Å
966	E	75.1	Confident	69.9	Low	93 Å²	93	108.9 Å²	108.9	44%	0.435	55%	0.553	S	S	.	*	H	α-helix	trans	-70.4	-38.4	177.3	-123.4	56.4	-151	0	0	112.5	N962 L963 N968 K969 N970	N962-E966 PolarHBondContact O-N 2.9Å; L963-E966 PolarHBondContact O-N 2.78Å; E966-N968 VanDerWaalsContact C-N 3.33Å; E966-N968 PolarHBondContact O-N 3.09Å; E966-K969 PolarHBondContact O-N 3.16Å; E966-K969 WeakPolarHBondContact OE1-CD 3.31Å; E966-K969 IonicContact OE1-NZ 2.74Å; E966-K969 PolarHBondContact OE1-NZ 2.91Å; E966-K969 IonicContact OE2-NZ 2.91Å; E966-K969 PolarHBondContact OE2-NZ 2.69Å; E966-N970 PolarHBondContact O-N 3.46Å; E966-N970 PolarHBondContact O-ND2 2.8Å
967	L	71.1	Confident	69.2	Low	100 Å²	100	110.7 Å²	110.7	52%	0.524	56%	0.561	S	S	.	*	H	α-helix	trans	-66.6	-34.8	175	-165.8	144.8	0	0	0	112	L963 N970 K971	L963-L967 WeakPolarHBondContact O-CB 3.26Å; L963-L967 PolarHBondContact O-N 2.89Å; L967-N970 PolarHBondContact O-N 2.76Å; L967-K971 HydrophobicContact CD2-CD 4.27Å; L967-K971 PolarHBondContact O-N 2.88Å
968	N	69.5	Low	68.5	Low	84 Å²	84	112.1 Å²	112.1	45%	0.449	57%	0.568	S	S	.	*	H	α-helix	trans	-75.4	-33.7	174.1	-73.8	-42.2	0	0	0	113.4	E964 R965 E966 N970 K971 L972	E964-N968 WeakPolarHBondContact O-CB 3.4Å; E964-N968 VanDerWaalsContact O-CG 3.31Å; E964-N968 PolarHBondContact O-N 2.65Å; E964-N968 PolarHBondContact O-ND2 2.65Å; R965-N968 PolarHBondContact O-N 2.82Å; E966-N968 VanDerWaalsContact C-N 3.33Å; E966-N968 PolarHBondContact O-N 3.09Å; N968-N970 VanDerWaalsContact C-N 3.33Å; N968-K971 PolarHBondContact O-N 2.59Å; N968-L972 PolarHBondContact O-N 3.45Å
969	K	69.3	Low	67.5	Low	108 Å²	108	113.9 Å²	113.9	47%	0.47	57%	0.572	S	S	.	*	H	α-helix	trans	-58.8	-44.9	166.7	-74.3	165	-179.7	167.1	0	111.1	R965 E966 K971 L972 N973	R965-K969 WeakPolarHBondContact O-CG 3.42Å; R965-K969 PolarHBondContact O-N 2.62Å; E966-K969 PolarHBondContact O-N 3.16Å; E966-K969 WeakPolarHBondContact OE1-CD 3.31Å; E966-K969 IonicContact OE1-NZ 2.74Å; E966-K969 PolarHBondContact OE1-NZ 2.91Å; E966-K969 IonicContact OE2-NZ 2.91Å; E966-K969 PolarHBondContact OE2-NZ 2.69Å; K969-K971 PolarHBondContact O-N 2.97Å; K969-L972 WeakPolarHBondContact O-CB 3.45Å; K969-L972 PolarHBondContact O-N 2.97Å; K969-L972 VanDerWaalsContact O-N 3.12Å; K969-N973 PolarHBondContact O-N 3.25Å
970	N	54	Low	66.6	Low	99 Å²	99	114.4 Å²	114.4	53%	0.529	57%	0.573	S	S	.	*	H	α-helix	trans	-65.7	-35.5	179	-74.6	-30	0	0	0	112.7	E966 L967 N968 L972 N973	E966-N970 PolarHBondContact O-N 3.46Å; E966-N970 PolarHBondContact O-ND2 2.8Å; L967-N970 PolarHBondContact O-N 2.76Å; N968-N970 VanDerWaalsContact C-N 3.33Å; N970-L972 VanDerWaalsContact C-N 3.28Å; N970-L972 PolarHBondContact O-N 3.29Å; N970-N973 PolarHBondContact O-N 3.26Å
971	K	57.7	Low	65.3	Low	138 Å²	138	116.6 Å²	116.6	60%	0.6	58%	0.583	S	S	*	*	H	α-helix	trans	-61.2	-32.8	170.8	-77.9	176.1	178.7	168.7	0	113.5	L967 N968 K969 N973 V974	L967-K971 HydrophobicContact CD2-CD 4.27Å; L967-K971 PolarHBondContact O-N 2.88Å; N968-K971 PolarHBondContact O-N 2.59Å; K969-K971 PolarHBondContact O-N 2.97Å; K971-N973 VanDerWaalsContact C-N 3.3Å; K971-N973 PolarHBondContact O-N 2.99Å; K971-V974 PolarHBondContact O-N 3.39Å
972	L	54	Low	64.1	Low	136 Å²	136	122.9 Å²	122.9	71%	0.712	61%	0.608	S	S	*	*	H	α-helix	trans	-73.8	-18.8	176.9	-71.9	166.3	0	0	0	113.5	N968 K969 N970	N968-L972 PolarHBondContact O-N 3.45Å; K969-L972 WeakPolarHBondContact O-CB 3.45Å; K969-L972 PolarHBondContact O-N 2.97Å; K969-L972 VanDerWaalsContact O-N 3.12Å; N970-L972 VanDerWaalsContact C-N 3.28Å; N970-L972 PolarHBondContact O-N 3.29Å
973	N	52.4	Low	62.9	Low	139 Å²	139	126.4 Å²	126.4	74%	0.743	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-0.8	175.5	-78.1	-15.2	0	0	0	114.1	K969 N970 K971	K969-N973 PolarHBondContact O-N 3.25Å; N970-N973 PolarHBondContact O-N 3.26Å; K971-N973 VanDerWaalsContact C-N 3.3Å; K971-N973 PolarHBondContact O-N 2.99Å
974	V	51.8	Low	61.7	Low	133 Å²	133	127.4 Å²	127.4	81%	0.806	63%	0.625	S	S	*	*	S	Bend	trans	-109.9	41.8	175.8	-167.9	0	0	0	0	109.8	K971	K971-V974 PolarHBondContact O-N 3.39Å
975	G	49.6	Very low	60.1	Low	52 Å²	52	127.8 Å²	127.8	54%	0.536	63%	0.63	S	S	.	*			trans	-145.9	29.2	-167	0	0	0	0	0	115.7
976	Y	40.1	Very low	58.6	Low	305 Å²	305	126.1 Å²	126.1	100%	1.196	64%	0.636	S	S	*	*			trans	-144	0	172.2	-88.4	-71.7	0	0	0	111.8

Retrieved 976 of 976 residues in 1050.7 ms (Link to these results)

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