A0A077ZEV3_TRITR Loading...

protein-serine/threonine phosphatase

AlphaFold DB , UniProt , Accession A0A077ZEV3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 277 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.5	Very low	37	Very low	162 Å²	162	104.5 Å²	104.5	80%	0.798	50%	0.496	S	S	*	.				0	-37.6	0	-157.1	160.2	70.7	0	0	113.8	L3 L4 D114	M1-L3 VanDerWaalsContact C-N 3.34Å; M1-L3 PolarHBondContact O-N 2.94Å; M1-L4 PolarHBondContact O-N 2.71Å; M1-D114 PolarHBondContact N-OD2 2.87Å
2	V	35.4	Very low	36.7	Very low	27 Å²	27	102.2 Å²	102.2	16%	0.164	50%	0.498	C	S	.	.	G	3₁₀ helix	trans	-62.3	-31.4	-170.4	-175.1	0	0	0	0	114.7	L4 W5 I113 L148	V2-L4 PolarHBondContact O-N 2.74Å; V2-W5 WeakPolarHBondContact O-CB 3.38Å; V2-W5 PolarHBondContact O-N 2.74Å; V2-I113 HydrophobicContact CB-CD1 4.15Å; V2-I113 HydrophobicContact CB-CG1 4.18Å; V2-I113 HydrophobicContact CB-CG2 3.74Å; V2-I113 HydrophobicContact CG1-CD1 4.21Å; V2-I113 HydrophobicContact CG1-CG1 4.42Å; V2-I113 HydrophobicContact CG2-CG2 3.95Å; V2-L148 HydrophobicContact CG1-CD1 4.25Å
3	L	34.5	Very low	36.7	Very low	91 Å²	91	104.3 Å²	104.3	48%	0.476	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-59.3	-18.1	-179.2	-140.3	79.9	0	0	0	114.4	M1 F99 I113	M1-L3 VanDerWaalsContact C-N 3.34Å; M1-L3 PolarHBondContact O-N 2.94Å; L3-F99 HydrophobicContact CD1-CB 4.37Å; L3-F99 HydrophobicContact CD1-CD1 3.84Å; L3-F99 HydrophobicContact CD1-CD2 3.62Å; L3-F99 HydrophobicContact CD1-CE1 3.96Å; L3-F99 HydrophobicContact CD1-CE2 3.75Å; L3-F99 HydrophobicContact CD1-CG 3.67Å; L3-F99 HydrophobicContact CD1-CZ 3.92Å; L3-F99 HydrophobicContact CG-CD2 4.39Å; L3-I113 HydrophobicContact CD1-CD1 4.41Å
4	L	37.3	Very low	36.6	Very low	132 Å²	132	103.4 Å²	103.4	69%	0.691	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-81.6	-22.7	174.5	-147.4	75.9	0	0	0	112.7	M1 V2 A8	M1-L4 PolarHBondContact O-N 2.71Å; V2-L4 PolarHBondContact O-N 2.74Å; L4-A8 WeakPolarHBondContact O-CB 3.3Å; L4-A8 PolarHBondContact O-N 3.15Å
5	W	37.8	Very low	36.6	Very low	110 Å²	110	105.5 Å²	105.5	42%	0.417	52%	0.521	S	S	.	.	H	α-helix	trans	-76	-49	-167.3	-75.7	59.5	0	0	0	113.7	V2 R7 A8 F9	V2-W5 WeakPolarHBondContact O-CB 3.38Å; V2-W5 PolarHBondContact O-N 2.74Å; W5-R7 VanDerWaalsContact C-N 3.25Å; W5-R7 PolarHBondContact O-N 2.98Å; W5-A8 PolarHBondContact O-N 3.06Å; W5-F9 PolarHBondContact O-N 2.8Å
6	M	37.1	Very low	36.7	Very low	53 Å²	53	108.7 Å²	108.7	26%	0.261	53%	0.531	S	S	.	.	H	α-helix	trans	-61.3	-38.6	176.4	-69.6	170.4	111.2	0	0	110.7	F99 Y151	M6-F99 HydrophobicContact SD-CE2 3.75Å; M6-F99 HydrophobicContact SD-CZ 4.24Å; M6-Y151 HydrophobicContact CE-CD1 3.99Å; M6-Y151 HydrophobicContact CE-CE1 3.66Å; M6-Y151 HydrophobicContact CE-CE2 4.44Å
7	R	39.9	Very low	36.7	Very low	173 Å²	173	110.6 Å²	110.6	65%	0.653	54%	0.544	S	S	*	.	H	α-helix	trans	-71.6	-32.5	175.2	-74.6	180	159.8	-154.8	-14.2	114.1	W5 W11	W5-R7 VanDerWaalsContact C-N 3.25Å; W5-R7 PolarHBondContact O-N 2.98Å; R7-W11 WeakPolarHBondContact O-CB 3.28Å; R7-W11 PolarHBondContact O-N 3.08Å
8	A	39	Very low	36.6	Very low	50 Å²	50	117.1 Å²	117.1	41%	0.413	56%	0.562	S	S	.	*	H	α-helix	trans	-67.7	-35.7	-177.7	0	0	0	0	0	113	L4 W5 C12	L4-A8 WeakPolarHBondContact O-CB 3.3Å; L4-A8 PolarHBondContact O-N 3.15Å; W5-A8 PolarHBondContact O-N 3.06Å; A8-C12 WeakPolarHBondContact O-CB 3.33Å; A8-C12 PolarHBondContact O-N 3.26Å
9	F	38.7	Very low	36.1	Very low	115 Å²	115	117.2 Å²	117.2	50%	0.504	58%	0.575	S	S	.	*	H	α-helix	trans	-71.8	-54.3	174.8	-96.4	-99.9	0	0	0	111.4	W5 W11 C12	W5-F9 PolarHBondContact O-N 2.8Å; F9-W11 VanDerWaalsContact C-N 3.31Å; F9-W11 PolarHBondContact O-N 3.21Å; F9-C12 PolarHBondContact O-N 2.94Å
10	C	38.2	Very low	36	Very low	63 Å²	63	119.5 Å²	119.5	43%	0.426	59%	0.589	S	S	.	*	H	α-helix	trans	-60	-36.4	-177.5	-158.9	0	0	0	0	112.9
11	W	28.5	Very low	35.7	Very low	173 Å²	173	119.7 Å²	119.7	66%	0.655	60%	0.597	S	S	*	*	H	α-helix	trans	-87.4	-30.2	-176.1	-150.7	33.2	0	0	0	114.6	R7 F9 F13 S14	R7-W11 WeakPolarHBondContact O-CB 3.28Å; R7-W11 PolarHBondContact O-N 3.08Å; F9-W11 VanDerWaalsContact C-N 3.31Å; F9-W11 PolarHBondContact O-N 3.21Å; W11-F13 VanDerWaalsContact C-N 3.28Å; W11-F13 PolarHBondContact O-N 3.13Å; W11-S14 PolarHBondContact O-N 3.49Å
12	C	33.2	Very low	35.2	Very low	77 Å²	77	117.9 Å²	117.9	52%	0.52	60%	0.595	S	S	.	*	H	α-helix	trans	-72.1	-16.6	-173.6	-170.2	0	0	0	0	114.5	A8 F9	A8-C12 WeakPolarHBondContact O-CB 3.33Å; A8-C12 PolarHBondContact O-N 3.26Å; F9-C12 PolarHBondContact O-N 2.94Å
13	F	36.5	Very low	35	Very low	130 Å²	130	125.4 Å²	125.4	57%	0.57	63%	0.628	S	S	*	*	H	α-helix	trans	-90.6	-36.4	175.2	-136.9	-99.1	0	0	0	112.7	W11 E15 K16 A201	W11-F13 VanDerWaalsContact C-N 3.28Å; W11-F13 PolarHBondContact O-N 3.13Å; F13-E15 PolarHBondContact O-N 3.09Å; F13-K16 PolarHBondContact O-N 3.37Å; F13-A201 HydrophobicContact CE2-CB 4.33Å
14	S	36.2	Very low	34.6	Very low	91 Å²	91	131.9 Å²	131.9	64%	0.636	65%	0.647	S	S	*	*	H	α-helix	trans	-62.3	-38.5	-174.2	-169.8	0	0	0	0	113.7	W11 K16	W11-S14 PolarHBondContact O-N 3.49Å; S14-K16 VanDerWaalsContact C-N 3.34Å; S14-K16 PolarHBondContact O-N 2.65Å
15	E	35.7	Very low	34.4	Very low	135 Å²	135	135 Å²	135	63%	0.631	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-77.8	-9.4	-174.1	-64.7	-164.3	128.4	0	0	115.2	F13	F13-E15 PolarHBondContact O-N 3.09Å
16	K	38.3	Very low	33.9	Very low	157 Å²	157	137 Å²	137	68%	0.683	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-92.1	-9.3	-171.3	-82.8	173.4	-178.3	153.4	0	116.3	F13 S14	F13-K16 PolarHBondContact O-N 3.37Å; S14-K16 VanDerWaalsContact C-N 3.34Å; S14-K16 PolarHBondContact O-N 2.65Å
17	N	36.5	Very low	33.7	Very low	141 Å²	141	145.9 Å²	145.9	75%	0.754	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-92.4	11.5	179.7	-78.8	-8.7	0	0	0	114.7	C19	N17-C19 PolarHBondContact O-N 3.03Å
18	R	34.7	Very low	33.7	Very low	227 Å²	227	144.3 Å²	144.3	86%	0.857	71%	0.713	S	S	*	*			trans	-85.1	96.1	165.9	-78.3	-168.8	175.4	-169.3	-0.4	111	N20	R18-N20 PolarHBondContact O-N 3.14Å
19	C	27.8	Very low	33.6	Very low	120 Å²	120	147.5 Å²	147.5	81%	0.811	73%	0.729	S	S	*	*			trans	-57.8	125.1	165.2	-62.6	0	0	0	0	110.6	N17	N17-C19 PolarHBondContact O-N 3.03Å
20	N	33.7	Very low	33.7	Very low	162 Å²	162	153.3 Å²	153.3	87%	0.866	75%	0.748	S	S	*	*			trans	-145.5	149.8	155.3	-104.6	-50.4	0	0	0	109.3	R18	R18-N20 PolarHBondContact O-N 3.14Å
21	V	30.6	Very low	34.1	Very low	124 Å²	124	156.6 Å²	156.6	75%	0.752	77%	0.765	S	S	*	*			trans	-121.3	136.5	-157.8	170.8	0	0	0	0	110
22	V	29.2	Very low	34.8	Very low	125 Å²	125	155.2 Å²	155.2	76%	0.758	78%	0.776	S	S	*	*			trans	69.3	145	170.4	163.1	0	0	0	0	113.3
23	E	31.9	Very low	34.9	Very low	184 Å²	184	163.2 Å²	163.2	86%	0.86	80%	0.795	S	S	*	*			cis	-139.8	-173.8	11.7	-151.8	152.3	-141.9	0	0	113.8
24	R	26.1	Very low	35.2	Very low	228 Å²	228	160.2 Å²	160.2	86%	0.86	80%	0.801	S	S	*	*			trans	-114.7	142	-178.7	-65.9	170.4	165.9	172.5	-5.4	113.1
25	K	32.8	Very low	35.8	Very low	196 Å²	196	162.8 Å²	162.8	85%	0.852	81%	0.807	S	S	*	*				172.5	115.8	126.3	-94	156.3	-176	169.6	0	116.8
26	L	27	Very low	36.1	Very low	152 Å²	152	165.2 Å²	165.2	80%	0.796	82%	0.816	S	S	*	*			trans	41.5	123.1	132	-62	166.6	0	0	0	123
27	R	33.4	Very low	36.2	Very low	240 Å²	240	162.7 Å²	162.7	91%	0.906	82%	0.817	S	S	*	*				173.1	110.7	108	-92.6	171.2	-174.8	179.4	3	116.6
28	V	38.4	Very low	36.7	Very low	141 Å²	141	160.8 Å²	160.8	86%	0.855	81%	0.813	S	S	*	*			trans	30.6	140.7	136	-170.2	0	0	0	0	122.8
29	P	38.1	Very low	36.8	Very low	117 Å²	117	160.2 Å²	160.2	76%	0.76	82%	0.817	S	S	*	*			trans	-113.4	-172	-167.3	45.2	-37.6	0	0	0	118.2
30	R	40.2	Very low	37.4	Very low	237 Å²	237	157.7 Å²	157.7	89%	0.894	81%	0.811	S	S	*	*			trans	-140.5	133.9	168	-75.2	-178.5	170.5	178.9	-4.6	109.5
31	V	46.1	Very low	37.6	Very low	131 Å²	131	157.3 Å²	157.3	79%	0.794	81%	0.808	S	S	*	*				64.5	124.1	76.7	-176.6	0	0	0	0	111.7
32	V	44.7	Very low	38	Very low	144 Å²	144	161 Å²	161	87%	0.873	81%	0.814	S	S	*	*				-150.4	174.2	68.7	-149.7	0	0	0	0	114.5
33	R	35.8	Very low	38.2	Very low	245 Å²	245	160.6 Å²	160.6	93%	0.925	82%	0.816	S	S	*	*			trans	-108.5	161.7	-179.8	-88.8	176.5	160.1	174	-6.5	114.5
34	G	41.2	Very low	38.7	Very low	68 Å²	68	158.7 Å²	158.7	70%	0.701	82%	0.817	S	S	*	*			trans	173.8	163	150.7	0	0	0	0	0	113.7
35	L	49.9	Very low	39.2	Very low	145 Å²	145	154.4 Å²	154.4	76%	0.759	81%	0.811	S	S	*	*			cis	-167.9	127.5	-15	-137.5	109.7	0	0	0	110.9
36	F	42.2	Very low	39.5	Very low	186 Å²	186	154.1 Å²	154.1	82%	0.816	81%	0.813	S	S	*	*			trans	65.8	162.4	159.8	-72.7	-134.1	0	0	0	116.9
37	C	39.6	Very low	40.1	Very low	104 Å²	104	151.1 Å²	151.1	70%	0.703	81%	0.81	S	S	*	*			cis	-156	-178.4	6	-136.3	0	0	0	0	108
38	C	46.6	Very low	40.4	Very low	100 Å²	100	145 Å²	145	68%	0.676	81%	0.81	S	S	*	*			cis	-168.4	-171.6	-25.6	-85.1	0	0	0	0	109.3
39	F	37.8	Very low	40.5	Very low	215 Å²	215	142.7 Å²	142.7	94%	0.943	81%	0.806	S	S	*	*			trans	-133.8	161.9	-172.6	-95.5	-97.8	0	0	0	114.6
40	G	40.9	Very low	41	Very low	67 Å²	67	142.7 Å²	142.7	69%	0.691	81%	0.806	S	S	*	*			trans	173.7	110.9	166.3	0	0	0	0	0	110.7
41	I	37.5	Very low	41	Very low	154 Å²	154	136.5 Å²	136.5	79%	0.79	80%	0.8	S	S	*	*				78.9	105.9	52.5	-52.3	167	0	0	0	114.4
42	K	38.1	Very low	40.8	Very low	203 Å²	203	135.1 Å²	135.1	88%	0.883	80%	0.796	S	S	*	*				176.2	156.9	126.5	-96.7	176.8	-174.1	-178.2	0	113
43	S	34.7	Very low	40.6	Very low	115 Å²	115	137.1 Å²	137.1	80%	0.804	80%	0.795	S	S	*	*			trans	-142.6	152.7	-176.1	-42	0	0	0	0	111.6
44	V	41.7	Very low	40.7	Very low	144 Å²	144	133.5 Å²	133.5	87%	0.873	79%	0.794	S	S	*	*			trans	-150.9	157.6	163.8	-171.5	0	0	0	0	109.4
45	D	37.4	Very low	40.6	Very low	138 Å²	138	136.1 Å²	136.1	74%	0.738	80%	0.801	S	S	*	*			trans	-107.6	-170.9	-158.8	-48.8	-88.8	0	0	0	117.3
46	Q	39.3	Very low	39.7	Very low	190 Å²	190	132.5 Å²	132.5	89%	0.888	80%	0.798	S	S	*	*			trans	88.5	140.7	158.8	-65.9	174.7	39.8	0	0	118.7
47	A	39.4	Very low	39.6	Very low	90 Å²	90	131.6 Å²	131.6	74%	0.744	80%	0.802	S	S	*	*			cis	-165.1	175	-8.2	0	0	0	0	0	113.7
48	A	40	Very low	39.4	Very low	110 Å²	110	138.1 Å²	138.1	91%	0.909	81%	0.812	S	S	*	*			trans	82	157.1	162.3	0	0	0	0	0	120.3
49	A	39.8	Very low	38.8	Very low	93 Å²	93	139.6 Å²	139.6	77%	0.769	82%	0.822	S	S	*	*			trans	-160	-155.9	-168.5	0	0	0	0	0	109.3
50	P	48.1	Very low	39.1	Very low	117 Å²	117	134 Å²	134	76%	0.76	81%	0.809	S	S	*	*			cis	-128.3	177.2	-36.5	39.5	-25.5	0	0	0	113.1
51	S	41.1	Very low	39.1	Very low	108 Å²	108	136.5 Å²	136.5	76%	0.755	81%	0.814	S	S	*	*			trans	173.9	148	139	36.2	0	0	0	0	114.1
52	S	41.9	Very low	39.3	Very low	102 Å²	102	138.7 Å²	138.7	71%	0.713	82%	0.818	S	S	*	*			trans	42	142.7	151	54.8	0	0	0	0	121.9
53	E	39.5	Very low	39.4	Very low	185 Å²	185	137 Å²	137	86%	0.864	82%	0.817	S	S	*	*			cis	-162	-172.6	-4.7	-123.8	176.7	177.3	0	0	111.2
54	L	37.3	Very low	39.7	Very low	170 Å²	170	137.6 Å²	137.6	89%	0.89	82%	0.816	S	S	*	*			trans	-65.5	134.3	-177.9	-82.1	61.7	0	0	0	114
55	S	39.1	Very low	39.6	Very low	123 Å²	123	139.6 Å²	139.6	86%	0.86	82%	0.816	S	S	*	*				-161	147.7	115.8	-163.6	0	0	0	0	110.6
56	G	32.7	Very low	39.8	Very low	68 Å²	68	138 Å²	138	70%	0.701	81%	0.807	S	S	*	*			trans	-101.7	163	-174.5	0	0	0	0	0	113.4
57	N	40	Very low	40.4	Very low	167 Å²	167	133.2 Å²	133.2	89%	0.893	80%	0.8	S	S	*	*			trans	-145.9	139.8	157.3	-134.6	-18.1	0	0	0	111.5
58	R	33.8	Very low	41.1	Very low	241 Å²	241	132.7 Å²	132.7	91%	0.909	79%	0.791	S	S	*	*			trans	-88.9	114	-178.1	-55.9	179.4	-161.3	-162.1	3.6	108.4
59	C	35.2	Very low	42.2	Very low	131 Å²	131	133.3 Å²	133.3	89%	0.885	78%	0.779	S	S	*	*			trans	-88.1	110.1	172.3	-159.5	0	0	0	0	109.3
60	S	44.4	Very low	44.3	Very low	97 Å²	97	136.8 Å²	136.8	68%	0.678	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-61.4	147.7	177.9	-58.2	0	0	0	0	111.6	K62	S60-K62 PolarHBondContact O-N 3.17Å
61	P	40	Very low	46.5	Very low	121 Å²	121	135.9 Å²	135.9	79%	0.786	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-61.9	127.2	174.4	27	-33.9	0	0	0	109.7	L63	P61-L63 PolarHBondContact O-N 2.81Å
62	K	41	Very low	49	Very low	199 Å²	199	132.5 Å²	132.5	87%	0.865	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-64.3	123.9	167.6	-71.7	-173.6	176.3	-176.1	0	108	S60 V64	S60-K62 PolarHBondContact O-N 3.17Å; K62-V64 PolarHBondContact O-N 3.32Å
63	L	40.4	Very low	51.6	Low	168 Å²	168	128.1 Å²	128.1	88%	0.88	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-61.3	123.7	169.3	-68.5	170.6	0	0	0	108.2	P61 E65	P61-L63 PolarHBondContact O-N 2.81Å; L63-E65 PolarHBondContact O-N 2.76Å
64	V	41.6	Very low	54.3	Low	128 Å²	128	122.6 Å²	122.6	78%	0.776	69%	0.687	S	S	*	*			trans	-80.9	99.1	168.8	178.5	0	0	0	0	106.2	K62 N66	K62-V64 PolarHBondContact O-N 3.32Å; V64-N66 PolarHBondContact O-N 2.82Å
65	E	40.1	Very low	57.1	Low	186 Å²	186	120.1 Å²	120.1	87%	0.869	68%	0.681	S	S	*	*			trans	-68.6	117.5	176.7	-162.5	168.5	-121.9	0	0	108.7	L63 A67	L63-E65 PolarHBondContact O-N 2.76Å; E65-A67 PolarHBondContact O-N 2.69Å
66	N	41.2	Very low	59.8	Low	104 Å²	104	117.1 Å²	117.1	56%	0.556	66%	0.658	S	S	*	*			trans	-69.5	117.7	-175.4	-81.9	-27.2	0	0	0	110.2	V64 S68 D69	V64-N66 PolarHBondContact O-N 2.82Å; N66-S68 PolarHBondContact O-N 3.29Å; N66-D69 PolarHBondContact O-N 3.04Å; N66-D69 VanDerWaalsContact O-N 3.1Å
67	A	51	Low	62.8	Low	90 Å²	90	119.2 Å²	119.2	74%	0.744	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	-4.8	-179.1	0	0	0	0	0	114.7	E65 D69	E65-A67 PolarHBondContact O-N 2.69Å; A67-D69 VanDerWaalsContact C-N 3.34Å
68	S	54.4	Low	65.5	Low	79 Å²	79	117 Å²	117	55%	0.552	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	-33.2	169.8	43.9	0	0	0	0	113.2	N66 K70	N66-S68 PolarHBondContact O-N 3.29Å; S68-K70 PolarHBondContact O-N 3.29Å
69	D	63.5	Low	68.5	Low	123 Å²	123	109.6 Å²	109.6	66%	0.658	62%	0.623	S	S	*	*	S	Bend	trans	-91.1	-6.3	-160.1	-58.3	3.8	0	0	0	112.4	N66 A67 L71	N66-D69 PolarHBondContact O-N 3.04Å; N66-D69 VanDerWaalsContact O-N 3.1Å; A67-D69 VanDerWaalsContact C-N 3.34Å; D69-L71 PolarHBondContact O-N 3.35Å
70	K	84.8	Confident	71.4	Confident	166 Å²	166	103.4 Å²	103.4	72%	0.722	58%	0.581	S	S	*	*			trans	-81.3	116.5	177.5	-170.7	175.9	-179.7	-179	0	111.2	S68	S68-K70 PolarHBondContact O-N 3.29Å
71	L	92.8	Very high	73.8	Confident	98 Å²	98	104.3 Å²	104.3	51%	0.513	58%	0.578	S	S	.	*			trans	-62.8	146.7	172	-56.7	173.9	0	0	0	111.6	D69 R185	D69-L71 PolarHBondContact O-N 3.35Å; L71-R185 CarbonylContact C-O 3.53Å; L71-R185 WeakPolarHBondContact CA-O 3.46Å
72	L	94.3	Very high	76.5	Confident	36 Å²	36	106.3 Å²	106.3	19%	0.188	58%	0.581	C	S	.	*	S	Bend	trans	-78.1	-33	-176.5	-64.7	176.4	0	0	0	113	F144 L169 A173 R185 L186	L72-F144 HydrophobicContact CD1-CE1 4.18Å; L72-F144 HydrophobicContact CD1-CZ 4.21Å; L72-L169 HydrophobicContact CB-CD1 4.09Å; L72-L169 HydrophobicContact CB-CD2 4.1Å; L72-L169 HydrophobicContact CD1-CD1 4.27Å; L72-A173 HydrophobicContact CD1-CB 4.34Å; L72-A173 HydrophobicContact CD2-CB 3.88Å; L72-R185 HydrophobicContact CD1-CB 3.85Å; L72-R185 HydrophobicContact CG-CB 3.93Å; L72-R185 PolarHBondContact N-O 3.16Å; L72-L186 HydrophobicContact CD1-CD2 4.45Å
73	L	96.4	Very high	79.2	Confident	11 Å²	11	99.5 Å²	99.5	6%	0.058	55%	0.552	C	S	.	*	S	Bend	trans	-105.1	150.6	-179.8	-55.5	179.6	0	0	0	111.7	I142 L169 L186 R188	L73-I142 HydrophobicContact CD1-CD1 3.95Å; L73-I142 HydrophobicContact CD1-CG1 3.98Å; L73-I142 HydrophobicContact CD2-CD1 3.91Å; L73-I142 HydrophobicContact CD2-CG1 4.31Å; L73-I142 HydrophobicContact CD2-CG2 3.97Å; L73-L169 HydrophobicContact CD2-CD1 3.95Å; L73-L169 HydrophobicContact CD2-CD2 4.45Å; L73-L169 HydrophobicContact CD2-CG 4.32Å; L73-L186 VanDerWaalsContact CB-O 3.32Å; L73-L186 WeakPolarHBondContact CB-O 3.47Å; L73-L186 HydrophobicContact CD1-CB 4.14Å; L73-L186 HydrophobicContact CD1-CD2 4.08Å; L73-L186 HydrophobicContact CG-CB 4.47Å; L73-L186 HydrophobicContact CG-CD2 4.14Å; L73-R188 HydrophobicContact CD1-CG 4.13Å
74	P	95.6	Very high	81.9	Confident	68 Å²	68	92.5 Å²	92.5	44%	0.442	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-66.2	171.1	165.4	31.3	-36.3	0	0	0	111.5	R188	P74-R188 PolarHBondContact O-NH1 2.71Å; P74-R188 PolarHBondContact O-NH2 2.93Å
75	P	95.7	Very high	84.6	Confident	119 Å²	119	86.5 Å²	86.5	77%	0.773	48%	0.478	S	S	*	.	S	Bend	trans	-50.7	146.6	164.8	-25.8	35.5	0	0	0	112.2
76	V	96.6	Very high	87.4	Confident	60 Å²	60	77.7 Å²	77.7	36%	0.364	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-59.6	137.9	-177.7	-175.2	0	0	0	0	110.7	D80	V76-D80 HydrophobicContact CG1-CB 4.25Å
77	R	96.4	Very high	90.2	Very high	112 Å²	112	72.7 Å²	72.7	42%	0.423	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-69.6	145	177.5	-58.1	-179.2	-177.2	-163.6	3.8	110.3	C79 D80 I81 R166	R77-C79 PolarHBondContact O-N 3.31Å; R77-C79 VanDerWaalsContact O-N 3.08Å; R77-D80 PolarHBondContact O-N 3.2Å; R77-I81 PolarHBondContact O-N 2.77Å; R77-R166 PolarHBondContact NH2-O 2.7Å
78	P	96.5	Very high	92.4	Very high	119 Å²	119	68.4 Å²	68.4	77%	0.773	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-29.3	179.9	-28.2	35.8	0	0	0	115.1	D80 I81	P78-D80 VanDerWaalsContact C-N 3.31Å; P78-D80 PolarHBondContact O-N 3.12Å; P78-I81 WeakPolarHBondContact O-CG2 3.42Å
79	C	95.7	Very high	94.5	Very high	87 Å²	87	65 Å²	65	59%	0.588	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-17.4	175.9	48.8	0	0	0	0	114.5	R77	R77-C79 PolarHBondContact O-N 3.31Å; R77-C79 VanDerWaalsContact O-N 3.08Å
80	D	97.1	Very high	96.2	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	6	-175	-54.8	-55.5	0	0	0	112.2	V76 R77 P78 N82 K83 E140 R166	V76-D80 HydrophobicContact CG1-CB 4.25Å; R77-D80 PolarHBondContact O-N 3.2Å; P78-D80 VanDerWaalsContact C-N 3.31Å; P78-D80 PolarHBondContact O-N 3.12Å; D80-N82 VanDerWaalsContact C-N 3.26Å; D80-N82 PolarHBondContact O-N 2.94Å; D80-N82 VanDerWaalsContact O-N 3.15Å; D80-K83 HydrophobicContact CB-CD 4.19Å; D80-K83 WeakPolarHBondContact O-CB 3.35Å; D80-K83 PolarHBondContact O-N 3.15Å; D80-K83 IonicContact OD1-NZ 2.74Å; D80-K83 PolarHBondContact OD1-NZ 3.26Å; D80-E140 HydrophobicContact CB-CB 4.07Å; D80-E140 HydrophobicContact CB-CG 4.28Å; D80-R166 IonicContact OD1-CZ 3.54Å; D80-R166 IonicContact OD1-NE 2.75Å; D80-R166 PolarHBondContact OD1-NE 3.31Å; D80-R166 IonicContact OD1-NH2 3.99Å; D80-R166 PolarHBondContact OD1-NH2 3.16Å; D80-R166 IonicContact OD2-CZ 3.31Å; D80-R166 IonicContact OD2-NE 3.16Å; D80-R166 PolarHBondContact OD2-NE 3.5Å; D80-R166 IonicContact OD2-NH2 3.17Å
81	I	95.7	Very high	96.8	Very high	116 Å²	116	52.3 Å²	52.3	60%	0.595	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-28.2	-173.3	-166.4	169	0	0	0	115.1	R77 P78	R77-I81 PolarHBondContact O-N 2.77Å; P78-I81 WeakPolarHBondContact O-CG2 3.42Å
82	N	95.5	Very high	97	Very high	162 Å²	162	48.9 Å²	48.9	87%	0.866	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	4.7	177.9	-63.8	-30.8	0	0	0	112.8	D80	D80-N82 VanDerWaalsContact C-N 3.26Å; D80-N82 PolarHBondContact O-N 2.94Å; D80-N82 VanDerWaalsContact O-N 3.15Å
83	K	97.8	Very high	97.2	Very high	57 Å²	57	47.2 Å²	47.2	25%	0.248	26%	0.263	C	S	.	.	S	Bend	trans	-94.9	157.1	-178.4	-60.6	-172.6	-179.1	-177.4	0	110.9	D80 S136 D137 Y138	D80-K83 HydrophobicContact CB-CD 4.19Å; D80-K83 WeakPolarHBondContact O-CB 3.35Å; D80-K83 PolarHBondContact O-N 3.15Å; D80-K83 IonicContact OD1-NZ 2.74Å; D80-K83 PolarHBondContact OD1-NZ 3.26Å; K83-S136 PolarHBondContact NZ-O 3.5Å; K83-D137 WeakPolarHBondContact CE-O 3.26Å; K83-D137 PolarHBondContact NZ-O 3.04Å; K83-D137 VanDerWaalsContact NZ-O 3.12Å; K83-Y138 WeakPolarHBondContact CB-O 3.09Å
84	K	98.1	Very high	97.4	Very high	20 Å²	20	46.7 Å²	46.7	9%	0.087	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	155.3	167.9	-72.1	177.3	-178.6	59.4	0	110	F139 E140 H192 L235 A236 V238 V241	K84-F139 HydrophobicContact CB-CD1 3.75Å; K84-F139 HydrophobicContact CB-CE1 3.83Å; K84-F139 WeakPolarHBondContact O-CA 3.19Å; K84-E140 PolarHBondContact O-N 2.9Å; K84-H192 WeakPolarHBondContact CA-O 3.08Å; K84-H192 WeakPolarHBondContact CB-O 3.21Å; K84-H192 HydrophobicContact CG-CB 4.09Å; K84-L235 WeakPolarHBondContact CD-O 3.43Å; K84-L235 WeakPolarHBondContact CE-O 3.42Å; K84-A236 PolarHBondContact NZ-O 3.38Å; K84-V238 WeakPolarHBondContact CE-O 2.96Å; K84-V238 PolarHBondContact NZ-O 3.08Å; K84-V241 HydrophobicContact CD-CG1 3.94Å
85	C	98.6	Very high	97.5	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.02	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	121.4	173.6	-165.9	0	0	0	0	109	E140 R188 H192 V193 I194	C85-E140 WeakPolarHBondContact CA-O 3.49Å; C85-R188 HydrophobicContact CB-CB 4.46Å; C85-R188 HydrophobicContact CB-CG 4.06Å; C85-H192 PolarHBondContact N-O 3.22Å; C85-V193 HydrophobicContact CB-CG2 4.22Å; C85-V193 WeakPolarHBondContact O-CA 3.12Å; C85-I194 PolarHBondContact O-N 2.93Å
86	L	98.7	Very high	97.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	109.5	176.7	178.8	61.2	0	0	0	108.9	V88 I135 F139 E140 C141 I142 I194 V196 L232	L86-V88 HydrophobicContact CD2-CG2 4.28Å; L86-V88 HydrophobicContact CG-CG2 3.9Å; L86-I135 HydrophobicContact CD2-CB 3.94Å; L86-I135 HydrophobicContact CD2-CD1 3.99Å; L86-I135 HydrophobicContact CD2-CG2 4Å; L86-F139 HydrophobicContact CB-CB 3.62Å; L86-F139 HydrophobicContact CB-CD1 3.75Å; L86-F139 HydrophobicContact CB-CD2 4.33Å; L86-F139 HydrophobicContact CB-CE1 4.5Å; L86-F139 HydrophobicContact CB-CG 3.64Å; L86-F139 HydrophobicContact CD2-CB 4.23Å; L86-F139 HydrophobicContact CD2-CD1 4.48Å; L86-F139 HydrophobicContact CD2-CD2 3.69Å; L86-F139 HydrophobicContact CD2-CE2 4.14Å; L86-F139 HydrophobicContact CD2-CG 3.88Å; L86-F139 HydrophobicContact CG-CG 4.38Å; L86-E140 PolarHBondContact N-O 3.05Å; L86-C141 CarbonylContact O-C 3.59Å; L86-C141 WeakPolarHBondContact O-CA 3.49Å; L86-I142 PolarHBondContact O-N 3.33Å; L86-I194 HydrophobicContact CD1-CB 3.8Å; L86-I194 HydrophobicContact CD1-CG2 3.71Å; L86-V196 HydrophobicContact CD1-CG2 3.98Å; L86-L232 HydrophobicContact CD1-CD2 4.11Å; L86-L232 HydrophobicContact CD2-CD1 4.28Å
87	I	98.5	Very high	97.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	131.4	171.4	-50.4	-51.4	0	0	0	108.3	I142 F144 L183 L186 V193 I194 I195 V196	I87-I142 WeakPolarHBondContact CA-O 3.29Å; I87-I142 HydrophobicContact CD1-CB 3.66Å; I87-I142 HydrophobicContact CD1-CG1 3.91Å; I87-I142 HydrophobicContact CD1-CG2 4.05Å; I87-F144 HydrophobicContact CG2-CB 3.44Å; I87-F144 VanDerWaalsContact CG2-CB 3.44Å; I87-F144 HydrophobicContact CG2-CD1 4.13Å; I87-F144 HydrophobicContact CG2-CG 4.28Å; I87-L183 HydrophobicContact CG1-CD2 4.49Å; I87-L186 HydrophobicContact CD1-CD1 3.75Å; I87-L186 HydrophobicContact CD1-CD2 4.06Å; I87-L186 HydrophobicContact CG1-CD1 3.96Å; I87-V193 HydrophobicContact CG1-CG1 4.21Å; I87-I194 WeakPolarHBondContact CB-O 3.34Å; I87-I194 PolarHBondContact N-O 3.08Å; I87-I195 HydrophobicContact CB-CB 3.97Å; I87-I195 HydrophobicContact CB-CD1 4.29Å; I87-I195 HydrophobicContact CB-CG1 3.95Å; I87-I195 HydrophobicContact CG2-CB 4.46Å; I87-I195 HydrophobicContact CG2-CD1 3.84Å; I87-I195 HydrophobicContact CG2-CG1 3.94Å; I87-I195 WeakPolarHBondContact O-CA 3.07Å; I87-V196 PolarHBondContact O-N 2.82Å
88	V	98.6	Very high	97.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	128.9	177.3	-162.7	0	0	0	0	108.7	L86 T93 L94 F131 I135 I142 L143 F144 F165	L86-V88 HydrophobicContact CD2-CG2 4.28Å; L86-V88 HydrophobicContact CG-CG2 3.9Å; V88-T93 HydrophobicContact CG1-CG2 4.41Å; V88-L94 HydrophobicContact CG1-CD1 3.83Å; V88-L94 HydrophobicContact CG1-CD2 3.95Å; V88-L94 HydrophobicContact CG1-CG 4.01Å; V88-F131 HydrophobicContact CG1-CE1 4.29Å; V88-I135 HydrophobicContact CG2-CD1 4.24Å; V88-I142 PolarHBondContact N-O 2.69Å; V88-L143 WeakPolarHBondContact O-CA 3.36Å; V88-F144 PolarHBondContact O-N 2.97Å; V88-F165 HydrophobicContact CB-CE1 4.28Å; V88-F165 HydrophobicContact CG2-CE1 4.42Å
89	D	98.2	Very high	97.4	Very high	8 Å²	8	30.6 Å²	30.6	4%	0.043	16%	0.163	C	C	.	.			trans	-79.8	168.4	170.4	173.3	62.2	0	0	0	112	D91 T93 L94 F144 T145 V196 D197	D89-D91 PolarHBondContact OD2-N 3.35Å; D89-T93 HydrophobicContact CB-CG2 4.33Å; D89-T93 WeakPolarHBondContact O-CG2 3.49Å; D89-T93 PolarHBondContact OD2-OG1 2.9Å; D89-L94 WeakPolarHBondContact O-CD1 3.49Å; D89-L94 WeakPolarHBondContact O-CG 3.48Å; D89-F144 WeakPolarHBondContact CA-O 3.37Å; D89-T145 VanDerWaalsContact OD1-CA 3.27Å; D89-T145 WeakPolarHBondContact OD1-CA 3.48Å; D89-T145 WeakPolarHBondContact OD1-CB 3.45Å; D89-T145 PolarHBondContact OD1-OG1 3.28Å; D89-V196 PolarHBondContact N-O 2.96Å; D89-V196 VanDerWaalsContact N-O 3.07Å; D89-D197 HydrophobicContact CB-CB 4.17Å
90	L	98.3	Very high	97.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.165	C	C	.	.			trans	-102.7	-59	-176.1	-172.9	64.1	0	0	0	113.9	T93 L94 V95 L143 T145 Y151 A152 V155 L159	L90-T93 PolarHBondContact O-N 3.05Å; L90-L94 PolarHBondContact O-N 3.25Å; L90-V95 HydrophobicContact CD1-CG2 3.82Å; L90-V95 HydrophobicContact CG-CG2 3.84Å; L90-V95 WeakPolarHBondContact O-CG2 3.33Å; L90-V95 PolarHBondContact O-N 3.3Å; L90-V95 VanDerWaalsContact O-N 3.14Å; L90-L143 HydrophobicContact CB-CD1 4.19Å; L90-L143 HydrophobicContact CD1-CD1 4.27Å; L90-T145 HydrophobicContact CB-CG2 4.15Å; L90-T145 HydrophobicContact CD2-CG2 4.45Å; L90-Y151 HydrophobicContact CD2-CE1 4.09Å; L90-A152 HydrophobicContact CD2-CB 3.78Å; L90-V155 HydrophobicContact CD1-CG1 3.86Å; L90-V155 HydrophobicContact CD2-CB 4.23Å; L90-V155 HydrophobicContact CD2-CG1 4.24Å; L90-V155 HydrophobicContact CG-CG1 4.47Å; L90-L159 HydrophobicContact CD1-CD2 4.36Å
91	D	97.5	Very high	97.2	Very high	21 Å²	21	37.9 Å²	37.9	11%	0.112	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-87.1	127.7	-162	-71	-36.8	0	0	0	110.6	D89 T93 S147 Y151	D89-D91 PolarHBondContact OD2-N 3.35Å; D91-T93 PolarHBondContact O-N 3.46Å; D91-S147 VanDerWaalsContact OD2-CB 3.23Å; D91-S147 WeakPolarHBondContact OD2-CB 3.49Å; D91-S147 PolarHBondContact OD2-OG 3.42Å; D91-Y151 WeakPolarHBondContact OD1-CE1 3.42Å; D91-Y151 VanDerWaalsContact OD1-CZ 3.28Å; D91-Y151 PolarHBondContact OD1-OH 2.94Å; D91-Y151 WeakPolarHBondContact OD2-CE1 3.46Å
92	E	98.2	Very high	97.1	Very high	27 Å²	27	34.6 Å²	34.6	13%	0.126	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	-1.9	-167.1	-74	79.5	-98.9	0	0	114.8	V95 H96 N198 W216 F217	E92-V95 WeakPolarHBondContact CA-O 3.41Å; E92-V95 PolarHBondContact N-O 3.27Å; E92-H96 IonicContact OE1-CE1 2.8Å; E92-H96 PolarHBondContact OE1-CE1 2.84Å; E92-H96 IonicContact OE1-CG 2.69Å; E92-H96 IonicContact OE1-ND1 2.62Å; E92-H96 PolarHBondContact OE1-ND1 3.19Å; E92-N198 VanDerWaalsContact CB-ND2 3.28Å; E92-N198 WeakPolarHBondContact CB-ND2 3.36Å; E92-W216 WeakPolarHBondContact CA-O 3.41Å; E92-W216 WeakPolarHBondContact CG-O 3.23Å; E92-W216 PolarHBondContact O-N 3.1Å; E92-F217 HydrophobicContact CG-CD1 3.92Å; E92-F217 HydrophobicContact CG-CE1 3.4Å; E92-F217 HydrophobicContact CG-CZ 3.78Å
93	T	98.7	Very high	97.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-56	176.4	-61.3	0	0	0	0	111.8	V88 D89 L90 D91 R125 V196 N198 V213	V88-T93 HydrophobicContact CG1-CG2 4.41Å; D89-T93 HydrophobicContact CB-CG2 4.33Å; D89-T93 WeakPolarHBondContact O-CG2 3.49Å; D89-T93 PolarHBondContact OD2-OG1 2.9Å; L90-T93 PolarHBondContact O-N 3.05Å; D91-T93 PolarHBondContact O-N 3.46Å; T93-R125 WeakPolarHBondContact O-CD 3.39Å; T93-R125 PolarHBondContact O-NH1 3.36Å; T93-V196 HydrophobicContact CG2-CG1 4.37Å; T93-N198 PolarHBondContact OG1-N 2.95Å; T93-N198 PolarHBondContact OG1-OD1 2.87Å; T93-V213 HydrophobicContact CG2-CG2 4.24Å
94	L	98.8	Very high	97	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112	-27	-179.4	-62.9	176.9	0	0	0	113.4	V88 D89 L90 R125 V128 F131 L132 L159 F165 L225	V88-L94 HydrophobicContact CG1-CD1 3.83Å; V88-L94 HydrophobicContact CG1-CD2 3.95Å; V88-L94 HydrophobicContact CG1-CG 4.01Å; D89-L94 WeakPolarHBondContact O-CD1 3.49Å; D89-L94 WeakPolarHBondContact O-CG 3.48Å; L90-L94 PolarHBondContact O-N 3.25Å; L94-R125 WeakPolarHBondContact O-CB 3.48Å; L94-R125 PolarHBondContact O-N 3.47Å; L94-V128 HydrophobicContact CB-CG2 4.16Å; L94-V128 HydrophobicContact CD2-CG2 4.01Å; L94-F131 HydrophobicContact CD2-CD1 3.96Å; L94-F131 HydrophobicContact CD2-CE1 3.8Å; L94-L132 HydrophobicContact CD1-CD2 4.5Å; L94-L159 HydrophobicContact CB-CD2 4.28Å; L94-L159 HydrophobicContact CD1-CD2 4.33Å; L94-F165 HydrophobicContact CD1-CZ 4.04Å; L94-L225 HydrophobicContact CD2-CD1 4.13Å; L94-L225 HydrophobicContact CD2-CD2 4.31Å
95	V	98.6	Very high	96.9	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	163.1	-179.2	-64.8	0	0	0	0	110	L90 E92 V122 L123 V155 L159	L90-V95 HydrophobicContact CD1-CG2 3.82Å; L90-V95 HydrophobicContact CG-CG2 3.84Å; L90-V95 WeakPolarHBondContact O-CG2 3.33Å; L90-V95 PolarHBondContact O-N 3.3Å; L90-V95 VanDerWaalsContact O-N 3.14Å; E92-V95 WeakPolarHBondContact CA-O 3.41Å; E92-V95 PolarHBondContact N-O 3.27Å; V95-V122 HydrophobicContact CB-CG1 3.79Å; V95-V122 HydrophobicContact CG1-CG1 4.01Å; V95-V122 HydrophobicContact CG2-CG1 4.22Å; V95-L123 CarbonylContact C-O 3.6Å; V95-L123 VanDerWaalsContact CA-O 3.23Å; V95-L123 WeakPolarHBondContact CA-O 3.38Å; V95-L123 WeakPolarHBondContact CB-O 3.32Å; V95-V155 HydrophobicContact CG1-CG1 4.24Å; V95-V155 HydrophobicContact CG2-CG1 4.16Å; V95-L159 HydrophobicContact CG1-CD1 4.37Å; V95-L159 HydrophobicContact CG1-CD2 4.05Å
96	H	98	Very high	96.9	Very high	40 Å²	40	45 Å²	45	19%	0.185	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	139.2	164.3	179.5	54.7	0	0	0	110.3	E92 V122 L123 W216 F217	E92-H96 IonicContact OE1-CE1 2.8Å; E92-H96 PolarHBondContact OE1-CE1 2.84Å; E92-H96 IonicContact OE1-CG 2.69Å; E92-H96 IonicContact OE1-ND1 2.62Å; E92-H96 PolarHBondContact OE1-ND1 3.19Å; H96-V122 WeakPolarHBondContact O-CA 3.17Å; H96-L123 PolarHBondContact N-O 3.16Å; H96-L123 PolarHBondContact O-N 2.69Å; H96-W216 HydrophobicContact CB-CE3 3.94Å; H96-W216 HydrophobicContact CB-CZ3 3.8Å; H96-F217 VanDerWaalsContact CB-O 3.22Å; H96-F217 WeakPolarHBondContact CB-O 3.22Å; H96-F217 PolarHBondContact CD2-O 3.47Å; H96-F217 VanDerWaalsContact CD2-O 3.29Å; H96-F217 AromaticContact CE1-CD1 3.72Å; H96-F217 AromaticContact ND1-CD1 3.75Å
97	S	96.1	Very high	96.8	Very high	16 Å²	16	46.3 Å²	46.3	11%	0.112	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	133.6	-170.9	-85.8	0	0	0	0	113.8	Y121 Y151	S97-Y121 WeakPolarHBondContact CA-O 3.27Å; S97-Y151 VanDerWaalsContact CB-OH 3.22Å; S97-Y151 WeakPolarHBondContact CB-OH 3.34Å; S97-Y151 WeakPolarHBondContact OG-CE2 3.49Å; S97-Y151 PolarHBondContact OG-OH 3.42Å
98	S	94.4	Very high	96.8	Very high	24 Å²	24	50.6 Å²	50.6	17%	0.168	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	135.8	-173.4	170.2	0	0	0	0	112.6	K100 Y121	S98-K100 VanDerWaalsContact C-N 3.28Å; S98-K100 WeakPolarHBondContact OG-CA 3.46Å; S98-K100 WeakPolarHBondContact OG-CB 3.5Å; S98-K100 PolarHBondContact OG-N 3.04Å; S98-K100 PolarHBondContact OG-O 2.96Å; S98-Y121 PolarHBondContact N-O 3.26Å; S98-Y121 WeakPolarHBondContact O-CD2 3.49Å; S98-Y121 PolarHBondContact O-N 3.44Å
99	F	93.6	Very high	96.6	Very high	61 Å²	61	50.9 Å²	50.9	27%	0.268	26%	0.261	S	S	.	.	S	Bend	trans	-79.3	-8.6	166.1	-69.3	-78.6	0	0	0	113.4	L3 M6 I113 H118 V120	L3-F99 HydrophobicContact CD1-CB 4.37Å; L3-F99 HydrophobicContact CD1-CD1 3.84Å; L3-F99 HydrophobicContact CD1-CD2 3.62Å; L3-F99 HydrophobicContact CD1-CE1 3.96Å; L3-F99 HydrophobicContact CD1-CE2 3.75Å; L3-F99 HydrophobicContact CD1-CG 3.67Å; L3-F99 HydrophobicContact CD1-CZ 3.92Å; L3-F99 HydrophobicContact CG-CD2 4.39Å; M6-F99 HydrophobicContact SD-CE2 3.75Å; M6-F99 HydrophobicContact SD-CZ 4.24Å; F99-I113 HydrophobicContact CE1-CD1 3.6Å; F99-I113 HydrophobicContact CZ-CD1 3.6Å; F99-H118 HydrophobicContact CD1-CB 4.01Å; F99-H118 HydrophobicContact CE1-CB 4.05Å; F99-V120 HydrophobicContact CD1-CG2 3.94Å; F99-V120 HydrophobicContact CE1-CG2 3.51Å; F99-V120 HydrophobicContact CZ-CG2 4.01Å
100	K	94.7	Very high	96.5	Very high	143 Å²	143	54.5 Å²	54.5	62%	0.622	29%	0.285	S	S	*	.	S	Bend	trans	-90.6	139.8	168.3	-65.2	-178.4	175.1	-175.6	0	109.2	S98 V102 Y121	S98-K100 VanDerWaalsContact C-N 3.28Å; S98-K100 WeakPolarHBondContact OG-CA 3.46Å; S98-K100 WeakPolarHBondContact OG-CB 3.5Å; S98-K100 PolarHBondContact OG-N 3.04Å; S98-K100 PolarHBondContact OG-O 2.96Å; K100-V102 PolarHBondContact O-N 3.17Å; K100-Y121 WeakPolarHBondContact O-CD2 3.5Å
101	P	94.5	Very high	96.3	Very high	98 Å²	98	54.8 Å²	54.8	64%	0.636	29%	0.287	S	S	*	.			trans	-54.5	129	169.7	-23.5	32.7	0	0	0	111.8	Y121	P101-Y121 HydrophobicContact CB-CE1 4.13Å; P101-Y121 HydrophobicContact CB-CE2 4.12Å; P101-Y121 HydrophobicContact CG-CE2 3.89Å
102	V	94.2	Very high	96	Very high	46 Å²	46	59.2 Å²	59.2	28%	0.279	31%	0.307	S	S	.	.			trans	-104.3	166.8	171	-53	0	0	0	0	109.7	K100 P105 L123	K100-V102 PolarHBondContact O-N 3.17Å; V102-P105 HydrophobicContact CG2-CB 3.85Å; V102-P105 HydrophobicContact CG2-CG 4.46Å; V102-L123 HydrophobicContact CG2-CD1 4.37Å; V102-L123 HydrophobicContact CG2-CD2 4.02Å; V102-L123 HydrophobicContact CG2-CG 4.14Å
103	K	94.6	Very high	95.6	Very high	189 Å²	189	58.2 Å²	58.2	82%	0.822	30%	0.302	S	S	*	.	S	Bend	trans	-79.2	139.9	169	-67	179.2	-179.6	176	0	108.9
104	N	95.6	Very high	95.3	Very high	149 Å²	149	63.6 Å²	63.6	80%	0.797	33%	0.331	S	S	*	.	S	Bend	trans	47.4	54.1	172.5	-52.4	-7.2	0	0	0	114.4
105	P	97.3	Very high	95.1	Very high	38 Å²	38	66.5 Å²	66.5	25%	0.247	36%	0.361	C	S	.	.			trans	-62.1	141.9	173.1	30.5	-37	0	0	0	111	V102 I108 Y121	V102-P105 HydrophobicContact CG2-CB 3.85Å; V102-P105 HydrophobicContact CG2-CG 4.46Å; P105-I108 HydrophobicContact CB-CG1 4.16Å; P105-I108 HydrophobicContact CG-CD1 3.82Å; P105-I108 HydrophobicContact CG-CG1 3.72Å; P105-Y121 HydrophobicContact CB-CD1 4.34Å; P105-Y121 HydrophobicContact CG-CD1 4.11Å
106	D	98.2	Very high	94.9	Very high	85 Å²	85	70.5 Å²	70.5	46%	0.455	39%	0.385	S	S	.	.	S	Bend	trans	-69.4	-44.2	170.3	-64.5	-89	0	0	0	110.8	V122 L123 K124	D106-V122 PolarHBondContact N-O 3.25Å; D106-L123 WeakPolarHBondContact OD2-CA 3.3Å; D106-K124 HydrophobicContact CB-CB 4.45Å; D106-K124 HydrophobicContact CB-CD 3.77Å; D106-K124 HydrophobicContact CB-CG 3.7Å; D106-K124 PolarHBondContact OD2-N 3.04Å
107	F	97.2	Very high	94.8	Very high	27 Å²	27	72.9 Å²	72.9	12%	0.118	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	147.8	178.2	-41.4	-50.9	0	0	0	111.7	I109 V122 K124 L158 L159	F107-I109 HydrophobicContact CB-CD1 4.4Å; F107-I109 HydrophobicContact CB-CG1 4.24Å; F107-V122 HydrophobicContact CB-CB 4.01Å; F107-V122 HydrophobicContact CB-CG2 4.13Å; F107-V122 HydrophobicContact CD2-CB 4.07Å; F107-V122 HydrophobicContact CD2-CG1 4.06Å; F107-V122 HydrophobicContact CG-CB 4.49Å; F107-V122 PolarHBondContact N-O 3.01Å; F107-V122 PolarHBondContact O-N 2.68Å; F107-K124 HydrophobicContact CE1-CD 4.43Å; F107-K124 HydrophobicContact CE2-CD 4.23Å; F107-K124 HydrophobicContact CE2-CG 4.12Å; F107-K124 HydrophobicContact CZ-CD 3.83Å; F107-K124 HydrophobicContact CZ-CG 4.24Å; F107-L158 HydrophobicContact CB-CD1 3.94Å; F107-L158 HydrophobicContact CD1-CB 3.92Å; F107-L158 HydrophobicContact CD1-CD1 3.98Å; F107-L158 HydrophobicContact CD1-CG 4.47Å; F107-L158 HydrophobicContact CD2-CB 4.13Å; F107-L158 HydrophobicContact CD2-CD1 4.37Å; F107-L158 HydrophobicContact CE1-CB 3.71Å; F107-L158 HydrophobicContact CE2-CB 3.91Å; F107-L158 HydrophobicContact CG-CB 4.14Å; F107-L158 HydrophobicContact CG-CD1 3.86Å; F107-L158 HydrophobicContact CZ-CB 3.69Å; F107-L158 WeakPolarHBondContact CZ-O 3.45Å; F107-L159 HydrophobicContact CE2-CB 4.31Å; F107-L159 HydrophobicContact CE2-CD1 4.38Å
108	I	97.4	Very high	94.6	Very high	90 Å²	90	75.4 Å²	75.4	46%	0.462	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	116.7	167.9	-54.5	176.8	0	0	0	107.3	P105 Q119 V120 Y121	P105-I108 HydrophobicContact CB-CG1 4.16Å; P105-I108 HydrophobicContact CG-CD1 3.82Å; P105-I108 HydrophobicContact CG-CG1 3.72Å; I108-Q119 HydrophobicContact CG2-CB 4.07Å; I108-Q119 HydrophobicContact CG2-CG 4.41Å; I108-V120 WeakPolarHBondContact CA-O 3.26Å; I108-Y121 HydrophobicContact CD1-CD1 4.09Å; I108-Y121 HydrophobicContact CD1-CE1 3.91Å; I108-Y121 HydrophobicContact CG1-CD1 3.95Å; I108-Y121 HydrophobicContact CG1-CE1 4.21Å; I108-Y121 HydrophobicContact CG2-CD1 4.4Å; I108-Y121 HydrophobicContact CG2-CE1 4.24Å
109	I	95	Very high	94.7	Very high	6 Å²	6	78.2 Å²	78.2	3%	0.031	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	123.3	-168.9	-58.4	177.9	0	0	0	109.9	F107 V111 V120 V122 P154 V155 L158	F107-I109 HydrophobicContact CB-CD1 4.4Å; F107-I109 HydrophobicContact CB-CG1 4.24Å; I109-V111 HydrophobicContact CG2-CG2 3.96Å; I109-V111 PolarHBondContact O-N 2.8Å; I109-V120 PolarHBondContact N-O 2.83Å; I109-V120 PolarHBondContact O-N 3.05Å; I109-V122 HydrophobicContact CD1-CG2 3.87Å; I109-V122 HydrophobicContact CG1-CG2 4.27Å; I109-P154 HydrophobicContact CD1-CB 4.21Å; I109-P154 HydrophobicContact CG2-CB 3.68Å; I109-P154 HydrophobicContact CG2-CG 4.39Å; I109-V155 HydrophobicContact CD1-CB 4.22Å; I109-V155 HydrophobicContact CD1-CG2 3.41Å; I109-V155 VanDerWaalsContact CD1-CG2 3.41Å; I109-L158 HydrophobicContact CD1-CD1 4.18Å; I109-L158 HydrophobicContact CG1-CD1 4.19Å
110	P	96.1	Very high	94.9	Very high	84 Å²	84	75.4 Å²	75.4	55%	0.545	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	113.9	173.2	29.9	-32	0	0	0	110.4	V117	P110-V117 HydrophobicContact CB-CG1 3.57Å
111	V	93.4	Very high	95	Very high	6 Å²	6	70.9 Å²	70.9	4%	0.036	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	119.3	177.5	-178	0	0	0	0	109.6	I109 I113 H118 V120 K150 Y151	I109-V111 HydrophobicContact CG2-CG2 3.96Å; I109-V111 PolarHBondContact O-N 2.8Å; V111-I113 HydrophobicContact CG1-CG1 4.35Å; V111-H118 PolarHBondContact N-O 2.99Å; V111-H118 PolarHBondContact O-N 3.14Å; V111-V120 HydrophobicContact CB-CG2 4.04Å; V111-V120 HydrophobicContact CG2-CB 4.36Å; V111-V120 HydrophobicContact CG2-CG2 3.65Å; V111-K150 HydrophobicContact CG1-CD 4.4Å; V111-K150 HydrophobicContact CG1-CG 4.37Å; V111-Y151 HydrophobicContact CG2-CD2 4.39Å
112	E	91.9	Very high	95.2	Very high	114 Å²	114	66.2 Å²	66.2	53%	0.533	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	128.2	175.2	-161.6	-162.2	123	0	0	111.1	G115 V116 V117 K150	E112-G115 WeakPolarHBondContact OE1-CA 3.38Å; E112-V116 CarbonylContact C-O 3.27Å; E112-V116 WeakPolarHBondContact CA-O 3.43Å; E112-V117 HydrophobicContact CG-CG2 4.46Å; E112-K150 WeakPolarHBondContact O-CE 3.32Å; E112-K150 PolarHBondContact O-NZ 2.69Å
113	I	90	Very high	95.4	Very high	7 Å²	7	65.2 Å²	65.2	4%	0.036	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	121.7	174.9	-64	172	0	0	0	107.7	V2 L3 F99 V111 G115 V116	V2-I113 HydrophobicContact CB-CD1 4.15Å; V2-I113 HydrophobicContact CB-CG1 4.18Å; V2-I113 HydrophobicContact CB-CG2 3.74Å; V2-I113 HydrophobicContact CG1-CD1 4.21Å; V2-I113 HydrophobicContact CG1-CG1 4.42Å; V2-I113 HydrophobicContact CG2-CG2 3.95Å; L3-I113 HydrophobicContact CD1-CD1 4.41Å; F99-I113 HydrophobicContact CE1-CD1 3.6Å; F99-I113 HydrophobicContact CZ-CD1 3.6Å; V111-I113 HydrophobicContact CG1-CG1 4.35Å; I113-G115 PolarHBondContact O-N 2.91Å; I113-G115 VanDerWaalsContact O-N 3.13Å; I113-V116 PolarHBondContact N-O 3.48Å; I113-V116 PolarHBondContact O-N 3.04Å
114	D	91.9	Very high	95.6	Very high	113 Å²	113	57.7 Å²	57.7	60%	0.604	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	36	174.5	-45.1	-34.9	0	0	0	113.7	M1	M1-D114 PolarHBondContact N-OD2 2.87Å
115	G	94	Very high	95.7	Very high	61 Å²	61	50.7 Å²	50.7	63%	0.629	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.2	1	-177.8	0	0	0	0	0	115.8	E112 I113	E112-G115 WeakPolarHBondContact OE1-CA 3.38Å; I113-G115 PolarHBondContact O-N 2.91Å; I113-G115 VanDerWaalsContact O-N 3.13Å
116	V	95	Very high	95.8	Very high	83 Å²	83	50 Å²	50	50%	0.503	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	129.8	-179.3	-178.2	0	0	0	0	110.2	E112 I113 H118	E112-V116 CarbonylContact C-O 3.27Å; E112-V116 WeakPolarHBondContact CA-O 3.43Å; I113-V116 PolarHBondContact N-O 3.48Å; I113-V116 PolarHBondContact O-N 3.04Å; V116-H118 PolarHBondContact O-CD2 3.09Å; V116-H118 VanDerWaalsContact O-CD2 3.3Å; V116-H118 PolarHBondContact O-N 2.85Å
117	V	94.8	Very high	95.8	Very high	90 Å²	90	51.3 Å²	51.3	55%	0.545	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	118.8	173.1	-179.6	0	0	0	0	109.7	P110 E112	P110-V117 HydrophobicContact CB-CG1 3.57Å; E112-V117 HydrophobicContact CG-CG2 4.46Å
118	H	93.7	Very high	95.9	Very high	69 Å²	69	50.1 Å²	50.1	32%	0.319	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	141.2	172.3	-65.8	-91.6	0	0	0	110	F99 V111 V116	F99-H118 HydrophobicContact CD1-CB 4.01Å; F99-H118 HydrophobicContact CE1-CB 4.05Å; V111-H118 PolarHBondContact N-O 2.99Å; V111-H118 PolarHBondContact O-N 3.14Å; V116-H118 PolarHBondContact O-CD2 3.09Å; V116-H118 VanDerWaalsContact O-CD2 3.3Å; V116-H118 PolarHBondContact O-N 2.85Å
119	Q	95.9	Very high	95.9	Very high	84 Å²	84	48.5 Å²	48.5	39%	0.393	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	126.5	170.4	-59.4	-61.6	-9.4	0	0	109.6	I108 Y121	I108-Q119 HydrophobicContact CG2-CB 4.07Å; I108-Q119 HydrophobicContact CG2-CG 4.41Å; Q119-Y121 HydrophobicContact CB-CE2 3.95Å
120	V	96.4	Very high	96.1	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.012	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	124.6	168.8	-177.6	0	0	0	0	107.9	F99 I108 I109 V111 V122 Y151	F99-V120 HydrophobicContact CD1-CG2 3.94Å; F99-V120 HydrophobicContact CE1-CG2 3.51Å; F99-V120 HydrophobicContact CZ-CG2 4.01Å; I108-V120 WeakPolarHBondContact CA-O 3.26Å; I109-V120 PolarHBondContact N-O 2.83Å; I109-V120 PolarHBondContact O-N 3.05Å; V111-V120 HydrophobicContact CB-CG2 4.04Å; V111-V120 HydrophobicContact CG2-CB 4.36Å; V111-V120 HydrophobicContact CG2-CG2 3.65Å; V120-V122 HydrophobicContact CG1-CG2 4.39Å; V120-Y151 HydrophobicContact CG1-CD2 4.21Å; V120-Y151 HydrophobicContact CG1-CE2 3.92Å
121	Y	97.7	Very high	96.2	Very high	47 Å²	47	47.1 Å²	47.1	18%	0.184	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	123.4	177.9	-60.7	-95.8	0	0	0	108.3	S97 S98 K100 P101 P105 I108 Q119	S97-Y121 WeakPolarHBondContact CA-O 3.27Å; S98-Y121 PolarHBondContact N-O 3.26Å; S98-Y121 WeakPolarHBondContact O-CD2 3.49Å; S98-Y121 PolarHBondContact O-N 3.44Å; K100-Y121 WeakPolarHBondContact O-CD2 3.5Å; P101-Y121 HydrophobicContact CB-CE1 4.13Å; P101-Y121 HydrophobicContact CB-CE2 4.12Å; P101-Y121 HydrophobicContact CG-CE2 3.89Å; P105-Y121 HydrophobicContact CB-CD1 4.34Å; P105-Y121 HydrophobicContact CG-CD1 4.11Å; I108-Y121 HydrophobicContact CD1-CD1 4.09Å; I108-Y121 HydrophobicContact CD1-CE1 3.91Å; I108-Y121 HydrophobicContact CG1-CD1 3.95Å; I108-Y121 HydrophobicContact CG1-CE1 4.21Å; I108-Y121 HydrophobicContact CG2-CD1 4.4Å; I108-Y121 HydrophobicContact CG2-CE1 4.24Å; Q119-Y121 HydrophobicContact CB-CE2 3.95Å
122	V	98	Very high	96.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	133.9	-174.6	-165.4	0	0	0	0	109.5	V95 H96 D106 F107 I109 V120 V155	V95-V122 HydrophobicContact CB-CG1 3.79Å; V95-V122 HydrophobicContact CG1-CG1 4.01Å; V95-V122 HydrophobicContact CG2-CG1 4.22Å; H96-V122 WeakPolarHBondContact O-CA 3.17Å; D106-V122 PolarHBondContact N-O 3.25Å; F107-V122 HydrophobicContact CB-CB 4.01Å; F107-V122 HydrophobicContact CB-CG2 4.13Å; F107-V122 HydrophobicContact CD2-CB 4.07Å; F107-V122 HydrophobicContact CD2-CG1 4.06Å; F107-V122 HydrophobicContact CG-CB 4.49Å; F107-V122 PolarHBondContact N-O 3.01Å; F107-V122 PolarHBondContact O-N 2.68Å; I109-V122 HydrophobicContact CD1-CG2 3.87Å; I109-V122 HydrophobicContact CG1-CG2 4.27Å; V120-V122 HydrophobicContact CG1-CG2 4.39Å; V122-V155 HydrophobicContact CG2-CG2 4.27Å
123	L	98.5	Very high	96.7	Very high	26 Å²	26	45.5 Å²	45.5	14%	0.136	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	137.7	168.6	-63.6	168.5	0	0	0	108.9	V95 H96 V102 D106 W216 D218	V95-L123 CarbonylContact C-O 3.6Å; V95-L123 VanDerWaalsContact CA-O 3.23Å; V95-L123 WeakPolarHBondContact CA-O 3.38Å; V95-L123 WeakPolarHBondContact CB-O 3.32Å; H96-L123 PolarHBondContact N-O 3.16Å; H96-L123 PolarHBondContact O-N 2.69Å; V102-L123 HydrophobicContact CG2-CD1 4.37Å; V102-L123 HydrophobicContact CG2-CD2 4.02Å; V102-L123 HydrophobicContact CG2-CG 4.14Å; D106-L123 WeakPolarHBondContact OD2-CA 3.3Å; L123-W216 HydrophobicContact CB-CH2 3.79Å; L123-W216 HydrophobicContact CB-CZ3 4.03Å; L123-D218 HydrophobicContact CD1-CB 4.27Å
124	K	98.7	Very high	97.1	Very high	30 Å²	30	48.3 Å²	48.3	13%	0.13	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	132.9	174.8	-69.4	175.3	71.1	173.8	0	110.2	D106 F107 V128 D129 L159 W216	D106-K124 HydrophobicContact CB-CB 4.45Å; D106-K124 HydrophobicContact CB-CD 3.77Å; D106-K124 HydrophobicContact CB-CG 3.7Å; D106-K124 PolarHBondContact OD2-N 3.04Å; F107-K124 HydrophobicContact CE1-CD 4.43Å; F107-K124 HydrophobicContact CE2-CD 4.23Å; F107-K124 HydrophobicContact CE2-CG 4.12Å; F107-K124 HydrophobicContact CZ-CD 3.83Å; F107-K124 HydrophobicContact CZ-CG 4.24Å; K124-V128 HydrophobicContact CB-CG1 3.99Å; K124-V128 VanDerWaalsContact CE-CG1 3.45Å; K124-V128 HydrophobicContact CG-CG1 4.42Å; K124-D129 IonicContact NZ-OD1 2.7Å; K124-D129 PolarHBondContact NZ-OD1 2.89Å; K124-D129 IonicContact NZ-OD2 3.44Å; K124-D129 PolarHBondContact NZ-OD2 2.82Å; K124-L159 HydrophobicContact CD-CD1 4.32Å; K124-L159 HydrophobicContact CG-CD1 4.19Å; K124-W216 VanDerWaalsContact C-CH2 3.48Å; K124-W216 WeakPolarHBondContact O-CH2 3.47Å
125	R	98.7	Very high	97.4	Very high	2 Å²	2	43 Å²	43	1%	0.008	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-62	139	169.5	-171.4	167	-172.3	163.8	11.9	109.3	T93 L94 V128 Q214 W216 D222 E224 L225	T93-R125 WeakPolarHBondContact O-CD 3.39Å; T93-R125 PolarHBondContact O-NH1 3.36Å; L94-R125 WeakPolarHBondContact O-CB 3.48Å; L94-R125 PolarHBondContact O-N 3.47Å; R125-V128 WeakPolarHBondContact O-CB 3.43Å; R125-V128 VanDerWaalsContact O-CG1 3.27Å; R125-V128 WeakPolarHBondContact O-CG1 3.49Å; R125-V128 PolarHBondContact O-N 2.9Å; R125-Q214 PolarHBondContact NH1-O 3.39Å; R125-W216 HydrophobicContact CB-CD2 3.88Å; R125-W216 HydrophobicContact CB-CE3 3.82Å; R125-W216 HydrophobicContact CB-CG 4.33Å; R125-W216 HydrophobicContact CB-CZ3 4.21Å; R125-W216 HydrophobicContact CG-CB 4.17Å; R125-W216 HydrophobicContact CG-CD2 3.74Å; R125-W216 HydrophobicContact CG-CE3 4.2Å; R125-W216 HydrophobicContact CG-CG 3.7Å; R125-D222 IonicContact CZ-OD1 2.75Å; R125-D222 IonicContact CZ-OD2 3.19Å; R125-D222 IonicContact NE-OD1 3.47Å; R125-D222 PolarHBondContact NE-OD1 2.68Å; R125-D222 IonicContact NE-OD2 3.8Å; R125-D222 PolarHBondContact NE-OD2 2.59Å; R125-D222 IonicContact NH2-OD1 2.76Å; R125-D222 PolarHBondContact NH2-OD1 2.54Å; R125-D222 IonicContact NH2-OD2 2.71Å; R125-D222 PolarHBondContact NH2-OD2 3.28Å; R125-E224 IonicContact CZ-OE2 3.9Å; R125-E224 IonicContact NH1-OE2 3.88Å; R125-E224 PolarHBondContact NH1-OE2 3.03Å; R125-E224 IonicContact NH2-OE2 2.84Å; R125-E224 PolarHBondContact NH2-OE2 3.46Å; R125-L225 HydrophobicContact CB-CD1 3.95Å; R125-L225 HydrophobicContact CG-CD1 3.85Å; R125-L225 HydrophobicContact CG-CG 4.16Å
126	P	98.7	Very high	97.6	Very high	23 Å²	23	41.1 Å²	41.1	15%	0.149	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.8	147	175.1	-30.9	37.3	0	0	0	112.7	V128 D222	P126-V128 PolarHBondContact O-N 3.38Å; P126-D222 VanDerWaalsContact CB-O 3.24Å; P126-D222 WeakPolarHBondContact CB-O 3.37Å; P126-D222 HydrophobicContact CG-CB 4.1Å
127	Y	98.7	Very high	97.6	Very high	114 Å²	114	42.7 Å²	42.7	45%	0.447	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	4.1	-179.9	-48.9	-79.8	0	0	0	116.8	D129 E130 F131 D222 T223 L226	Y127-D129 PolarHBondContact O-N 2.96Å; Y127-D129 VanDerWaalsContact O-N 3.13Å; Y127-E130 WeakPolarHBondContact O-CA 3.48Å; Y127-E130 WeakPolarHBondContact O-CB 3.43Å; Y127-E130 PolarHBondContact O-N 3.2Å; Y127-F131 PolarHBondContact O-N 2.8Å; Y127-D222 WeakPolarHBondContact CE2-O 3.3Å; Y127-T223 HydrophobicContact CE2-CG2 4.01Å; Y127-L226 HydrophobicContact CD1-CB 4.28Å; Y127-L226 HydrophobicContact CD1-CD1 4.33Å; Y127-L226 HydrophobicContact CD1-CD2 3.96Å; Y127-L226 HydrophobicContact CD1-CG 4.43Å; Y127-L226 HydrophobicContact CD2-CB 3.99Å; Y127-L226 HydrophobicContact CD2-CD2 4.48Å; Y127-L226 HydrophobicContact CE1-CD2 3.86Å; Y127-L226 HydrophobicContact CE2-CD2 4.4Å; Y127-L226 HydrophobicContact CG-CB 3.82Å; Y127-L226 HydrophobicContact CG-CD2 4.27Å; Y127-L226 HydrophobicContact CG-CG 4.46Å
128	V	98.7	Very high	97.7	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.012	20%	0.196	C	C	.	.	H	α-helix	trans	-54.8	-35.6	-179.5	69.7	0	0	0	0	113.7	L94 K124 R125 P126 E130 F131 L132 L159 L225	L94-V128 HydrophobicContact CB-CG2 4.16Å; L94-V128 HydrophobicContact CD2-CG2 4.01Å; K124-V128 HydrophobicContact CB-CG1 3.99Å; K124-V128 VanDerWaalsContact CE-CG1 3.45Å; K124-V128 HydrophobicContact CG-CG1 4.42Å; R125-V128 WeakPolarHBondContact O-CB 3.43Å; R125-V128 VanDerWaalsContact O-CG1 3.27Å; R125-V128 WeakPolarHBondContact O-CG1 3.49Å; R125-V128 PolarHBondContact O-N 2.9Å; P126-V128 PolarHBondContact O-N 3.38Å; V128-E130 VanDerWaalsContact C-N 3.31Å; V128-E130 PolarHBondContact O-N 2.67Å; V128-F131 PolarHBondContact O-N 2.96Å; V128-L132 HydrophobicContact CG2-CD1 4.08Å; V128-L132 HydrophobicContact CG2-CG 4.19Å; V128-L132 WeakPolarHBondContact O-CB 3.49Å; V128-L132 VanDerWaalsContact O-CG 3.32Å; V128-L132 WeakPolarHBondContact O-CG 3.21Å; V128-L132 PolarHBondContact O-N 3.41Å; V128-L159 HydrophobicContact CG1-CD1 3.91Å; V128-L159 HydrophobicContact CG2-CD1 4.04Å; V128-L159 HydrophobicContact CG2-CD2 4.38Å; V128-L225 HydrophobicContact CB-CD1 3.87Å; V128-L225 HydrophobicContact CG2-CD1 4.13Å
129	D	98.6	Very high	98	Very high	55 Å²	55	39.2 Å²	39.2	29%	0.294	18%	0.181	S	C	.	.	H	α-helix	trans	-70.2	-24.4	177.1	-67.2	-36	0	0	0	113.9	K124 Y127 R133 W162	K124-D129 IonicContact NZ-OD1 2.7Å; K124-D129 PolarHBondContact NZ-OD1 2.89Å; K124-D129 IonicContact NZ-OD2 3.44Å; K124-D129 PolarHBondContact NZ-OD2 2.82Å; Y127-D129 PolarHBondContact O-N 2.96Å; Y127-D129 VanDerWaalsContact O-N 3.13Å; D129-R133 PolarHBondContact O-NE 2.62Å; D129-R133 PolarHBondContact O-NH2 3.03Å; D129-W162 HydrophobicContact CB-CH2 3.84Å; D129-W162 HydrophobicContact CB-CZ3 4.47Å
130	E	98.3	Very high	98.1	Very high	61 Å²	61	35.5 Å²	35.5	29%	0.285	16%	0.164	S	C	.	.	H	α-helix	trans	-85.6	-44.4	174.8	-169.4	61.8	-131.5	0	0	109.9	Y127 V128 R133 Q134	Y127-E130 WeakPolarHBondContact O-CA 3.48Å; Y127-E130 WeakPolarHBondContact O-CB 3.43Å; Y127-E130 PolarHBondContact O-N 3.2Å; V128-E130 VanDerWaalsContact C-N 3.31Å; V128-E130 PolarHBondContact O-N 2.67Å; E130-R133 VanDerWaalsContact CD-NH1 3.26Å; E130-R133 PolarHBondContact O-N 3.46Å; E130-R133 IonicContact OE1-CZ 3.49Å; E130-R133 IonicContact OE1-NH1 2.74Å; E130-R133 PolarHBondContact OE1-NH1 2.77Å; E130-R133 IonicContact OE2-CZ 2.75Å; E130-R133 IonicContact OE2-NH1 3.62Å; E130-R133 PolarHBondContact OE2-NH1 3.41Å; E130-R133 IonicContact OE2-NH2 3.59Å; E130-R133 PolarHBondContact OE2-NH2 2.87Å; E130-Q134 PolarHBondContact O-N 3.4Å; E130-Q134 PolarHBondContact OE1-NE2 3.22Å
131	F	98.7	Very high	98.2	Very high	1 Å²	1	35.4 Å²	35.4	0%	0.004	16%	0.163	C	C	.	.	H	α-helix	trans	-53.6	-56.7	174.4	177.8	-102.4	0	0	0	112	V88 L94 Y127 V128 R133 Q134 I135 L225 L228 L229 L232	V88-F131 HydrophobicContact CG1-CE1 4.29Å; L94-F131 HydrophobicContact CD2-CD1 3.96Å; L94-F131 HydrophobicContact CD2-CE1 3.8Å; Y127-F131 PolarHBondContact O-N 2.8Å; V128-F131 PolarHBondContact O-N 2.96Å; F131-R133 VanDerWaalsContact C-N 3.34Å; F131-R133 PolarHBondContact O-N 3.39Å; F131-Q134 PolarHBondContact O-N 2.86Å; F131-I135 HydrophobicContact CD1-CD1 4.19Å; F131-I135 HydrophobicContact CD2-CG2 4.16Å; F131-I135 HydrophobicContact CE1-CD1 3.76Å; F131-I135 HydrophobicContact CE1-CG2 4.46Å; F131-I135 HydrophobicContact CE2-CG2 3.91Å; F131-I135 HydrophobicContact CZ-CD1 4.2Å; F131-I135 HydrophobicContact CZ-CG2 4.07Å; F131-I135 WeakPolarHBondContact O-CG1 3.35Å; F131-I135 WeakPolarHBondContact O-CG2 3.24Å; F131-I135 PolarHBondContact O-N 3.01Å; F131-L225 HydrophobicContact CB-CB 4.08Å; F131-L225 HydrophobicContact CD1-CD2 4.36Å; F131-L225 HydrophobicContact CD2-CB 4.16Å; F131-L225 HydrophobicContact CD2-CD2 4.37Å; F131-L225 VanDerWaalsContact CD2-O 3.26Å; F131-L225 WeakPolarHBondContact CD2-O 3.21Å; F131-L225 HydrophobicContact CE1-CD2 4.36Å; F131-L225 HydrophobicContact CE2-CD2 4.35Å; F131-L225 HydrophobicContact CG-CB 4.13Å; F131-L225 HydrophobicContact CG-CD2 4.37Å; F131-L225 HydrophobicContact CZ-CD2 4.35Å; F131-L228 HydrophobicContact CE2-CD2 4.05Å; F131-L228 HydrophobicContact CE2-CG 4.49Å; F131-L228 HydrophobicContact CZ-CD2 4.48Å; F131-L229 HydrophobicContact CD2-CD2 3.89Å; F131-L229 HydrophobicContact CD2-CG 4.08Å; F131-L229 HydrophobicContact CE2-CD2 4.49Å; F131-L232 HydrophobicContact CE2-CD1 3.61Å; F131-L232 HydrophobicContact CZ-CD1 4.05Å
132	L	98.7	Very high	98.2	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59	-41.9	-178.2	-74	-179.4	0	0	0	112.6	L94 V128 I135 S136 L159 W162 V164 F165	L94-L132 HydrophobicContact CD1-CD2 4.5Å; V128-L132 HydrophobicContact CG2-CD1 4.08Å; V128-L132 HydrophobicContact CG2-CG 4.19Å; V128-L132 WeakPolarHBondContact O-CB 3.49Å; V128-L132 VanDerWaalsContact O-CG 3.32Å; V128-L132 WeakPolarHBondContact O-CG 3.21Å; V128-L132 PolarHBondContact O-N 3.41Å; L132-I135 HydrophobicContact CD2-CD1 4.12Å; L132-I135 WeakPolarHBondContact O-CG1 3.47Å; L132-S136 WeakPolarHBondContact O-CB 3.41Å; L132-S136 PolarHBondContact O-N 3.39Å; L132-L159 HydrophobicContact CD1-CD1 4.49Å; L132-L159 HydrophobicContact CD1-CD2 4.2Å; L132-L159 HydrophobicContact CD1-CG 3.81Å; L132-W162 HydrophobicContact CB-CZ3 4.48Å; L132-V164 HydrophobicContact CB-CG2 4.28Å; L132-V164 HydrophobicContact CD2-CG1 4.45Å; L132-V164 WeakPolarHBondContact O-CG2 3.19Å; L132-F165 HydrophobicContact CD2-CE1 4.39Å; L132-F165 HydrophobicContact CD2-CE2 4.08Å; L132-F165 HydrophobicContact CD2-CZ 3.65Å
133	R	97.7	Very high	98.2	Very high	85 Å²	85	33.2 Å²	33.2	32%	0.321	15%	0.154	S	C	.	.	H	α-helix	trans	-60.2	-56.1	174.7	-84.4	-177.1	-76.1	117.4	-1.6	111.3	D129 E130 F131 I135 S136 W162	D129-R133 PolarHBondContact O-NE 2.62Å; D129-R133 PolarHBondContact O-NH2 3.03Å; E130-R133 VanDerWaalsContact CD-NH1 3.26Å; E130-R133 PolarHBondContact O-N 3.46Å; E130-R133 IonicContact OE1-CZ 3.49Å; E130-R133 IonicContact OE1-NH1 2.74Å; E130-R133 PolarHBondContact OE1-NH1 2.77Å; E130-R133 IonicContact OE2-CZ 2.75Å; E130-R133 IonicContact OE2-NH1 3.62Å; E130-R133 PolarHBondContact OE2-NH1 3.41Å; E130-R133 IonicContact OE2-NH2 3.59Å; E130-R133 PolarHBondContact OE2-NH2 2.87Å; F131-R133 VanDerWaalsContact C-N 3.34Å; F131-R133 PolarHBondContact O-N 3.39Å; R133-I135 PolarHBondContact O-N 2.59Å; R133-S136 WeakPolarHBondContact O-CB 3.49Å; R133-S136 PolarHBondContact O-N 3.27Å; R133-S136 VanDerWaalsContact O-N 3.16Å; R133-S136 PolarHBondContact O-OG 3Å; R133-W162 HydrophobicContact CG-CD2 3.55Å; R133-W162 HydrophobicContact CG-CE3 3.97Å; R133-W162 HydrophobicContact CG-CG 3.93Å; R133-W162 HydrophobicContact CG-CH2 4.4Å; R133-W162 HydrophobicContact CG-CZ2 4.01Å; R133-W162 HydrophobicContact CG-CZ3 4.37Å
134	Q	98	Very high	98.2	Very high	67 Å²	67	32 Å²	32	31%	0.313	15%	0.148	S	C	.	.	H	α-helix	trans	-64.6	-42.3	-174	-70.1	-169.7	31	0	0	112.6	E130 F131 S136 D137 Y138 L229	E130-Q134 PolarHBondContact O-N 3.4Å; E130-Q134 PolarHBondContact OE1-NE2 3.22Å; F131-Q134 PolarHBondContact O-N 2.86Å; Q134-S136 PolarHBondContact O-N 2.82Å; Q134-D137 PolarHBondContact O-N 2.98Å; Q134-Y138 WeakPolarHBondContact O-CD2 3.47Å; Q134-L229 HydrophobicContact CB-CD1 4.38Å; Q134-L229 HydrophobicContact CB-CD2 3.69Å
135	I	98.3	Very high	98	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-62.6	-28	177.8	66.2	173.9	0	0	0	112.5	L86 V88 F131 L132 R133 D137 Y138 F139 V164 L229 L232	L86-I135 HydrophobicContact CD2-CB 3.94Å; L86-I135 HydrophobicContact CD2-CD1 3.99Å; L86-I135 HydrophobicContact CD2-CG2 4Å; V88-I135 HydrophobicContact CG2-CD1 4.24Å; F131-I135 HydrophobicContact CD1-CD1 4.19Å; F131-I135 HydrophobicContact CD2-CG2 4.16Å; F131-I135 HydrophobicContact CE1-CD1 3.76Å; F131-I135 HydrophobicContact CE1-CG2 4.46Å; F131-I135 HydrophobicContact CE2-CG2 3.91Å; F131-I135 HydrophobicContact CZ-CD1 4.2Å; F131-I135 HydrophobicContact CZ-CG2 4.07Å; F131-I135 WeakPolarHBondContact O-CG1 3.35Å; F131-I135 WeakPolarHBondContact O-CG2 3.24Å; F131-I135 PolarHBondContact O-N 3.01Å; L132-I135 HydrophobicContact CD2-CD1 4.12Å; L132-I135 WeakPolarHBondContact O-CG1 3.47Å; R133-I135 PolarHBondContact O-N 2.59Å; I135-D137 VanDerWaalsContact C-N 3.28Å; I135-D137 PolarHBondContact O-N 3.29Å; I135-Y138 PolarHBondContact O-N 3.28Å; I135-F139 HydrophobicContact CB-CD2 4.2Å; I135-F139 WeakPolarHBondContact O-CB 3.45Å; I135-F139 WeakPolarHBondContact O-CD2 3.38Å; I135-F139 PolarHBondContact O-N 3.2Å; I135-V164 HydrophobicContact CD1-CG1 4.4Å; I135-V164 HydrophobicContact CG1-CG1 4.22Å; I135-L229 HydrophobicContact CG2-CD2 3.92Å; I135-L232 HydrophobicContact CG2-CD1 3.88Å
136	S	97.1	Very high	97.7	Very high	21 Å²	21	32 Å²	32	15%	0.147	15%	0.154	C	C	.	.	H	α-helix	trans	-67.7	-26.5	-177.3	83.6	0	0	0	0	113.8	K83 L132 R133 Q134	K83-S136 PolarHBondContact NZ-O 3.5Å; L132-S136 WeakPolarHBondContact O-CB 3.41Å; L132-S136 PolarHBondContact O-N 3.39Å; R133-S136 WeakPolarHBondContact O-CB 3.49Å; R133-S136 PolarHBondContact O-N 3.27Å; R133-S136 VanDerWaalsContact O-N 3.16Å; R133-S136 PolarHBondContact O-OG 3Å; Q134-S136 PolarHBondContact O-N 2.82Å
137	D	96.3	Very high	97.4	Very high	116 Å²	116	31 Å²	31	62%	0.62	15%	0.148	S	C	*	.	H	α-helix	trans	-70.3	-40.2	174.4	-73.5	-41	0	0	0	111	K83 Q134 I135	K83-D137 WeakPolarHBondContact CE-O 3.26Å; K83-D137 PolarHBondContact NZ-O 3.04Å; K83-D137 VanDerWaalsContact NZ-O 3.12Å; Q134-D137 PolarHBondContact O-N 2.98Å; I135-D137 VanDerWaalsContact C-N 3.28Å; I135-D137 PolarHBondContact O-N 3.29Å
138	Y	96.9	Very high	97.1	Very high	85 Å²	85	27.2 Å²	27.2	33%	0.333	14%	0.135	S	C	.	.	H	α-helix	trans	-92.8	-26.6	-172.8	-56.8	-73.8	0	0	0	115.2	K83 Q134 I135 E233 A236	K83-Y138 WeakPolarHBondContact CB-O 3.09Å; Q134-Y138 WeakPolarHBondContact O-CD2 3.47Å; I135-Y138 PolarHBondContact O-N 3.28Å; Y138-E233 HydrophobicContact CD1-CG 4.15Å; Y138-E233 HydrophobicContact CD2-CG 4.32Å; Y138-E233 HydrophobicContact CE1-CG 3.57Å; Y138-E233 HydrophobicContact CE2-CG 3.82Å; Y138-E233 HydrophobicContact CG-CG 4.49Å; Y138-E233 PolarHBondContact OH-OE1 3.26Å; Y138-A236 HydrophobicContact CD1-CB 4.34Å; Y138-A236 HydrophobicContact CG-CB 4.36Å
139	F	98.7	Very high	97	Very high	1 Å²	1	28.5 Å²	28.5	0%	0.004	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	151.6	-167.9	-63.3	-79	0	0	0	115.5	K84 L86 I135 C141 I194 L232 A236	K84-F139 HydrophobicContact CB-CD1 3.75Å; K84-F139 HydrophobicContact CB-CE1 3.83Å; K84-F139 WeakPolarHBondContact O-CA 3.19Å; L86-F139 HydrophobicContact CB-CB 3.62Å; L86-F139 HydrophobicContact CB-CD1 3.75Å; L86-F139 HydrophobicContact CB-CD2 4.33Å; L86-F139 HydrophobicContact CB-CE1 4.5Å; L86-F139 HydrophobicContact CB-CG 3.64Å; L86-F139 HydrophobicContact CD2-CB 4.23Å; L86-F139 HydrophobicContact CD2-CD1 4.48Å; L86-F139 HydrophobicContact CD2-CD2 3.69Å; L86-F139 HydrophobicContact CD2-CE2 4.14Å; L86-F139 HydrophobicContact CD2-CG 3.88Å; L86-F139 HydrophobicContact CG-CG 4.38Å; I135-F139 HydrophobicContact CB-CD2 4.2Å; I135-F139 WeakPolarHBondContact O-CB 3.45Å; I135-F139 WeakPolarHBondContact O-CD2 3.38Å; I135-F139 PolarHBondContact O-N 3.2Å; F139-C141 PolarHBondContact O-N 3.13Å; F139-I194 HydrophobicContact CE1-CD1 3.57Å; F139-I194 HydrophobicContact CZ-CD1 4Å; F139-L232 HydrophobicContact CE2-CB 4Å; F139-L232 HydrophobicContact CZ-CB 4.28Å; F139-L232 VanDerWaalsContact CZ-O 3.3Å; F139-L232 WeakPolarHBondContact CZ-O 3.48Å; F139-A236 HydrophobicContact CE1-CB 4.13Å; F139-A236 HydrophobicContact CE2-CB 4.16Å; F139-A236 HydrophobicContact CZ-CB 3.69Å
140	E	98.6	Very high	96.7	Very high	7 Å²	7	30.4 Å²	30.4	3%	0.033	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	92.4	153.9	-173.7	-168.2	-143.1	0	0	107.4	D80 K84 C85 L86 I142 R166 R188	D80-E140 HydrophobicContact CB-CB 4.07Å; D80-E140 HydrophobicContact CB-CG 4.28Å; K84-E140 PolarHBondContact O-N 2.9Å; C85-E140 WeakPolarHBondContact CA-O 3.49Å; L86-E140 PolarHBondContact N-O 3.05Å; E140-I142 HydrophobicContact CG-CD1 4.21Å; E140-R166 HydrophobicContact CG-CB 4.17Å; E140-R166 HydrophobicContact CG-CG 3.92Å; E140-R188 IonicContact OE1-CZ 3.71Å; E140-R188 IonicContact OE1-NE 3.66Å; E140-R188 IonicContact OE1-NH2 2.82Å; E140-R188 PolarHBondContact OE1-NH2 2.91Å; E140-R188 IonicContact OE2-CZ 3.54Å; E140-R188 IonicContact OE2-NE 3.41Å; E140-R188 PolarHBondContact OE2-NE 2.83Å; E140-R188 IonicContact OE2-NH2 3.5Å; E140-R188 PolarHBondContact OE2-NH2 2.92Å
141	C	98.6	Very high	96.6	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	132.4	-176.9	-59.9	0	0	0	0	111.1	L86 F139 V164 F165 R166	L86-C141 CarbonylContact O-C 3.59Å; L86-C141 WeakPolarHBondContact O-CA 3.49Å; F139-C141 PolarHBondContact O-N 3.13Å; C141-V164 HydrophobicContact CB-CG1 3.6Å; C141-F165 HydrophobicContact CB-CD1 4.21Å; C141-F165 CarbonylContact O-C 3.56Å; C141-F165 WeakPolarHBondContact O-CA 3.2Å; C141-R166 PolarHBondContact O-N 2.75Å
142	I	98.5	Very high	96.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	125.7	178.1	-51.7	-62.2	0	0	0	108.2	L73 L86 I87 V88 E140 R166 L169	L73-I142 HydrophobicContact CD1-CD1 3.95Å; L73-I142 HydrophobicContact CD1-CG1 3.98Å; L73-I142 HydrophobicContact CD2-CD1 3.91Å; L73-I142 HydrophobicContact CD2-CG1 4.31Å; L73-I142 HydrophobicContact CD2-CG2 3.97Å; L86-I142 PolarHBondContact O-N 3.33Å; I87-I142 WeakPolarHBondContact CA-O 3.29Å; I87-I142 HydrophobicContact CD1-CB 3.66Å; I87-I142 HydrophobicContact CD1-CG1 3.91Å; I87-I142 HydrophobicContact CD1-CG2 4.05Å; V88-I142 PolarHBondContact N-O 2.69Å; E140-I142 HydrophobicContact CG-CD1 4.21Å; I142-R166 HydrophobicContact CD1-CB 4.17Å; I142-L169 HydrophobicContact CG2-CD1 4.07Å; I142-L169 HydrophobicContact CG2-CG 4.24Å
143	L	98.4	Very high	96.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	122.4	168.2	-173.4	72.3	0	0	0	107.7	V88 L90 A156 F165 S167 R168 L169	V88-L143 WeakPolarHBondContact O-CA 3.36Å; L90-L143 HydrophobicContact CB-CD1 4.19Å; L90-L143 HydrophobicContact CD1-CD1 4.27Å; L143-A156 HydrophobicContact CD2-CB 3.78Å; L143-F165 HydrophobicContact CB-CB 4.44Å; L143-F165 HydrophobicContact CB-CD1 3.75Å; L143-F165 HydrophobicContact CB-CD2 4.26Å; L143-F165 HydrophobicContact CB-CE1 3.96Å; L143-F165 HydrophobicContact CB-CE2 4.45Å; L143-F165 HydrophobicContact CB-CG 3.9Å; L143-F165 HydrophobicContact CB-CZ 4.3Å; L143-F165 HydrophobicContact CD1-CE1 4.13Å; L143-F165 HydrophobicContact CD1-CE2 4.15Å; L143-F165 HydrophobicContact CD1-CZ 3.81Å; L143-F165 VanDerWaalsContact N-CD1 3.31Å; L143-S167 PolarHBondContact N-O 3.35Å; L143-S167 VanDerWaalsContact N-O 3.16Å; L143-R168 HydrophobicContact CB-CB 4.42Å; L143-R168 HydrophobicContact CB-CG 4.16Å; L143-R168 HydrophobicContact CD2-CB 4.48Å; L143-R168 HydrophobicContact CD2-CG 4.15Å; L143-R168 CarbonylContact O-C 3.59Å; L143-R168 WeakPolarHBondContact O-CA 3.37Å; L143-L169 PolarHBondContact O-N 3.41Å
144	F	96.8	Very high	96.5	Very high	1 Å²	1	28.2 Å²	28.2	0%	0.004	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	107.3	172.4	-163.7	171.7	0	0	0	109.2	L72 I87 V88 D89 L169 A173 Y181 L186	L72-F144 HydrophobicContact CD1-CE1 4.18Å; L72-F144 HydrophobicContact CD1-CZ 4.21Å; I87-F144 HydrophobicContact CG2-CB 3.44Å; I87-F144 VanDerWaalsContact CG2-CB 3.44Å; I87-F144 HydrophobicContact CG2-CD1 4.13Å; I87-F144 HydrophobicContact CG2-CG 4.28Å; V88-F144 PolarHBondContact O-N 2.97Å; D89-F144 WeakPolarHBondContact CA-O 3.37Å; F144-L169 WeakPolarHBondContact CA-O 3.35Å; F144-L169 HydrophobicContact CB-CB 4.03Å; F144-L169 HydrophobicContact CB-CD1 4.47Å; F144-L169 HydrophobicContact CD1-CB 4.23Å; F144-L169 HydrophobicContact CD1-CD1 3.71Å; F144-L169 HydrophobicContact CD2-CB 3.42Å; F144-L169 VanDerWaalsContact CD2-CB 3.42Å; F144-L169 HydrophobicContact CD2-CD1 4.4Å; F144-L169 HydrophobicContact CE1-CD1 3.93Å; F144-L169 HydrophobicContact CE2-CB 3.86Å; F144-L169 HydrophobicContact CG-CB 3.63Å; F144-L169 HydrophobicContact CG-CD1 3.95Å; F144-L169 HydrophobicContact CG-CG 4.43Å; F144-L169 HydrophobicContact CZ-CB 4.42Å; F144-L169 HydrophobicContact CZ-CD1 4.37Å; F144-A173 HydrophobicContact CE2-CB 3.81Å; F144-A173 HydrophobicContact CZ-CB 3.96Å; F144-Y181 HydrophobicContact CD1-CD1 4.32Å; F144-Y181 HydrophobicContact CD1-CD2 4.44Å; F144-Y181 HydrophobicContact CD1-CG 4.14Å; F144-Y181 AromaticContact CD2-CD1 3.94Å; F144-Y181 HydrophobicContact CD2-CD1 3.94Å; F144-Y181 AromaticContact CD2-CE1 3.8Å; F144-Y181 HydrophobicContact CD2-CE1 3.8Å; F144-Y181 HydrophobicContact CD2-CG 4.5Å; F144-Y181 AromaticContact CE1-CD1 3.97Å; F144-Y181 HydrophobicContact CE1-CD1 3.97Å; F144-Y181 AromaticContact CE1-CG 3.92Å; F144-Y181 HydrophobicContact CE1-CG 3.92Å; F144-Y181 AromaticContact CE2-CD1 3.53Å; F144-Y181 HydrophobicContact CE2-CD1 3.53Å; F144-Y181 AromaticContact CE2-CE1 3.73Å; F144-Y181 HydrophobicContact CE2-CE1 3.73Å; F144-Y181 HydrophobicContact CE2-CG 4.29Å; F144-Y181 HydrophobicContact CG-CD1 4.33Å; F144-Y181 HydrophobicContact CG-CE1 4.37Å; F144-Y181 HydrophobicContact CG-CG 4.45Å; F144-Y181 AromaticContact CZ-CD1 3.56Å; F144-Y181 HydrophobicContact CZ-CD1 3.56Å; F144-Y181 HydrophobicContact CZ-CE1 4.24Å; F144-Y181 HydrophobicContact CZ-CG 4Å; F144-Y181 PolarHBondContact O-OH 3.07Å; F144-L186 HydrophobicContact CD1-CD2 4.44Å; F144-L186 HydrophobicContact CE1-CD2 4.46Å
145	T	95.1	Very high	96.5	Very high	2 Å²	2	25 Å²	25	1%	0.012	14%	0.135	C	C	.	.			trans	-125.7	147.5	-178.5	-174	0	0	0	0	112.7	D89 L90 S147 A152 L169 F170 R171 Y181	D89-T145 VanDerWaalsContact OD1-CA 3.27Å; D89-T145 WeakPolarHBondContact OD1-CA 3.48Å; D89-T145 WeakPolarHBondContact OD1-CB 3.45Å; D89-T145 PolarHBondContact OD1-OG1 3.28Å; L90-T145 HydrophobicContact CB-CG2 4.15Å; L90-T145 HydrophobicContact CD2-CG2 4.45Å; T145-S147 PolarHBondContact O-N 3.29Å; T145-S147 PolarHBondContact OG1-N 3.39Å; T145-A152 HydrophobicContact CG2-CB 3.89Å; T145-L169 PolarHBondContact N-O 2.8Å; T145-F170 HydrophobicContact CG2-CD1 4.24Å; T145-F170 CarbonylContact O-C 3.57Å; T145-F170 VanDerWaalsContact O-CA 3.29Å; T145-F170 WeakPolarHBondContact O-CA 3.34Å; T145-R171 PolarHBondContact O-N 2.77Å; T145-Y181 WeakPolarHBondContact CA-OH 3.35Å
146	A	92.2	Very high	96.5	Very high	29 Å²	29	25 Å²	25	24%	0.24	14%	0.135	C	C	.	.	S	Bend	trans	-70	-1.1	170	0	0	0	0	0	112.9	R171 Y181	A146-R171 PolarHBondContact O-NE 3.27Å; A146-R171 PolarHBondContact O-NH2 2.95Å; A146-Y181 PolarHBondContact N-OH 2.75Å
147	S	93.1	Very high	96.5	Very high	4 Å²	4	29 Å²	29	3%	0.028	15%	0.154	C	C	.	.	S	Bend	trans	-79	166.2	175.3	-112.8	0	0	0	0	114.2	D91 T145 Y151 R171	D91-S147 VanDerWaalsContact OD2-CB 3.23Å; D91-S147 WeakPolarHBondContact OD2-CB 3.49Å; D91-S147 PolarHBondContact OD2-OG 3.42Å; T145-S147 PolarHBondContact O-N 3.29Å; T145-S147 PolarHBondContact OG1-N 3.39Å; S147-Y151 WeakPolarHBondContact OG-CD1 3.43Å; S147-R171 WeakPolarHBondContact O-CB 3.35Å; S147-R171 PolarHBondContact O-N 2.82Å
148	L	92.1	Very high	96.6	Very high	34 Å²	34	27 Å²	27	18%	0.178	14%	0.144	C	C	.	.			trans	-86.2	140.7	179.3	-71.8	168.7	0	0	0	111.2	V2 K150 Y151 A152 R171 E172	V2-L148 HydrophobicContact CG1-CD1 4.25Å; L148-K150 VanDerWaalsContact C-N 3.27Å; L148-K150 HydrophobicContact CB-CG 4.19Å; L148-K150 PolarHBondContact O-N 2.69Å; L148-K150 VanDerWaalsContact O-N 3.15Å; L148-Y151 PolarHBondContact O-N 2.92Å; L148-A152 PolarHBondContact O-N 3.27Å; L148-R171 HydrophobicContact CD2-CB 4.17Å; L148-R171 HydrophobicContact CD2-CG 4.46Å; L148-E172 WeakPolarHBondContact CD2-OE1 3.47Å
149	A	95.3	Very high	96.7	Very high	29 Å²	29	23 Å²	23	24%	0.24	13%	0.128	C	C	.	.	H	α-helix	trans	-47.1	-45.1	177.3	0	0	0	0	0	113.6	Y151 A152 D153 F170	A149-Y151 CarbonylContact O-C 3.47Å; A149-Y151 PolarHBondContact O-N 2.86Å; A149-A152 PolarHBondContact O-N 3.26Å; A149-D153 WeakPolarHBondContact O-CB 3.44Å; A149-D153 PolarHBondContact O-N 3.17Å; A149-F170 HydrophobicContact CB-CD1 4.31Å; A149-F170 HydrophobicContact CB-CD2 3.59Å; A149-F170 HydrophobicContact CB-CE1 4.44Å; A149-F170 HydrophobicContact CB-CE2 3.74Å; A149-F170 HydrophobicContact CB-CG 3.89Å; A149-F170 HydrophobicContact CB-CZ 4.16Å
150	K	94.2	Very high	96.6	Very high	95 Å²	95	23.8 Å²	23.8	41%	0.413	13%	0.132	S	C	.	.	H	α-helix	trans	-60.5	-4.8	179.6	70.9	170.7	-178.3	178.8	0	116.5	V111 E112 L148	V111-K150 HydrophobicContact CG1-CD 4.4Å; V111-K150 HydrophobicContact CG1-CG 4.37Å; E112-K150 WeakPolarHBondContact O-CE 3.32Å; E112-K150 PolarHBondContact O-NZ 2.69Å; L148-K150 VanDerWaalsContact C-N 3.27Å; L148-K150 HydrophobicContact CB-CG 4.19Å; L148-K150 PolarHBondContact O-N 2.69Å; L148-K150 VanDerWaalsContact O-N 3.15Å
151	Y	96	Very high	96.5	Very high	9 Å²	9	29.7 Å²	29.7	4%	0.035	16%	0.16	C	C	.	.	H	α-helix	trans	-119.5	-47.6	170.1	152.6	-103.1	0	0	0	109.8	M6 L90 D91 S97 V111 V120 S147 L148 A149 P154 V155	M6-Y151 HydrophobicContact CE-CD1 3.99Å; M6-Y151 HydrophobicContact CE-CE1 3.66Å; M6-Y151 HydrophobicContact CE-CE2 4.44Å; L90-Y151 HydrophobicContact CD2-CE1 4.09Å; D91-Y151 WeakPolarHBondContact OD1-CE1 3.42Å; D91-Y151 VanDerWaalsContact OD1-CZ 3.28Å; D91-Y151 PolarHBondContact OD1-OH 2.94Å; D91-Y151 WeakPolarHBondContact OD2-CE1 3.46Å; S97-Y151 VanDerWaalsContact CB-OH 3.22Å; S97-Y151 WeakPolarHBondContact CB-OH 3.34Å; S97-Y151 WeakPolarHBondContact OG-CE2 3.49Å; S97-Y151 PolarHBondContact OG-OH 3.42Å; V111-Y151 HydrophobicContact CG2-CD2 4.39Å; V120-Y151 HydrophobicContact CG1-CD2 4.21Å; V120-Y151 HydrophobicContact CG1-CE2 3.92Å; S147-Y151 WeakPolarHBondContact OG-CD1 3.43Å; L148-Y151 PolarHBondContact O-N 2.92Å; A149-Y151 CarbonylContact O-C 3.47Å; A149-Y151 PolarHBondContact O-N 2.86Å; Y151-P154 WeakPolarHBondContact O-CD 3.37Å; Y151-V155 HydrophobicContact CD2-CG2 3.97Å; Y151-V155 HydrophobicContact CE2-CG2 3.42Å; Y151-V155 VanDerWaalsContact CE2-CG2 3.42Å; Y151-V155 WeakPolarHBondContact O-CG2 3.37Å; Y151-V155 PolarHBondContact O-N 2.85Å
152	A	97.2	Very high	96.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-69	-34.6	-174.4	0	0	0	0	0	114.4	L90 T145 L148 A149 A156 F170	L90-A152 HydrophobicContact CD2-CB 3.78Å; T145-A152 HydrophobicContact CG2-CB 3.89Å; L148-A152 PolarHBondContact O-N 3.27Å; A149-A152 PolarHBondContact O-N 3.26Å; A152-A156 VanDerWaalsContact O-CB 3.25Å; A152-A156 WeakPolarHBondContact O-CB 3.41Å; A152-A156 PolarHBondContact O-N 3.31Å; A152-F170 HydrophobicContact CB-CD1 3.8Å; A152-F170 HydrophobicContact CB-CE1 3.62Å
153	D	97.4	Very high	96.4	Very high	48 Å²	48	36.9 Å²	36.9	26%	0.257	20%	0.2	S	C	.	.	H	α-helix	trans	-64.3	-54	174.4	-87.3	-52.1	0	0	0	111.5	A149 V155 A156 D157 R168 F170	A149-D153 WeakPolarHBondContact O-CB 3.44Å; A149-D153 PolarHBondContact O-N 3.17Å; D153-V155 VanDerWaalsContact C-N 3.27Å; D153-V155 PolarHBondContact O-N 2.84Å; D153-A156 CarbonylContact O-C 3.17Å; D153-A156 PolarHBondContact O-N 3.22Å; D153-D157 VanDerWaalsContact O-CG 3.3Å; D153-D157 PolarHBondContact O-N 2.95Å; D153-R168 WeakPolarHBondContact OD1-CD 3.46Å; D153-R168 IonicContact OD1-CZ 2.8Å; D153-R168 IonicContact OD1-NE 3.6Å; D153-R168 IonicContact OD1-NH1 3.66Å; D153-R168 PolarHBondContact OD1-NH1 2.87Å; D153-F170 VanDerWaalsContact CG-CZ 3.47Å; D153-F170 WeakPolarHBondContact OD1-CZ 3.43Å; D153-F170 WeakPolarHBondContact OD2-CE2 3.39Å; D153-F170 VanDerWaalsContact OD2-CZ 3.23Å; D153-F170 WeakPolarHBondContact OD2-CZ 3.4Å
154	P	97.5	Very high	96.4	Very high	44 Å²	44	36.9 Å²	36.9	29%	0.286	20%	0.2	S	C	.	.	H	α-helix	trans	-55.7	-34	174.4	-29.8	35.6	0	0	0	115.3	I109 Y151 L158	I109-P154 HydrophobicContact CD1-CB 4.21Å; I109-P154 HydrophobicContact CG2-CB 3.68Å; I109-P154 HydrophobicContact CG2-CG 4.39Å; Y151-P154 WeakPolarHBondContact O-CD 3.37Å; P154-L158 WeakPolarHBondContact O-CD1 3.49Å; P154-L158 WeakPolarHBondContact O-CG 3.44Å; P154-L158 PolarHBondContact O-N 3.38Å
155	V	97.8	Very high	96.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-68.1	-49.2	172.4	177.1	0	0	0	0	110.3	L90 V95 I109 V122 Y151 D153 D157 L158 L159	L90-V155 HydrophobicContact CD1-CG1 3.86Å; L90-V155 HydrophobicContact CD2-CB 4.23Å; L90-V155 HydrophobicContact CD2-CG1 4.24Å; L90-V155 HydrophobicContact CG-CG1 4.47Å; V95-V155 HydrophobicContact CG1-CG1 4.24Å; V95-V155 HydrophobicContact CG2-CG1 4.16Å; I109-V155 HydrophobicContact CD1-CB 4.22Å; I109-V155 HydrophobicContact CD1-CG2 3.41Å; I109-V155 VanDerWaalsContact CD1-CG2 3.41Å; V122-V155 HydrophobicContact CG2-CG2 4.27Å; Y151-V155 HydrophobicContact CD2-CG2 3.97Å; Y151-V155 HydrophobicContact CE2-CG2 3.42Å; Y151-V155 VanDerWaalsContact CE2-CG2 3.42Å; Y151-V155 WeakPolarHBondContact O-CG2 3.37Å; Y151-V155 PolarHBondContact O-N 2.85Å; D153-V155 VanDerWaalsContact C-N 3.27Å; D153-V155 PolarHBondContact O-N 2.84Å; V155-D157 VanDerWaalsContact C-N 3.3Å; V155-D157 PolarHBondContact O-N 2.85Å; V155-L158 PolarHBondContact O-N 2.74Å; V155-L158 VanDerWaalsContact O-N 3.15Å; V155-L159 VanDerWaalsContact O-CB 3.23Å; V155-L159 WeakPolarHBondContact O-CB 3.42Å; V155-L159 PolarHBondContact O-N 2.75Å
156	A	98.3	Very high	96.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64.7	-32.2	-177.9	0	0	0	0	0	112.9	L143 A152 D153 L158 D160 R168	L143-A156 HydrophobicContact CD2-CB 3.78Å; A152-A156 VanDerWaalsContact O-CB 3.25Å; A152-A156 WeakPolarHBondContact O-CB 3.41Å; A152-A156 PolarHBondContact O-N 3.31Å; D153-A156 CarbonylContact O-C 3.17Å; D153-A156 PolarHBondContact O-N 3.22Å; A156-L158 VanDerWaalsContact C-N 3.32Å; A156-D160 VanDerWaalsContact O-CB 3.3Å; A156-D160 WeakPolarHBondContact O-CB 3.42Å; A156-D160 PolarHBondContact O-N 3Å; A156-R168 VanDerWaalsContact CB-CZ 3.5Å
157	D	98.1	Very high	96.8	Very high	104 Å²	104	39.3 Å²	39.3	56%	0.556	21%	0.208	S	C	*	.	H	α-helix	trans	-68.4	-27.4	174.6	-70	-24.4	0	0	0	113.3	D153 V155 R168	D153-D157 VanDerWaalsContact O-CG 3.3Å; D153-D157 PolarHBondContact O-N 2.95Å; V155-D157 VanDerWaalsContact C-N 3.3Å; V155-D157 PolarHBondContact O-N 2.85Å; D157-R168 IonicContact OD1-CZ 2.67Å; D157-R168 IonicContact OD1-NH1 3.91Å; D157-R168 PolarHBondContact OD1-NH1 2.79Å; D157-R168 IonicContact OD1-NH2 2.77Å; D157-R168 PolarHBondContact OD1-NH2 2.8Å; D157-R168 IonicContact OD2-NH1 2.75Å
158	L	98	Very high	97.1	Very high	76 Å²	76	42.3 Å²	42.3	40%	0.398	22%	0.219	S	C	.	.	H	α-helix	trans	-90.7	-27.7	176.8	-66.1	172.3	0	0	0	112.7	F107 I109 P154 V155 A156	F107-L158 HydrophobicContact CB-CD1 3.94Å; F107-L158 HydrophobicContact CD1-CB 3.92Å; F107-L158 HydrophobicContact CD1-CD1 3.98Å; F107-L158 HydrophobicContact CD1-CG 4.47Å; F107-L158 HydrophobicContact CD2-CB 4.13Å; F107-L158 HydrophobicContact CD2-CD1 4.37Å; F107-L158 HydrophobicContact CE1-CB 3.71Å; F107-L158 HydrophobicContact CE2-CB 3.91Å; F107-L158 HydrophobicContact CG-CB 4.14Å; F107-L158 HydrophobicContact CG-CD1 3.86Å; F107-L158 HydrophobicContact CZ-CB 3.69Å; F107-L158 WeakPolarHBondContact CZ-O 3.45Å; I109-L158 HydrophobicContact CD1-CD1 4.18Å; I109-L158 HydrophobicContact CG1-CD1 4.19Å; P154-L158 WeakPolarHBondContact O-CD1 3.49Å; P154-L158 WeakPolarHBondContact O-CG 3.44Å; P154-L158 PolarHBondContact O-N 3.38Å; V155-L158 PolarHBondContact O-N 2.74Å; V155-L158 VanDerWaalsContact O-N 3.15Å; A156-L158 VanDerWaalsContact C-N 3.32Å
159	L	98.2	Very high	97.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-87.7	-44.8	-176.9	-171.6	68.1	0	0	0	113	L90 L94 V95 F107 K124 V128 L132 V155 Q161	L90-L159 HydrophobicContact CD1-CD2 4.36Å; L94-L159 HydrophobicContact CB-CD2 4.28Å; L94-L159 HydrophobicContact CD1-CD2 4.33Å; V95-L159 HydrophobicContact CG1-CD1 4.37Å; V95-L159 HydrophobicContact CG1-CD2 4.05Å; F107-L159 HydrophobicContact CE2-CB 4.31Å; F107-L159 HydrophobicContact CE2-CD1 4.38Å; K124-L159 HydrophobicContact CD-CD1 4.32Å; K124-L159 HydrophobicContact CG-CD1 4.19Å; V128-L159 HydrophobicContact CG1-CD1 3.91Å; V128-L159 HydrophobicContact CG2-CD1 4.04Å; V128-L159 HydrophobicContact CG2-CD2 4.38Å; L132-L159 HydrophobicContact CD1-CD1 4.49Å; L132-L159 HydrophobicContact CD1-CD2 4.2Å; L132-L159 HydrophobicContact CD1-CG 3.81Å; V155-L159 VanDerWaalsContact O-CB 3.23Å; V155-L159 WeakPolarHBondContact O-CB 3.42Å; V155-L159 PolarHBondContact O-N 2.75Å; L159-Q161 PolarHBondContact O-N 2.91Å
160	D	98.2	Very high	97.2	Very high	17 Å²	17	41.4 Å²	41.4	9%	0.091	21%	0.208	C	C	.	.			trans	-88.7	79.3	-177.2	-176.6	4.7	0	0	0	111.7	A156 W162 G163 V164 F165	A156-D160 VanDerWaalsContact O-CB 3.3Å; A156-D160 WeakPolarHBondContact O-CB 3.42Å; A156-D160 PolarHBondContact O-N 3Å; D160-W162 PolarHBondContact O-N 2.76Å; D160-W162 PolarHBondContact OD1-N 2.91Å; D160-G163 WeakPolarHBondContact OD1-CA 3.19Å; D160-G163 PolarHBondContact OD1-N 3.43Å; D160-V164 VanDerWaalsContact CG-N 3.28Å; D160-V164 WeakPolarHBondContact OD1-CB 3.46Å; D160-V164 WeakPolarHBondContact OD1-CG2 3.27Å; D160-V164 PolarHBondContact OD1-N 2.79Å; D160-V164 PolarHBondContact OD2-N 3.35Å; D160-F165 HydrophobicContact CB-CD2 3.85Å; D160-F165 HydrophobicContact CB-CE2 4.22Å; D160-F165 WeakPolarHBondContact OD2-CD2 3.33Å; D160-F165 PolarHBondContact OD2-N 2.75Å
161	Q	96.5	Very high	97.1	Very high	132 Å²	132	39.2 Å²	39.2	62%	0.617	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76	-1.3	-179.9	-57.4	-172	2.2	0	0	113.8	L159	L159-Q161 PolarHBondContact O-N 2.91Å
162	W	97.2	Very high	96.7	Very high	109 Å²	109	45.1 Å²	45.1	41%	0.413	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123	-3	-172.2	-53.8	-83.3	0	0	0	114.1	D129 L132 R133 D160 V164	D129-W162 HydrophobicContact CB-CH2 3.84Å; D129-W162 HydrophobicContact CB-CZ3 4.47Å; L132-W162 HydrophobicContact CB-CZ3 4.48Å; R133-W162 HydrophobicContact CG-CD2 3.55Å; R133-W162 HydrophobicContact CG-CE3 3.97Å; R133-W162 HydrophobicContact CG-CG 3.93Å; R133-W162 HydrophobicContact CG-CH2 4.4Å; R133-W162 HydrophobicContact CG-CZ2 4.01Å; R133-W162 HydrophobicContact CG-CZ3 4.37Å; D160-W162 PolarHBondContact O-N 2.76Å; D160-W162 PolarHBondContact OD1-N 2.91Å; W162-V164 HydrophobicContact CB-CG2 4.02Å
163	G	97	Very high	96.2	Very high	42 Å²	42	45.7 Å²	45.7	43%	0.433	23%	0.23	S	C	.	.			trans	72.1	31.4	-177.3	0	0	0	0	0	113.1	D160 R166	D160-G163 WeakPolarHBondContact OD1-CA 3.19Å; D160-G163 PolarHBondContact OD1-N 3.43Å; G163-R166 PolarHBondContact O-NH1 3Å
164	V	98.1	Very high	95.5	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.224	C	C	.	.			trans	-56.9	-50.2	179.4	178.9	0	0	0	0	110.5	L132 I135 C141 D160 W162 R166	L132-V164 HydrophobicContact CB-CG2 4.28Å; L132-V164 HydrophobicContact CD2-CG1 4.45Å; L132-V164 WeakPolarHBondContact O-CG2 3.19Å; I135-V164 HydrophobicContact CD1-CG1 4.4Å; I135-V164 HydrophobicContact CG1-CG1 4.22Å; C141-V164 HydrophobicContact CB-CG1 3.6Å; D160-V164 VanDerWaalsContact CG-N 3.28Å; D160-V164 WeakPolarHBondContact OD1-CB 3.46Å; D160-V164 WeakPolarHBondContact OD1-CG2 3.27Å; D160-V164 PolarHBondContact OD1-N 2.79Å; D160-V164 PolarHBondContact OD2-N 3.35Å; W162-V164 HydrophobicContact CB-CG2 4.02Å; V164-R166 PolarHBondContact O-N 3.27Å; V164-R166 PolarHBondContact O-NH1 3.41Å
165	F	98.3	Very high	94.5	Very high	17 Å²	17	44 Å²	44	8%	0.075	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	109	-174.2	-63.6	-59.6	0	0	0	112.2	V88 L94 L132 C141 L143 D160 S167	V88-F165 HydrophobicContact CB-CE1 4.28Å; V88-F165 HydrophobicContact CG2-CE1 4.42Å; L94-F165 HydrophobicContact CD1-CZ 4.04Å; L132-F165 HydrophobicContact CD2-CE1 4.39Å; L132-F165 HydrophobicContact CD2-CE2 4.08Å; L132-F165 HydrophobicContact CD2-CZ 3.65Å; C141-F165 HydrophobicContact CB-CD1 4.21Å; C141-F165 CarbonylContact O-C 3.56Å; C141-F165 WeakPolarHBondContact O-CA 3.2Å; L143-F165 HydrophobicContact CB-CB 4.44Å; L143-F165 HydrophobicContact CB-CD1 3.75Å; L143-F165 HydrophobicContact CB-CD2 4.26Å; L143-F165 HydrophobicContact CB-CE1 3.96Å; L143-F165 HydrophobicContact CB-CE2 4.45Å; L143-F165 HydrophobicContact CB-CG 3.9Å; L143-F165 HydrophobicContact CB-CZ 4.3Å; L143-F165 HydrophobicContact CD1-CE1 4.13Å; L143-F165 HydrophobicContact CD1-CE2 4.15Å; L143-F165 HydrophobicContact CD1-CZ 3.81Å; L143-F165 VanDerWaalsContact N-CD1 3.31Å; D160-F165 HydrophobicContact CB-CD2 3.85Å; D160-F165 HydrophobicContact CB-CE2 4.22Å; D160-F165 WeakPolarHBondContact OD2-CD2 3.33Å; D160-F165 PolarHBondContact OD2-N 2.75Å; F165-S167 VanDerWaalsContact C-N 3.29Å; F165-S167 PolarHBondContact O-N 3.49Å
166	R	97.3	Very high	92.6	Very high	35 Å²	35	54 Å²	54	13%	0.132	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	-19.6	-178.8	-52.9	-48.9	-157.8	-123.1	-11.5	113.3	R77 D80 E140 C141 I142 G163 V164	R77-R166 PolarHBondContact NH2-O 2.7Å; D80-R166 IonicContact OD1-CZ 3.54Å; D80-R166 IonicContact OD1-NE 2.75Å; D80-R166 PolarHBondContact OD1-NE 3.31Å; D80-R166 IonicContact OD1-NH2 3.99Å; D80-R166 PolarHBondContact OD1-NH2 3.16Å; D80-R166 IonicContact OD2-CZ 3.31Å; D80-R166 IonicContact OD2-NE 3.16Å; D80-R166 PolarHBondContact OD2-NE 3.5Å; D80-R166 IonicContact OD2-NH2 3.17Å; E140-R166 HydrophobicContact CG-CB 4.17Å; E140-R166 HydrophobicContact CG-CG 3.92Å; C141-R166 PolarHBondContact O-N 2.75Å; I142-R166 HydrophobicContact CD1-CB 4.17Å; G163-R166 PolarHBondContact O-NH1 3Å; V164-R166 PolarHBondContact O-N 3.27Å; V164-R166 PolarHBondContact O-NH1 3.41Å
167	S	97.7	Very high	90.6	Very high	31 Å²	31	59.5 Å²	59.5	22%	0.217	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	159.6	167.4	-67	0	0	0	0	109	L143 F165	L143-S167 PolarHBondContact N-O 3.35Å; L143-S167 VanDerWaalsContact N-O 3.16Å; F165-S167 VanDerWaalsContact C-N 3.29Å; F165-S167 PolarHBondContact O-N 3.49Å
168	R	97.9	Very high	88.6	Confident	67 Å²	67	62 Å²	62	25%	0.253	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	132.8	173.5	-58.3	175.3	-178.4	163.2	-1.3	108.9	L143 D153 A156 D157 F170	L143-R168 HydrophobicContact CB-CB 4.42Å; L143-R168 HydrophobicContact CB-CG 4.16Å; L143-R168 HydrophobicContact CD2-CB 4.48Å; L143-R168 HydrophobicContact CD2-CG 4.15Å; L143-R168 CarbonylContact O-C 3.59Å; L143-R168 WeakPolarHBondContact O-CA 3.37Å; D153-R168 WeakPolarHBondContact OD1-CD 3.46Å; D153-R168 IonicContact OD1-CZ 2.8Å; D153-R168 IonicContact OD1-NE 3.6Å; D153-R168 IonicContact OD1-NH1 3.66Å; D153-R168 PolarHBondContact OD1-NH1 2.87Å; A156-R168 VanDerWaalsContact CB-CZ 3.5Å; D157-R168 IonicContact OD1-CZ 2.67Å; D157-R168 IonicContact OD1-NH1 3.91Å; D157-R168 PolarHBondContact OD1-NH1 2.79Å; D157-R168 IonicContact OD1-NH2 2.77Å; D157-R168 PolarHBondContact OD1-NH2 2.8Å; D157-R168 IonicContact OD2-NH1 2.75Å; R168-F170 HydrophobicContact CB-CE1 4Å; R168-F170 HydrophobicContact CB-CE2 4.05Å; R168-F170 HydrophobicContact CB-CZ 3.46Å; R168-F170 VanDerWaalsContact CB-CZ 3.46Å; R168-F170 HydrophobicContact CG-CZ 4.44Å
169	L	96.3	Very high	86.9	Confident	15 Å²	15	59.4 Å²	59.4	8%	0.079	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	135.7	180	-63.3	178.4	0	0	0	108.7	L72 L73 I142 L143 F144 T145 A173 L186	L72-L169 HydrophobicContact CB-CD1 4.09Å; L72-L169 HydrophobicContact CB-CD2 4.1Å; L72-L169 HydrophobicContact CD1-CD1 4.27Å; L73-L169 HydrophobicContact CD2-CD1 3.95Å; L73-L169 HydrophobicContact CD2-CD2 4.45Å; L73-L169 HydrophobicContact CD2-CG 4.32Å; I142-L169 HydrophobicContact CG2-CD1 4.07Å; I142-L169 HydrophobicContact CG2-CG 4.24Å; L143-L169 PolarHBondContact O-N 3.41Å; F144-L169 WeakPolarHBondContact CA-O 3.35Å; F144-L169 HydrophobicContact CB-CB 4.03Å; F144-L169 HydrophobicContact CB-CD1 4.47Å; F144-L169 HydrophobicContact CD1-CB 4.23Å; F144-L169 HydrophobicContact CD1-CD1 3.71Å; F144-L169 HydrophobicContact CD2-CB 3.42Å; F144-L169 VanDerWaalsContact CD2-CB 3.42Å; F144-L169 HydrophobicContact CD2-CD1 4.4Å; F144-L169 HydrophobicContact CE1-CD1 3.93Å; F144-L169 HydrophobicContact CE2-CB 3.86Å; F144-L169 HydrophobicContact CG-CB 3.63Å; F144-L169 HydrophobicContact CG-CD1 3.95Å; F144-L169 HydrophobicContact CG-CG 4.43Å; F144-L169 HydrophobicContact CZ-CB 4.42Å; F144-L169 HydrophobicContact CZ-CD1 4.37Å; T145-L169 PolarHBondContact N-O 2.8Å; L169-A173 HydrophobicContact CB-CB 4.12Å; L169-A173 HydrophobicContact CD2-CB 4.21Å; L169-L186 HydrophobicContact CD1-CD2 3.82Å
170	F	94.4	Very high	85.8	Confident	28 Å²	28	59.9 Å²	59.9	12%	0.123	29%	0.291	C	S	.	.			trans	-122.7	-174.4	-170.4	-54.2	-63.2	0	0	0	111.5	T145 A149 A152 D153 R168 E172 A173 C174	T145-F170 HydrophobicContact CG2-CD1 4.24Å; T145-F170 CarbonylContact O-C 3.57Å; T145-F170 VanDerWaalsContact O-CA 3.29Å; T145-F170 WeakPolarHBondContact O-CA 3.34Å; A149-F170 HydrophobicContact CB-CD1 4.31Å; A149-F170 HydrophobicContact CB-CD2 3.59Å; A149-F170 HydrophobicContact CB-CE1 4.44Å; A149-F170 HydrophobicContact CB-CE2 3.74Å; A149-F170 HydrophobicContact CB-CG 3.89Å; A149-F170 HydrophobicContact CB-CZ 4.16Å; A152-F170 HydrophobicContact CB-CD1 3.8Å; A152-F170 HydrophobicContact CB-CE1 3.62Å; D153-F170 VanDerWaalsContact CG-CZ 3.47Å; D153-F170 WeakPolarHBondContact OD1-CZ 3.43Å; D153-F170 WeakPolarHBondContact OD2-CE2 3.39Å; D153-F170 VanDerWaalsContact OD2-CZ 3.23Å; D153-F170 WeakPolarHBondContact OD2-CZ 3.4Å; R168-F170 HydrophobicContact CB-CE1 4Å; R168-F170 HydrophobicContact CB-CE2 4.05Å; R168-F170 HydrophobicContact CB-CZ 3.46Å; R168-F170 VanDerWaalsContact CB-CZ 3.46Å; R168-F170 HydrophobicContact CG-CZ 4.44Å; F170-E172 WeakPolarHBondContact CB-OE2 3.43Å; F170-E172 PolarHBondContact O-N 3.5Å; F170-A173 WeakPolarHBondContact O-CB 3.34Å; F170-A173 PolarHBondContact O-N 3.22Å; F170-C174 PolarHBondContact O-SG 2.88Å
171	R	91	Very high	85.1	Confident	50 Å²	50	59.2 Å²	59.2	19%	0.189	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-41.8	-37.4	173	-174.5	164.8	-67.9	164	9.9	114.6	T145 A146 S147 L148 A173 C174	T145-R171 PolarHBondContact O-N 2.77Å; A146-R171 PolarHBondContact O-NE 3.27Å; A146-R171 PolarHBondContact O-NH2 2.95Å; S147-R171 WeakPolarHBondContact O-CB 3.35Å; S147-R171 PolarHBondContact O-N 2.82Å; L148-R171 HydrophobicContact CD2-CB 4.17Å; L148-R171 HydrophobicContact CD2-CG 4.46Å; R171-A173 VanDerWaalsContact C-N 3.31Å; R171-A173 PolarHBondContact O-N 3.23Å; R171-C174 VanDerWaalsContact O-CB 3.3Å; R171-C174 WeakPolarHBondContact O-CB 3.31Å; R171-C174 PolarHBondContact O-N 3.03Å
172	E	87.8	Confident	84.7	Confident	133 Å²	133	54.7 Å²	54.7	62%	0.621	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-71.4	-21.1	-179.3	-64.5	69.2	-152	0	0	113.7	L148 F170	L148-E172 WeakPolarHBondContact CD2-OE1 3.47Å; F170-E172 WeakPolarHBondContact CB-OE2 3.43Å; F170-E172 PolarHBondContact O-N 3.5Å
173	A	87.9	Confident	84.5	Confident	11 Å²	11	49.5 Å²	49.5	9%	0.091	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-85	-20.5	174.4	0	0	0	0	0	112.9	L72 F144 L169 F170 R171 R185	L72-A173 HydrophobicContact CD1-CB 4.34Å; L72-A173 HydrophobicContact CD2-CB 3.88Å; F144-A173 HydrophobicContact CE2-CB 3.81Å; F144-A173 HydrophobicContact CZ-CB 3.96Å; L169-A173 HydrophobicContact CB-CB 4.12Å; L169-A173 HydrophobicContact CD2-CB 4.21Å; F170-A173 WeakPolarHBondContact O-CB 3.34Å; F170-A173 PolarHBondContact O-N 3.22Å; R171-A173 VanDerWaalsContact C-N 3.31Å; R171-A173 PolarHBondContact O-N 3.23Å; A173-R185 PolarHBondContact O-NH1 3.4Å
174	C	82.5	Confident	84.3	Confident	20 Å²	20	52.2 Å²	52.2	14%	0.135	25%	0.252	C	S	.	.	S	Bend	trans	-63.6	151	-179	-56.2	0	0	0	0	111.8	F170 R171 F176 Y181	F170-C174 PolarHBondContact O-SG 2.88Å; R171-C174 VanDerWaalsContact O-CB 3.3Å; R171-C174 WeakPolarHBondContact O-CB 3.31Å; R171-C174 PolarHBondContact O-N 3.03Å; C174-F176 PolarHBondContact O-N 3.07Å; C174-Y181 VanDerWaalsContact SG-CE1 3.59Å
175	V	76.9	Confident	84.1	Confident	38 Å²	38	55.2 Å²	55.2	23%	0.23	26%	0.263	C	S	.	.			trans	-81.7	121.9	175.2	-178.6	0	0	0	0	109.3	H177 G179 N180 D182	V175-H177 HydrophobicContact CG1-CB 4.15Å; V175-H177 CarbonylContact O-C 3.57Å; V175-H177 PolarHBondContact O-N 3.27Å; V175-G179 WeakPolarHBondContact O-CA 3.44Å; V175-G179 PolarHBondContact O-N 2.9Å; V175-G179 VanDerWaalsContact O-N 3.07Å; V175-N180 WeakPolarHBondContact CB-O 3.47Å; V175-N180 PolarHBondContact N-O 3.19Å; V175-D182 HydrophobicContact CG2-CB 3.65Å
176	F	56.8	Low	83.9	Confident	208 Å²	208	54.4 Å²	54.4	91%	0.912	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-12.4	-175.6	-154.8	-95.7	0	0	0	114	C174 K178	C174-F176 PolarHBondContact O-N 3.07Å; F176-K178 VanDerWaalsContact C-N 3.34Å; F176-K178 PolarHBondContact O-N 2.93Å
177	H	56.3	Low	83.8	Confident	116 Å²	116	54.1 Å²	54.1	54%	0.537	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	87.4	164.6	-161.8	94.3	0	0	0	110.5	V175 G179	V175-H177 HydrophobicContact CG1-CB 4.15Å; V175-H177 CarbonylContact O-C 3.57Å; V175-H177 PolarHBondContact O-N 3.27Å; H177-G179 VanDerWaalsContact C-N 3.31Å; H177-G179 PolarHBondContact O-N 3.09Å
178	K	56.2	Low	83.8	Confident	157 Å²	157	54.5 Å²	54.5	68%	0.683	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	-4.1	176.5	-53.5	170.8	-175.5	168.4	0	117	F176 N180	F176-K178 VanDerWaalsContact C-N 3.34Å; F176-K178 PolarHBondContact O-N 2.93Å; K178-N180 WeakPolarHBondContact CB-OD1 3.32Å
179	G	61.6	Low	83.7	Confident	21 Å²	21	55.2 Å²	55.2	22%	0.216	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	3.8	-179.4	0	0	0	0	0	114	V175 H177	V175-G179 WeakPolarHBondContact O-CA 3.44Å; V175-G179 PolarHBondContact O-N 2.9Å; V175-G179 VanDerWaalsContact O-N 3.07Å; H177-G179 VanDerWaalsContact C-N 3.31Å; H177-G179 PolarHBondContact O-N 3.09Å
180	N	76.7	Confident	83.8	Confident	11 Å²	11	56 Å²	56	6%	0.059	28%	0.278	C	S	.	.			trans	-58.3	145.6	174.6	-59	18.4	0	0	0	111.2	V175 K178 A201 S202 F205	V175-N180 WeakPolarHBondContact CB-O 3.47Å; V175-N180 PolarHBondContact N-O 3.19Å; K178-N180 WeakPolarHBondContact CB-OD1 3.32Å; N180-A201 PolarHBondContact OD1-O 3.26Å; N180-S202 WeakPolarHBondContact CA-O 3.36Å; N180-F205 HydrophobicContact CB-CD2 3.67Å; N180-F205 HydrophobicContact CB-CE2 3.43Å; N180-F205 VanDerWaalsContact CB-CE2 3.43Å; N180-F205 HydrophobicContact CB-CG 4.33Å; N180-F205 HydrophobicContact CB-CZ 3.89Å; N180-F205 VanDerWaalsContact ND2-CE1 3.3Å; N180-F205 WeakPolarHBondContact ND2-CE1 3.3Å; N180-F205 WeakPolarHBondContact ND2-CZ 3.23Å
181	Y	81.8	Confident	83.9	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.008	29%	0.288	C	S	.	.			trans	-83.1	127.9	167.9	-48.7	-38.6	0	0	0	109.8	F144 T145 A146 C174 I195 D197 S202	F144-Y181 HydrophobicContact CD1-CD1 4.32Å; F144-Y181 HydrophobicContact CD1-CD2 4.44Å; F144-Y181 HydrophobicContact CD1-CG 4.14Å; F144-Y181 AromaticContact CD2-CD1 3.94Å; F144-Y181 HydrophobicContact CD2-CD1 3.94Å; F144-Y181 AromaticContact CD2-CE1 3.8Å; F144-Y181 HydrophobicContact CD2-CE1 3.8Å; F144-Y181 HydrophobicContact CD2-CG 4.5Å; F144-Y181 AromaticContact CE1-CD1 3.97Å; F144-Y181 HydrophobicContact CE1-CD1 3.97Å; F144-Y181 AromaticContact CE1-CG 3.92Å; F144-Y181 HydrophobicContact CE1-CG 3.92Å; F144-Y181 AromaticContact CE2-CD1 3.53Å; F144-Y181 HydrophobicContact CE2-CD1 3.53Å; F144-Y181 AromaticContact CE2-CE1 3.73Å; F144-Y181 HydrophobicContact CE2-CE1 3.73Å; F144-Y181 HydrophobicContact CE2-CG 4.29Å; F144-Y181 HydrophobicContact CG-CD1 4.33Å; F144-Y181 HydrophobicContact CG-CE1 4.37Å; F144-Y181 HydrophobicContact CG-CG 4.45Å; F144-Y181 AromaticContact CZ-CD1 3.56Å; F144-Y181 HydrophobicContact CZ-CD1 3.56Å; F144-Y181 HydrophobicContact CZ-CE1 4.24Å; F144-Y181 HydrophobicContact CZ-CG 4Å; F144-Y181 PolarHBondContact O-OH 3.07Å; T145-Y181 WeakPolarHBondContact CA-OH 3.35Å; A146-Y181 PolarHBondContact N-OH 2.75Å; C174-Y181 VanDerWaalsContact SG-CE1 3.59Å; Y181-I195 HydrophobicContact CD2-CD1 3.48Å; Y181-I195 VanDerWaalsContact CD2-CD1 3.48Å; Y181-I195 HydrophobicContact CE2-CD1 3.87Å; Y181-D197 VanDerWaalsContact CE2-OD2 3.26Å; Y181-D197 WeakPolarHBondContact CE2-OD2 3Å; Y181-S202 PolarHBondContact N-O 3.04Å
182	D	88.8	Confident	84.2	Confident	38 Å²	38	59.1 Å²	59.1	20%	0.203	29%	0.293	C	S	.	.			trans	-99.4	99.9	169.2	179.9	21.9	0	0	0	110	V175 N184 R185 F205 H206	V175-D182 HydrophobicContact CG2-CB 3.65Å; D182-N184 PolarHBondContact O-N 2.93Å; D182-N184 WeakPolarHBondContact OD1-CB 3.15Å; D182-N184 PolarHBondContact OD1-N 3.15Å; D182-N184 PolarHBondContact OD1-ND2 3.49Å; D182-R185 HydrophobicContact CB-CG 4.31Å; D182-R185 WeakPolarHBondContact O-CB 3.38Å; D182-R185 PolarHBondContact O-N 2.91Å; D182-R185 VanDerWaalsContact O-N 3.07Å; D182-F205 HydrophobicContact CB-CD2 4.27Å; D182-H206 IonicContact OD1-CD2 3.54Å; D182-H206 IonicContact OD1-CE1 2.68Å; D182-H206 IonicContact OD1-NE2 3.41Å; D182-H206 PolarHBondContact OD1-NE2 3.15Å
183	L	93.5	Very high	84.7	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-64.5	-20.4	-175.8	-52.8	-174.7	0	0	0	112.8	I87 R185 L186 L190 V193 I195 H206 N209	I87-L183 HydrophobicContact CG1-CD2 4.49Å; L183-R185 PolarHBondContact O-N 3.3Å; L183-L186 HydrophobicContact CB-CD1 3.98Å; L183-L186 HydrophobicContact CD2-CD1 3.95Å; L183-L186 VanDerWaalsContact O-CB 3.31Å; L183-L186 WeakPolarHBondContact O-CB 3.44Å; L183-L186 WeakPolarHBondContact O-CG 3.43Å; L183-L186 PolarHBondContact O-N 3.2Å; L183-L186 VanDerWaalsContact O-N 3.09Å; L183-L190 HydrophobicContact CB-CD2 3.69Å; L183-V193 HydrophobicContact CD1-CG1 4Å; L183-I195 HydrophobicContact CD1-CG2 4.21Å; L183-H206 HydrophobicContact CD1-CB 3.56Å; L183-H206 HydrophobicContact CG-CB 3.95Å; L183-H206 PolarHBondContact N-CD2 2.84Å; L183-H206 VanDerWaalsContact N-CD2 3.33Å; L183-H206 PolarHBondContact N-NE2 3.29Å; L183-H206 VanDerWaalsContact N-NE2 3.15Å; L183-N209 HydrophobicContact CD1-CB 3.91Å
184	N	92.3	Very high	85.2	Confident	98 Å²	98	52.2 Å²	52.2	52%	0.524	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-54.9	-35.4	171.8	-67.4	-67	0	0	0	111.7	D182 L186 H206	D182-N184 PolarHBondContact O-N 2.93Å; D182-N184 WeakPolarHBondContact OD1-CB 3.15Å; D182-N184 PolarHBondContact OD1-N 3.15Å; D182-N184 PolarHBondContact OD1-ND2 3.49Å; N184-L186 PolarHBondContact O-N 3.27Å; N184-H206 PolarHBondContact ND2-CE1 3.45Å; N184-H206 VanDerWaalsContact ND2-CE1 3.27Å; N184-H206 PolarHBondContact ND2-NE2 2.98Å
185	R	93.3	Very high	86	Confident	63 Å²	63	51.3 Å²	51.3	24%	0.238	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-74.5	-7.9	-176.6	-59.2	178.7	64.6	-134.7	-3	113.2	L71 L72 A173 D182 L183 G187	L71-R185 CarbonylContact C-O 3.53Å; L71-R185 WeakPolarHBondContact CA-O 3.46Å; L72-R185 HydrophobicContact CD1-CB 3.85Å; L72-R185 HydrophobicContact CG-CB 3.93Å; L72-R185 PolarHBondContact N-O 3.16Å; A173-R185 PolarHBondContact O-NH1 3.4Å; D182-R185 HydrophobicContact CB-CG 4.31Å; D182-R185 WeakPolarHBondContact O-CB 3.38Å; D182-R185 PolarHBondContact O-N 2.91Å; D182-R185 VanDerWaalsContact O-N 3.07Å; L183-R185 PolarHBondContact O-N 3.3Å; R185-G187 VanDerWaalsContact C-N 3.28Å; R185-G187 PolarHBondContact O-N 2.79Å
186	L	95.2	Very high	87	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-68.6	-23.8	178.3	-64.8	170.8	0	0	0	113.3	L72 L73 I87 F144 L169 L183 N184 R188 V193	L72-L186 HydrophobicContact CD1-CD2 4.45Å; L73-L186 VanDerWaalsContact CB-O 3.32Å; L73-L186 WeakPolarHBondContact CB-O 3.47Å; L73-L186 HydrophobicContact CD1-CB 4.14Å; L73-L186 HydrophobicContact CD1-CD2 4.08Å; L73-L186 HydrophobicContact CG-CB 4.47Å; L73-L186 HydrophobicContact CG-CD2 4.14Å; I87-L186 HydrophobicContact CD1-CD1 3.75Å; I87-L186 HydrophobicContact CD1-CD2 4.06Å; I87-L186 HydrophobicContact CG1-CD1 3.96Å; F144-L186 HydrophobicContact CD1-CD2 4.44Å; F144-L186 HydrophobicContact CE1-CD2 4.46Å; L169-L186 HydrophobicContact CD1-CD2 3.82Å; L183-L186 HydrophobicContact CB-CD1 3.98Å; L183-L186 HydrophobicContact CD2-CD1 3.95Å; L183-L186 VanDerWaalsContact O-CB 3.31Å; L183-L186 WeakPolarHBondContact O-CB 3.44Å; L183-L186 WeakPolarHBondContact O-CG 3.43Å; L183-L186 PolarHBondContact O-N 3.2Å; L183-L186 VanDerWaalsContact O-N 3.09Å; N184-L186 PolarHBondContact O-N 3.27Å; L186-R188 HydrophobicContact CB-CB 4.43Å; L186-R188 HydrophobicContact CB-CG 4.19Å; L186-V193 HydrophobicContact CD1-CG1 3.91Å; L186-V193 HydrophobicContact CD1-CG2 4.47Å
187	G	95.4	Very high	88.9	Confident	30 Å²	30	39.6 Å²	39.6	31%	0.309	20%	0.198	S	C	.	.	S	Bend	trans	69.4	43.7	-171.7	0	0	0	0	0	112.1	R185	R185-G187 VanDerWaalsContact C-N 3.28Å; R185-G187 PolarHBondContact O-N 2.79Å
188	R	97.1	Very high	90.9	Very high	39 Å²	39	35.4 Å²	35.4	15%	0.147	18%	0.18	C	C	.	.	S	Bend	trans	-137.2	150	177.8	-59.6	-64.5	-178.7	-92.6	6.6	108.4	L73 P74 C85 E140 L186 L190 V193	L73-R188 HydrophobicContact CD1-CG 4.13Å; P74-R188 PolarHBondContact O-NH1 2.71Å; P74-R188 PolarHBondContact O-NH2 2.93Å; C85-R188 HydrophobicContact CB-CB 4.46Å; C85-R188 HydrophobicContact CB-CG 4.06Å; E140-R188 IonicContact OE1-CZ 3.71Å; E140-R188 IonicContact OE1-NE 3.66Å; E140-R188 IonicContact OE1-NH2 2.82Å; E140-R188 PolarHBondContact OE1-NH2 2.91Å; E140-R188 IonicContact OE2-CZ 3.54Å; E140-R188 IonicContact OE2-NE 3.41Å; E140-R188 PolarHBondContact OE2-NE 2.83Å; E140-R188 IonicContact OE2-NH2 3.5Å; E140-R188 PolarHBondContact OE2-NH2 2.92Å; L186-R188 HydrophobicContact CB-CB 4.43Å; L186-R188 HydrophobicContact CB-CG 4.19Å; R188-L190 PolarHBondContact O-N 3.48Å; R188-V193 HydrophobicContact CB-CG2 3.58Å
189	D	96.7	Very high	92.7	Very high	81 Å²	81	29.3 Å²	29.3	43%	0.433	16%	0.157	S	C	.	.			trans	-72.7	121.4	174.8	-173.6	-32.8	0	0	0	109.4	K191 H192 V193	D189-K191 PolarHBondContact O-N 2.88Å; D189-K191 VanDerWaalsContact O-N 3.09Å; D189-K191 WeakPolarHBondContact OD1-CB 3.28Å; D189-K191 WeakPolarHBondContact OD1-CD 3.32Å; D189-K191 VanDerWaalsContact OD1-CG 3.26Å; D189-K191 WeakPolarHBondContact OD1-CG 3.33Å; D189-K191 PolarHBondContact OD1-N 3.44Å; D189-K191 WeakPolarHBondContact OD2-CD 3.32Å; D189-K191 WeakPolarHBondContact OD2-CE 3.38Å; D189-K191 IonicContact OD2-NZ 2.74Å; D189-K191 PolarHBondContact OD2-NZ 2.76Å; D189-H192 CarbonylContact O-C 3.55Å; D189-H192 WeakPolarHBondContact O-CA 3.32Å; D189-H192 WeakPolarHBondContact O-CB 3.42Å; D189-H192 PolarHBondContact O-N 3.42Å; D189-V193 PolarHBondContact O-N 3.43Å
190	L	97	Very high	94.2	Very high	33 Å²	33	32 Å²	32	17%	0.173	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-61.3	-20.5	-175.2	-60.5	179.9	0	0	0	113.5	L183 R188 H192 V193 N209 Y242	L183-L190 HydrophobicContact CB-CD2 3.69Å; R188-L190 PolarHBondContact O-N 3.48Å; L190-H192 PolarHBondContact O-N 2.84Å; L190-H192 VanDerWaalsContact O-N 3.14Å; L190-V193 HydrophobicContact CD2-CB 4.4Å; L190-V193 HydrophobicContact CD2-CG2 4.26Å; L190-V193 PolarHBondContact O-N 2.91Å; L190-N209 PolarHBondContact O-ND2 3.23Å; L190-Y242 WeakPolarHBondContact CB-OH 3.13Å
191	K	97.3	Very high	94.9	Very high	77 Å²	77	32.8 Å²	32.8	34%	0.335	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-67.2	-10.5	171.6	87.8	-160	178.8	-143.5	0	113.2	D189 N240 V241	D189-K191 PolarHBondContact O-N 2.88Å; D189-K191 VanDerWaalsContact O-N 3.09Å; D189-K191 WeakPolarHBondContact OD1-CB 3.28Å; D189-K191 WeakPolarHBondContact OD1-CD 3.32Å; D189-K191 VanDerWaalsContact OD1-CG 3.26Å; D189-K191 WeakPolarHBondContact OD1-CG 3.33Å; D189-K191 PolarHBondContact OD1-N 3.44Å; D189-K191 WeakPolarHBondContact OD2-CD 3.32Å; D189-K191 WeakPolarHBondContact OD2-CE 3.38Å; D189-K191 IonicContact OD2-NZ 2.74Å; D189-K191 PolarHBondContact OD2-NZ 2.76Å; K191-N240 HydrophobicContact CB-CB 4.42Å; K191-N240 WeakPolarHBondContact O-CA 3.45Å; K191-V241 PolarHBondContact O-N 2.86Å
192	H	97.8	Very high	95.3	Very high	65 Å²	65	33.3 Å²	33.3	30%	0.301	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-124.7	13.5	-179.5	-58.6	-36.5	0	0	0	112.7	K84 C85 D189 L190 D239	K84-H192 WeakPolarHBondContact CA-O 3.08Å; K84-H192 WeakPolarHBondContact CB-O 3.21Å; K84-H192 HydrophobicContact CG-CB 4.09Å; C85-H192 PolarHBondContact N-O 3.22Å; D189-H192 CarbonylContact O-C 3.55Å; D189-H192 WeakPolarHBondContact O-CA 3.32Å; D189-H192 WeakPolarHBondContact O-CB 3.42Å; D189-H192 PolarHBondContact O-N 3.42Å; L190-H192 PolarHBondContact O-N 2.84Å; L190-H192 VanDerWaalsContact O-N 3.14Å; H192-D239 PolarHBondContact CE1-O 2.84Å; H192-D239 PolarHBondContact ND1-O 3Å
193	V	98.2	Very high	95.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	135.1	174.7	178.4	0	0	0	0	109.9	C85 I87 L183 L186 R188 D189 L190 N209	C85-V193 HydrophobicContact CB-CG2 4.22Å; C85-V193 WeakPolarHBondContact O-CA 3.12Å; I87-V193 HydrophobicContact CG1-CG1 4.21Å; L183-V193 HydrophobicContact CD1-CG1 4Å; L186-V193 HydrophobicContact CD1-CG1 3.91Å; L186-V193 HydrophobicContact CD1-CG2 4.47Å; R188-V193 HydrophobicContact CB-CG2 3.58Å; D189-V193 PolarHBondContact O-N 3.43Å; L190-V193 HydrophobicContact CD2-CB 4.4Å; L190-V193 HydrophobicContact CD2-CG2 4.26Å; L190-V193 PolarHBondContact O-N 2.91Å; V193-N209 PolarHBondContact O-ND2 2.76Å
194	I	98.5	Very high	95.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	146	173.1	-55.9	168.1	0	0	0	107.6	C85 L86 I87 F139 N209 V211 L232 L235 V241	C85-I194 PolarHBondContact O-N 2.93Å; L86-I194 HydrophobicContact CD1-CB 3.8Å; L86-I194 HydrophobicContact CD1-CG2 3.71Å; I87-I194 WeakPolarHBondContact CB-O 3.34Å; I87-I194 PolarHBondContact N-O 3.08Å; F139-I194 HydrophobicContact CE1-CD1 3.57Å; F139-I194 HydrophobicContact CZ-CD1 4Å; I194-N209 WeakPolarHBondContact CA-O 3.44Å; I194-V211 HydrophobicContact CG2-CB 4.33Å; I194-V211 HydrophobicContact CG2-CG2 3.59Å; I194-L232 HydrophobicContact CG2-CD2 4.39Å; I194-L235 HydrophobicContact CD1-CB 3.69Å; I194-L235 HydrophobicContact CD1-CD1 4.18Å; I194-L235 HydrophobicContact CD1-CG 4.46Å; I194-V241 HydrophobicContact CD1-CG1 4.09Å; I194-V241 HydrophobicContact CG1-CB 4.49Å; I194-V241 HydrophobicContact CG1-CG1 3.75Å
195	I	98	Very high	95.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	129.4	167.6	-177.9	165.2	0	0	0	112.2	I87 Y181 L183 D197 Y203 N209 A210 V211	I87-I195 HydrophobicContact CB-CB 3.97Å; I87-I195 HydrophobicContact CB-CD1 4.29Å; I87-I195 HydrophobicContact CB-CG1 3.95Å; I87-I195 HydrophobicContact CG2-CB 4.46Å; I87-I195 HydrophobicContact CG2-CD1 3.84Å; I87-I195 HydrophobicContact CG2-CG1 3.94Å; I87-I195 WeakPolarHBondContact O-CA 3.07Å; Y181-I195 HydrophobicContact CD2-CD1 3.48Å; Y181-I195 VanDerWaalsContact CD2-CD1 3.48Å; Y181-I195 HydrophobicContact CE2-CD1 3.87Å; L183-I195 HydrophobicContact CD1-CG2 4.21Å; I195-D197 HydrophobicContact CD1-CB 4.19Å; I195-D197 HydrophobicContact CG1-CB 3.98Å; I195-Y203 HydrophobicContact CG2-CD1 4.38Å; I195-Y203 HydrophobicContact CG2-CG 4.3Å; I195-N209 PolarHBondContact N-O 3.22Å; I195-A210 HydrophobicContact CG2-CB 3.99Å; I195-V211 PolarHBondContact O-N 2.76Å
196	V	98.5	Very high	95.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	114.4	170.5	174.7	0	0	0	0	108.1	L86 I87 D89 T93 V211 V213 L228 L232	L86-V196 HydrophobicContact CD1-CG2 3.98Å; I87-V196 PolarHBondContact O-N 2.82Å; D89-V196 PolarHBondContact N-O 2.96Å; D89-V196 VanDerWaalsContact N-O 3.07Å; T93-V196 HydrophobicContact CG2-CG1 4.37Å; V196-V211 HydrophobicContact CG2-CB 4.07Å; V196-V211 HydrophobicContact CG2-CG1 4.23Å; V196-V213 HydrophobicContact CG1-CG1 3.85Å; V196-V213 HydrophobicContact CG1-CG2 4.15Å; V196-L228 HydrophobicContact CG1-CD2 4.02Å; V196-L228 HydrophobicContact CG2-CD2 4.22Å; V196-L232 HydrophobicContact CG2-CD2 4.23Å
197	D	97.8	Very high	95.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	140.8	-171.4	-177.6	-62	0	0	0	108.6	D89 Y181 I195 S199 S202 Y203	D89-D197 HydrophobicContact CB-CB 4.17Å; Y181-D197 VanDerWaalsContact CE2-OD2 3.26Å; Y181-D197 WeakPolarHBondContact CE2-OD2 3Å; I195-D197 HydrophobicContact CD1-CB 4.19Å; I195-D197 HydrophobicContact CG1-CB 3.98Å; D197-S199 VanDerWaalsContact C-N 3.31Å; D197-S199 PolarHBondContact O-N 3.21Å; D197-S199 WeakPolarHBondContact OD1-CA 3.16Å; D197-S199 WeakPolarHBondContact OD1-CB 3.23Å; D197-S199 PolarHBondContact OD1-N 2.81Å; D197-S202 VanDerWaalsContact CG-CB 3.42Å; D197-S202 VanDerWaalsContact CG-OG 3.31Å; D197-S202 WeakPolarHBondContact OD1-CB 3.45Å; D197-S202 PolarHBondContact OD1-OG 2.8Å; D197-S202 WeakPolarHBondContact OD2-CB 3.26Å; D197-S202 PolarHBondContact OD2-OG 2.98Å; D197-S202 VanDerWaalsContact OD2-OG 3.04Å; D197-Y203 HydrophobicContact CB-CD1 3.93Å; D197-Y203 HydrophobicContact CB-CE1 4.01Å
198	N	97	Very high	95.4	Very high	28 Å²	28	36.4 Å²	36.4	15%	0.15	20%	0.202	C	C	.	.	S	Bend	trans	-79.9	-8.9	-176.6	71.7	-39.1	0	0	0	114.4	E92 T93 V213 S215	E92-N198 VanDerWaalsContact CB-ND2 3.28Å; E92-N198 WeakPolarHBondContact CB-ND2 3.36Å; T93-N198 PolarHBondContact OG1-N 2.95Å; T93-N198 PolarHBondContact OG1-OD1 2.87Å; N198-V213 WeakPolarHBondContact CA-O 3.09Å; N198-V213 HydrophobicContact CB-CG2 4.23Å; N198-S215 PolarHBondContact ND2-OG 3.45Å
199	S	94	Very high	95.4	Very high	30 Å²	30	34.6 Å²	34.6	21%	0.21	20%	0.195	C	C	.	.			trans	-119.6	106.9	-167.6	150.2	0	0	0	0	111.1	D197 A201 S202 Y203	D197-S199 VanDerWaalsContact C-N 3.31Å; D197-S199 PolarHBondContact O-N 3.21Å; D197-S199 WeakPolarHBondContact OD1-CA 3.16Å; D197-S199 WeakPolarHBondContact OD1-CB 3.23Å; D197-S199 PolarHBondContact OD1-N 2.81Å; S199-A201 PolarHBondContact O-N 3.14Å; S199-S202 VanDerWaalsContact CB-OG 3.24Å; S199-S202 WeakPolarHBondContact CB-OG 3.27Å; S199-S202 VanDerWaalsContact O-CB 3.32Å; S199-S202 WeakPolarHBondContact O-CB 3.42Å; S199-S202 PolarHBondContact O-N 2.95Å; S199-S202 PolarHBondContact O-OG 2.86Å; S199-S202 VanDerWaalsContact O-OG 3.08Å; S199-S202 PolarHBondContact OG-N 2.98Å; S199-S202 PolarHBondContact OG-OG 3.49Å; S199-Y203 WeakPolarHBondContact O-CE1 3.45Å
200	P	93.2	Very high	95.4	Very high	76 Å²	76	30.8 Å²	30.8	49%	0.494	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-10.4	175.1	-26.6	35	0	0	0	115.9	Y203	P200-Y203 HydrophobicContact CB-CE2 4.25Å
201	A	90.6	Very high	95.4	Very high	28 Å²	28	29.4 Å²	29.4	23%	0.231	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-36.7	170.9	0	0	0	0	0	112	F13 N180 S199 Y203 A204	F13-A201 HydrophobicContact CE2-CB 4.33Å; N180-A201 PolarHBondContact OD1-O 3.26Å; S199-A201 PolarHBondContact O-N 3.14Å; A201-Y203 PolarHBondContact O-N 3.33Å; A201-A204 VanDerWaalsContact O-CB 3.26Å; A201-A204 WeakPolarHBondContact O-CB 3.48Å; A201-A204 PolarHBondContact O-N 2.78Å
202	S	91.2	Very high	95.4	Very high	14 Å²	14	29.4 Å²	29.4	10%	0.098	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-48.1	-173.9	-45.3	0	0	0	0	111.1	N180 Y181 D197 S199	N180-S202 WeakPolarHBondContact CA-O 3.36Å; Y181-S202 PolarHBondContact N-O 3.04Å; D197-S202 VanDerWaalsContact CG-CB 3.42Å; D197-S202 VanDerWaalsContact CG-OG 3.31Å; D197-S202 WeakPolarHBondContact OD1-CB 3.45Å; D197-S202 PolarHBondContact OD1-OG 2.8Å; D197-S202 WeakPolarHBondContact OD2-CB 3.26Å; D197-S202 PolarHBondContact OD2-OG 2.98Å; D197-S202 VanDerWaalsContact OD2-OG 3.04Å; S199-S202 VanDerWaalsContact CB-OG 3.24Å; S199-S202 WeakPolarHBondContact CB-OG 3.27Å; S199-S202 VanDerWaalsContact O-CB 3.32Å; S199-S202 WeakPolarHBondContact O-CB 3.42Å; S199-S202 PolarHBondContact O-N 2.95Å; S199-S202 PolarHBondContact O-OG 2.86Å; S199-S202 VanDerWaalsContact O-OG 3.08Å; S199-S202 PolarHBondContact OG-N 2.98Å; S199-S202 PolarHBondContact OG-OG 3.49Å
203	Y	92.4	Very high	95.4	Very high	17 Å²	17	26.9 Å²	26.9	7%	0.067	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	20.8	178.5	51.6	-99.9	0	0	0	114.1	I195 D197 S199 P200 A201 F205 H206 A210	I195-Y203 HydrophobicContact CG2-CD1 4.38Å; I195-Y203 HydrophobicContact CG2-CG 4.3Å; D197-Y203 HydrophobicContact CB-CD1 3.93Å; D197-Y203 HydrophobicContact CB-CE1 4.01Å; S199-Y203 WeakPolarHBondContact O-CE1 3.45Å; P200-Y203 HydrophobicContact CB-CE2 4.25Å; A201-Y203 PolarHBondContact O-N 3.33Å; Y203-F205 PolarHBondContact O-N 2.82Å; Y203-H206 CarbonylContact O-C 3.53Å; Y203-H206 VanDerWaalsContact O-C 3.27Å; Y203-H206 PolarHBondContact O-N 3.33Å; Y203-A210 HydrophobicContact CD1-CB 3.93Å; Y203-A210 HydrophobicContact CD2-CB 3.22Å; Y203-A210 HydrophobicContact CE1-CB 4.08Å; Y203-A210 HydrophobicContact CE2-CB 3.37Å; Y203-A210 HydrophobicContact CG-CB 3.49Å; Y203-A210 VanDerWaalsContact CG-CB 3.49Å
204	A	91.5	Very high	95.4	Very high	52 Å²	52	33.4 Å²	33.4	43%	0.43	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-9.4	-175.8	0	0	0	0	0	115.5	A201	A201-A204 VanDerWaalsContact O-CB 3.26Å; A201-A204 WeakPolarHBondContact O-CB 3.48Å; A201-A204 PolarHBondContact O-N 2.78Å
205	F	91.3	Very high	95.4	Very high	91 Å²	91	36 Å²	36	40%	0.399	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-19.3	169.2	-62.6	-33.9	0	0	0	113.7	N180 D182 Y203	N180-F205 HydrophobicContact CB-CD2 3.67Å; N180-F205 HydrophobicContact CB-CE2 3.43Å; N180-F205 VanDerWaalsContact CB-CE2 3.43Å; N180-F205 HydrophobicContact CB-CG 4.33Å; N180-F205 HydrophobicContact CB-CZ 3.89Å; N180-F205 VanDerWaalsContact ND2-CE1 3.3Å; N180-F205 WeakPolarHBondContact ND2-CE1 3.3Å; N180-F205 WeakPolarHBondContact ND2-CZ 3.23Å; D182-F205 HydrophobicContact CB-CD2 4.27Å; Y203-F205 PolarHBondContact O-N 2.82Å
206	H	93.9	Very high	95.4	Very high	16 Å²	16	36.3 Å²	36.3	7%	0.074	22%	0.215	C	C	.	.			trans	-136.2	50.7	-172.1	-63.1	-84.7	0	0	0	112.2	D182 L183 N184 Y203 D208 N209	D182-H206 IonicContact OD1-CD2 3.54Å; D182-H206 IonicContact OD1-CE1 2.68Å; D182-H206 IonicContact OD1-NE2 3.41Å; D182-H206 PolarHBondContact OD1-NE2 3.15Å; L183-H206 HydrophobicContact CD1-CB 3.56Å; L183-H206 HydrophobicContact CG-CB 3.95Å; L183-H206 PolarHBondContact N-CD2 2.84Å; L183-H206 VanDerWaalsContact N-CD2 3.33Å; L183-H206 PolarHBondContact N-NE2 3.29Å; L183-H206 VanDerWaalsContact N-NE2 3.15Å; N184-H206 PolarHBondContact ND2-CE1 3.45Å; N184-H206 VanDerWaalsContact ND2-CE1 3.27Å; N184-H206 PolarHBondContact ND2-NE2 2.98Å; Y203-H206 CarbonylContact O-C 3.53Å; Y203-H206 VanDerWaalsContact O-C 3.27Å; Y203-H206 PolarHBondContact O-N 3.33Å; H206-D208 PolarHBondContact O-N 2.99Å; H206-N209 HydrophobicContact CB-CB 4.3Å; H206-N209 WeakPolarHBondContact O-CB 3.5Å; H206-N209 PolarHBondContact O-N 2.94Å
207	P	94.4	Very high	95.3	Very high	63 Å²	63	40.4 Å²	40.4	41%	0.409	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-64.3	-26.9	-174.4	27.9	-36.4	0	0	0	113.4	N209 A210 N249	P207-N209 PolarHBondContact O-N 3.38Å; P207-A210 PolarHBondContact O-N 2.83Å; P207-N249 PolarHBondContact O-ND2 3.47Å
208	D	96.3	Very high	95.2	Very high	54 Å²	54	46.1 Å²	46.1	29%	0.289	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-73	-8.3	176.7	-66.2	-10.9	0	0	0	113.2	H206 Y242 L245 K246	H206-D208 PolarHBondContact O-N 2.99Å; D208-Y242 HydrophobicContact CB-CD1 3.82Å; D208-Y242 HydrophobicContact CB-CE1 3.65Å; D208-Y242 VanDerWaalsContact O-CD1 3.29Å; D208-Y242 WeakPolarHBondContact O-CD1 3.21Å; D208-Y242 WeakPolarHBondContact O-CE1 3.34Å; D208-L245 WeakPolarHBondContact O-CB 3.41Å; D208-K246 HydrophobicContact CB-CG 4Å; D208-K246 WeakPolarHBondContact OD2-CE 3.25Å; D208-K246 IonicContact OD2-NZ 3.49Å; D208-K246 PolarHBondContact OD2-NZ 3.04Å
209	N	97.4	Very high	95.3	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-100.5	-5.2	174.1	-71.6	92.2	0	0	0	112.8	L183 L190 V193 I194 I195 H206 P207 Y242	L183-N209 HydrophobicContact CD1-CB 3.91Å; L190-N209 PolarHBondContact O-ND2 3.23Å; V193-N209 PolarHBondContact O-ND2 2.76Å; I194-N209 WeakPolarHBondContact CA-O 3.44Å; I195-N209 PolarHBondContact N-O 3.22Å; H206-N209 HydrophobicContact CB-CB 4.3Å; H206-N209 WeakPolarHBondContact O-CB 3.5Å; H206-N209 PolarHBondContact O-N 2.94Å; P207-N209 PolarHBondContact O-N 3.38Å; N209-Y242 PolarHBondContact ND2-OH 3.49Å; N209-Y242 WeakPolarHBondContact OD1-CE1 3.05Å; N209-Y242 PolarHBondContact OD1-OH 2.75Å
210	A	97.2	Very high	95.4	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.008	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	139.4	-170.1	0	0	0	0	0	113	I195 Y203 P207 N249	I195-A210 HydrophobicContact CG2-CB 3.99Å; Y203-A210 HydrophobicContact CD1-CB 3.93Å; Y203-A210 HydrophobicContact CD2-CB 3.22Å; Y203-A210 HydrophobicContact CE1-CB 4.08Å; Y203-A210 HydrophobicContact CE2-CB 3.37Å; Y203-A210 HydrophobicContact CG-CB 3.49Å; Y203-A210 VanDerWaalsContact CG-CB 3.49Å; P207-A210 PolarHBondContact O-N 2.83Å; A210-N249 PolarHBondContact O-ND2 2.93Å
211	V	98	Very high	95.6	Very high	5 Å²	5	56.9 Å²	56.9	3%	0.03	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	93.4	171.5	176.6	0	0	0	0	106	I194 I195 V196 L228 F231 L235 L245	I194-V211 HydrophobicContact CG2-CB 4.33Å; I194-V211 HydrophobicContact CG2-CG2 3.59Å; I195-V211 PolarHBondContact O-N 2.76Å; V196-V211 HydrophobicContact CG2-CB 4.07Å; V196-V211 HydrophobicContact CG2-CG1 4.23Å; V211-L228 HydrophobicContact CG1-CD1 3.6Å; V211-F231 HydrophobicContact CG1-CD1 4.09Å; V211-F231 HydrophobicContact CG1-CE1 3.96Å; V211-F231 HydrophobicContact CG2-CE1 4.06Å; V211-L235 HydrophobicContact CG2-CD1 3.83Å; V211-L245 HydrophobicContact CG2-CD1 4.32Å; V211-L245 HydrophobicContact CG2-CD2 3.71Å
212	P	97.2	Very high	96	Very high	76 Å²	76	56.7 Å²	56.7	49%	0.494	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	142.6	-173.5	27.9	-34.6	0	0	0	111.1
213	V	97.9	Very high	96.3	Very high	13 Å²	13	58.6 Å²	58.6	8%	0.079	32%	0.32	C	S	.	.			trans	-124.5	159.8	170.2	-70.1	0	0	0	0	110.3	T93 V196 N198 E224 L228	T93-V213 HydrophobicContact CG2-CG2 4.24Å; V196-V213 HydrophobicContact CG1-CG1 3.85Å; V196-V213 HydrophobicContact CG1-CG2 4.15Å; N198-V213 WeakPolarHBondContact CA-O 3.09Å; N198-V213 HydrophobicContact CB-CG2 4.23Å; V213-E224 WeakPolarHBondContact CB-OE2 3.4Å; V213-E224 HydrophobicContact CG1-CG 4.46Å; V213-L228 HydrophobicContact CG1-CD2 3.84Å
214	Q	97.6	Very high	96.6	Very high	136 Å²	136	59.5 Å²	59.5	64%	0.636	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-73.5	149.4	170.7	-68.4	169.5	82.6	0	0	110.8	R125 W216 E224	R125-Q214 PolarHBondContact NH1-O 3.39Å; Q214-W216 PolarHBondContact O-N 3.29Å; Q214-E224 WeakPolarHBondContact CA-OE2 3.22Å; Q214-E224 WeakPolarHBondContact CB-OE2 3.4Å; Q214-E224 WeakPolarHBondContact CG-OE1 3.45Å; Q214-E224 VanDerWaalsContact N-CD 3.32Å; Q214-E224 PolarHBondContact N-OE1 3.27Å; Q214-E224 VanDerWaalsContact N-OE1 3.16Å; Q214-E224 PolarHBondContact N-OE2 2.86Å; Q214-E224 PolarHBondContact NE2-OE1 3.5Å
215	S	98.2	Very high	97	Very high	54 Å²	54	57 Å²	57	38%	0.378	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-75.3	120.2	173.5	-59.2	0	0	0	0	109.9	N198 F217	N198-S215 PolarHBondContact ND2-OG 3.45Å; S215-F217 WeakPolarHBondContact O-CE2 3.43Å
216	W	98.5	Very high	97.3	Very high	8 Å²	8	55.8 Å²	55.8	3%	0.03	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-102.7	146	-178.5	-178.4	86.9	0	0	0	112.4	E92 H96 L123 K124 R125 Q214 D219	E92-W216 WeakPolarHBondContact CA-O 3.41Å; E92-W216 WeakPolarHBondContact CG-O 3.23Å; E92-W216 PolarHBondContact O-N 3.1Å; H96-W216 HydrophobicContact CB-CE3 3.94Å; H96-W216 HydrophobicContact CB-CZ3 3.8Å; L123-W216 HydrophobicContact CB-CH2 3.79Å; L123-W216 HydrophobicContact CB-CZ3 4.03Å; K124-W216 VanDerWaalsContact C-CH2 3.48Å; K124-W216 WeakPolarHBondContact O-CH2 3.47Å; R125-W216 HydrophobicContact CB-CD2 3.88Å; R125-W216 HydrophobicContact CB-CE3 3.82Å; R125-W216 HydrophobicContact CB-CG 4.33Å; R125-W216 HydrophobicContact CB-CZ3 4.21Å; R125-W216 HydrophobicContact CG-CB 4.17Å; R125-W216 HydrophobicContact CG-CD2 3.74Å; R125-W216 HydrophobicContact CG-CE3 4.2Å; R125-W216 HydrophobicContact CG-CG 3.7Å; Q214-W216 PolarHBondContact O-N 3.29Å; W216-D219 PolarHBondContact NE1-O 2.75Å
217	F	96.6	Very high	97.5	Very high	85 Å²	85	59.6 Å²	59.6	37%	0.373	32%	0.322	S	S	.	.	S	Bend	trans	-132.4	-62.1	-174.1	-60.6	-83.6	0	0	0	112.8	E92 H96 S215	E92-F217 HydrophobicContact CG-CD1 3.92Å; E92-F217 HydrophobicContact CG-CE1 3.4Å; E92-F217 HydrophobicContact CG-CZ 3.78Å; H96-F217 VanDerWaalsContact CB-O 3.22Å; H96-F217 WeakPolarHBondContact CB-O 3.22Å; H96-F217 PolarHBondContact CD2-O 3.47Å; H96-F217 VanDerWaalsContact CD2-O 3.29Å; H96-F217 AromaticContact CE1-CD1 3.72Å; H96-F217 AromaticContact ND1-CD1 3.75Å; S215-F217 WeakPolarHBondContact O-CE2 3.43Å
218	D	95.9	Very high	97.7	Very high	121 Å²	121	57.3 Å²	57.3	65%	0.647	31%	0.307	S	S	*	.	S	Bend	trans	-153.6	9.7	-176.3	60.2	-8	0	0	0	115	L123 L220	L123-D218 HydrophobicContact CD1-CB 4.27Å; D218-L220 PolarHBondContact O-N 2.81Å
219	D	97.4	Very high	97.8	Very high	81 Å²	81	55.4 Å²	55.4	43%	0.433	30%	0.296	S	S	.	.			trans	-76.7	112.2	177.9	-169.6	3.1	0	0	0	111.8	W216 N221 D222	W216-D219 PolarHBondContact NE1-O 2.75Å; D219-N221 PolarHBondContact O-N 3.47Å; D219-N221 WeakPolarHBondContact OD1-CB 3.24Å; D219-N221 PolarHBondContact OD1-N 3.3Å; D219-N221 PolarHBondContact OD1-ND2 2.89Å; D219-D222 WeakPolarHBondContact O-CB 3.26Å; D219-D222 PolarHBondContact O-N 2.86Å
220	L	96.1	Very high	97.8	Very high	146 Å²	146	59.3 Å²	59.3	76%	0.764	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-5.6	178	-57.3	179.6	0	0	0	113.5	D218	D218-L220 PolarHBondContact O-N 2.81Å
221	N	98	Very high	97.9	Very high	133 Å²	133	62.7 Å²	62.7	71%	0.711	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	0.2	175.9	-48	-88.2	0	0	0	112.7	D219	D219-N221 PolarHBondContact O-N 3.47Å; D219-N221 WeakPolarHBondContact OD1-CB 3.24Å; D219-N221 PolarHBondContact OD1-N 3.3Å; D219-N221 PolarHBondContact OD1-ND2 2.89Å
222	D	98.6	Very high	97.9	Very high	24 Å²	24	62.6 Å²	62.6	13%	0.128	34%	0.335	C	S	.	.			trans	-59.4	133.8	176.1	-177.8	-89.3	0	0	0	111.3	R125 P126 Y127 D219 E224	R125-D222 IonicContact CZ-OD1 2.75Å; R125-D222 IonicContact CZ-OD2 3.19Å; R125-D222 IonicContact NE-OD1 3.47Å; R125-D222 PolarHBondContact NE-OD1 2.68Å; R125-D222 IonicContact NE-OD2 3.8Å; R125-D222 PolarHBondContact NE-OD2 2.59Å; R125-D222 IonicContact NH2-OD1 2.76Å; R125-D222 PolarHBondContact NH2-OD1 2.54Å; R125-D222 IonicContact NH2-OD2 2.71Å; R125-D222 PolarHBondContact NH2-OD2 3.28Å; P126-D222 VanDerWaalsContact CB-O 3.24Å; P126-D222 WeakPolarHBondContact CB-O 3.37Å; P126-D222 HydrophobicContact CG-CB 4.1Å; Y127-D222 WeakPolarHBondContact CE2-O 3.3Å; D219-D222 WeakPolarHBondContact O-CB 3.26Å; D219-D222 PolarHBondContact O-N 2.86Å; D222-E224 PolarHBondContact OD1-N 3.2Å
223	T	98.6	Very high	97.9	Very high	54 Å²	54	61.9 Å²	61.9	33%	0.331	33%	0.325	S	S	.	.			trans	-121.8	2.4	177.3	53.4	0	0	0	0	112.8	Y127 L225 L226 D227	Y127-T223 HydrophobicContact CE2-CG2 4.01Å; T223-L225 VanDerWaalsContact C-N 3.33Å; T223-L225 PolarHBondContact O-N 2.98Å; T223-L226 WeakPolarHBondContact O-CA 3.49Å; T223-L226 WeakPolarHBondContact O-CB 3.47Å; T223-L226 PolarHBondContact O-N 3.18Å; T223-D227 WeakPolarHBondContact CB-OD2 3.43Å; T223-D227 PolarHBondContact O-N 2.94Å; T223-D227 PolarHBondContact OG1-OD2 2.85Å
224	E	98.7	Very high	97.9	Very high	36 Å²	36	64.4 Å²	64.4	17%	0.168	34%	0.341	C	S	.	.	H	α-helix	trans	-63.7	-36.6	-163	-166.4	173.1	-125.9	0	0	112.8	R125 V213 Q214 D222 L226 D227 L228	R125-E224 IonicContact CZ-OE2 3.9Å; R125-E224 IonicContact NH1-OE2 3.88Å; R125-E224 PolarHBondContact NH1-OE2 3.03Å; R125-E224 IonicContact NH2-OE2 2.84Å; R125-E224 PolarHBondContact NH2-OE2 3.46Å; V213-E224 WeakPolarHBondContact CB-OE2 3.4Å; V213-E224 HydrophobicContact CG1-CG 4.46Å; Q214-E224 WeakPolarHBondContact CA-OE2 3.22Å; Q214-E224 WeakPolarHBondContact CB-OE2 3.4Å; Q214-E224 WeakPolarHBondContact CG-OE1 3.45Å; Q214-E224 VanDerWaalsContact N-CD 3.32Å; Q214-E224 PolarHBondContact N-OE1 3.27Å; Q214-E224 VanDerWaalsContact N-OE1 3.16Å; Q214-E224 PolarHBondContact N-OE2 2.86Å; Q214-E224 PolarHBondContact NE2-OE1 3.5Å; D222-E224 PolarHBondContact OD1-N 3.2Å; E224-L226 VanDerWaalsContact C-N 3.29Å; E224-L226 PolarHBondContact O-N 2.99Å; E224-D227 PolarHBondContact O-N 3.31Å; E224-L228 WeakPolarHBondContact O-CB 3.45Å; E224-L228 PolarHBondContact O-N 3.44Å
225	L	98.8	Very high	97.9	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-65.4	-30.2	173.8	-64.6	-173.8	0	0	0	113.1	L94 R125 V128 F131 T223	L94-L225 HydrophobicContact CD2-CD1 4.13Å; L94-L225 HydrophobicContact CD2-CD2 4.31Å; R125-L225 HydrophobicContact CB-CD1 3.95Å; R125-L225 HydrophobicContact CG-CD1 3.85Å; R125-L225 HydrophobicContact CG-CG 4.16Å; V128-L225 HydrophobicContact CB-CD1 3.87Å; V128-L225 HydrophobicContact CG2-CD1 4.13Å; F131-L225 HydrophobicContact CB-CB 4.08Å; F131-L225 HydrophobicContact CD1-CD2 4.36Å; F131-L225 HydrophobicContact CD2-CB 4.16Å; F131-L225 HydrophobicContact CD2-CD2 4.37Å; F131-L225 VanDerWaalsContact CD2-O 3.26Å; F131-L225 WeakPolarHBondContact CD2-O 3.21Å; F131-L225 HydrophobicContact CE1-CD2 4.36Å; F131-L225 HydrophobicContact CE2-CD2 4.35Å; F131-L225 HydrophobicContact CG-CB 4.13Å; F131-L225 HydrophobicContact CG-CD2 4.37Å; F131-L225 HydrophobicContact CZ-CD2 4.35Å; T223-L225 VanDerWaalsContact C-N 3.33Å; T223-L225 PolarHBondContact O-N 2.98Å
226	L	98.5	Very high	97.9	Very high	64 Å²	64	56.3 Å²	56.3	34%	0.335	30%	0.301	S	S	.	.	H	α-helix	trans	-76.9	-47.1	175.5	-176.6	67.8	0	0	0	110.9	Y127 T223 E224 L228 L229	Y127-L226 HydrophobicContact CD1-CB 4.28Å; Y127-L226 HydrophobicContact CD1-CD1 4.33Å; Y127-L226 HydrophobicContact CD1-CD2 3.96Å; Y127-L226 HydrophobicContact CD1-CG 4.43Å; Y127-L226 HydrophobicContact CD2-CB 3.99Å; Y127-L226 HydrophobicContact CD2-CD2 4.48Å; Y127-L226 HydrophobicContact CE1-CD2 3.86Å; Y127-L226 HydrophobicContact CE2-CD2 4.4Å; Y127-L226 HydrophobicContact CG-CB 3.82Å; Y127-L226 HydrophobicContact CG-CD2 4.27Å; Y127-L226 HydrophobicContact CG-CG 4.46Å; T223-L226 WeakPolarHBondContact O-CA 3.49Å; T223-L226 WeakPolarHBondContact O-CB 3.47Å; T223-L226 PolarHBondContact O-N 3.18Å; E224-L226 VanDerWaalsContact C-N 3.29Å; E224-L226 PolarHBondContact O-N 2.99Å; L226-L228 PolarHBondContact O-N 2.87Å; L226-L229 HydrophobicContact CD1-CD1 4.37Å; L226-L229 PolarHBondContact O-N 3.15Å
227	D	98.3	Very high	97.8	Very high	96 Å²	96	62.2 Å²	62.2	51%	0.513	33%	0.327	S	S	.	.	H	α-helix	trans	-65.8	-25.6	-178.9	-64	-36.3	0	0	0	112.6	T223 E224 P230	T223-D227 WeakPolarHBondContact CB-OD2 3.43Å; T223-D227 PolarHBondContact O-N 2.94Å; T223-D227 PolarHBondContact OG1-OD2 2.85Å; E224-D227 PolarHBondContact O-N 3.31Å; D227-P230 WeakPolarHBondContact O-CD 3.23Å
228	L	98.1	Very high	97.9	Very high	16 Å²	16	59.8 Å²	59.8	8%	0.084	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-23.5	178.3	-178.3	58.8	0	0	0	113.8	F131 V196 V211 V213 E224 L226 F231 L232	F131-L228 HydrophobicContact CE2-CD2 4.05Å; F131-L228 HydrophobicContact CE2-CG 4.49Å; F131-L228 HydrophobicContact CZ-CD2 4.48Å; V196-L228 HydrophobicContact CG1-CD2 4.02Å; V196-L228 HydrophobicContact CG2-CD2 4.22Å; V211-L228 HydrophobicContact CG1-CD1 3.6Å; V213-L228 HydrophobicContact CG1-CD2 3.84Å; E224-L228 WeakPolarHBondContact O-CB 3.45Å; E224-L228 PolarHBondContact O-N 3.44Å; L226-L228 PolarHBondContact O-N 2.87Å; L228-F231 HydrophobicContact CD1-CD1 4.07Å; L228-F231 PolarHBondContact O-N 3.23Å; L228-L232 HydrophobicContact CD1-CG 4.25Å; L228-L232 HydrophobicContact CD2-CD1 4.1Å; L228-L232 HydrophobicContact CG-CD1 3.86Å; L228-L232 HydrophobicContact CG-CG 3.98Å; L228-L232 PolarHBondContact O-N 3Å
229	L	98.6	Very high	97.9	Very high	13 Å²	13	61 Å²	61	7%	0.068	33%	0.325	C	S	.	.	H	α-helix	trans	-60.3	-46.7	-172.3	-77.6	164	0	0	0	114.4	F131 Q134 I135 L226 F231 L232 E233	F131-L229 HydrophobicContact CD2-CD2 3.89Å; F131-L229 HydrophobicContact CD2-CG 4.08Å; F131-L229 HydrophobicContact CE2-CD2 4.49Å; Q134-L229 HydrophobicContact CB-CD1 4.38Å; Q134-L229 HydrophobicContact CB-CD2 3.69Å; I135-L229 HydrophobicContact CG2-CD2 3.92Å; L226-L229 HydrophobicContact CD1-CD1 4.37Å; L226-L229 PolarHBondContact O-N 3.15Å; L229-F231 PolarHBondContact O-N 3.32Å; L229-L232 PolarHBondContact O-N 2.91Å; L229-E233 WeakPolarHBondContact O-CB 3.29Å; L229-E233 PolarHBondContact O-N 2.96Å
230	P	98	Very high	97.8	Very high	83 Å²	83	60 Å²	60	54%	0.539	32%	0.32	S	S	.	.	H	α-helix	trans	-62.5	-30	177.3	-23.2	35	0	0	0	113.5	D227 T234	D227-P230 WeakPolarHBondContact O-CD 3.23Å; P230-T234 PolarHBondContact O-N 3.45Å; P230-T234 VanDerWaalsContact O-N 3.08Å; P230-T234 PolarHBondContact O-OG1 3.32Å
231	F	97.7	Very high	97.9	Very high	73 Å²	73	53.1 Å²	53.1	32%	0.32	28%	0.284	S	S	.	.	H	α-helix	trans	-73.7	-43.2	176.9	-176.2	-117.7	0	0	0	111.5	V211 L228 L229 T234 L235 I244 L245	V211-F231 HydrophobicContact CG1-CD1 4.09Å; V211-F231 HydrophobicContact CG1-CE1 3.96Å; V211-F231 HydrophobicContact CG2-CE1 4.06Å; L228-F231 HydrophobicContact CD1-CD1 4.07Å; L228-F231 PolarHBondContact O-N 3.23Å; L229-F231 PolarHBondContact O-N 3.32Å; F231-T234 WeakPolarHBondContact O-CB 3.4Å; F231-T234 PolarHBondContact O-N 3.4Å; F231-L235 HydrophobicContact CD1-CD1 3.9Å; F231-L235 HydrophobicContact CE1-CD1 3.61Å; F231-L235 HydrophobicContact CE1-CG 4.46Å; F231-L235 HydrophobicContact CZ-CD1 3.99Å; F231-L235 HydrophobicContact CZ-CG 4.43Å; F231-L235 WeakPolarHBondContact O-CG 3.3Å; F231-L235 PolarHBondContact O-N 2.72Å; F231-I244 HydrophobicContact CE2-CG2 3.61Å; F231-I244 HydrophobicContact CZ-CG2 3.79Å; F231-L245 HydrophobicContact CE1-CD2 4.19Å; F231-L245 HydrophobicContact CZ-CD2 3.99Å
232	L	98.4	Very high	97.8	Very high	2 Å²	2	49 Å²	49	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-62.5	-42	171.2	-70.8	176	0	0	0	111.5	L86 F131 I135 F139 I194 V196 L228 L229 T234 L235 A236	L86-L232 HydrophobicContact CD1-CD2 4.11Å; L86-L232 HydrophobicContact CD2-CD1 4.28Å; F131-L232 HydrophobicContact CE2-CD1 3.61Å; F131-L232 HydrophobicContact CZ-CD1 4.05Å; I135-L232 HydrophobicContact CG2-CD1 3.88Å; F139-L232 HydrophobicContact CE2-CB 4Å; F139-L232 HydrophobicContact CZ-CB 4.28Å; F139-L232 VanDerWaalsContact CZ-O 3.3Å; F139-L232 WeakPolarHBondContact CZ-O 3.48Å; I194-L232 HydrophobicContact CG2-CD2 4.39Å; V196-L232 HydrophobicContact CG2-CD2 4.23Å; L228-L232 HydrophobicContact CD1-CG 4.25Å; L228-L232 HydrophobicContact CD2-CD1 4.1Å; L228-L232 HydrophobicContact CG-CD1 3.86Å; L228-L232 HydrophobicContact CG-CG 3.98Å; L228-L232 PolarHBondContact O-N 3Å; L229-L232 PolarHBondContact O-N 2.91Å; L232-T234 PolarHBondContact O-N 3.27Å; L232-L235 HydrophobicContact CD2-CD1 4.34Å; L232-L235 CarbonylContact O-C 3.59Å; L232-L235 PolarHBondContact O-N 2.92Å; L232-L235 VanDerWaalsContact O-N 3.13Å; L232-A236 PolarHBondContact O-N 2.88Å
233	E	97.9	Very high	97.7	Very high	61 Å²	61	51 Å²	51	29%	0.285	28%	0.275	S	S	.	.	H	α-helix	trans	-60.7	-32.7	175.6	-148.8	-144.4	168.3	0	0	112.4	Y138 L229 K237	Y138-E233 HydrophobicContact CD1-CG 4.15Å; Y138-E233 HydrophobicContact CD2-CG 4.32Å; Y138-E233 HydrophobicContact CE1-CG 3.57Å; Y138-E233 HydrophobicContact CE2-CG 3.82Å; Y138-E233 HydrophobicContact CG-CG 4.49Å; Y138-E233 PolarHBondContact OH-OE1 3.26Å; L229-E233 WeakPolarHBondContact O-CB 3.29Å; L229-E233 PolarHBondContact O-N 2.96Å; E233-K237 VanDerWaalsContact O-CD 3.28Å; E233-K237 WeakPolarHBondContact O-CD 3.45Å; E233-K237 WeakPolarHBondContact O-CE 3.45Å; E233-K237 WeakPolarHBondContact O-CG 3.39Å; E233-K237 VanDerWaalsContact OE1-CE 3.3Å; E233-K237 WeakPolarHBondContact OE1-CE 3.41Å; E233-K237 IonicContact OE1-NZ 3.38Å; E233-K237 PolarHBondContact OE1-NZ 3.34Å; E233-K237 IonicContact OE2-NZ 2.69Å; E233-K237 PolarHBondContact OE2-NZ 3.34Å
234	T	97.7	Very high	97.5	Very high	66 Å²	66	50.4 Å²	50.4	41%	0.405	27%	0.269	S	S	.	.	H	α-helix	trans	-71.1	-45.6	173.7	-57.8	0	0	0	0	111.3	P230 F231 L232 A236 K237 V238 I244	P230-T234 PolarHBondContact O-N 3.45Å; P230-T234 VanDerWaalsContact O-N 3.08Å; P230-T234 PolarHBondContact O-OG1 3.32Å; F231-T234 WeakPolarHBondContact O-CB 3.4Å; F231-T234 PolarHBondContact O-N 3.4Å; L232-T234 PolarHBondContact O-N 3.27Å; T234-A236 VanDerWaalsContact C-N 3.27Å; T234-A236 PolarHBondContact O-N 2.97Å; T234-K237 PolarHBondContact O-N 3.27Å; T234-K237 VanDerWaalsContact O-N 3.09Å; T234-V238 PolarHBondContact O-N 3.43Å; T234-I244 HydrophobicContact CG2-CD1 3.85Å
235	L	98	Very high	97.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.6	-31	175.6	-72.2	166.4	0	0	0	112.7	K84 I194 V211 F231 L232 K237 V241 I244 L245	K84-L235 WeakPolarHBondContact CD-O 3.43Å; K84-L235 WeakPolarHBondContact CE-O 3.42Å; I194-L235 HydrophobicContact CD1-CB 3.69Å; I194-L235 HydrophobicContact CD1-CD1 4.18Å; I194-L235 HydrophobicContact CD1-CG 4.46Å; V211-L235 HydrophobicContact CG2-CD1 3.83Å; F231-L235 HydrophobicContact CD1-CD1 3.9Å; F231-L235 HydrophobicContact CE1-CD1 3.61Å; F231-L235 HydrophobicContact CE1-CG 4.46Å; F231-L235 HydrophobicContact CZ-CD1 3.99Å; F231-L235 HydrophobicContact CZ-CG 4.43Å; F231-L235 WeakPolarHBondContact O-CG 3.3Å; F231-L235 PolarHBondContact O-N 2.72Å; L232-L235 HydrophobicContact CD2-CD1 4.34Å; L232-L235 CarbonylContact O-C 3.59Å; L232-L235 PolarHBondContact O-N 2.92Å; L232-L235 VanDerWaalsContact O-N 3.13Å; L235-K237 PolarHBondContact O-N 3.07Å; L235-V241 HydrophobicContact CD2-CB 4.39Å; L235-I244 HydrophobicContact CD2-CB 3.94Å; L235-I244 HydrophobicContact CD2-CD1 4.06Å; L235-I244 HydrophobicContact CD2-CG2 4.03Å; L235-L245 HydrophobicContact CD1-CD2 4.07Å; L235-L245 HydrophobicContact CD2-CD1 4.45Å; L235-L245 HydrophobicContact CD2-CD2 3.99Å; L235-L245 HydrophobicContact CD2-CG 3.97Å
236	A	97.8	Very high	96.4	Very high	20 Å²	20	53.2 Å²	53.2	17%	0.165	28%	0.28	C	S	.	.	H	α-helix	trans	-59.3	-33.6	173	0	0	0	0	0	112.1	K84 Y138 F139 L232 T234	K84-A236 PolarHBondContact NZ-O 3.38Å; Y138-A236 HydrophobicContact CD1-CB 4.34Å; Y138-A236 HydrophobicContact CG-CB 4.36Å; F139-A236 HydrophobicContact CE1-CB 4.13Å; F139-A236 HydrophobicContact CE2-CB 4.16Å; F139-A236 HydrophobicContact CZ-CB 3.69Å; L232-A236 PolarHBondContact O-N 2.88Å; T234-A236 VanDerWaalsContact C-N 3.27Å; T234-A236 PolarHBondContact O-N 2.97Å
237	K	97.3	Very high	94.5	Very high	133 Å²	133	56.1 Å²	56.1	58%	0.578	30%	0.296	S	S	*	.	H	α-helix	trans	-89.7	-22.7	-170.9	-66.3	163.4	-171.2	171.7	0	115.1	E233 T234 L235	E233-K237 VanDerWaalsContact O-CD 3.28Å; E233-K237 WeakPolarHBondContact O-CD 3.45Å; E233-K237 WeakPolarHBondContact O-CE 3.45Å; E233-K237 WeakPolarHBondContact O-CG 3.39Å; E233-K237 VanDerWaalsContact OE1-CE 3.3Å; E233-K237 WeakPolarHBondContact OE1-CE 3.41Å; E233-K237 IonicContact OE1-NZ 3.38Å; E233-K237 PolarHBondContact OE1-NZ 3.34Å; E233-K237 IonicContact OE2-NZ 2.69Å; E233-K237 PolarHBondContact OE2-NZ 3.34Å; T234-K237 PolarHBondContact O-N 3.27Å; T234-K237 VanDerWaalsContact O-N 3.09Å; L235-K237 PolarHBondContact O-N 3.07Å
238	V	96.9	Very high	92.7	Very high	33 Å²	33	54.7 Å²	54.7	20%	0.2	29%	0.294	C	S	.	.	S	Bend	trans	-77.8	146.8	-179	-63.6	0	0	0	0	113.2	K84 T234 N240 I244	K84-V238 WeakPolarHBondContact CE-O 2.96Å; K84-V238 PolarHBondContact NZ-O 3.08Å; T234-V238 PolarHBondContact O-N 3.43Å; V238-N240 PolarHBondContact O-N 2.77Å; V238-I244 HydrophobicContact CG1-CD1 3.77Å; V238-I244 HydrophobicContact CG1-CG1 4.46Å; V238-I244 HydrophobicContact CG2-CD1 4.37Å
239	D	95.9	Very high	90.7	Very high	147 Å²	147	56.8 Å²	56.8	79%	0.786	31%	0.305	S	S	*	.	S	Bend	trans	-64.1	-28.1	176.7	-66.6	-47.9	0	0	0	113.4	H192	H192-D239 PolarHBondContact CE1-O 2.84Å; H192-D239 PolarHBondContact ND1-O 3Å
240	N	96.9	Very high	87.8	Confident	61 Å²	61	62.9 Å²	62.9	33%	0.326	33%	0.333	S	S	.	.			trans	-145.2	117.8	-176	-177.8	-12.2	0	0	0	109.9	K191 V238 Y242 S243	K191-N240 HydrophobicContact CB-CB 4.42Å; K191-N240 WeakPolarHBondContact O-CA 3.45Å; V238-N240 PolarHBondContact O-N 2.77Å; N240-Y242 PolarHBondContact O-N 2.75Å; N240-Y242 VanDerWaalsContact O-N 3.14Å; N240-Y242 VanDerWaalsContact OD1-CB 3.27Å; N240-Y242 WeakPolarHBondContact OD1-CB 3.39Å; N240-Y242 WeakPolarHBondContact OD1-CD2 3.18Å; N240-Y242 PolarHBondContact OD1-N 2.84Å; N240-S243 WeakPolarHBondContact O-CB 3.41Å; N240-S243 PolarHBondContact O-N 2.92Å; N240-S243 PolarHBondContact O-OG 3.3Å
241	V	97.5	Very high	84.9	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-29	-177.6	-59.8	0	0	0	0	112.7	K84 K191 I194 L235 S243 I244 L245	K84-V241 HydrophobicContact CD-CG1 3.94Å; K191-V241 PolarHBondContact O-N 2.86Å; I194-V241 HydrophobicContact CD1-CG1 4.09Å; I194-V241 HydrophobicContact CG1-CB 4.49Å; I194-V241 HydrophobicContact CG1-CG1 3.75Å; L235-V241 HydrophobicContact CD2-CB 4.39Å; V241-S243 PolarHBondContact O-N 3.36Å; V241-S243 VanDerWaalsContact O-N 3.17Å; V241-I244 PolarHBondContact O-N 3.27Å; V241-L245 HydrophobicContact CB-CD1 4.02Å; V241-L245 HydrophobicContact CG2-CD1 4.17Å; V241-L245 PolarHBondContact O-N 3.3Å
242	Y	96.7	Very high	82	Confident	48 Å²	48	65.8 Å²	65.8	19%	0.188	36%	0.361	C	S	.	.	H	α-helix	trans	-65.2	-16.5	177.9	-60.2	-43.6	0	0	0	114.3	L190 D208 N209 N240 I244 K246	L190-Y242 WeakPolarHBondContact CB-OH 3.13Å; D208-Y242 HydrophobicContact CB-CD1 3.82Å; D208-Y242 HydrophobicContact CB-CE1 3.65Å; D208-Y242 VanDerWaalsContact O-CD1 3.29Å; D208-Y242 WeakPolarHBondContact O-CD1 3.21Å; D208-Y242 WeakPolarHBondContact O-CE1 3.34Å; N209-Y242 PolarHBondContact ND2-OH 3.49Å; N209-Y242 WeakPolarHBondContact OD1-CE1 3.05Å; N209-Y242 PolarHBondContact OD1-OH 2.75Å; N240-Y242 PolarHBondContact O-N 2.75Å; N240-Y242 VanDerWaalsContact O-N 3.14Å; N240-Y242 VanDerWaalsContact OD1-CB 3.27Å; N240-Y242 WeakPolarHBondContact OD1-CB 3.39Å; N240-Y242 WeakPolarHBondContact OD1-CD2 3.18Å; N240-Y242 PolarHBondContact OD1-N 2.84Å; Y242-I244 PolarHBondContact O-N 3.31Å; Y242-K246 HydrophobicContact CD1-CD 4.42Å; Y242-K246 HydrophobicContact CD1-CG 4.16Å; Y242-K246 HydrophobicContact CG-CD 4.25Å; Y242-K246 VanDerWaalsContact CG-CE 3.44Å; Y242-K246 HydrophobicContact CG-CG 4.37Å; Y242-K246 WeakPolarHBondContact O-CB 3.48Å
243	S	95.6	Very high	78.9	Confident	66 Å²	66	71.2 Å²	71.2	46%	0.462	40%	0.4	S	S	.	.	H	α-helix	trans	-63.6	-24.8	171.5	61.5	0	0	0	0	112.9	N240 V241 N247	N240-S243 WeakPolarHBondContact O-CB 3.41Å; N240-S243 PolarHBondContact O-N 2.92Å; N240-S243 PolarHBondContact O-OG 3.3Å; V241-S243 PolarHBondContact O-N 3.36Å; V241-S243 VanDerWaalsContact O-N 3.17Å; S243-N247 PolarHBondContact O-ND2 3.27Å
244	I	94.3	Very high	75.8	Confident	41 Å²	41	73.4 Å²	73.4	21%	0.21	43%	0.429	C	S	.	.	H	α-helix	trans	-106.8	-56.7	177.5	-64.9	176.7	0	0	0	109.7	F231 T234 L235 V238 V241 Y242 K246 N247 S248	F231-I244 HydrophobicContact CE2-CG2 3.61Å; F231-I244 HydrophobicContact CZ-CG2 3.79Å; T234-I244 HydrophobicContact CG2-CD1 3.85Å; L235-I244 HydrophobicContact CD2-CB 3.94Å; L235-I244 HydrophobicContact CD2-CD1 4.06Å; L235-I244 HydrophobicContact CD2-CG2 4.03Å; V238-I244 HydrophobicContact CG1-CD1 3.77Å; V238-I244 HydrophobicContact CG1-CG1 4.46Å; V238-I244 HydrophobicContact CG2-CD1 4.37Å; V241-I244 PolarHBondContact O-N 3.27Å; Y242-I244 PolarHBondContact O-N 3.31Å; I244-K246 PolarHBondContact O-N 3.38Å; I244-N247 WeakPolarHBondContact O-CB 3.41Å; I244-N247 PolarHBondContact O-N 3.5Å; I244-S248 PolarHBondContact O-N 2.85Å
245	L	93.8	Very high	72.8	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.005	44%	0.439	C	S	.	.	H	α-helix	trans	-67.1	-29.2	-166.4	-61.4	-178.3	0	0	0	115	D208 V211 F231 L235 V241 N247 S248 N249	D208-L245 WeakPolarHBondContact O-CB 3.41Å; V211-L245 HydrophobicContact CG2-CD1 4.32Å; V211-L245 HydrophobicContact CG2-CD2 3.71Å; F231-L245 HydrophobicContact CE1-CD2 4.19Å; F231-L245 HydrophobicContact CZ-CD2 3.99Å; L235-L245 HydrophobicContact CD1-CD2 4.07Å; L235-L245 HydrophobicContact CD2-CD1 4.45Å; L235-L245 HydrophobicContact CD2-CD2 3.99Å; L235-L245 HydrophobicContact CD2-CG 3.97Å; V241-L245 HydrophobicContact CB-CD1 4.02Å; V241-L245 HydrophobicContact CG2-CD1 4.17Å; V241-L245 PolarHBondContact O-N 3.3Å; L245-N247 PolarHBondContact O-N 3.2Å; L245-S248 WeakPolarHBondContact CA-OG 3.46Å; L245-S248 PolarHBondContact O-N 3.38Å; L245-S248 PolarHBondContact O-OG 3.26Å; L245-N249 PolarHBondContact O-N 3.3Å
246	K	80.4	Confident	69.6	Low	93 Å²	93	84.4 Å²	84.4	40%	0.404	48%	0.48	S	S	.	.	H	α-helix	trans	-69.9	-20.4	175.7	-69.6	-175	-176.9	-97.8	0	113	D208 Y242 I244	D208-K246 HydrophobicContact CB-CG 4Å; D208-K246 WeakPolarHBondContact OD2-CE 3.25Å; D208-K246 IonicContact OD2-NZ 3.49Å; D208-K246 PolarHBondContact OD2-NZ 3.04Å; Y242-K246 HydrophobicContact CD1-CD 4.42Å; Y242-K246 HydrophobicContact CD1-CG 4.16Å; Y242-K246 HydrophobicContact CG-CD 4.25Å; Y242-K246 VanDerWaalsContact CG-CE 3.44Å; Y242-K246 HydrophobicContact CG-CG 4.37Å; Y242-K246 WeakPolarHBondContact O-CB 3.48Å; I244-K246 PolarHBondContact O-N 3.38Å
247	N	59.3	Low	66.5	Low	126 Å²	126	95 Å²	95	67%	0.674	52%	0.516	S	S	*	.	H	α-helix	trans	-90	-29	178.8	-63.1	-44.4	0	0	0	112.2	S243 I244 L245	S243-N247 PolarHBondContact O-ND2 3.27Å; I244-N247 WeakPolarHBondContact O-CB 3.41Å; I244-N247 PolarHBondContact O-N 3.5Å; L245-N247 PolarHBondContact O-N 3.2Å
248	S	60.8	Low	63.5	Low	66 Å²	66	94.5 Å²	94.5	46%	0.462	52%	0.524	S	S	.	.	H	α-helix	trans	-74.8	-31.6	176.9	55.3	0	0	0	0	113.4	I244 L245 Q250	I244-S248 PolarHBondContact O-N 2.85Å; L245-S248 WeakPolarHBondContact CA-OG 3.46Å; L245-S248 PolarHBondContact O-N 3.38Å; L245-S248 PolarHBondContact O-OG 3.26Å; S248-Q250 VanDerWaalsContact C-N 3.33Å; S248-Q250 PolarHBondContact O-N 2.86Å
249	N	55.1	Low	60.4	Low	59 Å²	59	100.2 Å²	100.2	32%	0.316	55%	0.554	S	S	.	*	S	Bend	trans	-92.7	9.5	-167.1	-61.1	1.4	0	0	0	113.3	P207 A210 L245	P207-N249 PolarHBondContact O-ND2 3.47Å; A210-N249 PolarHBondContact O-ND2 2.93Å; L245-N249 PolarHBondContact O-N 3.3Å
250	Q	37.4	Very low	57.4	Low	142 Å²	142	98.2 Å²	98.2	66%	0.664	55%	0.55	S	S	*	.	S	Bend	trans	-99.4	118.8	171.8	-75.5	-86	-19.1	0	0	110.4	S248 S252	S248-Q250 VanDerWaalsContact C-N 3.33Å; S248-Q250 PolarHBondContact O-N 2.86Å; Q250-S252 PolarHBondContact O-N 2.81Å
251	P	38.5	Very low	54.6	Low	120 Å²	120	103.4 Å²	103.4	78%	0.779	58%	0.578	S	S	*	*			trans	-69.5	102.7	171.5	28.3	-32.6	0	0	0	109.8	S253	P251-S253 PolarHBondContact O-N 2.7Å
252	S	36.8	Very low	51.4	Low	96 Å²	96	106.9 Å²	106.9	67%	0.671	61%	0.613	S	S	*	*			trans	-69.6	95.7	-170.4	53.4	0	0	0	0	113	Q250	Q250-S252 PolarHBondContact O-N 2.81Å
253	S	32.1	Very low	48.2	Very low	116 Å²	116	109.4 Å²	109.4	81%	0.811	64%	0.638	S	S	*	*	S	Bend	trans	-73.2	128.7	162.6	60.2	0	0	0	0	109.9	P251	P251-S253 PolarHBondContact O-N 2.7Å
254	A	32.9	Very low	45.2	Very low	108 Å²	108	116.7 Å²	116.7	89%	0.893	66%	0.657	S	S	*	*	S	Bend	trans	65.4	71.8	177.6	0	0	0	0	0	117.9
255	A	34	Very low	42.2	Very low	76 Å²	76	119.9 Å²	119.9	63%	0.628	67%	0.674	S	S	*	*			trans	-141.5	20.8	165.5	0	0	0	0	0	116.3
256	Y	32.7	Very low	39.4	Very low	221 Å²	221	123.8 Å²	123.8	87%	0.867	72%	0.715	S	S	*	*			trans	-111.6	82.9	172.4	-78.6	-75.1	0	0	0	112.1
257	R	31.7	Very low	37.3	Very low	241 Å²	241	129.1 Å²	129.1	91%	0.909	73%	0.733	S	S	*	*			trans	-113.9	114.6	153.9	-89.8	-174.7	171.3	157.5	-1.6	107.5
258	V	33.7	Very low	36	Very low	124 Å²	124	126.5 Å²	126.5	75%	0.752	74%	0.735	S	S	*	*			trans	-95.1	112.4	176	179.2	0	0	0	0	107.8
259	D	32.1	Very low	34.7	Very low	153 Å²	153	130.9 Å²	130.9	82%	0.818	75%	0.752	S	S	*	*			trans	-107	149.7	161.2	-88.8	-54.5	0	0	0	109.1
260	C	34.1	Very low	33.6	Very low	105 Å²	105	135.6 Å²	135.6	71%	0.709	78%	0.775	S	S	*	*			trans	-87.3	148	-160.3	-53.5	0	0	0	0	114.5
261	N	36.5	Very low	33.3	Very low	170 Å²	170	132.6 Å²	132.6	91%	0.909	78%	0.775	S	S	*	*			trans	101.4	98.7	162	-52.4	-39.6	0	0	0	117.8
262	G	30.7	Very low	32.8	Very low	73 Å²	73	135.2 Å²	135.2	75%	0.753	78%	0.777	S	S	*	*			trans	124.9	137.5	144.5	0	0	0	0	0	117.4
263	S	29.9	Very low	32.6	Very low	100 Å²	100	137.9 Å²	137.9	70%	0.699	79%	0.789	S	S	*	*			trans	63.3	100.2	152.2	-65.4	0	0	0	0	120.5
264	Y	32.1	Very low	32.6	Very low	220 Å²	220	140.3 Å²	140.3	86%	0.863	79%	0.787	S	S	*	*			trans	67.7	126.2	148	-48.1	-65.2	0	0	0	119.2
265	D	32.3	Very low	32.5	Very low	107 Å²	107	141.6 Å²	141.6	57%	0.572	78%	0.775	S	S	*	*			trans	-99.3	96.7	-168.2	56.3	-41.6	0	0	0	114.1	R267	D265-R267 HydrophobicContact CB-CG 4.48Å; D265-R267 PolarHBondContact O-N 2.99Å; D265-R267 IonicContact OD2-CZ 2.87Å; D265-R267 IonicContact OD2-NE 3.18Å; D265-R267 PolarHBondContact OD2-NE 2.55Å; D265-R267 IonicContact OD2-NH2 2.71Å; D265-R267 PolarHBondContact OD2-NH2 2.92Å
266	G	34.5	Very low	32.5	Very low	84 Å²	84	148.2 Å²	148.2	87%	0.866	78%	0.783	S	S	*	*			trans	-70	87.4	165.9	0	0	0	0	0	112	G268	G266-G268 PolarHBondContact O-N 3.32Å; G266-G268 VanDerWaalsContact O-N 3.15Å
267	R	36.3	Very low	32.8	Very low	205 Å²	205	148 Å²	148	77%	0.774	81%	0.805	S	S	*	*			trans	-78.9	92.6	177.8	-61.5	-172.1	-161.5	-173.7	7.5	112	D265	D265-R267 HydrophobicContact CB-CG 4.48Å; D265-R267 PolarHBondContact O-N 2.99Å; D265-R267 IonicContact OD2-CZ 2.87Å; D265-R267 IonicContact OD2-NE 3.18Å; D265-R267 PolarHBondContact OD2-NE 2.55Å; D265-R267 IonicContact OD2-NH2 2.71Å; D265-R267 PolarHBondContact OD2-NH2 2.92Å
268	G	31.8	Very low	32.9	Very low	70 Å²	70	143.3 Å²	143.3	72%	0.722	80%	0.8	S	S	*	*			trans	-68	131.9	156.2	0	0	0	0	0	110	G266 I270	G266-G268 PolarHBondContact O-N 3.32Å; G266-G268 VanDerWaalsContact O-N 3.15Å; G268-I270 PolarHBondContact O-N 3.13Å
269	I	34.6	Very low	32.9	Very low	158 Å²	158	144.3 Å²	144.3	81%	0.81	80%	0.802	S	S	*	*			trans	-84.5	95	-177.2	-61.2	-178.7	0	0	0	110
270	I	31.8	Very low	32.9	Very low	159 Å²	159	143.8 Å²	143.8	82%	0.815	80%	0.801	S	S	*	*			trans	-141.1	137.6	162.8	-67.9	-173	0	0	0	109.6	G268	G268-I270 PolarHBondContact O-N 3.13Å
271	A	30.1	Very low	32.8	Very low	79 Å²	79	146.1 Å²	146.1	65%	0.653	81%	0.807	S	S	*	*			trans	74.1	119.2	162.2	0	0	0	0	0	121.1
272	Q	29.2	Very low	32.6	Very low	174 Å²	174	144.6 Å²	144.6	81%	0.813	80%	0.8	S	S	*	*				55.8	114.1	129.5	-59.6	-175.2	-63.7	0	0	120.6
273	V	32.3	Very low	32.7	Very low	153 Å²	153	149.4 Å²	149.4	93%	0.927	80%	0.804	S	S	*	*			trans	-125.1	110	136	177.7	0	0	0	0	108.7
274	E	31.1	Very low	32.9	Very low	166 Å²	166	152.9 Å²	152.9	78%	0.776	81%	0.811	S	S	*	*			trans	-127.6	108.6	164.3	179.1	-173.3	-156.3	0	0	107.8
275	Q	31.7	Very low	33	Very low	135 Å²	135	147.8 Å²	147.8	63%	0.631	81%	0.807	S	S	*	*			trans	167.4	139.5	142.7	-99.8	-179.7	46	0	0	112.3
276	R	33.3	Very low	33	Very low	216 Å²	216	151.2 Å²	151.2	82%	0.815	83%	0.827	S	S	*	*			trans	71	128.5	168.3	-53.2	147.1	-158.3	-139.4	2.7	113.2
277	T	39.8	Very low	32.9	Very low	215 Å²	215	157.3 Å²	157.3	100%	1.319	82%	0.823	S	S	*	*			cis	-123.7	0	18.9	-42.4	0	0	0	0	111.6

Retrieved 277 of 277 residues in 88.4 ms (Link to these results)

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