A0A3Q0KQS2_SCHMA Loading...

Serine/threonine-protein

AlphaFold DB , UniProt , Accession A0A3Q0KQS2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 646 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.8	Very low	38.4	Very low	244 Å²	244	123.8 Å²	123.8	100%	1.202	64%	0.641	S	S	*	*				0	133	0	-71.2	141.9	62	0	0	107.3
2	Q	28.9	Very low	37.5	Very low	197 Å²	197	123.4 Å²	123.4	92%	0.921	65%	0.648	S	S	*	*			trans	-107.3	139.5	163.1	-78.4	178.3	-33.6	0	0	107
3	E	29.3	Very low	37.2	Very low	192 Å²	192	126.5 Å²	126.5	90%	0.897	65%	0.653	S	S	*	*			trans	-74	129.7	-177.4	-65.7	177.1	109.7	0	0	110.2	D5	E3-D5 VanDerWaalsContact C-N 3.29Å; E3-D5 PolarHBondContact O-N 2.83Å
4	D	37.2	Very low	36.2	Very low	77 Å²	77	129.6 Å²	129.6	41%	0.412	67%	0.671	S	S	.	*			trans	-84.5	78.4	-176.4	-156	-0.9	0	0	0	108.6	T6 F67	D4-T6 PolarHBondContact O-N 3.2Å; D4-T6 PolarHBondContact O-OG1 3.49Å; D4-F67 HydrophobicContact CB-CZ 3.95Å; D4-F67 WeakPolarHBondContact OD2-CE2 3.28Å; D4-F67 WeakPolarHBondContact OD2-CZ 3.35Å
5	D	41.3	Very low	35.6	Very low	99 Å²	99	132.3 Å²	132.3	53%	0.529	68%	0.679	S	S	.	*			trans	-60.1	88.3	-167.1	-170.3	22.1	0	0	0	113.1	E3 K7	E3-D5 VanDerWaalsContact C-N 3.29Å; E3-D5 PolarHBondContact O-N 2.83Å; D5-K7 WeakPolarHBondContact OD1-CE 3.47Å
6	T	42.9	Very low	35	Very low	57 Å²	57	132.4 Å²	132.4	35%	0.35	69%	0.689	S	S	.	*			trans	-111.5	105.7	-179.5	46.9	0	0	0	0	112.7	D4 F67	D4-T6 PolarHBondContact O-N 3.2Å; D4-T6 PolarHBondContact O-OG1 3.49Å; T6-F67 HydrophobicContact CG2-CD1 3.75Å; T6-F67 HydrophobicContact CG2-CD2 3.78Å; T6-F67 HydrophobicContact CG2-CE1 3.45Å; T6-F67 VanDerWaalsContact CG2-CE1 3.45Å; T6-F67 HydrophobicContact CG2-CE2 3.48Å; T6-F67 VanDerWaalsContact CG2-CE2 3.48Å; T6-F67 HydrophobicContact CG2-CG 3.9Å; T6-F67 HydrophobicContact CG2-CZ 3.31Å; T6-F67 VanDerWaalsContact OG1-CE1 3.28Å; T6-F67 WeakPolarHBondContact OG1-CE1 3.48Å
7	K	48.5	Very low	34.5	Very low	142 Å²	142	136.5 Å²	136.5	62%	0.617	70%	0.703	S	S	*	*			trans	-107.1	121.7	172.1	-63.6	176.5	-175.2	172.3	0	109.8	D5	D5-K7 WeakPolarHBondContact OD1-CE 3.47Å
8	T	46.8	Very low	33.9	Very low	87 Å²	87	135.2 Å²	135.2	53%	0.534	71%	0.708	S	S	.	*	B	Isolated β-bridge	trans	-78.2	121.4	168.8	-50.2	0	0	0	0	108.3	T10	T8-T10 VanDerWaalsContact C-N 3.26Å; T8-T10 WeakPolarHBondContact CG2-OG1 3.49Å; T8-T10 PolarHBondContact O-N 3.47Å
9	I	50.4	Low	33.5	Very low	50 Å²	50	138.1 Å²	138.1	26%	0.256	72%	0.717	S	S	.	*			trans	-89.3	67.5	-173.1	-49	178.8	0	0	0	109.5	F13	I9-F13 HydrophobicContact CG2-CD2 4.28Å; I9-F13 HydrophobicContact CG2-CE2 4.03Å
10	T	35.6	Very low	33.2	Very low	100 Å²	100	138.3 Å²	138.3	61%	0.613	73%	0.725	S	S	*	*			trans	-80.1	-42.1	-174	-38	0	0	0	0	112.4	T8	T8-T10 VanDerWaalsContact C-N 3.26Å; T8-T10 WeakPolarHBondContact CG2-OG1 3.49Å; T8-T10 PolarHBondContact O-N 3.47Å
11	T	28.6	Very low	32.7	Very low	117 Å²	117	139.1 Å²	139.1	72%	0.718	73%	0.73	S	S	*	*	S	Bend	trans	-146	165.8	-172.1	41.9	0	0	0	0	112.1
12	V	27.3	Very low	32.5	Very low	119 Å²	119	134.2 Å²	134.2	72%	0.721	71%	0.714	S	S	*	*			trans	66.3	110.7	-178	-169.2	0	0	0	0	114.6
13	F	33.6	Very low	32.3	Very low	163 Å²	163	131.8 Å²	131.8	72%	0.715	71%	0.708	S	S	*	*			trans	-173.3	65.1	148	-83.7	-50.9	0	0	0	109.5	I9	I9-F13 HydrophobicContact CG2-CD2 4.28Å; I9-F13 HydrophobicContact CG2-CE2 4.03Å
14	D	24	Very low	32.1	Very low	170 Å²	170	130.2 Å²	130.2	91%	0.909	71%	0.705	S	S	*	*			trans	-106.1	84.8	159.3	-82.4	-46.5	0	0	0	107.5
15	E	27.5	Very low	31.6	Very low	170 Å²	170	132.2 Å²	132.2	79%	0.794	72%	0.724	S	S	*	*			trans	-131.2	134.7	170.9	-72.4	-171.4	149.8	0	0	109.5
16	T	25	Very low	30.7	Very low	135 Å²	135	135.4 Å²	135.4	83%	0.828	74%	0.736	S	S	*	*			trans	-87.2	121.8	-177.7	49.3	0	0	0	0	110.6	S18	T16-S18 PolarHBondContact O-N 3.28Å
17	E	27	Very low	29.9	Very low	201 Å²	201	140 Å²	140	94%	0.939	75%	0.753	S	S	*	*			trans	-62.9	117.3	173.1	-69.6	179.7	161.1	0	0	110.6
18	S	24.3	Very low	28.8	Very low	113 Å²	113	142.3 Å²	142.3	79%	0.79	76%	0.763	S	S	*	*			trans	-108.6	143.5	165	56.9	0	0	0	0	109.7	T16	T16-S18 PolarHBondContact O-N 3.28Å
19	H	25.1	Very low	27.7	Very low	191 Å²	191	144 Å²	144	88%	0.884	77%	0.773	S	S	*	*			trans	-82.9	136.3	-170.8	-61.6	-74	0	0	0	113.6
20	T	27.8	Very low	26.6	Very low	142 Å²	142	150.8 Å²	150.8	87%	0.871	80%	0.804	S	S	*	*			trans	-153.2	147.3	137.9	31.5	0	0	0	0	110.8
21	N	23.3	Very low	26.1	Very low	155 Å²	155	153.8 Å²	153.8	83%	0.829	82%	0.816	S	S	*	*			trans	-90.4	157	171.5	-61.3	-33	0	0	0	110.4
22	T	29	Very low	25.9	Very low	142 Å²	142	152 Å²	152	87%	0.871	82%	0.821	S	S	*	*				-176	132	119.1	30.9	0	0	0	0	110.7
23	D	23.3	Very low	25.7	Very low	146 Å²	146	155 Å²	155	78%	0.781	83%	0.827	S	S	*	*			trans	-82	156.4	163	-56.2	-79.1	0	0	0	111.2
24	N	25	Very low	25.4	Very low	158 Å²	158	156.5 Å²	156.5	85%	0.845	83%	0.833	S	S	*	*				177.7	156	123.4	-98.9	-35	0	0	0	117
25	C	26.9	Very low	25.6	Very low	119 Å²	119	157.4 Å²	157.4	80%	0.804	83%	0.829	S	S	*	*			trans	78.7	155.8	154.9	-68.7	0	0	0	0	121.4
26	E	22.6	Very low	25.4	Very low	167 Å²	167	156.1 Å²	156.1	78%	0.78	83%	0.827	S	S	*	*			trans	-132.5	166.3	-159.2	-54.7	157.4	105	0	0	110.4
27	H	26.2	Very low	25.5	Very low	152 Å²	152	155.8 Å²	155.8	70%	0.704	82%	0.82	S	S	*	*				165.9	122.1	119.8	-101	-94.2	0	0	0	115.5
28	F	25.5	Very low	25.5	Very low	192 Å²	192	152.7 Å²	152.7	84%	0.842	81%	0.81	S	S	*	*			trans	66.6	168.6	133.7	-86.2	-113.5	0	0	0	123.4
29	V	23.8	Very low	25.6	Very low	122 Å²	122	153 Å²	153	74%	0.739	81%	0.812	S	S	*	*			trans	-145.5	144.9	-163.9	170.9	0	0	0	0	109.5
30	Q	27.4	Very low	25.9	Very low	192 Å²	192	147.7 Å²	147.7	90%	0.897	81%	0.809	S	S	*	*			trans	-162.5	161.5	150.7	-115.4	168.1	20.7	0	0	114.1
31	N	24.2	Very low	25.8	Very low	163 Å²	163	149.5 Å²	149.5	87%	0.872	81%	0.813	S	S	*	*			trans	-103.8	167.1	-176.5	-69.2	-23.6	0	0	0	112.5
32	G	26	Very low	26.1	Very low	79 Å²	79	145.5 Å²	145.5	81%	0.814	81%	0.809	S	S	*	*			trans	-159	136	165.8	0	0	0	0	0	113.4
33	E	23.3	Very low	25.9	Very low	182 Å²	182	146.5 Å²	146.5	85%	0.85	81%	0.807	S	S	*	*			trans	-113	172.3	-177.7	-55.7	177.7	120.8	0	0	113.1
34	K	26.2	Very low	26.2	Very low	196 Å²	196	149.3 Å²	149.3	85%	0.852	81%	0.813	S	S	*	*			trans	129.9	148.6	160.8	-72.2	153.9	-169.7	167.4	0	111.1
35	K	28.2	Very low	26.1	Very low	189 Å²	189	148.7 Å²	148.7	82%	0.822	81%	0.808	S	S	*	*			cis	-155.9	177.3	-0.3	-130.8	179.1	178.8	-167.6	0	110.4
36	L	24.4	Very low	26	Very low	142 Å²	142	149.8 Å²	149.8	74%	0.743	81%	0.805	S	S	*	*			trans	-76	177.2	168.8	-56.6	81	0	0	0	110.6
37	D	26.1	Very low	26.2	Very low	129 Å²	129	147.3 Å²	147.3	69%	0.69	80%	0.801	S	S	*	*			cis	-169	173.9	36.7	-122.1	-40.2	0	0	0	116
38	N	28	Very low	26.1	Very low	136 Å²	136	146.8 Å²	146.8	73%	0.727	81%	0.808	S	S	*	*			trans	80.2	111.8	150.3	-81.8	-25.8	0	0	0	125.8
39	S	26.1	Very low	26.1	Very low	118 Å²	118	144.9 Å²	144.9	83%	0.825	80%	0.802	S	S	*	*				71.2	136.9	122.7	72.4	0	0	0	0	123.8
40	G	30.5	Very low	26.4	Very low	80 Å²	80	144.2 Å²	144.2	83%	0.825	80%	0.8	S	S	*	*			trans	159.8	106.9	161.4	0	0	0	0	0	114.3
41	D	26.3	Very low	26.3	Very low	180 Å²	180	142.5 Å²	142.5	96%	0.963	80%	0.796	S	S	*	*			trans	-76.4	152.8	176.9	-89.2	-56.3	0	0	0	113.7
42	G	29.9	Very low	26.5	Very low	72 Å²	72	139.1 Å²	139.1	74%	0.742	79%	0.79	S	S	*	*			trans	-179.2	94.7	174.5	0	0	0	0	0	115.6
43	I	23.4	Very low	26.6	Very low	163 Å²	163	142 Å²	142	84%	0.836	79%	0.786	S	S	*	*			trans	-73.1	130.3	175.4	-60.2	173	0	0	0	110.8
44	K	31.1	Very low	27	Very low	205 Å²	205	138.4 Å²	138.4	89%	0.891	77%	0.772	S	S	*	*			trans	-135.8	143.2	162	-85.5	-172.9	174.6	177	0	111.4
45	L	23	Very low	27.4	Very low	144 Å²	144	137.4 Å²	137.4	75%	0.754	77%	0.768	S	S	*	*			trans	-89	149.8	-172.7	-83.2	96.4	0	0	0	114
46	I	24.4	Very low	27.6	Very low	143 Å²	143	136.4 Å²	136.4	73%	0.733	77%	0.766	S	S	*	*			trans	58.6	112.9	149.5	-60.1	158.7	0	0	0	117.8
47	T	25.6	Very low	28.3	Very low	114 Å²	114	134.1 Å²	134.1	70%	0.699	76%	0.757	S	S	*	*				-156.1	124.5	120.4	-71.8	0	0	0	0	108.5	Q49	T47-Q49 PolarHBondContact O-N 2.97Å
48	V	24.1	Very low	28.6	Very low	141 Å²	141	135.2 Å²	135.2	86%	0.855	76%	0.758	S	S	*	*			trans	-80	98.7	174.1	-176.6	0	0	0	0	108.6
49	Q	26.7	Very low	29	Very low	152 Å²	152	136 Å²	136	71%	0.71	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-70.8	137.9	171.7	-74.2	-79.1	-25.7	0	0	110.1	T47	T47-Q49 PolarHBondContact O-N 2.97Å
50	P	28.4	Very low	29.7	Very low	108 Å²	108	139.1 Å²	139.1	70%	0.701	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-66.4	151.1	175.3	28.7	-34.6	0	0	0	111.3	A52	P50-A52 PolarHBondContact O-N 3.33Å; P50-A52 VanDerWaalsContact O-N 3.15Å
51	I	27.2	Very low	30.3	Very low	156 Å²	156	143.6 Å²	143.6	80%	0.8	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-55	118.8	-174.1	-61	170.6	0	0	0	110.6	I53	I51-I53 VanDerWaalsContact C-N 3.3Å; I51-I53 HydrophobicContact CG2-CG1 4.13Å; I51-I53 PolarHBondContact O-N 3.48Å
52	A	27.7	Very low	31	Very low	92 Å²	92	141.7 Å²	141.7	76%	0.76	74%	0.738	S	S	*	*			trans	-76.9	73.3	-176.1	0	0	0	0	0	112.5	P50 N54	P50-A52 PolarHBondContact O-N 3.33Å; P50-A52 VanDerWaalsContact O-N 3.15Å; A52-N54 PolarHBondContact O-N 3.39Å
53	I	28.7	Very low	31.7	Very low	141 Å²	141	143 Å²	143	72%	0.723	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	109.7	179.7	-60.5	174.9	0	0	0	110.8	I51	I51-I53 VanDerWaalsContact C-N 3.3Å; I51-I53 HydrophobicContact CG2-CG1 4.13Å; I51-I53 PolarHBondContact O-N 3.48Å
54	N	31.1	Very low	33	Very low	106 Å²	106	139.5 Å²	139.5	57%	0.567	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	53.5	54.3	159.1	-79.2	-35	0	0	0	119.3	A52 V57	A52-N54 PolarHBondContact O-N 3.39Å; N54-V57 HydrophobicContact CB-CB 4.3Å; N54-V57 HydrophobicContact CB-CG2 3.86Å; N54-V57 WeakPolarHBondContact OD1-CG2 3.47Å
55	K	34	Very low	33.9	Very low	174 Å²	174	133.2 Å²	133.2	76%	0.757	69%	0.687	S	S	*	*	S	Bend	trans	-68.4	-34.6	159.4	-74.9	-173.4	176.1	178.3	0	113.2	V57 Q58	K55-V57 VanDerWaalsContact C-N 3.28Å; K55-V57 PolarHBondContact O-N 2.79Å; K55-Q58 PolarHBondContact O-N 3.01Å
56	H	33.3	Very low	35.3	Very low	168 Å²	168	126.7 Å²	126.7	78%	0.778	65%	0.653	S	S	*	*	H	α-helix	trans	-66.5	-20.6	-179.7	-82.4	-40.3	0	0	0	115.4	Q58	H56-Q58 VanDerWaalsContact C-N 3.33Å
57	V	38.2	Very low	36.6	Very low	94 Å²	94	123.1 Å²	123.1	57%	0.57	63%	0.632	S	S	*	*	H	α-helix	trans	-70.9	-30.1	175.8	177.8	0	0	0	0	111.6	N54 K55	N54-V57 HydrophobicContact CB-CB 4.3Å; N54-V57 HydrophobicContact CB-CG2 3.86Å; N54-V57 WeakPolarHBondContact OD1-CG2 3.47Å; K55-V57 VanDerWaalsContact C-N 3.28Å; K55-V57 PolarHBondContact O-N 2.79Å
58	Q	33.7	Very low	38.8	Very low	152 Å²	152	126.7 Å²	126.7	71%	0.71	64%	0.638	S	S	*	*	H	α-helix	trans	-78.8	-36.8	-178.7	-61.7	-167.7	5.7	0	0	112.7	K55 H56 K60 K61	K55-Q58 PolarHBondContact O-N 3.01Å; H56-Q58 VanDerWaalsContact C-N 3.33Å; Q58-K60 PolarHBondContact O-N 2.87Å; Q58-K61 PolarHBondContact O-N 3.34Å
59	Q	35.7	Very low	41.8	Very low	152 Å²	152	123 Å²	123	71%	0.71	61%	0.61	S	S	*	*	H	α-helix	trans	-55.4	-39.4	179.6	-138.6	82.7	28.2	0	0	112.3	K61 H62	Q59-K61 VanDerWaalsContact C-N 3.33Å; Q59-K61 PolarHBondContact O-N 3.02Å; Q59-H62 PolarHBondContact O-N 2.99Å
60	K	40.6	Very low	45	Very low	184 Å²	184	116 Å²	116	80%	0.8	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-21.9	-174.6	-147.9	172.2	-172.5	176.9	0	113.7	Q58 H62	Q58-K60 PolarHBondContact O-N 2.87Å; K60-H62 PolarHBondContact O-N 2.82Å
61	K	42.7	Very low	48.1	Very low	174 Å²	174	115.2 Å²	115.2	76%	0.757	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-18.2	175.4	-102.4	-172.6	173.9	-173.4	0	113.6	Q58 Q59	Q58-K61 PolarHBondContact O-N 3.34Å; Q59-K61 VanDerWaalsContact C-N 3.33Å; Q59-K61 PolarHBondContact O-N 3.02Å
62	H	40.5	Very low	51.2	Low	141 Å²	141	111 Å²	111	65%	0.653	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-23.8	-165.3	-132.9	-77.4	0	0	0	114.6	Q59 K60	Q59-H62 PolarHBondContact O-N 2.99Å; K60-H62 PolarHBondContact O-N 2.82Å
63	D	46	Very low	54.4	Low	100 Å²	100	110.3 Å²	110.3	54%	0.535	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-26.3	177.5	-133	-33.9	0	0	0	112.5	L65 K138 K139	D63-L65 PolarHBondContact O-N 3.24Å; D63-K138 PolarHBondContact O-NZ 2.84Å; D63-K139 IonicContact OD1-NZ 2.72Å; D63-K139 PolarHBondContact OD1-NZ 3.37Å; D63-K139 IonicContact OD2-NZ 2.71Å; D63-K139 PolarHBondContact OD2-NZ 3.28Å
64	D	50.7	Low	57.5	Low	88 Å²	88	106.2 Å²	106.2	47%	0.471	51%	0.506	S	S	.	.	S	Bend	trans	-75.5	-6.7	176.3	-95.6	-42.8	0	0	0	114	L66 K72	D64-L66 PolarHBondContact O-N 3.49Å; D64-K72 IonicContact OD1-NZ 2.67Å; D64-K72 PolarHBondContact OD1-NZ 3.32Å
65	L	49	Very low	60.4	Low	73 Å²	73	106.2 Å²	106.2	38%	0.382	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	108	162.7	-73.6	170.8	0	0	0	109	D63 F67 K138	D63-L65 PolarHBondContact O-N 3.24Å; L65-F67 PolarHBondContact O-N 3.42Å; L65-K138 PolarHBondContact O-NZ 3.02Å
66	L	53.3	Low	63	Low	7 Å²	7	101.3 Å²	101.3	4%	0.037	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	60.8	173	-150.7	75.4	0	0	0	108.7	D64 Y70 I98 F136 K138	D64-L66 PolarHBondContact O-N 3.49Å; L66-Y70 WeakPolarHBondContact CA-O 3.45Å; L66-Y70 VanDerWaalsContact CB-O 3.25Å; L66-Y70 WeakPolarHBondContact CB-O 3.42Å; L66-Y70 PolarHBondContact N-O 3.11Å; L66-Y70 VanDerWaalsContact N-O 3.1Å; L66-Y70 PolarHBondContact O-N 3.25Å; L66-I98 HydrophobicContact CD2-CD1 3.59Å; L66-I98 HydrophobicContact CD2-CG2 4.31Å; L66-F136 HydrophobicContact CD2-CZ 3.97Å; L66-F136 HydrophobicContact CG-CE2 4.43Å; L66-F136 HydrophobicContact CG-CZ 3.96Å; L66-K138 HydrophobicContact CD1-CD 4.23Å
67	F	51.9	Low	65.2	Low	69 Å²	69	94.6 Å²	94.6	30%	0.303	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	65.8	172.8	-100.7	-88.5	0	0	0	117.6	D4 T6 L65 K69 K138	D4-F67 HydrophobicContact CB-CZ 3.95Å; D4-F67 WeakPolarHBondContact OD2-CE2 3.28Å; D4-F67 WeakPolarHBondContact OD2-CZ 3.35Å; T6-F67 HydrophobicContact CG2-CD1 3.75Å; T6-F67 HydrophobicContact CG2-CD2 3.78Å; T6-F67 HydrophobicContact CG2-CE1 3.45Å; T6-F67 VanDerWaalsContact CG2-CE1 3.45Å; T6-F67 HydrophobicContact CG2-CE2 3.48Å; T6-F67 VanDerWaalsContact CG2-CE2 3.48Å; T6-F67 HydrophobicContact CG2-CG 3.9Å; T6-F67 HydrophobicContact CG2-CZ 3.31Å; T6-F67 VanDerWaalsContact OG1-CE1 3.28Å; T6-F67 WeakPolarHBondContact OG1-CE1 3.48Å; L65-F67 PolarHBondContact O-N 3.42Å; F67-K69 PolarHBondContact O-N 3.07Å; F67-K138 HydrophobicContact CD2-CD 3.8Å; F67-K138 HydrophobicContact CD2-CG 3.95Å; F67-K138 HydrophobicContact CE2-CD 4.14Å; F67-K138 HydrophobicContact CE2-CG 3.99Å
68	K	70.4	Confident	67.1	Low	189 Å²	189	96.3 Å²	96.3	82%	0.822	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	-16.1	173.2	-69.7	-176.1	177.3	177.8	0	117.1
69	K	88.5	Confident	68.8	Low	62 Å²	62	91.3 Å²	91.3	27%	0.27	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-35.2	-178.7	-171.2	-176.1	178.3	-161.1	0	112	F67 D89 I90 E134	F67-K69 PolarHBondContact O-N 3.07Å; K69-D89 WeakPolarHBondContact CE-OD2 3.34Å; K69-D89 CarbonylContact O-C 3.57Å; K69-D89 WeakPolarHBondContact O-CA 3.25Å; K69-I90 WeakPolarHBondContact O-CB 3.45Å; K69-I90 WeakPolarHBondContact O-CG1 3.48Å; K69-I90 PolarHBondContact O-N 3.26Å; K69-E134 IonicContact NZ-OE1 2.76Å; K69-E134 PolarHBondContact NZ-OE1 3.01Å; K69-E134 IonicContact NZ-OE2 3.8Å; K69-E134 PolarHBondContact NZ-OE2 3.26Å
70	Y	93.3	Very high	70.1	Confident	5 Å²	5	86.9 Å²	86.9	2%	0.02	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126.1	-178	-65.2	-60.7	0	0	0	113.8	L66 R88 D89 V96 I98 E134 F136 V145	L66-Y70 WeakPolarHBondContact CA-O 3.45Å; L66-Y70 VanDerWaalsContact CB-O 3.25Å; L66-Y70 WeakPolarHBondContact CB-O 3.42Å; L66-Y70 PolarHBondContact N-O 3.11Å; L66-Y70 VanDerWaalsContact N-O 3.1Å; L66-Y70 PolarHBondContact O-N 3.25Å; Y70-R88 WeakPolarHBondContact CA-O 3.24Å; Y70-D89 HydrophobicContact CD1-CB 4.2Å; Y70-D89 HydrophobicContact CE1-CB 3.72Å; Y70-D89 WeakPolarHBondContact CE1-OD2 3.39Å; Y70-D89 PolarHBondContact OH-OD2 2.91Å; Y70-V96 HydrophobicContact CD1-CG2 3.67Å; Y70-V96 HydrophobicContact CE1-CB 4.49Å; Y70-V96 HydrophobicContact CE1-CG1 4.17Å; Y70-V96 HydrophobicContact CE1-CG2 3.57Å; Y70-I98 HydrophobicContact CD1-CD1 4.28Å; Y70-I98 HydrophobicContact CD2-CD1 3.82Å; Y70-I98 HydrophobicContact CE2-CD1 4.34Å; Y70-I98 HydrophobicContact CG-CD1 3.81Å; Y70-E134 VanDerWaalsContact CE2-OE1 3.29Å; Y70-E134 WeakPolarHBondContact CE2-OE1 3.44Å; Y70-E134 PolarHBondContact OH-OE1 3.1Å; Y70-F136 HydrophobicContact CD2-CE1 4.2Å; Y70-F136 HydrophobicContact CE2-CE1 4.42Å; Y70-V145 HydrophobicContact CE2-CG1 4.24Å; Y70-V145 HydrophobicContact CE2-CG2 4.05Å
71	E	92.8	Very high	71.4	Confident	93 Å²	93	81 Å²	81	44%	0.435	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	126.2	164.4	169.4	-175.3	-121.9	0	0	108.2	C87 R88 I90	E71-C87 CarbonylContact O-C 3.47Å; E71-C87 WeakPolarHBondContact O-CA 3.29Å; E71-C87 WeakPolarHBondContact O-CB 3.45Å; E71-R88 HydrophobicContact CB-CB 4.32Å; E71-R88 PolarHBondContact N-O 3.02Å; E71-R88 PolarHBondContact O-N 3.36Å; E71-R88 IonicContact OE2-NE 2.65Å; E71-R88 PolarHBondContact OE2-NE 3.24Å; E71-I90 HydrophobicContact CB-CD1 4.26Å; E71-I90 HydrophobicContact CB-CG1 4.01Å
72	K	92.8	Very high	73	Confident	67 Å²	67	73 Å²	73	29%	0.291	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	127.1	173	-174	-166	-68.6	159.7	0	109.7	D64 F85	D64-K72 IonicContact OD1-NZ 2.67Å; D64-K72 PolarHBondContact OD1-NZ 3.32Å; K72-F85 HydrophobicContact CD-CD1 3.63Å; K72-F85 HydrophobicContact CD-CE1 3.89Å; K72-F85 HydrophobicContact CD-CG 4.21Å; K72-F85 HydrophobicContact CG-CB 4.26Å; K72-F85 HydrophobicContact CG-CD1 3.98Å; K72-F85 HydrophobicContact CG-CG 4.28Å
73	I	94.3	Very high	75.3	Confident	78 Å²	78	67 Å²	67	40%	0.4	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	-58.8	177.4	-56.5	179.9	0	0	0	110.7	K86 R88 L95	I73-K86 WeakPolarHBondContact CA-O 3.44Å; I73-K86 HydrophobicContact CB-CG 4.48Å; I73-K86 WeakPolarHBondContact CB-O 3.22Å; I73-K86 HydrophobicContact CD1-CG 4.35Å; I73-K86 PolarHBondContact N-O 3.36Å; I73-R88 HydrophobicContact CD1-CB 4.21Å; I73-L95 HydrophobicContact CD1-CD2 3.58Å
74	C	94	Very high	77.4	Confident	55 Å²	55	64.1 Å²	64.1	37%	0.372	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	162.5	-176.9	60.7	0	0	0	0	112.6	F85 K86	C74-F85 CarbonylContact O-C 3.56Å; C74-F85 VanDerWaalsContact O-CA 3.28Å; C74-F85 WeakPolarHBondContact O-CA 3.29Å; C74-K86 PolarHBondContact N-O 3.08Å; C74-K86 PolarHBondContact O-N 2.71Å
75	K	92.4	Very high	79.4	Confident	106 Å²	106	61.3 Å²	61.3	46%	0.461	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	130.4	164.8	176.5	172.9	170.1	174	0	108.4	E78 V83 F85	K75-E78 IonicContact NZ-OE1 3.59Å; K75-E78 PolarHBondContact NZ-OE1 2.75Å; K75-E78 IonicContact NZ-OE2 3.23Å; K75-E78 PolarHBondContact NZ-OE2 3.02Å; K75-V83 HydrophobicContact CD-CG1 3.72Å; K75-V83 HydrophobicContact CG-CG1 3.79Å; K75-F85 HydrophobicContact CB-CD1 4.13Å; K75-F85 HydrophobicContact CB-CE1 4.1Å
76	I	88.4	Confident	81.6	Confident	71 Å²	71	59.8 Å²	59.8	36%	0.364	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	-18.9	178.4	59.4	176.9	0	0	0	113.1	V84 K86 A97 F148	I76-V84 HydrophobicContact CD1-CG1 3.85Å; I76-V84 HydrophobicContact CG1-CB 4.05Å; I76-V84 HydrophobicContact CG1-CG1 3.78Å; I76-V84 WeakPolarHBondContact CG1-O 3.44Å; I76-V84 PolarHBondContact N-O 3.41Å; I76-K86 HydrophobicContact CD1-CB 4.36Å; I76-K86 HydrophobicContact CG2-CB 3.65Å; I76-A97 HydrophobicContact CD1-CB 4.23Å; I76-F148 HydrophobicContact CD1-CD2 4.3Å; I76-F148 HydrophobicContact CD1-CE2 3.79Å
77	G	80.7	Confident	83.6	Confident	26 Å²	26	59.5 Å²	59.5	27%	0.268	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	168.3	177.3	0	0	0	0	0	112.8	V84	G77-V84 PolarHBondContact N-O 2.73Å; G77-V84 PolarHBondContact O-N 3.32Å
78	E	78.2	Confident	85.7	Confident	131 Å²	131	60.9 Å²	60.9	61%	0.612	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.1	140.2	173.2	-174.1	158.3	-106.5	0	0	107.3	K75 V83	K75-E78 IonicContact NZ-OE1 3.59Å; K75-E78 PolarHBondContact NZ-OE1 2.75Å; K75-E78 IonicContact NZ-OE2 3.23Å; K75-E78 PolarHBondContact NZ-OE2 3.02Å; E78-V83 HydrophobicContact CG-CG2 4.33Å; E78-V83 WeakPolarHBondContact OE1-CG2 3.47Å
79	G	68.8	Low	86.9	Confident	46 Å²	46	52.5 Å²	52.5	47%	0.474	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	177.4	178.3	0	0	0	0	0	110.3	Y81 G82	G79-Y81 PolarHBondContact O-N 2.87Å; G79-G82 PolarHBondContact N-O 3.08Å; G79-G82 PolarHBondContact O-N 3.31Å; G79-G82 VanDerWaalsContact O-N 3.07Å
80	A	62.5	Low	87.1	Confident	59 Å²	59	53.7 Å²	53.7	49%	0.488	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-20.3	-167.6	0	0	0	0	0	116.4
81	Y	67.8	Low	87.1	Confident	62 Å²	62	62.4 Å²	62.4	24%	0.243	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-7.1	-176.6	-51.9	-65.7	0	0	0	114.8	G79 F101 T102 I113	G79-Y81 PolarHBondContact O-N 2.87Å; Y81-F101 WeakPolarHBondContact O-CA 3.47Å; Y81-F101 WeakPolarHBondContact O-CD1 3.39Å; Y81-T102 PolarHBondContact O-N 3.29Å; Y81-I113 HydrophobicContact CE1-CD1 4.04Å
82	G	77.8	Confident	87.2	Confident	5 Å²	5	61.4 Å²	61.4	5%	0.052	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.9	168.4	-168.1	0	0	0	0	0	117	G79 Q100	G79-G82 PolarHBondContact N-O 3.08Å; G79-G82 PolarHBondContact O-N 3.31Å; G79-G82 VanDerWaalsContact O-N 3.07Å; G82-Q100 CarbonylContact C-O 3.53Å; G82-Q100 WeakPolarHBondContact CA-O 3.32Å
83	V	86.9	Confident	87.2	Confident	16 Å²	16	60 Å²	60	10%	0.097	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	133.5	175.5	-173.1	0	0	0	0	109.1	K75 E78 F85 Q100 T102	K75-V83 HydrophobicContact CD-CG1 3.72Å; K75-V83 HydrophobicContact CG-CG1 3.79Å; E78-V83 HydrophobicContact CG-CG2 4.33Å; E78-V83 WeakPolarHBondContact OE1-CG2 3.47Å; V83-F85 HydrophobicContact CB-CE2 3.83Å; V83-F85 HydrophobicContact CB-CZ 4.03Å; V83-F85 HydrophobicContact CG1-CD2 4.27Å; V83-F85 HydrophobicContact CG1-CE1 3.96Å; V83-F85 HydrophobicContact CG1-CE2 3.65Å; V83-F85 HydrophobicContact CG1-CZ 3.48Å; V83-F85 VanDerWaalsContact CG1-CZ 3.48Å; V83-Q100 PolarHBondContact N-O 3.35Å; V83-Q100 PolarHBondContact O-N 2.94Å; V83-T102 HydrophobicContact CG2-CG2 4.06Å
84	V	90.7	Very high	87.3	Confident	38 Å²	38	61.3 Å²	61.3	23%	0.23	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	124.1	177	-166.2	0	0	0	0	109.5	I76 G77 A97 I98 K99	I76-V84 HydrophobicContact CD1-CG1 3.85Å; I76-V84 HydrophobicContact CG1-CB 4.05Å; I76-V84 HydrophobicContact CG1-CG1 3.78Å; I76-V84 WeakPolarHBondContact CG1-O 3.44Å; I76-V84 PolarHBondContact N-O 3.41Å; G77-V84 PolarHBondContact N-O 2.73Å; G77-V84 PolarHBondContact O-N 3.32Å; V84-A97 HydrophobicContact CG1-CB 4.4Å; V84-I98 WeakPolarHBondContact CA-O 3.4Å; V84-K99 HydrophobicContact CG2-CB 4.34Å; V84-K99 HydrophobicContact CG2-CG 4.29Å
85	F	93.5	Very high	87.4	Confident	29 Å²	29	61.1 Å²	61.1	13%	0.127	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	142.7	176.9	-61.7	-81.8	0	0	0	111.3	K72 C74 K75 V83 A97 I98 Q100	K72-F85 HydrophobicContact CD-CD1 3.63Å; K72-F85 HydrophobicContact CD-CE1 3.89Å; K72-F85 HydrophobicContact CD-CG 4.21Å; K72-F85 HydrophobicContact CG-CB 4.26Å; K72-F85 HydrophobicContact CG-CD1 3.98Å; K72-F85 HydrophobicContact CG-CG 4.28Å; C74-F85 CarbonylContact O-C 3.56Å; C74-F85 VanDerWaalsContact O-CA 3.28Å; C74-F85 WeakPolarHBondContact O-CA 3.29Å; K75-F85 HydrophobicContact CB-CD1 4.13Å; K75-F85 HydrophobicContact CB-CE1 4.1Å; V83-F85 HydrophobicContact CB-CE2 3.83Å; V83-F85 HydrophobicContact CB-CZ 4.03Å; V83-F85 HydrophobicContact CG1-CD2 4.27Å; V83-F85 HydrophobicContact CG1-CE1 3.96Å; V83-F85 HydrophobicContact CG1-CE2 3.65Å; V83-F85 HydrophobicContact CG1-CZ 3.48Å; V83-F85 VanDerWaalsContact CG1-CZ 3.48Å; F85-A97 CarbonylContact O-C 3.59Å; F85-A97 WeakPolarHBondContact O-CA 3.36Å; F85-I98 PolarHBondContact N-O 2.8Å; F85-I98 PolarHBondContact O-N 3.23Å; F85-Q100 HydrophobicContact CD2-CB 4.5Å; F85-Q100 HydrophobicContact CE2-CB 4.3Å
86	K	95	Very high	87.5	Confident	42 Å²	42	56.1 Å²	56.1	18%	0.183	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	126.4	159.6	-179	177.3	-171.3	163	0	108.1	I73 C74 I76 F148	I73-K86 WeakPolarHBondContact CA-O 3.44Å; I73-K86 HydrophobicContact CB-CG 4.48Å; I73-K86 WeakPolarHBondContact CB-O 3.22Å; I73-K86 HydrophobicContact CD1-CG 4.35Å; I73-K86 PolarHBondContact N-O 3.36Å; C74-K86 PolarHBondContact N-O 3.08Å; C74-K86 PolarHBondContact O-N 2.71Å; I76-K86 HydrophobicContact CD1-CB 4.36Å; I76-K86 HydrophobicContact CG2-CB 3.65Å; K86-F148 HydrophobicContact CB-CD2 4.4Å; K86-F148 HydrophobicContact CB-CE2 3.99Å; K86-F148 HydrophobicContact CD-CD2 4.36Å; K86-F148 HydrophobicContact CD-CE1 4Å; K86-F148 HydrophobicContact CD-CE2 3.73Å; K86-F148 HydrophobicContact CD-CZ 3.54Å; K86-F148 VanDerWaalsContact CE-CE1 3.42Å; K86-F148 HydrophobicContact CG-CD2 3.97Å; K86-F148 HydrophobicContact CG-CE2 3.72Å; K86-F148 HydrophobicContact CG-CZ 4.06Å
87	C	95.7	Very high	87.9	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	165.5	178.5	-60.2	0	0	0	0	110.5	E71 L95 V96 I98	E71-C87 CarbonylContact O-C 3.47Å; E71-C87 WeakPolarHBondContact O-CA 3.29Å; E71-C87 WeakPolarHBondContact O-CB 3.45Å; C87-L95 WeakPolarHBondContact O-CA 3.43Å; C87-V96 HydrophobicContact CB-CG2 3.88Å; C87-V96 PolarHBondContact N-O 3.43Å; C87-V96 PolarHBondContact O-N 2.97Å; C87-I98 HydrophobicContact CB-CD1 3.87Å; C87-I98 HydrophobicContact CB-CG1 4.31Å
88	R	95.5	Very high	88.5	Confident	98 Å²	98	52.2 Å²	52.2	37%	0.37	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	134	172	-173.4	-165.6	-61.8	-79.8	8	109.9	Y70 E71 I73 I90 G93 Q94 L95	Y70-R88 WeakPolarHBondContact CA-O 3.24Å; E71-R88 HydrophobicContact CB-CB 4.32Å; E71-R88 PolarHBondContact N-O 3.02Å; E71-R88 PolarHBondContact O-N 3.36Å; E71-R88 IonicContact OE2-NE 2.65Å; E71-R88 PolarHBondContact OE2-NE 3.24Å; I73-R88 HydrophobicContact CD1-CB 4.21Å; R88-I90 PolarHBondContact O-N 2.7Å; R88-G93 WeakPolarHBondContact CG-O 3.36Å; R88-G93 PolarHBondContact NH1-O 2.93Å; R88-G93 VanDerWaalsContact NH1-O 3.11Å; R88-Q94 CarbonylContact C-O 3.35Å; R88-Q94 WeakPolarHBondContact CA-O 3.42Å; R88-L95 HydrophobicContact CB-CD2 4.42Å
89	D	95.1	Very high	89	Confident	13 Å²	13	46.9 Å²	46.9	7%	0.07	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	118.6	163.6	-165	-61.5	0	0	0	109.5	K69 Y70 K91 S92 G93 Q94	K69-D89 WeakPolarHBondContact CE-OD2 3.34Å; K69-D89 CarbonylContact O-C 3.57Å; K69-D89 WeakPolarHBondContact O-CA 3.25Å; Y70-D89 HydrophobicContact CD1-CB 4.2Å; Y70-D89 HydrophobicContact CE1-CB 3.72Å; Y70-D89 WeakPolarHBondContact CE1-OD2 3.39Å; Y70-D89 PolarHBondContact OH-OD2 2.91Å; D89-K91 PolarHBondContact O-N 3.44Å; D89-K91 WeakPolarHBondContact OD1-CA 3.35Å; D89-K91 WeakPolarHBondContact OD1-CB 3.45Å; D89-K91 PolarHBondContact OD1-N 3.21Å; D89-S92 WeakPolarHBondContact CB-OG 3.14Å; D89-S92 PolarHBondContact OD1-N 3.43Å; D89-S92 VanDerWaalsContact OD1-N 3.11Å; D89-G93 WeakPolarHBondContact O-CA 3.31Å; D89-G93 PolarHBondContact O-N 3.1Å; D89-Q94 HydrophobicContact CB-CB 4.46Å; D89-Q94 PolarHBondContact N-O 2.92Å
90	I	93.8	Very high	89.9	Confident	87 Å²	87	46.1 Å²	46.1	45%	0.446	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-24.4	-175.9	-63.9	169.2	0	0	0	111.2	K69 E71 R88	K69-I90 WeakPolarHBondContact O-CB 3.45Å; K69-I90 WeakPolarHBondContact O-CG1 3.48Å; K69-I90 PolarHBondContact O-N 3.26Å; E71-I90 HydrophobicContact CB-CD1 4.26Å; E71-I90 HydrophobicContact CB-CG1 4.01Å; R88-I90 PolarHBondContact O-N 2.7Å
91	K	92.2	Very high	90.9	Very high	189 Å²	189	43.4 Å²	43.4	82%	0.822	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-43.8	179.1	-66.9	-171.6	174.9	-172	0	112.8	D89	D89-K91 PolarHBondContact O-N 3.44Å; D89-K91 WeakPolarHBondContact OD1-CA 3.35Å; D89-K91 WeakPolarHBondContact OD1-CB 3.45Å; D89-K91 PolarHBondContact OD1-N 3.21Å
92	S	94.3	Very high	91.3	Very high	72 Å²	72	43.7 Å²	43.7	50%	0.503	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-8.6	-176.8	69	0	0	0	0	114.4	D89 Q94	D89-S92 WeakPolarHBondContact CB-OG 3.14Å; D89-S92 PolarHBondContact OD1-N 3.43Å; D89-S92 VanDerWaalsContact OD1-N 3.11Å; S92-Q94 PolarHBondContact O-N 3.49Å; S92-Q94 VanDerWaalsContact O-N 3.12Å; S92-Q94 VanDerWaalsContact OG-CB 3.26Å; S92-Q94 WeakPolarHBondContact OG-CB 3.35Å; S92-Q94 PolarHBondContact OG-N 2.85Å
93	G	94	Very high	91	Very high	36 Å²	36	45 Å²	45	37%	0.371	24%	0.239	S	C	.	.			trans	70.8	-5.1	-172.8	0	0	0	0	0	114.5	R88 D89	R88-G93 WeakPolarHBondContact CG-O 3.36Å; R88-G93 PolarHBondContact NH1-O 2.93Å; R88-G93 VanDerWaalsContact NH1-O 3.11Å; D89-G93 WeakPolarHBondContact O-CA 3.31Å; D89-G93 PolarHBondContact O-N 3.1Å
94	Q	95.2	Very high	90.2	Very high	106 Å²	106	45.8 Å²	45.8	50%	0.495	25%	0.246	S	C	.	.			trans	-67.8	142.9	-172.3	-171.8	178.7	14.3	0	0	112.2	R88 D89 S92	R88-Q94 CarbonylContact C-O 3.35Å; R88-Q94 WeakPolarHBondContact CA-O 3.42Å; D89-Q94 HydrophobicContact CB-CB 4.46Å; D89-Q94 PolarHBondContact N-O 2.92Å; S92-Q94 PolarHBondContact O-N 3.49Å; S92-Q94 VanDerWaalsContact O-N 3.12Å; S92-Q94 VanDerWaalsContact OG-CB 3.26Å; S92-Q94 WeakPolarHBondContact OG-CB 3.35Å; S92-Q94 PolarHBondContact OG-N 2.85Å
95	L	96.4	Very high	89	Confident	51 Å²	51	44.8 Å²	44.8	27%	0.267	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	134.8	173.4	-64.2	172.6	0	0	0	111.2	I73 C87 R88 F148	I73-L95 HydrophobicContact CD1-CD2 3.58Å; C87-L95 WeakPolarHBondContact O-CA 3.43Å; R88-L95 HydrophobicContact CB-CD2 4.42Å; L95-F148 VanDerWaalsContact C-CB 3.47Å; L95-F148 HydrophobicContact CB-CB 3.8Å; L95-F148 HydrophobicContact CB-CD1 3.95Å; L95-F148 HydrophobicContact CB-CG 4.05Å; L95-F148 HydrophobicContact CD1-CD1 4.17Å; L95-F148 VanDerWaalsContact O-CB 3.25Å; L95-F148 WeakPolarHBondContact O-CB 3.16Å; L95-F148 PolarHBondContact O-N 3.41Å
96	V	96	Very high	88.1	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.006	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	153.2	176.6	-62	0	0	0	0	110.9	Y70 C87 I98 I133 V145 F146	Y70-V96 HydrophobicContact CD1-CG2 3.67Å; Y70-V96 HydrophobicContact CE1-CB 4.49Å; Y70-V96 HydrophobicContact CE1-CG1 4.17Å; Y70-V96 HydrophobicContact CE1-CG2 3.57Å; C87-V96 HydrophobicContact CB-CG2 3.88Å; C87-V96 PolarHBondContact N-O 3.43Å; C87-V96 PolarHBondContact O-N 2.97Å; V96-I98 HydrophobicContact CG2-CD1 3.92Å; V96-I98 HydrophobicContact CG2-CG1 3.95Å; V96-I133 HydrophobicContact CG1-CD1 3.88Å; V96-V145 HydrophobicContact CB-CG1 3.88Å; V96-V145 HydrophobicContact CG1-CG1 4.07Å; V96-V145 HydrophobicContact CG2-CG1 4.05Å; V96-F146 WeakPolarHBondContact CA-O 3.4Å; V96-F146 WeakPolarHBondContact CB-O 3.46Å
97	A	95	Very high	87.2	Confident	14 Å²	14	49 Å²	49	12%	0.116	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	129.7	168.6	0	0	0	0	0	108.9	I76 V84 F85 F146 F148	I76-A97 HydrophobicContact CD1-CB 4.23Å; V84-A97 HydrophobicContact CG1-CB 4.4Å; F85-A97 CarbonylContact O-C 3.59Å; F85-A97 WeakPolarHBondContact O-CA 3.36Å; A97-F146 HydrophobicContact CB-CB 4.34Å; A97-F146 PolarHBondContact N-O 3.23Å; A97-F146 PolarHBondContact O-N 3.32Å; A97-F148 HydrophobicContact CB-CD2 4.21Å
98	I	93.3	Very high	86.4	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	110.6	-178	-57.7	-175.3	0	0	0	109.6	L66 Y70 V84 F85 C87 V96 Q100 F136 N143 L144 V145	L66-I98 HydrophobicContact CD2-CD1 3.59Å; L66-I98 HydrophobicContact CD2-CG2 4.31Å; Y70-I98 HydrophobicContact CD1-CD1 4.28Å; Y70-I98 HydrophobicContact CD2-CD1 3.82Å; Y70-I98 HydrophobicContact CE2-CD1 4.34Å; Y70-I98 HydrophobicContact CG-CD1 3.81Å; V84-I98 WeakPolarHBondContact CA-O 3.4Å; F85-I98 PolarHBondContact N-O 2.8Å; F85-I98 PolarHBondContact O-N 3.23Å; C87-I98 HydrophobicContact CB-CD1 3.87Å; C87-I98 HydrophobicContact CB-CG1 4.31Å; V96-I98 HydrophobicContact CG2-CD1 3.92Å; V96-I98 HydrophobicContact CG2-CG1 3.95Å; I98-Q100 PolarHBondContact O-N 3.22Å; I98-F136 HydrophobicContact CD1-CE1 4.35Å; I98-F136 HydrophobicContact CG2-CE1 4.46Å; I98-F136 HydrophobicContact CG2-CZ 4.44Å; I98-N143 HydrophobicContact CG2-CB 3.93Å; I98-L144 WeakPolarHBondContact CA-O 3.3Å; I98-V145 HydrophobicContact CD1-CG1 4.39Å; I98-V145 HydrophobicContact CD1-CG2 4.08Å; I98-V145 HydrophobicContact CG1-CB 4.44Å; I98-V145 HydrophobicContact CG1-CG1 4.17Å; I98-V145 HydrophobicContact CG1-CG2 4.13Å
99	K	89.5	Confident	85.5	Confident	19 Å²	19	53.3 Å²	53.3	8%	0.083	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	102.2	174.9	-176.9	174.8	173.6	-173.4	0	107.8	V84 F101 E117 N143 L144 F146 D210	V84-K99 HydrophobicContact CG2-CB 4.34Å; V84-K99 HydrophobicContact CG2-CG 4.29Å; K99-F101 HydrophobicContact CG-CE2 4.41Å; K99-E117 IonicContact NZ-OE1 2.94Å; K99-E117 PolarHBondContact NZ-OE1 2.99Å; K99-E117 IonicContact NZ-OE2 3.56Å; K99-E117 PolarHBondContact NZ-OE2 3.05Å; K99-N143 WeakPolarHBondContact O-CA 3.41Å; K99-L144 HydrophobicContact CB-CB 4.49Å; K99-L144 PolarHBondContact N-O 3.4Å; K99-L144 PolarHBondContact O-N 3.37Å; K99-F146 HydrophobicContact CB-CE2 3.99Å; K99-F146 HydrophobicContact CD-CE2 4.44Å; K99-D210 IonicContact NZ-OD1 3.29Å; K99-D210 PolarHBondContact NZ-OD1 3.05Å
100	Q	88.7	Confident	84.4	Confident	30 Å²	30	54.3 Å²	54.3	14%	0.14	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	121.9	176.1	175.6	168.2	112.1	0	0	109.6	G82 V83 F85 I98 R141 N143	G82-Q100 CarbonylContact C-O 3.53Å; G82-Q100 WeakPolarHBondContact CA-O 3.32Å; V83-Q100 PolarHBondContact N-O 3.35Å; V83-Q100 PolarHBondContact O-N 2.94Å; F85-Q100 HydrophobicContact CD2-CB 4.5Å; F85-Q100 HydrophobicContact CE2-CB 4.3Å; I98-Q100 PolarHBondContact O-N 3.22Å; Q100-R141 HydrophobicContact CG-CB 4.47Å; Q100-N143 WeakPolarHBondContact CG-OD1 3.46Å; Q100-N143 PolarHBondContact NE2-OD1 3.33Å
101	F	82.8	Confident	83.6	Confident	3 Å²	3	56 Å²	56	1%	0.013	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	136	173.1	-74.8	-102.9	0	0	0	110.1	Y81 K99 I110 A114 R141 L142 L144	Y81-F101 WeakPolarHBondContact O-CA 3.47Å; Y81-F101 WeakPolarHBondContact O-CD1 3.39Å; K99-F101 HydrophobicContact CG-CE2 4.41Å; F101-I110 HydrophobicContact CD1-CG2 4.1Å; F101-A114 HydrophobicContact CD1-CB 4.26Å; F101-A114 HydrophobicContact CE1-CB 3.77Å; F101-A114 HydrophobicContact CE2-CB 4.06Å; F101-A114 HydrophobicContact CZ-CB 3.67Å; F101-R141 VanDerWaalsContact O-CD 3.31Å; F101-R141 WeakPolarHBondContact O-CD 3.04Å; F101-R141 WeakPolarHBondContact O-CG 3.22Å; F101-L142 HydrophobicContact CB-CB 4.5Å; F101-L142 HydrophobicContact CD2-CB 4.33Å; F101-L142 PolarHBondContact N-O 3.29Å; F101-L144 HydrophobicContact CD2-CD1 4.33Å; F101-L144 HydrophobicContact CE2-CD1 3.85Å; F101-L144 HydrophobicContact CE2-CD2 4.33Å
102	T	75.1	Confident	83	Confident	67 Å²	67	54.8 Å²	54.8	41%	0.411	30%	0.3	S	S	.	.	S	Bend	trans	-79.2	-35.9	-173.5	41.1	0	0	0	0	113.4	Y81 V83 R141	Y81-T102 PolarHBondContact O-N 3.29Å; V83-T102 HydrophobicContact CG2-CG2 4.06Å; T102-R141 VanDerWaalsContact O-CZ 3.23Å; T102-R141 PolarHBondContact O-NE 2.82Å; T102-R141 PolarHBondContact O-NH2 2.72Å
103	A	71.3	Confident	82	Confident	32 Å²	32	53.4 Å²	53.4	26%	0.264	29%	0.286	S	S	.	.	S	Bend	trans	-80.1	165	176.4	0	0	0	0	0	112.5	I110	A103-I110 HydrophobicContact CB-CD1 3.35Å; A103-I110 HydrophobicContact CB-CG2 4.47Å
104	S	70.7	Confident	81.2	Confident	34 Å²	34	51.8 Å²	51.8	24%	0.238	27%	0.27	C	S	.	.			trans	-72.1	144.8	169.1	-174.6	0	0	0	0	110.3	E106 D107	S104-E106 PolarHBondContact O-N 3.45Å; S104-E106 VanDerWaalsContact O-N 3.07Å; S104-E106 WeakPolarHBondContact OG-CB 3.24Å; S104-E106 WeakPolarHBondContact OG-CG 3.35Å; S104-E106 PolarHBondContact OG-N 3.49Å; S104-E106 PolarHBondContact OG-OE2 3.07Å; S104-D107 PolarHBondContact O-N 2.63Å; S104-D107 VanDerWaalsContact O-N 3.11Å
105	E	66.1	Low	80.4	Confident	17 Å²	17	49 Å²	49	8%	0.079	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-3	167	-63.5	179.2	98.7	0	0	113.2	D107 R111 M115 R137 K140 L142	E105-D107 PolarHBondContact O-N 3.32Å; E105-R111 VanDerWaalsContact O-CZ 3.24Å; E105-R111 PolarHBondContact O-NE 3.12Å; E105-R111 PolarHBondContact O-NH2 3.17Å; E105-M115 VanDerWaalsContact OE1-CE 3.31Å; E105-M115 WeakPolarHBondContact OE1-CE 3.17Å; E105-R137 WeakPolarHBondContact OE2-CD 3.27Å; E105-R137 IonicContact OE2-CZ 3.71Å; E105-R137 IonicContact OE2-NE 3.93Å; E105-R137 IonicContact OE2-NH1 2.73Å; E105-R137 PolarHBondContact OE2-NH1 3.08Å; E105-K140 PolarHBondContact N-O 3.25Å; E105-L142 HydrophobicContact CG-CB 3.84Å
106	E	73.8	Confident	79.5	Confident	103 Å²	103	49 Å²	49	48%	0.481	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-23.3	168.8	-70.3	158.7	149.6	0	0	112.1	S104 P108 K140	S104-E106 PolarHBondContact O-N 3.45Å; S104-E106 VanDerWaalsContact O-N 3.07Å; S104-E106 WeakPolarHBondContact OG-CB 3.24Å; S104-E106 WeakPolarHBondContact OG-CG 3.35Å; S104-E106 PolarHBondContact OG-N 3.49Å; S104-E106 PolarHBondContact OG-OE2 3.07Å; E106-P108 WeakPolarHBondContact O-CD 3.36Å; E106-K140 WeakPolarHBondContact OE1-CD 3.33Å; E106-K140 WeakPolarHBondContact OE1-CE 3.38Å; E106-K140 IonicContact OE1-NZ 3.54Å; E106-K140 PolarHBondContact OE1-NZ 3.11Å; E106-K140 WeakPolarHBondContact OE2-CD 3.4Å; E106-K140 IonicContact OE2-NZ 3.57Å; E106-K140 PolarHBondContact OE2-NZ 3.2Å
107	D	77.1	Confident	78.6	Confident	57 Å²	57	49.2 Å²	49.2	31%	0.305	26%	0.255	S	S	.	.	S	Bend	trans	-68.3	116.7	165.2	-179.4	-41	0	0	0	109.8	S104 E105 V109 I110 R111	S104-D107 PolarHBondContact O-N 2.63Å; S104-D107 VanDerWaalsContact O-N 3.11Å; E105-D107 PolarHBondContact O-N 3.32Å; D107-V109 VanDerWaalsContact C-N 3.34Å; D107-V109 PolarHBondContact O-N 2.65Å; D107-V109 WeakPolarHBondContact OD1-CA 3.34Å; D107-V109 VanDerWaalsContact OD1-CB 3.27Å; D107-V109 WeakPolarHBondContact OD1-CB 3.43Å; D107-V109 PolarHBondContact OD1-N 3.33Å; D107-I110 HydrophobicContact CB-CB 4.09Å; D107-I110 HydrophobicContact CB-CD1 4.25Å; D107-I110 HydrophobicContact CB-CG1 4.28Å; D107-I110 PolarHBondContact O-N 3.45Å; D107-I110 PolarHBondContact OD1-N 3.31Å; D107-I110 WeakPolarHBondContact OD2-CD1 3.3Å; D107-R111 WeakPolarHBondContact O-CB 3.46Å; D107-R111 PolarHBondContact O-N 3.42Å
108	P	79.4	Confident	78	Confident	93 Å²	93	49.1 Å²	49.1	60%	0.604	25%	0.252	S	S	*	.	H	α-helix	trans	-71.8	-26.2	-176.8	29.9	-35.1	0	0	0	112.9	E106 K112	E106-P108 WeakPolarHBondContact O-CD 3.36Å; P108-K112 WeakPolarHBondContact O-CB 3.37Å; P108-K112 PolarHBondContact O-N 3.04Å
109	V	75.5	Confident	77.5	Confident	94 Å²	94	57 Å²	57	57%	0.57	28%	0.282	S	S	*	.	H	α-helix	trans	-70	-46.9	176.1	-175.8	0	0	0	0	109.3	D107 K112 I113	D107-V109 VanDerWaalsContact C-N 3.34Å; D107-V109 PolarHBondContact O-N 2.65Å; D107-V109 WeakPolarHBondContact OD1-CA 3.34Å; D107-V109 VanDerWaalsContact OD1-CB 3.27Å; D107-V109 WeakPolarHBondContact OD1-CB 3.43Å; D107-V109 PolarHBondContact OD1-N 3.33Å; V109-K112 PolarHBondContact O-N 3.12Å; V109-I113 HydrophobicContact CG1-CD1 4.12Å; V109-I113 WeakPolarHBondContact O-CG1 3.33Å; V109-I113 PolarHBondContact O-N 3.34Å
110	I	72.2	Confident	77.1	Confident	35 Å²	35	56.1 Å²	56.1	18%	0.179	28%	0.278	C	S	.	.	H	α-helix	trans	-71.6	-38.7	-178.9	-63.1	176.8	0	0	0	110.7	F101 A103 D107 K112 I113 A114	F101-I110 HydrophobicContact CD1-CG2 4.1Å; A103-I110 HydrophobicContact CB-CD1 3.35Å; A103-I110 HydrophobicContact CB-CG2 4.47Å; D107-I110 HydrophobicContact CB-CB 4.09Å; D107-I110 HydrophobicContact CB-CD1 4.25Å; D107-I110 HydrophobicContact CB-CG1 4.28Å; D107-I110 PolarHBondContact O-N 3.45Å; D107-I110 PolarHBondContact OD1-N 3.31Å; D107-I110 WeakPolarHBondContact OD2-CD1 3.3Å; I110-K112 VanDerWaalsContact C-N 3.32Å; I110-K112 PolarHBondContact O-N 3.21Å; I110-I113 PolarHBondContact O-N 2.99Å; I110-A114 WeakPolarHBondContact O-CB 3.26Å; I110-A114 PolarHBondContact O-N 3.34Å
111	R	77.3	Confident	76.9	Confident	123 Å²	123	54.9 Å²	54.9	46%	0.464	27%	0.272	S	S	.	.	H	α-helix	trans	-56.5	-45.7	168.2	-167.7	-170	-56.4	176.4	6	111.3	E105 D107 I113 A114 M115	E105-R111 VanDerWaalsContact O-CZ 3.24Å; E105-R111 PolarHBondContact O-NE 3.12Å; E105-R111 PolarHBondContact O-NH2 3.17Å; D107-R111 WeakPolarHBondContact O-CB 3.46Å; D107-R111 PolarHBondContact O-N 3.42Å; R111-I113 PolarHBondContact O-N 3.04Å; R111-A114 PolarHBondContact O-N 3.38Å; R111-M115 HydrophobicContact CG-CG 4.13Å; R111-M115 VanDerWaalsContact O-CB 3.25Å; R111-M115 WeakPolarHBondContact O-CB 3.47Å; R111-M115 VanDerWaalsContact O-CG 3.24Å; R111-M115 WeakPolarHBondContact O-CG 3.13Å; R111-M115 PolarHBondContact O-N 3.03Å
112	K	78.8	Confident	77	Confident	163 Å²	163	60.3 Å²	60.3	71%	0.709	30%	0.296	S	S	*	.	H	α-helix	trans	-65.9	-35.1	179	-173	169	-173.8	166.6	0	112.8	P108 V109 I110 R116	P108-K112 WeakPolarHBondContact O-CB 3.37Å; P108-K112 PolarHBondContact O-N 3.04Å; V109-K112 PolarHBondContact O-N 3.12Å; I110-K112 VanDerWaalsContact C-N 3.32Å; I110-K112 PolarHBondContact O-N 3.21Å; K112-R116 WeakPolarHBondContact O-CB 3.36Å; K112-R116 PolarHBondContact O-N 2.97Å
113	I	74.1	Confident	77.5	Confident	42 Å²	42	66.3 Å²	66.3	22%	0.215	31%	0.311	C	S	.	.	H	α-helix	trans	-68	-52.4	173	-69.5	165.3	0	0	0	110.6	Y81 V109 I110 R111 R116 E117	Y81-I113 HydrophobicContact CE1-CD1 4.04Å; V109-I113 HydrophobicContact CG1-CD1 4.12Å; V109-I113 WeakPolarHBondContact O-CG1 3.33Å; V109-I113 PolarHBondContact O-N 3.34Å; I110-I113 PolarHBondContact O-N 2.99Å; R111-I113 PolarHBondContact O-N 3.04Å; I113-R116 WeakPolarHBondContact O-CB 3.18Å; I113-R116 PolarHBondContact O-N 3.4Å; I113-E117 PolarHBondContact O-N 3.41Å
114	A	75.8	Confident	78.2	Confident	2 Å²	2	65.1 Å²	65.1	2%	0.017	30%	0.3	C	S	.	.	H	α-helix	trans	-73.1	-39.4	-172.3	0	0	0	0	0	113.2	F101 I110 R111 R116 E117 I118 L142	F101-A114 HydrophobicContact CD1-CB 4.26Å; F101-A114 HydrophobicContact CE1-CB 3.77Å; F101-A114 HydrophobicContact CE2-CB 4.06Å; F101-A114 HydrophobicContact CZ-CB 3.67Å; I110-A114 WeakPolarHBondContact O-CB 3.26Å; I110-A114 PolarHBondContact O-N 3.34Å; R111-A114 PolarHBondContact O-N 3.38Å; A114-R116 PolarHBondContact O-N 2.77Å; A114-E117 PolarHBondContact O-N 2.81Å; A114-I118 VanDerWaalsContact O-CG1 3.29Å; A114-I118 WeakPolarHBondContact O-CG1 3.32Å; A114-I118 PolarHBondContact O-N 3.48Å; A114-L142 HydrophobicContact CB-CD2 3.46Å; A114-L142 VanDerWaalsContact CB-CD2 3.46Å
115	M	80	Confident	79.2	Confident	49 Å²	49	67.9 Å²	67.9	24%	0.241	31%	0.308	C	S	.	.	H	α-helix	trans	-64.1	-24.5	172.7	-68.3	-63.8	149.4	0	0	112.3	E105 R111 I118 R119 L142	E105-M115 VanDerWaalsContact OE1-CE 3.31Å; E105-M115 WeakPolarHBondContact OE1-CE 3.17Å; R111-M115 HydrophobicContact CG-CG 4.13Å; R111-M115 VanDerWaalsContact O-CB 3.25Å; R111-M115 WeakPolarHBondContact O-CB 3.47Å; R111-M115 VanDerWaalsContact O-CG 3.24Å; R111-M115 WeakPolarHBondContact O-CG 3.13Å; R111-M115 PolarHBondContact O-N 3.03Å; M115-I118 HydrophobicContact CE-CD1 4.26Å; M115-I118 HydrophobicContact SD-CD1 4.17Å; M115-R119 WeakPolarHBondContact O-CB 3.29Å; M115-R119 VanDerWaalsContact O-CG 3.22Å; M115-R119 WeakPolarHBondContact O-CG 3.41Å; M115-R119 PolarHBondContact O-N 3.11Å; M115-R119 VanDerWaalsContact O-N 3.08Å; M115-L142 HydrophobicContact CE-CD1 4.41Å; M115-L142 HydrophobicContact CE-CD2 4.05Å
116	R	76.6	Confident	80.6	Confident	51 Å²	51	69 Å²	69	19%	0.192	31%	0.313	C	S	.	.	H	α-helix	trans	-78.6	-43	174.7	178.1	179.2	177.6	-66.7	-50.8	111.4	K112 I113 A114 I118 R119 M120 A214	K112-R116 WeakPolarHBondContact O-CB 3.36Å; K112-R116 PolarHBondContact O-N 2.97Å; I113-R116 WeakPolarHBondContact O-CB 3.18Å; I113-R116 PolarHBondContact O-N 3.4Å; A114-R116 PolarHBondContact O-N 2.77Å; R116-I118 VanDerWaalsContact C-N 3.34Å; R116-I118 PolarHBondContact O-N 2.88Å; R116-R119 PolarHBondContact O-N 2.87Å; R116-M120 PolarHBondContact NH2-SD 2.78Å; R116-M120 WeakPolarHBondContact O-CG 3.37Å; R116-M120 PolarHBondContact O-N 2.83Å; R116-M120 VanDerWaalsContact O-N 3.12Å; R116-A214 PolarHBondContact NH1-O 3.06Å; R116-A214 PolarHBondContact NH2-O 3.17Å
117	E	77.1	Confident	81.7	Confident	4 Å²	4	67.6 Å²	67.6	2%	0.019	31%	0.313	C	S	.	.	H	α-helix	trans	-56.8	-46.4	170	-165.8	-178.9	148.7	0	0	110.8	K99 I113 A114 M120 L121 L144	K99-E117 IonicContact NZ-OE1 2.94Å; K99-E117 PolarHBondContact NZ-OE1 2.99Å; K99-E117 IonicContact NZ-OE2 3.56Å; K99-E117 PolarHBondContact NZ-OE2 3.05Å; I113-E117 PolarHBondContact O-N 3.41Å; A114-E117 PolarHBondContact O-N 2.81Å; E117-M120 PolarHBondContact O-N 3.36Å; E117-L121 HydrophobicContact CG-CD1 3.8Å; E117-L121 HydrophobicContact CG-CG 4.45Å; E117-L121 WeakPolarHBondContact O-CB 3.45Å; E117-L121 VanDerWaalsContact O-CG 3.29Å; E117-L121 WeakPolarHBondContact O-CG 3.5Å; E117-L121 PolarHBondContact O-N 2.91Å; E117-L144 HydrophobicContact CG-CD2 4.4Å
118	I	82.6	Confident	82.7	Confident	13 Å²	13	65.6 Å²	65.6	7%	0.067	30%	0.302	C	S	.	.	H	α-helix	trans	-61	-47.5	176.6	-68	162.7	0	0	0	112.2	A114 M115 R116 M120 L121 K122 V135 L142 L144	A114-I118 VanDerWaalsContact O-CG1 3.29Å; A114-I118 WeakPolarHBondContact O-CG1 3.32Å; A114-I118 PolarHBondContact O-N 3.48Å; M115-I118 HydrophobicContact CE-CD1 4.26Å; M115-I118 HydrophobicContact SD-CD1 4.17Å; R116-I118 VanDerWaalsContact C-N 3.34Å; R116-I118 PolarHBondContact O-N 2.88Å; I118-M120 PolarHBondContact O-N 3.41Å; I118-L121 PolarHBondContact O-N 3.46Å; I118-K122 HydrophobicContact CG2-CD 4.22Å; I118-K122 HydrophobicContact CG2-CG 4.26Å; I118-K122 WeakPolarHBondContact O-CB 3.41Å; I118-K122 WeakPolarHBondContact O-CG 3.32Å; I118-K122 PolarHBondContact O-N 3.27Å; I118-V135 HydrophobicContact CD1-CG1 3.76Å; I118-V135 HydrophobicContact CD1-CG2 4.05Å; I118-V135 HydrophobicContact CG1-CG2 4Å; I118-V135 HydrophobicContact CG2-CG2 4.25Å; I118-L142 HydrophobicContact CD1-CD1 4.49Å; I118-L142 HydrophobicContact CD1-CD2 3.91Å; I118-L144 HydrophobicContact CD1-CD1 4.02Å; I118-L144 HydrophobicContact CG1-CD1 4.11Å; I118-L144 HydrophobicContact CG1-CD2 4.06Å; I118-L144 HydrophobicContact CG1-CG 4.08Å
119	R	83.1	Confident	83.4	Confident	166 Å²	166	61.3 Å²	61.3	63%	0.626	27%	0.274	S	S	*	.	H	α-helix	trans	-60	-35.3	178.5	-78.5	173.1	-176.7	123.6	-11	112.2	M115 R116	M115-R119 WeakPolarHBondContact O-CB 3.29Å; M115-R119 VanDerWaalsContact O-CG 3.22Å; M115-R119 WeakPolarHBondContact O-CG 3.41Å; M115-R119 PolarHBondContact O-N 3.11Å; M115-R119 VanDerWaalsContact O-N 3.08Å; R116-R119 PolarHBondContact O-N 2.87Å
120	M	81	Confident	84.3	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-71.5	-51.1	175.2	-65	-179.8	81.9	0	0	110.9	R116 E117 I118 K122 R123 L124 C188 A214 F216	R116-M120 PolarHBondContact NH2-SD 2.78Å; R116-M120 WeakPolarHBondContact O-CG 3.37Å; R116-M120 PolarHBondContact O-N 2.83Å; R116-M120 VanDerWaalsContact O-N 3.12Å; E117-M120 PolarHBondContact O-N 3.36Å; I118-M120 PolarHBondContact O-N 3.41Å; M120-K122 VanDerWaalsContact C-N 3.3Å; M120-K122 PolarHBondContact O-N 3.12Å; M120-R123 PolarHBondContact O-N 2.76Å; M120-R123 VanDerWaalsContact O-N 3.08Å; M120-L124 HydrophobicContact CB-CD1 4.25Å; M120-L124 WeakPolarHBondContact O-CB 3.35Å; M120-L124 WeakPolarHBondContact O-CG 3.25Å; M120-L124 PolarHBondContact O-N 2.9Å; M120-C188 HydrophobicContact CE-CB 4.08Å; M120-C188 WeakPolarHBondContact CE-SG 3.33Å; M120-A214 HydrophobicContact CE-CB 3.67Å; M120-A214 HydrophobicContact SD-CB 4.15Å; M120-F216 HydrophobicContact CB-CZ 4.44Å; M120-F216 HydrophobicContact CE-CD1 4.15Å; M120-F216 HydrophobicContact CE-CD2 4.34Å; M120-F216 HydrophobicContact CE-CE1 4.3Å; M120-F216 HydrophobicContact CE-CE2 4.49Å; M120-F216 HydrophobicContact CE-CG 4.16Å; M120-F216 HydrophobicContact CE-CZ 4.47Å; M120-F216 HydrophobicContact CG-CD2 4.05Å; M120-F216 HydrophobicContact CG-CE1 4.32Å; M120-F216 HydrophobicContact CG-CE2 3.47Å; M120-F216 VanDerWaalsContact CG-CE2 3.47Å; M120-F216 HydrophobicContact CG-CZ 3.63Å; M120-F216 HydrophobicContact SD-CD2 4.29Å; M120-F216 HydrophobicContact SD-CE2 4.31Å
121	L	83.8	Confident	85.2	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.021	26%	0.257	C	S	.	.	H	α-helix	trans	-66.9	-21.3	-179.7	-69.7	170.2	0	0	0	115.4	E117 I118 K125 L132 L144 F146 F211	E117-L121 HydrophobicContact CG-CD1 3.8Å; E117-L121 HydrophobicContact CG-CG 4.45Å; E117-L121 WeakPolarHBondContact O-CB 3.45Å; E117-L121 VanDerWaalsContact O-CG 3.29Å; E117-L121 WeakPolarHBondContact O-CG 3.5Å; E117-L121 PolarHBondContact O-N 2.91Å; I118-L121 PolarHBondContact O-N 3.46Å; L121-K125 PolarHBondContact O-NZ 3.41Å; L121-L132 HydrophobicContact CB-CB 3.91Å; L121-L132 HydrophobicContact CB-CD2 3.7Å; L121-L132 HydrophobicContact CB-CG 4.39Å; L121-L132 HydrophobicContact CD1-CB 4.41Å; L121-L132 HydrophobicContact CD1-CD1 4.47Å; L121-L132 HydrophobicContact CD1-CD2 4.29Å; L121-L144 HydrophobicContact CD1-CD2 4.12Å; L121-F146 HydrophobicContact CD1-CE1 3.54Å; L121-F146 HydrophobicContact CD1-CZ 3.57Å; L121-F146 HydrophobicContact CD2-CE1 4.07Å; L121-F146 HydrophobicContact CG-CE1 4.43Å; L121-F211 HydrophobicContact CD2-CB 4.19Å; L121-F211 HydrophobicContact CD2-CD2 3.79Å; L121-F211 HydrophobicContact CD2-CG 4.12Å; L121-F211 HydrophobicContact CG-CB 4.48Å
122	K	85.2	Confident	85.9	Confident	117 Å²	117	53.2 Å²	53.2	51%	0.509	24%	0.237	S	C	.	.	H	α-helix	trans	-72.1	-37.9	169.7	-80.1	-168.6	175	-169.6	0	111.7	I118 M120 K125	I118-K122 HydrophobicContact CG2-CD 4.22Å; I118-K122 HydrophobicContact CG2-CG 4.26Å; I118-K122 WeakPolarHBondContact O-CB 3.41Å; I118-K122 WeakPolarHBondContact O-CG 3.32Å; I118-K122 PolarHBondContact O-N 3.27Å; M120-K122 VanDerWaalsContact C-N 3.3Å; M120-K122 PolarHBondContact O-N 3.12Å; K122-K125 WeakPolarHBondContact O-CE 3.44Å
123	R	85.1	Confident	86.6	Confident	194 Å²	194	48.8 Å²	48.8	73%	0.732	22%	0.221	S	C	*	.	H	α-helix	trans	-83.2	-37.1	179	-73.4	-176.5	169.8	-176.4	-3.3	113.7	M120 K125	M120-R123 PolarHBondContact O-N 2.76Å; M120-R123 VanDerWaalsContact O-N 3.08Å; R123-K125 PolarHBondContact O-N 2.9Å
124	L	87.7	Confident	87.4	Confident	6 Å²	6	49.2 Å²	49.2	3%	0.031	22%	0.222	C	C	.	.			trans	-81.2	83.8	-173.9	-66.2	171.6	0	0	0	111.6	M120 L129 F182 C188 F211	M120-L124 HydrophobicContact CB-CD1 4.25Å; M120-L124 WeakPolarHBondContact O-CB 3.35Å; M120-L124 WeakPolarHBondContact O-CG 3.25Å; M120-L124 PolarHBondContact O-N 2.9Å; L124-L129 HydrophobicContact CB-CD1 3.92Å; L124-F182 HydrophobicContact CB-CE1 4.22Å; L124-F182 HydrophobicContact CD2-CD1 4.3Å; L124-F182 HydrophobicContact CD2-CE1 3.75Å; L124-C188 HydrophobicContact CD1-CB 4.45Å; L124-C188 HydrophobicContact CD2-CB 4.49Å; L124-F211 HydrophobicContact CD1-CD1 3.75Å; L124-F211 HydrophobicContact CD1-CE1 3.51Å; L124-F211 HydrophobicContact CD1-CZ 4.28Å
125	K	91.8	Very high	88.1	Confident	93 Å²	93	49.6 Å²	49.6	40%	0.404	22%	0.224	S	C	.	.			trans	-109.2	112	175.3	-57.5	-52.4	-172.5	-168.5	0	110.5	L121 K122 R123 N131 L132 F182	L121-K125 PolarHBondContact O-NZ 3.41Å; K122-K125 WeakPolarHBondContact O-CE 3.44Å; R123-K125 PolarHBondContact O-N 2.9Å; K125-N131 PolarHBondContact NZ-OD1 3.48Å; K125-L132 PolarHBondContact NZ-O 3.23Å; K125-L132 VanDerWaalsContact NZ-O 3.17Å; K125-F182 VanDerWaalsContact O-CZ 3.24Å; K125-F182 WeakPolarHBondContact O-CZ 3.09Å
126	H	95.3	Very high	88.5	Confident	40 Å²	40	48 Å²	48	19%	0.185	22%	0.216	C	C	.	.			trans	-154.8	144.8	-179.1	176.5	-98.5	0	0	0	109.8	N128 L129 F182	H126-N128 VanDerWaalsContact C-N 3.27Å; H126-N128 PolarHBondContact ND1-N 3.25Å; H126-N128 VanDerWaalsContact ND1-N 3.18Å; H126-N128 PolarHBondContact O-N 2.76Å; H126-L129 HydrophobicContact CB-CB 4.46Å; H126-L129 HydrophobicContact CB-CD1 4.07Å; H126-L129 HydrophobicContact CB-CG 4Å; H126-L129 PolarHBondContact O-N 3.41Å; H126-F182 HydrophobicContact CB-CB 4.48Å; H126-F182 HydrophobicContact CB-CD1 3.57Å; H126-F182 HydrophobicContact CB-CD2 4.19Å; H126-F182 HydrophobicContact CB-CE1 3.73Å; H126-F182 HydrophobicContact CB-CE2 4.32Å; H126-F182 HydrophobicContact CB-CG 3.81Å; H126-F182 HydrophobicContact CB-CZ 4.11Å; H126-F182 AromaticContact CD2-CD2 3.95Å; H126-F182 AromaticContact CD2-CG 3.82Å; H126-F182 AromaticContact CG-CG 3.86Å
127	P	96	Very high	88.9	Confident	73 Å²	73	48.5 Å²	48.5	47%	0.474	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-40.6	-178.5	16	-32.1	0	0	0	113.8	L129 K207	P127-L129 VanDerWaalsContact C-N 3.33Å; P127-L129 PolarHBondContact O-N 3.08Å; P127-K207 WeakPolarHBondContact O-CD 3.43Å; P127-K207 WeakPolarHBondContact O-CE 3.28Å; P127-K207 PolarHBondContact O-NZ 2.88Å
128	N	97.4	Very high	89.1	Confident	15 Å²	15	49.1 Å²	49.1	8%	0.08	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	13.6	179.8	-60.1	113.6	0	0	0	115.8	H126 Q175 A179 V206 K207 L208	H126-N128 VanDerWaalsContact C-N 3.27Å; H126-N128 PolarHBondContact ND1-N 3.25Å; H126-N128 VanDerWaalsContact ND1-N 3.18Å; H126-N128 PolarHBondContact O-N 2.76Å; N128-Q175 PolarHBondContact ND2-OE1 2.87Å; N128-A179 HydrophobicContact CB-CB 3.91Å; N128-V206 VanDerWaalsContact CA-O 3.24Å; N128-V206 WeakPolarHBondContact CA-O 3.05Å; N128-V206 WeakPolarHBondContact CB-O 3.36Å; N128-V206 PolarHBondContact ND2-O 2.87Å; N128-K207 WeakPolarHBondContact O-CA 3.47Å; N128-L208 PolarHBondContact O-N 2.83Å
129	L	95.5	Very high	89.1	Confident	4 Å²	4	53.7 Å²	53.7	2%	0.021	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-108.5	149.2	170.7	-62.9	-173.9	0	0	0	111.3	L124 H126 P127 N131 A179 F182 K207 L208 F211	L124-L129 HydrophobicContact CB-CD1 3.92Å; H126-L129 HydrophobicContact CB-CB 4.46Å; H126-L129 HydrophobicContact CB-CD1 4.07Å; H126-L129 HydrophobicContact CB-CG 4Å; H126-L129 PolarHBondContact O-N 3.41Å; P127-L129 VanDerWaalsContact C-N 3.33Å; P127-L129 PolarHBondContact O-N 3.08Å; L129-N131 PolarHBondContact O-N 3.16Å; L129-A179 HydrophobicContact CD2-CB 3.75Å; L129-F182 HydrophobicContact CD1-CD1 3.84Å; L129-F182 HydrophobicContact CD1-CE1 3.95Å; L129-K207 WeakPolarHBondContact O-CD 3.21Å; L129-K207 PolarHBondContact O-NZ 2.97Å; L129-K207 VanDerWaalsContact O-NZ 3.15Å; L129-L208 HydrophobicContact CD2-CB 3.88Å; L129-L208 HydrophobicContact CD2-CD2 4.32Å; L129-F211 HydrophobicContact CD1-CZ 4.06Å; L129-F211 HydrophobicContact CD2-CE2 4.15Å; L129-F211 HydrophobicContact CD2-CZ 3.74Å; L129-F211 HydrophobicContact CG-CZ 4.47Å
130	V	94.1	Very high	89	Confident	7 Å²	7	50.8 Å²	50.8	4%	0.042	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-67.3	121.2	171.6	73.4	0	0	0	0	110	L132 F146 Q147 L208 C209	V130-L132 PolarHBondContact O-N 2.89Å; V130-F146 HydrophobicContact CG1-CD1 3.92Å; V130-F146 HydrophobicContact CG1-CE1 4.16Å; V130-F146 HydrophobicContact CG2-CB 4.12Å; V130-F146 HydrophobicContact CG2-CD1 4.15Å; V130-Q147 HydrophobicContact CG2-CG 3.79Å; V130-L208 PolarHBondContact N-O 3.01Å; V130-C209 HydrophobicContact CB-CB 4.01Å; V130-C209 HydrophobicContact CG1-CB 3.53Å
131	N	91.6	Very high	89	Confident	65 Å²	65	55.9 Å²	55.9	35%	0.348	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-77.2	122.2	178.5	-171.2	35.4	0	0	0	111.6	K125 L129 I133 F146 Q147	K125-N131 PolarHBondContact NZ-OD1 3.48Å; L129-N131 PolarHBondContact O-N 3.16Å; N131-I133 PolarHBondContact O-N 3.32Å; N131-F146 WeakPolarHBondContact O-CA 3.47Å; N131-Q147 HydrophobicContact CB-CG 4.38Å; N131-Q147 PolarHBondContact O-N 2.74Å
132	L	92.3	Very high	89.1	Confident	9 Å²	9	55.8 Å²	55.8	5%	0.047	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	118.8	159.3	180	74.5	0	0	0	108.9	L121 K125 V130 V135 L144 F146	L121-L132 HydrophobicContact CB-CB 3.91Å; L121-L132 HydrophobicContact CB-CD2 3.7Å; L121-L132 HydrophobicContact CB-CG 4.39Å; L121-L132 HydrophobicContact CD1-CB 4.41Å; L121-L132 HydrophobicContact CD1-CD1 4.47Å; L121-L132 HydrophobicContact CD1-CD2 4.29Å; K125-L132 PolarHBondContact NZ-O 3.23Å; K125-L132 VanDerWaalsContact NZ-O 3.17Å; V130-L132 PolarHBondContact O-N 2.89Å; L132-V135 HydrophobicContact CD1-CG2 4.28Å; L132-V135 HydrophobicContact CD2-CG2 4.02Å; L132-L144 HydrophobicContact CD1-CB 3.8Å; L132-L144 HydrophobicContact CD1-CD2 4.45Å; L132-L144 HydrophobicContact CD1-CG 4.03Å; L132-F146 HydrophobicContact CB-CD1 4.24Å; L132-F146 HydrophobicContact CB-CE1 4.17Å; L132-F146 HydrophobicContact CD1-CD1 4.28Å; L132-F146 HydrophobicContact CD1-CE1 4.04Å; L132-F146 HydrophobicContact CD1-CE2 4.36Å; L132-F146 HydrophobicContact CD1-CZ 4.09Å
133	I	92.4	Very high	89.3	Confident	71 Å²	71	50.2 Å²	50.2	36%	0.364	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-58.2	-179.8	-59.9	174.4	0	0	0	109.9	V96 N131 V145 Q147	V96-I133 HydrophobicContact CG1-CD1 3.88Å; N131-I133 PolarHBondContact O-N 3.32Å; I133-V145 HydrophobicContact CB-CG1 4.3Å; I133-V145 WeakPolarHBondContact CB-O 3.43Å; I133-V145 HydrophobicContact CD1-CG1 4.44Å; I133-V145 PolarHBondContact N-O 2.77Å; I133-Q147 HydrophobicContact CD1-CB 4.49Å
134	E	91.3	Very high	89.5	Confident	50 Å²	50	41 Å²	41	23%	0.234	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	174.8	-179.6	69.2	-179	-169	0	0	112.4	K69 Y70 V145	K69-E134 IonicContact NZ-OE1 2.76Å; K69-E134 PolarHBondContact NZ-OE1 3.01Å; K69-E134 IonicContact NZ-OE2 3.8Å; K69-E134 PolarHBondContact NZ-OE2 3.26Å; Y70-E134 VanDerWaalsContact CE2-OE1 3.29Å; Y70-E134 WeakPolarHBondContact CE2-OE1 3.44Å; Y70-E134 PolarHBondContact OH-OE1 3.1Å; E134-V145 HydrophobicContact CG-CB 3.84Å; E134-V145 HydrophobicContact CG-CG1 4.46Å; E134-V145 HydrophobicContact CG-CG2 3.74Å; E134-V145 PolarHBondContact N-O 2.95Å; E134-V145 PolarHBondContact O-N 2.99Å
135	V	90.3	Very high	89.7	Confident	11 Å²	11	40.7 Å²	40.7	7%	0.067	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	132.1	179.2	179.8	0	0	0	0	109.1	I118 L132 L142 N143 L144	I118-V135 HydrophobicContact CD1-CG1 3.76Å; I118-V135 HydrophobicContact CD1-CG2 4.05Å; I118-V135 HydrophobicContact CG1-CG2 4Å; I118-V135 HydrophobicContact CG2-CG2 4.25Å; L132-V135 HydrophobicContact CD1-CG2 4.28Å; L132-V135 HydrophobicContact CD2-CG2 4.02Å; V135-L142 HydrophobicContact CG1-CD1 3.48Å; V135-L142 VanDerWaalsContact CG1-CD1 3.48Å; V135-L142 HydrophobicContact CG1-CG 4.38Å; V135-N143 WeakPolarHBondContact CA-O 3.35Å; V135-L144 HydrophobicContact CG1-CD1 4.34Å; V135-L144 HydrophobicContact CG2-CG 4.33Å
136	F	89.3	Confident	89.9	Confident	15 Å²	15	37.1 Å²	37.1	7%	0.066	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	156.8	176	72.3	-94.3	0	0	0	113	L66 Y70 I98 K138 N143 V145	L66-F136 HydrophobicContact CD2-CZ 3.97Å; L66-F136 HydrophobicContact CG-CE2 4.43Å; L66-F136 HydrophobicContact CG-CZ 3.96Å; Y70-F136 HydrophobicContact CD2-CE1 4.2Å; Y70-F136 HydrophobicContact CE2-CE1 4.42Å; I98-F136 HydrophobicContact CD1-CE1 4.35Å; I98-F136 HydrophobicContact CG2-CE1 4.46Å; I98-F136 HydrophobicContact CG2-CZ 4.44Å; F136-K138 HydrophobicContact CE2-CB 4.26Å; F136-N143 HydrophobicContact CD1-CB 4.09Å; F136-N143 HydrophobicContact CD2-CB 4Å; F136-N143 HydrophobicContact CE1-CB 3.74Å; F136-N143 HydrophobicContact CE2-CB 3.63Å; F136-N143 VanDerWaalsContact CE2-CG 3.49Å; F136-N143 WeakPolarHBondContact CE2-ND2 3.41Å; F136-N143 HydrophobicContact CG-CB 4.21Å; F136-N143 HydrophobicContact CZ-CB 3.48Å; F136-N143 VanDerWaalsContact CZ-CB 3.48Å; F136-N143 PolarHBondContact N-O 2.9Å; F136-N143 WeakPolarHBondContact O-CB 3.41Å; F136-N143 PolarHBondContact O-N 2.95Å; F136-N143 PolarHBondContact O-ND2 2.83Å; F136-N143 VanDerWaalsContact O-ND2 3.1Å; F136-V145 HydrophobicContact CD1-CG2 3.75Å; F136-V145 HydrophobicContact CE1-CG2 3.52Å
137	R	84.2	Confident	89.8	Confident	61 Å²	61	37.3 Å²	37.3	23%	0.23	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	133.5	178.1	-178.9	176	162.2	93.4	-7.8	109.5	E105 K140 R141	E105-R137 WeakPolarHBondContact OE2-CD 3.27Å; E105-R137 IonicContact OE2-CZ 3.71Å; E105-R137 IonicContact OE2-NE 3.93Å; E105-R137 IonicContact OE2-NH1 2.73Å; E105-R137 PolarHBondContact OE2-NH1 3.08Å; R137-K140 PolarHBondContact NH1-O 2.94Å; R137-R141 CarbonylContact C-O 3.49Å; R137-R141 WeakPolarHBondContact CA-O 3.31Å
138	K	81.6	Confident	89.8	Confident	18 Å²	18	35.4 Å²	35.4	8%	0.078	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	128.7	171.7	-179.4	-178.7	-175.7	179.3	0	108.4	D63 L65 L66 F67 F136 K140 R141	D63-K138 PolarHBondContact O-NZ 2.84Å; L65-K138 PolarHBondContact O-NZ 3.02Å; L66-K138 HydrophobicContact CD1-CD 4.23Å; F67-K138 HydrophobicContact CD2-CD 3.8Å; F67-K138 HydrophobicContact CD2-CG 3.95Å; F67-K138 HydrophobicContact CE2-CD 4.14Å; F67-K138 HydrophobicContact CE2-CG 3.99Å; F136-K138 HydrophobicContact CE2-CB 4.26Å; K138-K140 VanDerWaalsContact C-N 3.32Å; K138-K140 PolarHBondContact O-N 2.9Å; K138-R141 PolarHBondContact N-O 2.85Å; K138-R141 PolarHBondContact O-N 2.9Å
139	K	82.6	Confident	89.7	Confident	109 Å²	109	35.7 Å²	35.7	47%	0.474	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.2	53.2	177.4	-64	-178	175	-177.8	0	112.7	D63 R141	D63-K139 IonicContact OD1-NZ 2.72Å; D63-K139 PolarHBondContact OD1-NZ 3.37Å; D63-K139 IonicContact OD2-NZ 2.71Å; D63-K139 PolarHBondContact OD2-NZ 3.28Å; K139-R141 PolarHBondContact O-N 3.45Å
140	K	79.5	Confident	89.3	Confident	105 Å²	105	38.9 Å²	38.9	46%	0.457	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.3	0.5	-175.5	-49.3	-166.4	-176.7	-175.1	0	118	E105 E106 R137 K138	E105-K140 PolarHBondContact N-O 3.25Å; E106-K140 WeakPolarHBondContact OE1-CD 3.33Å; E106-K140 WeakPolarHBondContact OE1-CE 3.38Å; E106-K140 IonicContact OE1-NZ 3.54Å; E106-K140 PolarHBondContact OE1-NZ 3.11Å; E106-K140 WeakPolarHBondContact OE2-CD 3.4Å; E106-K140 IonicContact OE2-NZ 3.57Å; E106-K140 PolarHBondContact OE2-NZ 3.2Å; R137-K140 PolarHBondContact NH1-O 2.94Å; K138-K140 VanDerWaalsContact C-N 3.32Å; K138-K140 PolarHBondContact O-N 2.9Å
141	R	81.3	Confident	89.2	Confident	106 Å²	106	39.8 Å²	39.8	40%	0.4	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	142.9	174.5	-70	178.1	170.8	164.6	3.1	111.9	Q100 F101 T102 R137 K138 K139 N143	Q100-R141 HydrophobicContact CG-CB 4.47Å; F101-R141 VanDerWaalsContact O-CD 3.31Å; F101-R141 WeakPolarHBondContact O-CD 3.04Å; F101-R141 WeakPolarHBondContact O-CG 3.22Å; T102-R141 VanDerWaalsContact O-CZ 3.23Å; T102-R141 PolarHBondContact O-NE 2.82Å; T102-R141 PolarHBondContact O-NH2 2.72Å; R137-R141 CarbonylContact C-O 3.49Å; R137-R141 WeakPolarHBondContact CA-O 3.31Å; K138-R141 PolarHBondContact N-O 2.85Å; K138-R141 PolarHBondContact O-N 2.9Å; K139-R141 PolarHBondContact O-N 3.45Å; R141-N143 PolarHBondContact O-ND2 2.67Å; R141-N143 VanDerWaalsContact O-ND2 3.08Å
142	L	86	Confident	89.4	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.01	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	141.8	175.6	-170.4	60.1	0	0	0	111.4	F101 E105 A114 M115 I118 V135 L144	F101-L142 HydrophobicContact CB-CB 4.5Å; F101-L142 HydrophobicContact CD2-CB 4.33Å; F101-L142 PolarHBondContact N-O 3.29Å; E105-L142 HydrophobicContact CG-CB 3.84Å; A114-L142 HydrophobicContact CB-CD2 3.46Å; A114-L142 VanDerWaalsContact CB-CD2 3.46Å; M115-L142 HydrophobicContact CE-CD1 4.41Å; M115-L142 HydrophobicContact CE-CD2 4.05Å; I118-L142 HydrophobicContact CD1-CD1 4.49Å; I118-L142 HydrophobicContact CD1-CD2 3.91Å; V135-L142 HydrophobicContact CG1-CD1 3.48Å; V135-L142 VanDerWaalsContact CG1-CD1 3.48Å; V135-L142 HydrophobicContact CG1-CG 4.38Å; L142-L144 HydrophobicContact CD2-CD1 4.06Å; L142-L144 HydrophobicContact CG-CD1 3.82Å
143	N	89.1	Confident	89.5	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	121.3	-178.4	-51	-98.2	0	0	0	108.8	I98 K99 Q100 V135 F136 R141	I98-N143 HydrophobicContact CG2-CB 3.93Å; K99-N143 WeakPolarHBondContact O-CA 3.41Å; Q100-N143 WeakPolarHBondContact CG-OD1 3.46Å; Q100-N143 PolarHBondContact NE2-OD1 3.33Å; V135-N143 WeakPolarHBondContact CA-O 3.35Å; F136-N143 HydrophobicContact CD1-CB 4.09Å; F136-N143 HydrophobicContact CD2-CB 4Å; F136-N143 HydrophobicContact CE1-CB 3.74Å; F136-N143 HydrophobicContact CE2-CB 3.63Å; F136-N143 VanDerWaalsContact CE2-CG 3.49Å; F136-N143 WeakPolarHBondContact CE2-ND2 3.41Å; F136-N143 HydrophobicContact CG-CB 4.21Å; F136-N143 HydrophobicContact CZ-CB 3.48Å; F136-N143 VanDerWaalsContact CZ-CB 3.48Å; F136-N143 PolarHBondContact N-O 2.9Å; F136-N143 WeakPolarHBondContact O-CB 3.41Å; F136-N143 PolarHBondContact O-N 2.95Å; F136-N143 PolarHBondContact O-ND2 2.83Å; F136-N143 VanDerWaalsContact O-ND2 3.1Å; R141-N143 PolarHBondContact O-ND2 2.67Å; R141-N143 VanDerWaalsContact O-ND2 3.08Å
144	L	90.3	Very high	89.5	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	123.7	175.1	-80.6	57.1	0	0	0	108.4	I98 K99 F101 E117 I118 L121 L132 V135 L142 F146	I98-L144 WeakPolarHBondContact CA-O 3.3Å; K99-L144 HydrophobicContact CB-CB 4.49Å; K99-L144 PolarHBondContact N-O 3.4Å; K99-L144 PolarHBondContact O-N 3.37Å; F101-L144 HydrophobicContact CD2-CD1 4.33Å; F101-L144 HydrophobicContact CE2-CD1 3.85Å; F101-L144 HydrophobicContact CE2-CD2 4.33Å; E117-L144 HydrophobicContact CG-CD2 4.4Å; I118-L144 HydrophobicContact CD1-CD1 4.02Å; I118-L144 HydrophobicContact CG1-CD1 4.11Å; I118-L144 HydrophobicContact CG1-CD2 4.06Å; I118-L144 HydrophobicContact CG1-CG 4.08Å; L121-L144 HydrophobicContact CD1-CD2 4.12Å; L132-L144 HydrophobicContact CD1-CB 3.8Å; L132-L144 HydrophobicContact CD1-CD2 4.45Å; L132-L144 HydrophobicContact CD1-CG 4.03Å; V135-L144 HydrophobicContact CG1-CD1 4.34Å; V135-L144 HydrophobicContact CG2-CG 4.33Å; L142-L144 HydrophobicContact CD2-CD1 4.06Å; L142-L144 HydrophobicContact CG-CD1 3.82Å; L144-F146 HydrophobicContact CB-CD2 4.26Å; L144-F146 HydrophobicContact CB-CE2 3.51Å; L144-F146 HydrophobicContact CB-CZ 4.04Å; L144-F146 HydrophobicContact CD2-CE2 4.28Å; L144-F146 HydrophobicContact CD2-CZ 4.05Å
145	V	92.9	Very high	89.5	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	119.8	-179.1	-173.2	0	0	0	0	109.5	Y70 V96 I98 I133 E134 F136	Y70-V145 HydrophobicContact CE2-CG1 4.24Å; Y70-V145 HydrophobicContact CE2-CG2 4.05Å; V96-V145 HydrophobicContact CB-CG1 3.88Å; V96-V145 HydrophobicContact CG1-CG1 4.07Å; V96-V145 HydrophobicContact CG2-CG1 4.05Å; I98-V145 HydrophobicContact CD1-CG1 4.39Å; I98-V145 HydrophobicContact CD1-CG2 4.08Å; I98-V145 HydrophobicContact CG1-CB 4.44Å; I98-V145 HydrophobicContact CG1-CG1 4.17Å; I98-V145 HydrophobicContact CG1-CG2 4.13Å; I133-V145 HydrophobicContact CB-CG1 4.3Å; I133-V145 WeakPolarHBondContact CB-O 3.43Å; I133-V145 HydrophobicContact CD1-CG1 4.44Å; I133-V145 PolarHBondContact N-O 2.77Å; E134-V145 HydrophobicContact CG-CB 3.84Å; E134-V145 HydrophobicContact CG-CG1 4.46Å; E134-V145 HydrophobicContact CG-CG2 3.74Å; E134-V145 PolarHBondContact N-O 2.95Å; E134-V145 PolarHBondContact O-N 2.99Å; F136-V145 HydrophobicContact CD1-CG2 3.75Å; F136-V145 HydrophobicContact CE1-CG2 3.52Å
146	F	94	Very high	89.6	Confident	19 Å²	19	34 Å²	34	8%	0.083	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	158.7	179.8	-62.7	-92.2	0	0	0	111.3	V96 A97 K99 L121 V130 N131 L132 L144 F148	V96-F146 WeakPolarHBondContact CA-O 3.4Å; V96-F146 WeakPolarHBondContact CB-O 3.46Å; A97-F146 HydrophobicContact CB-CB 4.34Å; A97-F146 PolarHBondContact N-O 3.23Å; A97-F146 PolarHBondContact O-N 3.32Å; K99-F146 HydrophobicContact CB-CE2 3.99Å; K99-F146 HydrophobicContact CD-CE2 4.44Å; L121-F146 HydrophobicContact CD1-CE1 3.54Å; L121-F146 HydrophobicContact CD1-CZ 3.57Å; L121-F146 HydrophobicContact CD2-CE1 4.07Å; L121-F146 HydrophobicContact CG-CE1 4.43Å; V130-F146 HydrophobicContact CG1-CD1 3.92Å; V130-F146 HydrophobicContact CG1-CE1 4.16Å; V130-F146 HydrophobicContact CG2-CB 4.12Å; V130-F146 HydrophobicContact CG2-CD1 4.15Å; N131-F146 WeakPolarHBondContact O-CA 3.47Å; L132-F146 HydrophobicContact CB-CD1 4.24Å; L132-F146 HydrophobicContact CB-CE1 4.17Å; L132-F146 HydrophobicContact CD1-CD1 4.28Å; L132-F146 HydrophobicContact CD1-CE1 4.04Å; L132-F146 HydrophobicContact CD1-CE2 4.36Å; L132-F146 HydrophobicContact CD1-CZ 4.09Å; L144-F146 HydrophobicContact CB-CD2 4.26Å; L144-F146 HydrophobicContact CB-CE2 3.51Å; L144-F146 HydrophobicContact CB-CZ 4.04Å; L144-F146 HydrophobicContact CD2-CE2 4.28Å; L144-F146 HydrophobicContact CD2-CZ 4.05Å; F146-F148 PolarHBondContact O-N 3.46Å
147	Q	93.8	Very high	89.7	Confident	43 Å²	43	34.2 Å²	34.2	20%	0.201	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	134.6	164	66	174	118	0	0	110.6	V130 N131 I133	V130-Q147 HydrophobicContact CG2-CG 3.79Å; N131-Q147 HydrophobicContact CB-CG 4.38Å; N131-Q147 PolarHBondContact O-N 2.74Å; I133-Q147 HydrophobicContact CD1-CB 4.49Å
148	F	95.7	Very high	89.8	Confident	34 Å²	34	33.1 Å²	33.1	15%	0.149	15%	0.153	C	C	.	.			trans	-76.7	143.4	172	-171.7	-105.1	0	0	0	110.5	I76 K86 L95 A97 F146 D150	I76-F148 HydrophobicContact CD1-CD2 4.3Å; I76-F148 HydrophobicContact CD1-CE2 3.79Å; K86-F148 HydrophobicContact CB-CD2 4.4Å; K86-F148 HydrophobicContact CB-CE2 3.99Å; K86-F148 HydrophobicContact CD-CD2 4.36Å; K86-F148 HydrophobicContact CD-CE1 4Å; K86-F148 HydrophobicContact CD-CE2 3.73Å; K86-F148 HydrophobicContact CD-CZ 3.54Å; K86-F148 VanDerWaalsContact CE-CE1 3.42Å; K86-F148 HydrophobicContact CG-CD2 3.97Å; K86-F148 HydrophobicContact CG-CE2 3.72Å; K86-F148 HydrophobicContact CG-CZ 4.06Å; L95-F148 VanDerWaalsContact C-CB 3.47Å; L95-F148 HydrophobicContact CB-CB 3.8Å; L95-F148 HydrophobicContact CB-CD1 3.95Å; L95-F148 HydrophobicContact CB-CG 4.05Å; L95-F148 HydrophobicContact CD1-CD1 4.17Å; L95-F148 VanDerWaalsContact O-CB 3.25Å; L95-F148 WeakPolarHBondContact O-CB 3.16Å; L95-F148 PolarHBondContact O-N 3.41Å; A97-F148 HydrophobicContact CB-CD2 4.21Å; F146-F148 PolarHBondContact O-N 3.46Å; F148-D150 WeakPolarHBondContact CE1-OD1 3.4Å
149	I	95.3	Very high	89.8	Confident	20 Å²	20	38.4 Å²	38.4	10%	0.103	18%	0.178	C	C	.	.			trans	-129.3	134.6	169.2	-60.4	-66.9	0	0	0	107.1	N151 L199 I200 N201 K207	I149-N151 VanDerWaalsContact C-N 3.34Å; I149-N151 PolarHBondContact O-N 3.28Å; I149-L199 HydrophobicContact CB-CB 3.93Å; I149-L199 HydrophobicContact CB-CD1 4.19Å; I149-L199 HydrophobicContact CG1-CB 4.29Å; I149-L199 HydrophobicContact CG1-CD1 4.35Å; I149-L199 HydrophobicContact CG2-CB 3.77Å; I149-I200 VanDerWaalsContact CG2-C 3.48Å; I149-I200 WeakPolarHBondContact CG2-O 3.24Å; I149-N201 HydrophobicContact CD1-CB 4.42Å; I149-N201 HydrophobicContact CG2-CB 4.17Å; I149-K207 HydrophobicContact CD1-CG 3.87Å; I149-K207 HydrophobicContact CG1-CB 4.19Å; I149-K207 HydrophobicContact CG1-CG 4.06Å
150	D	88	Confident	89.3	Confident	71 Å²	71	38.3 Å²	38.3	38%	0.38	17%	0.174	S	C	.	.	S	Bend	trans	-66.4	-29	-169.5	-78.2	-33.1	0	0	0	114.5	F148 K202	F148-D150 WeakPolarHBondContact CE1-OD1 3.4Å; D150-K202 VanDerWaalsContact OD2-CE 3.26Å; D150-K202 WeakPolarHBondContact OD2-CE 3.49Å; D150-K202 IonicContact OD2-NZ 3.41Å; D150-K202 PolarHBondContact OD2-NZ 3Å
151	N	92.7	Very high	88.3	Confident	27 Å²	27	39 Å²	39	14%	0.144	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	163	-170.3	-142.8	23	0	0	0	113.2	I149 N155 E156 L199 I200	I149-N151 VanDerWaalsContact C-N 3.34Å; I149-N151 PolarHBondContact O-N 3.28Å; N151-N155 WeakPolarHBondContact OD1-CB 3.25Å; N151-N155 PolarHBondContact OD1-ND2 2.94Å; N151-E156 PolarHBondContact ND2-OE2 3.15Å; N151-L199 WeakPolarHBondContact O-CA 3.34Å; N151-I200 WeakPolarHBondContact CB-O 3.36Å; N151-I200 PolarHBondContact N-O 3.24Å; N151-I200 PolarHBondContact O-N 3.33Å
152	S	94	Very high	87.4	Confident	12 Å²	12	44 Å²	44	8%	0.084	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	163.8	167.1	65.3	0	0	0	0	111	L154 N155 E156 I198	S152-L154 VanDerWaalsContact C-N 3.28Å; S152-L154 PolarHBondContact O-N 3.02Å; S152-N155 PolarHBondContact O-N 2.76Å; S152-N155 VanDerWaalsContact OG-CG 3.22Å; S152-N155 PolarHBondContact OG-N 3Å; S152-N155 PolarHBondContact OG-OD1 3.18Å; S152-E156 WeakPolarHBondContact O-CB 3.45Å; S152-E156 PolarHBondContact O-N 3.44Å; S152-I198 CarbonylContact C-O 3.2Å; S152-I198 WeakPolarHBondContact CA-O 3.34Å
153	L	95.5	Very high	86.7	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.8	-38.5	172.7	177.2	59.2	0	0	0	111.2	E156 M157 L164 I172 P195 I198 I200 V257 M261	L153-E156 PolarHBondContact O-N 2.93Å; L153-M157 HydrophobicContact CD1-CG 4.07Å; L153-M157 HydrophobicContact CD1-SD 3.84Å; L153-M157 HydrophobicContact CG-SD 3.9Å; L153-M157 VanDerWaalsContact O-CG 3.25Å; L153-M157 WeakPolarHBondContact O-CG 3.37Å; L153-M157 PolarHBondContact O-N 3.38Å; L153-L164 HydrophobicContact CD1-CD1 3.92Å; L153-I172 HydrophobicContact CD1-CD1 4.14Å; L153-I172 HydrophobicContact CD2-CG2 4.3Å; L153-P195 HydrophobicContact CB-CB 4.13Å; L153-P195 WeakPolarHBondContact CB-O 3.37Å; L153-P195 HydrophobicContact CD2-CB 4.27Å; L153-P195 HydrophobicContact CG-CB 4.07Å; L153-P195 PolarHBondContact N-O 3.21Å; L153-I198 HydrophobicContact CB-CB 3.99Å; L153-I198 HydrophobicContact CB-CG2 3.93Å; L153-I198 HydrophobicContact CD2-CB 4.34Å; L153-I198 HydrophobicContact CD2-CD1 3.99Å; L153-I198 HydrophobicContact CD2-CG2 4.09Å; L153-I198 PolarHBondContact N-O 2.81Å; L153-I200 HydrophobicContact CB-CD1 3.86Å; L153-I200 HydrophobicContact CB-CG1 4.48Å; L153-I200 HydrophobicContact CD1-CD1 3.83Å; L153-I200 HydrophobicContact CG-CD1 4.4Å; L153-V257 HydrophobicContact CD2-CG1 3.67Å; L153-M261 HydrophobicContact CD1-CG 4.12Å; L153-M261 HydrophobicContact CD1-SD 3.86Å; L153-M261 HydrophobicContact CD2-CG 4.09Å; L153-M261 HydrophobicContact CD2-SD 3.87Å
154	L	92.9	Very high	86.5	Confident	6 Å²	6	47.7 Å²	47.7	3%	0.031	22%	0.224	C	C	.	.	H	α-helix	trans	-56	-54.6	173.5	179.1	62.6	0	0	0	110.9	S152 E156 M157 E158 P195 E196 I614	S152-L154 VanDerWaalsContact C-N 3.28Å; S152-L154 PolarHBondContact O-N 3.02Å; L154-E156 VanDerWaalsContact C-N 3.29Å; L154-E156 PolarHBondContact O-N 2.74Å; L154-M157 PolarHBondContact O-N 3.2Å; L154-M157 VanDerWaalsContact O-N 3.08Å; L154-E158 HydrophobicContact CD1-CG 3.96Å; L154-E158 HydrophobicContact CG-CG 4.25Å; L154-E158 WeakPolarHBondContact O-CG 3.46Å; L154-E158 PolarHBondContact O-N 2.81Å; L154-P195 HydrophobicContact CB-CB 3.95Å; L154-P195 PolarHBondContact N-O 3.06Å; L154-E196 HydrophobicContact CD2-CG 3.88Å; L154-I614 HydrophobicContact CD1-CB 4.35Å; L154-I614 HydrophobicContact CD1-CG2 4.1Å
155	N	91.1	Very high	86.4	Confident	45 Å²	45	52.5 Å²	52.5	24%	0.241	25%	0.25	C	S	.	.	H	α-helix	trans	-59.7	-40.3	-179.8	-68.2	-0.3	0	0	0	112	N151 S152 M157 E158 Q159	N151-N155 WeakPolarHBondContact OD1-CB 3.25Å; N151-N155 PolarHBondContact OD1-ND2 2.94Å; S152-N155 PolarHBondContact O-N 2.76Å; S152-N155 VanDerWaalsContact OG-CG 3.22Å; S152-N155 PolarHBondContact OG-N 3Å; S152-N155 PolarHBondContact OG-OD1 3.18Å; N155-M157 PolarHBondContact O-N 3.45Å; N155-E158 PolarHBondContact O-N 3.41Å; N155-Q159 WeakPolarHBondContact O-CB 3.36Å; N155-Q159 WeakPolarHBondContact O-CG 3.41Å; N155-Q159 PolarHBondContact O-N 3.12Å; N155-Q159 PolarHBondContact O-NE2 3.18Å
156	E	91.5	Very high	86.4	Confident	22 Å²	22	55.8 Å²	55.8	10%	0.103	27%	0.265	C	S	.	.	H	α-helix	trans	-64.8	-25.5	178.6	-177.1	67	-151	0	0	112.7	N151 S152 L153 L154 R160 L164 K168	N151-E156 PolarHBondContact ND2-OE2 3.15Å; S152-E156 WeakPolarHBondContact O-CB 3.45Å; S152-E156 PolarHBondContact O-N 3.44Å; L153-E156 PolarHBondContact O-N 2.93Å; L154-E156 VanDerWaalsContact C-N 3.29Å; L154-E156 PolarHBondContact O-N 2.74Å; E156-R160 VanDerWaalsContact O-CD 3.26Å; E156-R160 WeakPolarHBondContact O-CD 3.42Å; E156-R160 WeakPolarHBondContact O-CG 3.37Å; E156-R160 PolarHBondContact O-NE 3.44Å; E156-R160 IonicContact OE1-CZ 2.82Å; E156-R160 VanDerWaalsContact OE1-CZ 3.23Å; E156-R160 IonicContact OE1-NE 2.73Å; E156-R160 PolarHBondContact OE1-NE 3.42Å; E156-R160 IonicContact OE1-NH2 2.77Å; E156-R160 PolarHBondContact OE1-NH2 2.8Å; E156-L164 HydrophobicContact CG-CD2 4.12Å; E156-K168 IonicContact OE1-NZ 2.87Å; E156-K168 PolarHBondContact OE1-NZ 2.79Å; E156-K168 IonicContact OE2-NZ 2.74Å
157	M	91.5	Very high	86.3	Confident	18 Å²	18	56 Å²	56	9%	0.089	27%	0.272	C	S	.	.	H	α-helix	trans	-86.9	-46.3	174.7	-67.7	176.7	61.3	0	0	111.8	L153 L154 N155 Q159 R160 L164 E260 M261	L153-M157 HydrophobicContact CD1-CG 4.07Å; L153-M157 HydrophobicContact CD1-SD 3.84Å; L153-M157 HydrophobicContact CG-SD 3.9Å; L153-M157 VanDerWaalsContact O-CG 3.25Å; L153-M157 WeakPolarHBondContact O-CG 3.37Å; L153-M157 PolarHBondContact O-N 3.38Å; L154-M157 PolarHBondContact O-N 3.2Å; L154-M157 VanDerWaalsContact O-N 3.08Å; N155-M157 PolarHBondContact O-N 3.45Å; M157-Q159 VanDerWaalsContact C-N 3.26Å; M157-Q159 PolarHBondContact O-N 3.17Å; M157-R160 PolarHBondContact O-N 2.82Å; M157-L164 HydrophobicContact CG-CD1 3.71Å; M157-L164 HydrophobicContact CG-CG 4.17Å; M157-L164 HydrophobicContact SD-CD1 4.21Å; M157-E260 HydrophobicContact CE-CG 3.68Å; M157-E260 WeakPolarHBondContact CE-O 3.18Å; M157-M261 HydrophobicContact SD-CG 3.9Å
158	E	87.2	Confident	86.3	Confident	39 Å²	39	55 Å²	55	18%	0.182	27%	0.267	C	S	.	.	H	α-helix	trans	-62	-30.5	176.9	-68.6	-171.4	134	0	0	112.8	L154 N155 R160 I614 R615	L154-E158 HydrophobicContact CD1-CG 3.96Å; L154-E158 HydrophobicContact CG-CG 4.25Å; L154-E158 WeakPolarHBondContact O-CG 3.46Å; L154-E158 PolarHBondContact O-N 2.81Å; N155-E158 PolarHBondContact O-N 3.41Å; E158-R160 PolarHBondContact O-N 3.34Å; E158-I614 HydrophobicContact CG-CB 4.46Å; E158-I614 PolarHBondContact OE1-N 3.27Å; E158-R615 VanDerWaalsContact OE1-CB 3.29Å; E158-R615 WeakPolarHBondContact OE1-CB 3.34Å; E158-R615 PolarHBondContact OE1-N 3.3Å
159	Q	81.5	Confident	86.3	Confident	128 Å²	128	53.4 Å²	53.4	60%	0.598	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-6.6	174.9	-75.1	170	38.9	0	0	114	N155 M157	N155-Q159 WeakPolarHBondContact O-CB 3.36Å; N155-Q159 WeakPolarHBondContact O-CG 3.41Å; N155-Q159 PolarHBondContact O-N 3.12Å; N155-Q159 PolarHBondContact O-NE2 3.18Å; M157-Q159 VanDerWaalsContact C-N 3.26Å; M157-Q159 PolarHBondContact O-N 3.17Å
160	R	71.6	Confident	86.3	Confident	108 Å²	108	56.2 Å²	56.2	41%	0.408	27%	0.269	S	S	.	.			trans	-126.8	101.4	-172.7	-60.9	177	179.9	-108.9	-2.7	111.1	E156 M157 E158 R162	E156-R160 VanDerWaalsContact O-CD 3.26Å; E156-R160 WeakPolarHBondContact O-CD 3.42Å; E156-R160 WeakPolarHBondContact O-CG 3.37Å; E156-R160 PolarHBondContact O-NE 3.44Å; E156-R160 IonicContact OE1-CZ 2.82Å; E156-R160 VanDerWaalsContact OE1-CZ 3.23Å; E156-R160 IonicContact OE1-NE 2.73Å; E156-R160 PolarHBondContact OE1-NE 3.42Å; E156-R160 IonicContact OE1-NH2 2.77Å; E156-R160 PolarHBondContact OE1-NH2 2.8Å; M157-R160 PolarHBondContact O-N 2.82Å; E158-R160 PolarHBondContact O-N 3.34Å; R160-R162 VanDerWaalsContact CB-O 3.31Å; R160-R162 WeakPolarHBondContact CB-O 3.09Å; R160-R162 PolarHBondContact O-N 3Å
161	P	59.1	Low	86.7	Confident	118 Å²	118	57.9 Å²	57.9	77%	0.766	27%	0.273	S	S	*	.	S	Bend	trans	-67.9	6.6	170.2	29.8	-36.4	0	0	0	113.7
162	R	61.4	Low	86.9	Confident	212 Å²	212	56.6 Å²	56.6	80%	0.8	27%	0.266	S	S	*	.	S	Bend	trans	-126.4	135	169.4	-73.6	-176.9	-79	-178.6	-6	108.3	R160	R160-R162 VanDerWaalsContact CB-O 3.31Å; R160-R162 WeakPolarHBondContact CB-O 3.09Å; R160-R162 PolarHBondContact O-N 3Å
163	K	71.2	Confident	87.1	Confident	69 Å²	69	56.1 Å²	56.1	30%	0.3	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-47.4	151.6	-177.3	-64.3	164.1	178.7	-130.1	0	112.4	L262 L263 T322 L325	K163-L262 VanDerWaalsContact CD-O 3.3Å; K163-L262 WeakPolarHBondContact CD-O 3.3Å; K163-L262 PolarHBondContact NZ-O 3.28Å; K163-L263 WeakPolarHBondContact CE-O 3.29Å; K163-L263 PolarHBondContact NZ-O 3.28Å; K163-T322 PolarHBondContact NZ-O 3.17Å; K163-L325 HydrophobicContact CD-CD2 4.45Å
164	L	84.8	Confident	87.3	Confident	10 Å²	10	56.8 Å²	56.8	5%	0.052	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-59.5	145.3	175.7	-71.3	173	0	0	0	110.7	L153 E156 M157 K166 K168 I169 I172 M261	L153-L164 HydrophobicContact CD1-CD1 3.92Å; E156-L164 HydrophobicContact CG-CD2 4.12Å; M157-L164 HydrophobicContact CG-CD1 3.71Å; M157-L164 HydrophobicContact CG-CG 4.17Å; M157-L164 HydrophobicContact SD-CD1 4.21Å; L164-K166 PolarHBondContact O-N 3.11Å; L164-K168 HydrophobicContact CD2-CD 4.26Å; L164-I169 HydrophobicContact CB-CD1 3.92Å; L164-I169 HydrophobicContact CB-CG1 3.59Å; L164-I169 HydrophobicContact CD1-CG1 4.45Å; L164-I169 WeakPolarHBondContact O-CD1 3.33Å; L164-I172 HydrophobicContact CD1-CD1 4.49Å; L164-M261 HydrophobicContact CD1-CB 4.36Å; L164-M261 HydrophobicContact CD1-CG 3.97Å; L164-M261 HydrophobicContact CD1-SD 4.14Å
165	D	89.7	Confident	87.5	Confident	102 Å²	102	57.7 Å²	57.7	55%	0.545	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-58.9	134.2	172.1	157.5	54	0	0	0	110.4	G167 K168 I169	D165-G167 VanDerWaalsContact CG-N 3.25Å; D165-G167 PolarHBondContact O-N 3.27Å; D165-G167 VanDerWaalsContact O-N 3.15Å; D165-G167 PolarHBondContact OD1-N 3.2Å; D165-G167 VanDerWaalsContact OD1-N 3.1Å; D165-G167 WeakPolarHBondContact OD2-CA 3.47Å; D165-G167 PolarHBondContact OD2-N 2.88Å; D165-K168 HydrophobicContact CB-CB 4.32Å; D165-K168 CarbonylContact O-C 3.58Å; D165-K168 WeakPolarHBondContact O-CA 3.48Å; D165-K168 WeakPolarHBondContact O-CB 3.23Å; D165-K168 PolarHBondContact O-N 2.85Å; D165-K168 PolarHBondContact OD2-N 2.93Å; D165-I169 WeakPolarHBondContact O-CG1 3.45Å; D165-I169 PolarHBondContact O-N 2.9Å
166	K	91.7	Very high	87.9	Confident	69 Å²	69	55.7 Å²	55.7	30%	0.3	26%	0.259	S	S	.	.	H	α-helix	trans	-58.2	-28	178.8	-71.4	-173.2	165.9	-155.6	0	112.8	L164 R170 L262 E331	L164-K166 PolarHBondContact O-N 3.11Å; K166-R170 WeakPolarHBondContact O-CB 3.19Å; K166-R170 PolarHBondContact O-N 2.9Å; K166-R170 VanDerWaalsContact O-N 3.08Å; K166-L262 HydrophobicContact CG-CD2 4.28Å; K166-E331 WeakPolarHBondContact CD-OE1 3.41Å; K166-E331 WeakPolarHBondContact CE-OE1 3.26Å; K166-E331 IonicContact NZ-OE1 2.78Å; K166-E331 PolarHBondContact NZ-OE1 3.49Å; K166-E331 IonicContact NZ-OE2 2.7Å; K166-E331 PolarHBondContact NZ-OE2 2.95Å
167	G	93	Very high	88.2	Confident	22 Å²	22	54.7 Å²	54.7	23%	0.227	25%	0.254	C	S	.	.	H	α-helix	trans	-66	-47.8	169.7	0	0	0	0	0	113.2	D165 R170 K171	D165-G167 VanDerWaalsContact CG-N 3.25Å; D165-G167 PolarHBondContact O-N 3.27Å; D165-G167 VanDerWaalsContact O-N 3.15Å; D165-G167 PolarHBondContact OD1-N 3.2Å; D165-G167 VanDerWaalsContact OD1-N 3.1Å; D165-G167 WeakPolarHBondContact OD2-CA 3.47Å; D165-G167 PolarHBondContact OD2-N 2.88Å; G167-R170 PolarHBondContact O-N 2.82Å; G167-K171 PolarHBondContact O-N 2.79Å; G167-K171 VanDerWaalsContact O-N 3.13Å
168	K	93.3	Very high	88.5	Confident	22 Å²	22	54.5 Å²	54.5	10%	0.096	25%	0.253	C	S	.	.	H	α-helix	trans	-62.3	-43.8	173.2	178.2	161.6	177.9	162.1	0	112	E156 L164 D165 R170 K171 I172 N204	E156-K168 IonicContact OE1-NZ 2.87Å; E156-K168 PolarHBondContact OE1-NZ 2.79Å; E156-K168 IonicContact OE2-NZ 2.74Å; L164-K168 HydrophobicContact CD2-CD 4.26Å; D165-K168 HydrophobicContact CB-CB 4.32Å; D165-K168 CarbonylContact O-C 3.58Å; D165-K168 WeakPolarHBondContact O-CA 3.48Å; D165-K168 WeakPolarHBondContact O-CB 3.23Å; D165-K168 PolarHBondContact O-N 2.85Å; D165-K168 PolarHBondContact OD2-N 2.93Å; K168-R170 PolarHBondContact O-N 3.24Å; K168-K171 PolarHBondContact O-N 3.36Å; K168-I172 HydrophobicContact CD-CD1 4.31Å; K168-I172 HydrophobicContact CG-CD1 3.61Å; K168-I172 HydrophobicContact CG-CG1 4.32Å; K168-I172 WeakPolarHBondContact O-CG1 3.31Å; K168-I172 PolarHBondContact O-N 2.77Å; K168-N204 WeakPolarHBondContact CD-OD1 3.34Å; K168-N204 WeakPolarHBondContact CE-OD1 3.47Å; K168-N204 PolarHBondContact NZ-OD1 3.24Å
169	I	95.3	Very high	89	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	24%	0.244	C	C	.	.	H	α-helix	trans	-56.5	-48.6	175.3	-63.7	176.2	0	0	0	110.7	L164 D165 K171 I172 T173 F258 M261 L262	L164-I169 HydrophobicContact CB-CD1 3.92Å; L164-I169 HydrophobicContact CB-CG1 3.59Å; L164-I169 HydrophobicContact CD1-CG1 4.45Å; L164-I169 WeakPolarHBondContact O-CD1 3.33Å; D165-I169 WeakPolarHBondContact O-CG1 3.45Å; D165-I169 PolarHBondContact O-N 2.9Å; I169-K171 PolarHBondContact O-N 2.97Å; I169-I172 PolarHBondContact O-N 2.71Å; I169-T173 WeakPolarHBondContact O-CB 3.36Å; I169-T173 PolarHBondContact O-N 3.25Å; I169-T173 PolarHBondContact O-OG1 3.46Å; I169-F258 HydrophobicContact CG2-CD2 4.04Å; I169-F258 HydrophobicContact CG2-CE2 4Å; I169-M261 HydrophobicContact CD1-CB 4.14Å; I169-M261 WeakPolarHBondContact CD1-O 3.42Å; I169-M261 HydrophobicContact CG1-CB 4.04Å; I169-M261 HydrophobicContact CG2-CB 4.07Å; I169-M261 HydrophobicContact CG2-CE 4.06Å; I169-M261 HydrophobicContact CG2-SD 4.34Å; I169-L262 HydrophobicContact CD1-CD2 3.71Å; I169-L262 HydrophobicContact CD1-CG 4.12Å; I169-L262 HydrophobicContact CG2-CG 4.46Å
170	R	96.3	Very high	89.8	Confident	79 Å²	79	46.6 Å²	46.6	30%	0.298	22%	0.216	S	C	.	.	H	α-helix	trans	-57	-47.4	177.2	-172.2	-175.8	-65	108.4	4.5	111.8	K166 G167 K168 W174 Y357 F358	K166-R170 WeakPolarHBondContact O-CB 3.19Å; K166-R170 PolarHBondContact O-N 2.9Å; K166-R170 VanDerWaalsContact O-N 3.08Å; G167-R170 PolarHBondContact O-N 2.82Å; K168-R170 PolarHBondContact O-N 3.24Å; R170-W174 VanDerWaalsContact O-CB 3.3Å; R170-W174 WeakPolarHBondContact O-CB 3.37Å; R170-W174 PolarHBondContact O-N 2.97Å; R170-Y357 HydrophobicContact CB-CE1 4.01Å; R170-Y357 HydrophobicContact CG-CD1 4.38Å; R170-Y357 HydrophobicContact CG-CE1 3.79Å; R170-Y357 PolarHBondContact NE-O 3.08Å; R170-Y357 VanDerWaalsContact NE-O 3.09Å; R170-F358 HydrophobicContact CG-CD1 3.63Å; R170-F358 HydrophobicContact CG-CE1 3.93Å
171	K	96.1	Very high	91	Very high	107 Å²	107	42.1 Å²	42.1	47%	0.465	20%	0.2	S	C	.	.	H	α-helix	trans	-66.2	-34.6	179.5	-73.6	-177	176.3	-173.8	0	113.7	G167 K168 I169 Q175 H361	G167-K171 PolarHBondContact O-N 2.79Å; G167-K171 VanDerWaalsContact O-N 3.13Å; K168-K171 PolarHBondContact O-N 3.36Å; I169-K171 PolarHBondContact O-N 2.97Å; K171-Q175 WeakPolarHBondContact O-CG 3.45Å; K171-Q175 PolarHBondContact O-N 2.91Å; K171-Q175 PolarHBondContact O-NE2 2.87Å; K171-H361 VanDerWaalsContact CE-NE2 3.29Å; K171-H361 WeakPolarHBondContact CE-NE2 3.3Å
172	I	97.1	Very high	92.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-70.1	-51.4	175.9	-70.5	165	0	0	0	109.8	L153 L164 K168 I169 W174 Q175 I176 I200 V206 M261	L153-I172 HydrophobicContact CD1-CD1 4.14Å; L153-I172 HydrophobicContact CD2-CG2 4.3Å; L164-I172 HydrophobicContact CD1-CD1 4.49Å; K168-I172 HydrophobicContact CD-CD1 4.31Å; K168-I172 HydrophobicContact CG-CD1 3.61Å; K168-I172 HydrophobicContact CG-CG1 4.32Å; K168-I172 WeakPolarHBondContact O-CG1 3.31Å; K168-I172 PolarHBondContact O-N 2.77Å; I169-I172 PolarHBondContact O-N 2.71Å; I172-W174 VanDerWaalsContact C-N 3.3Å; I172-W174 PolarHBondContact O-N 2.83Å; I172-Q175 PolarHBondContact O-N 3.46Å; I172-Q175 VanDerWaalsContact O-N 3.12Å; I172-I176 HydrophobicContact CG2-CD1 3.63Å; I172-I176 HydrophobicContact CG2-CG1 4.33Å; I172-I176 WeakPolarHBondContact O-CG1 3.45Å; I172-I176 PolarHBondContact O-N 2.78Å; I172-I200 HydrophobicContact CD1-CD1 3.73Å; I172-I200 HydrophobicContact CG1-CD1 4.02Å; I172-I200 HydrophobicContact CG2-CD1 4.38Å; I172-V206 HydrophobicContact CB-CG2 4.28Å; I172-V206 HydrophobicContact CG1-CG2 4.2Å; I172-V206 HydrophobicContact CG2-CG2 4.06Å; I172-M261 HydrophobicContact CB-CE 4.49Å; I172-M261 HydrophobicContact CB-SD 4.11Å; I172-M261 HydrophobicContact CD1-SD 4.25Å; I172-M261 HydrophobicContact CG2-CE 4.02Å; I172-M261 HydrophobicContact CG2-SD 3.7Å
173	T	98.2	Very high	94.4	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.006	14%	0.136	C	C	.	.	H	α-helix	trans	-57.5	-43.1	-179.7	-47.7	0	0	0	0	111.7	I169 Q175 I176 L177 F258 M261 F334 F358	I169-T173 WeakPolarHBondContact O-CB 3.36Å; I169-T173 PolarHBondContact O-N 3.25Å; I169-T173 PolarHBondContact O-OG1 3.46Å; T173-Q175 PolarHBondContact O-N 2.82Å; T173-I176 PolarHBondContact O-N 3.3Å; T173-L177 WeakPolarHBondContact O-CG 3.32Å; T173-L177 PolarHBondContact O-N 3.2Å; T173-F258 HydrophobicContact CG2-CB 4.49Å; T173-F258 HydrophobicContact CG2-CD2 3.91Å; T173-F258 WeakPolarHBondContact OG1-CD2 3.42Å; T173-M261 WeakPolarHBondContact OG1-CE 3.07Å; T173-F334 HydrophobicContact CG2-CE1 3.73Å; T173-F334 HydrophobicContact CG2-CZ 3.63Å; T173-F358 HydrophobicContact CG2-CZ 4.14Å
174	W	98.2	Very high	95.6	Very high	15 Å²	15	26.9 Å²	26.9	6%	0.057	13%	0.128	C	C	.	.	H	α-helix	trans	-57.7	-47	175.1	-179	-101.9	0	0	0	112.9	R170 I172 L177 L178 L353 F358 E365	R170-W174 VanDerWaalsContact O-CB 3.3Å; R170-W174 WeakPolarHBondContact O-CB 3.37Å; R170-W174 PolarHBondContact O-N 2.97Å; I172-W174 VanDerWaalsContact C-N 3.3Å; I172-W174 PolarHBondContact O-N 2.83Å; W174-L177 WeakPolarHBondContact O-CB 3.39Å; W174-L177 PolarHBondContact O-N 2.74Å; W174-L178 WeakPolarHBondContact O-CG 3.28Å; W174-L178 PolarHBondContact O-N 2.71Å; W174-L353 HydrophobicContact CD2-CD2 3.8Å; W174-L353 HydrophobicContact CE3-CD2 3.54Å; W174-L353 HydrophobicContact CH2-CB 4.37Å; W174-L353 HydrophobicContact CH2-CD2 3.97Å; W174-L353 VanDerWaalsContact CH2-O 3.28Å; W174-L353 WeakPolarHBondContact CH2-O 3.43Å; W174-L353 HydrophobicContact CZ2-CD2 4.19Å; W174-L353 HydrophobicContact CZ3-CB 4.18Å; W174-L353 HydrophobicContact CZ3-CD2 3.65Å; W174-L353 WeakPolarHBondContact CZ3-O 3.34Å; W174-F358 HydrophobicContact CB-CD1 4.16Å; W174-F358 HydrophobicContact CB-CE1 3.82Å; W174-F358 HydrophobicContact CD2-CD1 4.28Å; W174-F358 HydrophobicContact CE3-CB 3.88Å; W174-F358 AromaticContact CE3-CD1 3.49Å; W174-F358 HydrophobicContact CE3-CD1 3.49Å; W174-F358 VanDerWaalsContact CE3-CD1 3.49Å; W174-F358 AromaticContact CE3-CD2 3.71Å; W174-F358 HydrophobicContact CE3-CD2 3.71Å; W174-F358 AromaticContact CE3-CE1 3.91Å; W174-F358 HydrophobicContact CE3-CE1 3.91Å; W174-F358 HydrophobicContact CE3-CE2 4.09Å; W174-F358 AromaticContact CE3-CG 3.39Å; W174-F358 HydrophobicContact CE3-CG 3.39Å; W174-F358 HydrophobicContact CE3-CZ 4.2Å; W174-F358 HydrophobicContact CZ3-CB 3.74Å; W174-F358 HydrophobicContact CZ3-CD1 4.23Å; W174-F358 AromaticContact CZ3-CD2 3.84Å; W174-F358 HydrophobicContact CZ3-CD2 3.84Å; W174-F358 AromaticContact CZ3-CG 3.66Å; W174-F358 HydrophobicContact CZ3-CG 3.66Å; W174-E365 VanDerWaalsContact NE1-CD 3.29Å; W174-E365 PolarHBondContact NE1-OE1 3.15Å; W174-E365 PolarHBondContact NE1-OE2 3.13Å
175	Q	98.3	Very high	96	Very high	25 Å²	25	32.5 Å²	32.5	12%	0.117	15%	0.154	C	C	.	.	H	α-helix	trans	-71.4	-32.3	179.8	-69.9	174.2	84.9	0	0	113.2	N128 K171 I172 T173 L177 L178 A179 N204 V206	N128-Q175 PolarHBondContact ND2-OE1 2.87Å; K171-Q175 WeakPolarHBondContact O-CG 3.45Å; K171-Q175 PolarHBondContact O-N 2.91Å; K171-Q175 PolarHBondContact O-NE2 2.87Å; I172-Q175 PolarHBondContact O-N 3.46Å; I172-Q175 VanDerWaalsContact O-N 3.12Å; T173-Q175 PolarHBondContact O-N 2.82Å; Q175-L177 VanDerWaalsContact C-N 3.35Å; Q175-L178 PolarHBondContact O-N 2.99Å; Q175-A179 WeakPolarHBondContact O-CB 3.27Å; Q175-A179 PolarHBondContact O-N 3.18Å; Q175-N204 PolarHBondContact NE2-O 2.89Å; Q175-V206 HydrophobicContact CB-CB 3.72Å; Q175-V206 HydrophobicContact CB-CG1 4.5Å; Q175-V206 HydrophobicContact CB-CG2 3.89Å
176	I	98.5	Very high	96.1	Very high	3 Å²	3	29.6 Å²	29.6	2%	0.015	14%	0.142	C	C	.	.	H	α-helix	trans	-64.3	-42.6	171	-61.7	162	0	0	0	109.9	I172 T173 A179 T180 I193 I198 V206 I254 V257	I172-I176 HydrophobicContact CG2-CD1 3.63Å; I172-I176 HydrophobicContact CG2-CG1 4.33Å; I172-I176 WeakPolarHBondContact O-CG1 3.45Å; I172-I176 PolarHBondContact O-N 2.78Å; T173-I176 PolarHBondContact O-N 3.3Å; I176-A179 PolarHBondContact O-N 3.16Å; I176-T180 WeakPolarHBondContact O-CB 3.37Å; I176-T180 PolarHBondContact O-N 3.2Å; I176-T180 PolarHBondContact O-OG1 3.2Å; I176-I193 HydrophobicContact CG2-CG2 4.46Å; I176-I198 HydrophobicContact CD1-CD1 3.74Å; I176-I198 HydrophobicContact CD1-CG1 4.36Å; I176-I198 HydrophobicContact CD1-CG2 4.07Å; I176-I198 HydrophobicContact CG1-CD1 4.35Å; I176-I198 HydrophobicContact CG1-CG1 4.49Å; I176-I198 HydrophobicContact CG1-CG2 4.14Å; I176-V206 HydrophobicContact CG1-CG1 4.03Å; I176-I254 HydrophobicContact CG2-CD1 3.95Å; I176-I254 HydrophobicContact CG2-CG1 3.77Å; I176-V257 HydrophobicContact CD1-CG1 4.44Å
177	L	98.6	Very high	96.1	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-62.8	-42.3	174	-73	170.9	0	0	0	111.9	T173 W174 Q175 T180 D181 I254 F334 C349 L352 L353 F358	T173-L177 WeakPolarHBondContact O-CG 3.32Å; T173-L177 PolarHBondContact O-N 3.2Å; W174-L177 WeakPolarHBondContact O-CB 3.39Å; W174-L177 PolarHBondContact O-N 2.74Å; Q175-L177 VanDerWaalsContact C-N 3.35Å; L177-T180 PolarHBondContact O-N 3.24Å; L177-D181 WeakPolarHBondContact O-CB 3.39Å; L177-D181 PolarHBondContact O-N 3.19Å; L177-I254 HydrophobicContact CD2-CD1 4.17Å; L177-I254 HydrophobicContact CD2-CG2 4.24Å; L177-F334 HydrophobicContact CD1-CE2 4.09Å; L177-F334 HydrophobicContact CD1-CZ 4.04Å; L177-C349 HydrophobicContact CD2-CB 4.19Å; L177-L352 HydrophobicContact CD1-CB 3.84Å; L177-L352 HydrophobicContact CD2-CB 3.83Å; L177-L352 HydrophobicContact CD2-CD1 3.81Å; L177-L352 HydrophobicContact CD2-CG 4.49Å; L177-L353 HydrophobicContact CB-CD1 4.46Å; L177-L353 HydrophobicContact CB-CD2 3.63Å; L177-L353 HydrophobicContact CB-CG 3.88Å; L177-L353 HydrophobicContact CD1-CD2 4.28Å; L177-L353 HydrophobicContact CD1-CG 4.46Å; L177-F358 HydrophobicContact CD1-CE2 3.66Å; L177-F358 HydrophobicContact CD1-CZ 3.66Å
178	L	98	Very high	96	Very high	15 Å²	15	29.6 Å²	29.6	8%	0.079	14%	0.14	C	C	.	.	H	α-helix	trans	-60.9	-44.7	175	-71.6	176.2	0	0	0	112.4	W174 Q175 T180 F182 L353	W174-L178 WeakPolarHBondContact O-CG 3.28Å; W174-L178 PolarHBondContact O-N 2.71Å; Q175-L178 PolarHBondContact O-N 2.99Å; L178-T180 VanDerWaalsContact C-N 3.34Å; L178-T180 PolarHBondContact O-N 3.15Å; L178-F182 PolarHBondContact O-N 3.42Å; L178-L353 HydrophobicContact CD2-CD1 3.96Å; L178-L353 HydrophobicContact CD2-CD2 4Å; L178-L353 HydrophobicContact CG-CD2 4.13Å
179	A	97.4	Very high	95.9	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59.4	-44.1	174.7	0	0	0	0	0	112.2	N128 L129 Q175 I176 C183 L208	N128-A179 HydrophobicContact CB-CB 3.91Å; L129-A179 HydrophobicContact CD2-CB 3.75Å; Q175-A179 WeakPolarHBondContact O-CB 3.27Å; Q175-A179 PolarHBondContact O-N 3.18Å; I176-A179 PolarHBondContact O-N 3.16Å; A179-C183 PolarHBondContact O-N 3.48Å; A179-C183 VanDerWaalsContact O-N 3.12Å; A179-C183 PolarHBondContact O-SG 3.24Å; A179-L208 HydrophobicContact CB-CB 4.21Å; A179-L208 HydrophobicContact CB-CD2 4.34Å
180	T	97.7	Very high	95.8	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.006	14%	0.135	C	C	.	.	H	α-helix	trans	-77.6	-37.7	-174.5	-50.2	0	0	0	0	111.9	I176 L177 L178 F182 C183 H184 I193 D250 I254	I176-T180 WeakPolarHBondContact O-CB 3.37Å; I176-T180 PolarHBondContact O-N 3.2Å; I176-T180 PolarHBondContact O-OG1 3.2Å; L177-T180 PolarHBondContact O-N 3.24Å; L178-T180 VanDerWaalsContact C-N 3.34Å; L178-T180 PolarHBondContact O-N 3.15Å; T180-F182 VanDerWaalsContact C-N 3.34Å; T180-F182 PolarHBondContact O-N 3.14Å; T180-C183 WeakPolarHBondContact O-CB 3.47Å; T180-C183 PolarHBondContact O-N 3.4Å; T180-H184 WeakPolarHBondContact CG2-NE2 3.11Å; T180-H184 WeakPolarHBondContact O-CB 3.45Å; T180-H184 PolarHBondContact O-CD2 2.79Å; T180-H184 VanDerWaalsContact O-CG 3.29Å; T180-H184 PolarHBondContact O-N 2.74Å; T180-I193 HydrophobicContact CG2-CD1 4.14Å; T180-D250 HydrophobicContact CG2-CB 3.88Å; T180-I254 HydrophobicContact CG2-CD1 3.99Å
181	D	97.8	Very high	95.5	Very high	13 Å²	13	25.3 Å²	25.3	7%	0.07	12%	0.123	C	C	.	.	H	α-helix	trans	-54.3	-48.1	170.3	-175.3	44.9	0	0	0	111.1	L177 H184 Q185 C349 L353 K369	L177-D181 WeakPolarHBondContact O-CB 3.39Å; L177-D181 PolarHBondContact O-N 3.19Å; D181-H184 PolarHBondContact O-N 2.76Å; D181-Q185 WeakPolarHBondContact O-CB 3.47Å; D181-Q185 WeakPolarHBondContact O-CG 3.35Å; D181-Q185 PolarHBondContact O-N 3.11Å; D181-Q185 PolarHBondContact OD1-NE2 2.84Å; D181-Q185 PolarHBondContact OD2-NE2 3.04Å; D181-C349 HydrophobicContact CB-CB 3.69Å; D181-L353 HydrophobicContact CB-CD1 3.94Å; D181-K369 IonicContact OD2-NZ 3.32Å
182	F	96.7	Very high	95.3	Very high	50 Å²	50	20.3 Å²	20.3	22%	0.219	10%	0.102	C	C	.	.	H	α-helix	trans	-64.1	-41	175.9	174.1	-93.1	0	0	0	112.9	L124 K125 H126 L129 L178 T180 S186	L124-F182 HydrophobicContact CB-CE1 4.22Å; L124-F182 HydrophobicContact CD2-CD1 4.3Å; L124-F182 HydrophobicContact CD2-CE1 3.75Å; K125-F182 VanDerWaalsContact O-CZ 3.24Å; K125-F182 WeakPolarHBondContact O-CZ 3.09Å; H126-F182 HydrophobicContact CB-CB 4.48Å; H126-F182 HydrophobicContact CB-CD1 3.57Å; H126-F182 HydrophobicContact CB-CD2 4.19Å; H126-F182 HydrophobicContact CB-CE1 3.73Å; H126-F182 HydrophobicContact CB-CE2 4.32Å; H126-F182 HydrophobicContact CB-CG 3.81Å; H126-F182 HydrophobicContact CB-CZ 4.11Å; H126-F182 AromaticContact CD2-CD2 3.95Å; H126-F182 AromaticContact CD2-CG 3.82Å; H126-F182 AromaticContact CG-CG 3.86Å; L129-F182 HydrophobicContact CD1-CD1 3.84Å; L129-F182 HydrophobicContact CD1-CE1 3.95Å; L178-F182 PolarHBondContact O-N 3.42Å; T180-F182 VanDerWaalsContact C-N 3.34Å; T180-F182 PolarHBondContact O-N 3.14Å; F182-S186 VanDerWaalsContact O-CB 3.3Å; F182-S186 WeakPolarHBondContact O-CB 3.24Å; F182-S186 PolarHBondContact O-N 2.58Å; F182-S186 PolarHBondContact O-OG 2.97Å
183	C	94.9	Very high	95.3	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.007	10%	0.102	C	C	.	.	H	α-helix	trans	-61.9	-49	173.8	-71.3	0	0	0	0	111.4	A179 T180 Q185 S186 N187 C188	A179-C183 PolarHBondContact O-N 3.48Å; A179-C183 VanDerWaalsContact O-N 3.12Å; A179-C183 PolarHBondContact O-SG 3.24Å; T180-C183 WeakPolarHBondContact O-CB 3.47Å; T180-C183 PolarHBondContact O-N 3.4Å; C183-Q185 PolarHBondContact O-N 2.71Å; C183-S186 CarbonylContact O-C 3.55Å; C183-S186 WeakPolarHBondContact O-CA 3.49Å; C183-S186 WeakPolarHBondContact O-CB 3.1Å; C183-S186 PolarHBondContact O-N 3.17Å; C183-N187 PolarHBondContact O-N 3.49Å; C183-C188 CarbonylContact C-O 3.43Å; C183-C188 HydrophobicContact CB-CB 4.32Å; C183-C188 WeakPolarHBondContact CB-O 3.17Å; C183-C188 WeakPolarHBondContact O-CA 3.3Å; C183-C188 VanDerWaalsContact O-CB 3.3Å; C183-C188 WeakPolarHBondContact O-CB 3.45Å; C183-C188 PolarHBondContact O-N 3.33Å
184	H	95.4	Very high	95.1	Very high	28 Å²	28	21.2 Å²	21.2	13%	0.13	11%	0.106	C	C	.	.	H	α-helix	trans	-62	-42.9	-179.6	-69.2	-176.6	0	0	0	111.7	T180 D181 S186 N187 C188 P247 D250	T180-H184 WeakPolarHBondContact CG2-NE2 3.11Å; T180-H184 WeakPolarHBondContact O-CB 3.45Å; T180-H184 PolarHBondContact O-CD2 2.79Å; T180-H184 VanDerWaalsContact O-CG 3.29Å; T180-H184 PolarHBondContact O-N 2.74Å; D181-H184 PolarHBondContact O-N 2.76Å; H184-S186 VanDerWaalsContact C-N 3.27Å; H184-S186 PolarHBondContact O-N 2.79Å; H184-N187 WeakPolarHBondContact O-CA 3.24Å; H184-N187 PolarHBondContact O-N 3.39Å; H184-C188 PolarHBondContact CD2-O 2.97Å; H184-P247 PolarHBondContact CE1-O 3.36Å; H184-D250 IonicContact CD2-OD2 2.83Å; H184-D250 IonicContact CE1-OD2 3.24Å; H184-D250 IonicContact NE2-OD2 3.6Å; H184-D250 PolarHBondContact NE2-OD2 3.32Å
185	Q	94.7	Very high	95	Very high	128 Å²	128	20.6 Å²	20.6	60%	0.598	10%	0.103	S	C	*	.	H	α-helix	trans	-63.5	-31.5	172.5	-70.2	170	30.7	0	0	112.7	D181 C183 N187	D181-Q185 WeakPolarHBondContact O-CB 3.47Å; D181-Q185 WeakPolarHBondContact O-CG 3.35Å; D181-Q185 PolarHBondContact O-N 3.11Å; D181-Q185 PolarHBondContact OD1-NE2 2.84Å; D181-Q185 PolarHBondContact OD2-NE2 3.04Å; C183-Q185 PolarHBondContact O-N 2.71Å; Q185-N187 PolarHBondContact O-N 3.29Å
186	S	91.6	Very high	94.7	Very high	41 Å²	41	21.8 Å²	21.8	29%	0.287	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	15.1	171.2	-56.4	0	0	0	0	113.5	F182 C183 H184 C188	F182-S186 VanDerWaalsContact O-CB 3.3Å; F182-S186 WeakPolarHBondContact O-CB 3.24Å; F182-S186 PolarHBondContact O-N 2.58Å; F182-S186 PolarHBondContact O-OG 2.97Å; C183-S186 CarbonylContact O-C 3.55Å; C183-S186 WeakPolarHBondContact O-CA 3.49Å; C183-S186 WeakPolarHBondContact O-CB 3.1Å; C183-S186 PolarHBondContact O-N 3.17Å; H184-S186 VanDerWaalsContact C-N 3.27Å; H184-S186 PolarHBondContact O-N 2.79Å; S186-C188 VanDerWaalsContact C-N 3.27Å; S186-C188 PolarHBondContact O-N 3.39Å
187	N	90.7	Very high	94.5	Very high	90 Å²	90	22.2 Å²	22.2	48%	0.481	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	38.7	-173.3	-67.1	-65.2	0	0	0	113.1	C183 H184 Q185 F216 L217	C183-N187 PolarHBondContact O-N 3.49Å; H184-N187 WeakPolarHBondContact O-CA 3.24Å; H184-N187 PolarHBondContact O-N 3.39Å; Q185-N187 PolarHBondContact O-N 3.29Å; N187-F216 CarbonylContact O-C 3.6Å; N187-F216 WeakPolarHBondContact O-CA 3.37Å; N187-L217 HydrophobicContact CB-CB 4.2Å; N187-L217 HydrophobicContact CB-CD1 4.21Å; N187-L217 HydrophobicContact CB-CG 4.33Å; N187-L217 PolarHBondContact O-N 2.87Å
188	C	90.7	Very high	94.4	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.007	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	116.7	-175.6	170.6	0	0	0	0	112.3	M120 L124 C183 H184 S186 R215	M120-C188 HydrophobicContact CE-CB 4.08Å; M120-C188 WeakPolarHBondContact CE-SG 3.33Å; L124-C188 HydrophobicContact CD1-CB 4.45Å; L124-C188 HydrophobicContact CD2-CB 4.49Å; C183-C188 CarbonylContact C-O 3.43Å; C183-C188 HydrophobicContact CB-CB 4.32Å; C183-C188 WeakPolarHBondContact CB-O 3.17Å; C183-C188 WeakPolarHBondContact O-CA 3.3Å; C183-C188 VanDerWaalsContact O-CB 3.3Å; C183-C188 WeakPolarHBondContact O-CB 3.45Å; C183-C188 PolarHBondContact O-N 3.33Å; H184-C188 PolarHBondContact CD2-O 2.97Å; S186-C188 VanDerWaalsContact C-N 3.27Å; S186-C188 PolarHBondContact O-N 3.39Å; C188-R215 CarbonylContact C-O 3.46Å; C188-R215 WeakPolarHBondContact CA-O 3.41Å
189	I	92.4	Very high	94.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	136.5	167.3	-42.6	171.6	0	0	0	108.9	R191 A214 R215 L217 Y245 P247 V249 D250	I189-R191 HydrophobicContact CB-CG 3.92Å; I189-R191 HydrophobicContact CG2-CG 3.49Å; I189-R191 VanDerWaalsContact CG2-CG 3.49Å; I189-A214 CarbonylContact O-C 3.43Å; I189-A214 WeakPolarHBondContact O-CA 3.31Å; I189-A214 WeakPolarHBondContact O-CB 3.32Å; I189-R215 PolarHBondContact N-O 2.75Å; I189-R215 PolarHBondContact O-N 2.93Å; I189-L217 HydrophobicContact CD1-CD2 3.6Å; I189-L217 HydrophobicContact CG1-CD2 3.62Å; I189-L217 HydrophobicContact CG1-CG 4.49Å; I189-Y245 HydrophobicContact CD1-CD2 4.49Å; I189-P247 HydrophobicContact CG1-CG 4.41Å; I189-V249 HydrophobicContact CG2-CG2 3.43Å; I189-V249 VanDerWaalsContact CG2-CG2 3.43Å; I189-D250 WeakPolarHBondContact CA-OD2 3.39Å; I189-D250 VanDerWaalsContact CG2-OD2 3.23Å; I189-D250 WeakPolarHBondContact CG2-OD2 3.47Å
190	H	92.2	Very high	94.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.116	C	C	.	.			trans	-77.9	-47.4	179.4	-162.8	-95	0	0	0	112.7	D192 I193 C209 F211 F213 A214 D250	H190-D192 PolarHBondContact CE1-O 2.81Å; H190-D192 PolarHBondContact ND1-O 2.96Å; H190-D192 PolarHBondContact O-N 3.18Å; H190-I193 HydrophobicContact CB-CD1 4.16Å; H190-I193 HydrophobicContact CB-CG1 3.85Å; H190-C209 PolarHBondContact CE1-O 2.93Å; H190-C209 PolarHBondContact NE2-O 2.68Å; H190-F211 AromaticContact CD2-CD1 3.9Å; H190-F211 AromaticContact CD2-CE1 3.59Å; H190-F211 AromaticContact CD2-CZ 3.67Å; H190-F211 AromaticContact NE2-CD2 3.96Å; H190-F211 AromaticContact NE2-CE2 3.85Å; H190-F211 AromaticContact NE2-CZ 3.95Å; H190-F213 CarbonylContact O-C 3.46Å; H190-A214 WeakPolarHBondContact O-CA 3.12Å; H190-A214 PolarHBondContact O-N 2.83Å; H190-D250 WeakPolarHBondContact CB-OD1 3.31Å; H190-D250 PolarHBondContact N-OD1 2.95Å; H190-D250 PolarHBondContact N-OD2 3.01Å
191	R	91.4	Very high	94.1	Very high	13 Å²	13	25 Å²	25	5%	0.049	13%	0.126	C	C	.	.	S	Bend	trans	60.9	17.2	177.4	-46.2	-169.9	-54.9	148	11.5	116.6	I189 F213 R215 T225 V228 A229 Y245 V249 D250	I189-R191 HydrophobicContact CB-CG 3.92Å; I189-R191 HydrophobicContact CG2-CG 3.49Å; I189-R191 VanDerWaalsContact CG2-CG 3.49Å; R191-F213 PolarHBondContact NE-O 2.87Å; R191-F213 PolarHBondContact NH2-O 3.07Å; R191-R215 VanDerWaalsContact NE-CG 3.31Å; R191-T225 PolarHBondContact NH1-O 3.36Å; R191-V228 HydrophobicContact CB-CG2 3.96Å; R191-A229 WeakPolarHBondContact O-CB 3.26Å; R191-A229 PolarHBondContact O-N 2.93Å; R191-Y245 HydrophobicContact CG-CE2 4.48Å; R191-Y245 PolarHBondContact NH1-OH 3.48Å; R191-V249 HydrophobicContact CG-CG2 4.31Å; R191-D250 PolarHBondContact N-OD1 3.04Å
192	D	91.1	Very high	93.7	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	16%	0.158	C	C	.	.			trans	-159.5	54.8	169.7	-167.2	29.3	0	0	0	110.9	H190 K194 N197 F213 A229 T230	H190-D192 PolarHBondContact CE1-O 2.81Å; H190-D192 PolarHBondContact ND1-O 2.96Å; H190-D192 PolarHBondContact O-N 3.18Å; D192-K194 WeakPolarHBondContact OD1-CD 3.5Å; D192-K194 WeakPolarHBondContact OD1-CE 3.48Å; D192-K194 IonicContact OD1-NZ 2.71Å; D192-K194 PolarHBondContact OD1-NZ 3.34Å; D192-K194 WeakPolarHBondContact OD2-CE 3.37Å; D192-K194 IonicContact OD2-NZ 3.27Å; D192-K194 PolarHBondContact OD2-NZ 2.94Å; D192-N197 VanDerWaalsContact CG-ND2 3.29Å; D192-N197 PolarHBondContact O-ND2 2.83Å; D192-N197 PolarHBondContact OD2-ND2 3.27Å; D192-F213 HydrophobicContact CB-CB 4.04Å; D192-F213 HydrophobicContact CB-CD2 3.78Å; D192-F213 HydrophobicContact CB-CG 4.21Å; D192-A229 HydrophobicContact CB-CB 4.45Å; D192-A229 VanDerWaalsContact OD1-CA 3.31Å; D192-A229 WeakPolarHBondContact OD1-CA 3.23Å; D192-T230 PolarHBondContact OD1-N 3.44Å
193	I	96.2	Very high	93.5	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	17%	0.174	C	C	.	.			trans	-82.6	116.8	173.2	-59.9	-176.9	0	0	0	108.4	I176 T180 H190 I198 L208 D250 A253 I254	I176-I193 HydrophobicContact CG2-CG2 4.46Å; T180-I193 HydrophobicContact CG2-CD1 4.14Å; H190-I193 HydrophobicContact CB-CD1 4.16Å; H190-I193 HydrophobicContact CB-CG1 3.85Å; I193-I198 HydrophobicContact CG2-CD1 4.11Å; I193-L208 HydrophobicContact CG1-CD1 4.42Å; I193-L208 HydrophobicContact CG2-CD1 4.48Å; I193-D250 HydrophobicContact CD1-CB 3.76Å; I193-A253 HydrophobicContact CB-CB 3.93Å; I193-I254 HydrophobicContact CD1-CD1 4.11Å; I193-I254 HydrophobicContact CD1-CG1 4.03Å; I193-I254 HydrophobicContact CG2-CG1 4.23Å
194	K	94.7	Very high	93.4	Very high	20 Å²	20	36.3 Å²	36.3	9%	0.087	19%	0.19	C	C	.	.			trans	-156.7	161.3	179.8	60.8	-176.1	179.8	-139.7	0	111	D192 E196 N197 I198 T230 Y233	D192-K194 WeakPolarHBondContact OD1-CD 3.5Å; D192-K194 WeakPolarHBondContact OD1-CE 3.48Å; D192-K194 IonicContact OD1-NZ 2.71Å; D192-K194 PolarHBondContact OD1-NZ 3.34Å; D192-K194 WeakPolarHBondContact OD2-CE 3.37Å; D192-K194 IonicContact OD2-NZ 3.27Å; D192-K194 PolarHBondContact OD2-NZ 2.94Å; K194-E196 WeakPolarHBondContact CD-OE2 3.43Å; K194-E196 HydrophobicContact CG-CB 4.33Å; K194-E196 VanDerWaalsContact CG-OE2 3.3Å; K194-E196 WeakPolarHBondContact CG-OE2 3.44Å; K194-E196 PolarHBondContact O-N 3.43Å; K194-E196 VanDerWaalsContact O-N 3.11Å; K194-N197 HydrophobicContact CG-CB 4.13Å; K194-N197 PolarHBondContact O-N 2.91Å; K194-I198 WeakPolarHBondContact O-CD1 3.4Å; K194-I198 WeakPolarHBondContact O-CG1 3.47Å; K194-I198 PolarHBondContact O-N 2.82Å; K194-T230 WeakPolarHBondContact CD-OG1 3.28Å; K194-T230 PolarHBondContact NZ-OG1 3.03Å; K194-Y233 HydrophobicContact CB-CD1 4.46Å; K194-Y233 HydrophobicContact CB-CD2 3.6Å; K194-Y233 HydrophobicContact CB-CE1 4.44Å; K194-Y233 HydrophobicContact CB-CE2 3.56Å; K194-Y233 HydrophobicContact CB-CG 4.08Å
195	P	95.1	Very high	93.4	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.006	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-23	-174.8	-26.5	36.4	0	0	0	115.9	L153 L154 Y233 V257 E260	L153-P195 HydrophobicContact CB-CB 4.13Å; L153-P195 WeakPolarHBondContact CB-O 3.37Å; L153-P195 HydrophobicContact CD2-CB 4.27Å; L153-P195 HydrophobicContact CG-CB 4.07Å; L153-P195 PolarHBondContact N-O 3.21Å; L154-P195 HydrophobicContact CB-CB 3.95Å; L154-P195 PolarHBondContact N-O 3.06Å; P195-Y233 VanDerWaalsContact CD-CZ 3.49Å; P195-Y233 VanDerWaalsContact CD-OH 3.28Å; P195-Y233 WeakPolarHBondContact CD-OH 3.49Å; P195-Y233 HydrophobicContact CG-CE1 4.46Å; P195-V257 HydrophobicContact CG-CG2 4.29Å; P195-E260 VanDerWaalsContact CG-OE2 3.31Å; P195-E260 WeakPolarHBondContact CG-OE2 3.41Å
196	E	92.1	Very high	93.5	Very high	50 Å²	50	33.8 Å²	33.8	23%	0.234	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-43	171.3	-63.7	81.2	175.4	0	0	111.6	L154 K194 I198 R618	L154-E196 HydrophobicContact CD2-CG 3.88Å; K194-E196 WeakPolarHBondContact CD-OE2 3.43Å; K194-E196 HydrophobicContact CG-CB 4.33Å; K194-E196 VanDerWaalsContact CG-OE2 3.3Å; K194-E196 WeakPolarHBondContact CG-OE2 3.44Å; K194-E196 PolarHBondContact O-N 3.43Å; K194-E196 VanDerWaalsContact O-N 3.11Å; E196-I198 VanDerWaalsContact C-N 3.29Å; E196-I198 PolarHBondContact O-N 3.29Å; E196-R618 WeakPolarHBondContact OE1-CD 3.24Å; E196-R618 IonicContact OE1-CZ 2.78Å; E196-R618 IonicContact OE1-NE 2.71Å; E196-R618 IonicContact OE1-NH1 3.64Å; E196-R618 PolarHBondContact OE1-NH1 3.4Å; E196-R618 IonicContact OE2-NH1 2.69Å; E196-R618 PolarHBondContact OE2-NH1 3.49Å
197	N	94.4	Very high	93.8	Very high	13 Å²	13	33.1 Å²	33.1	7%	0.07	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-0.9	-173.9	-68.5	-1.3	0	0	0	112.9	D192 K194 C209	D192-N197 VanDerWaalsContact CG-ND2 3.29Å; D192-N197 PolarHBondContact O-ND2 2.83Å; D192-N197 PolarHBondContact OD2-ND2 3.27Å; K194-N197 HydrophobicContact CG-CB 4.13Å; K194-N197 PolarHBondContact O-N 2.91Å; N197-C209 PolarHBondContact O-N 2.87Å; N197-C209 PolarHBondContact O-SG 2.71Å
198	I	97.2	Very high	94.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	92.4	176.2	-63.8	161	0	0	0	106.9	S152 L153 I176 I193 K194 E196 I200 V206 L208 V257	S152-I198 CarbonylContact C-O 3.2Å; S152-I198 WeakPolarHBondContact CA-O 3.34Å; L153-I198 HydrophobicContact CB-CB 3.99Å; L153-I198 HydrophobicContact CB-CG2 3.93Å; L153-I198 HydrophobicContact CD2-CB 4.34Å; L153-I198 HydrophobicContact CD2-CD1 3.99Å; L153-I198 HydrophobicContact CD2-CG2 4.09Å; L153-I198 PolarHBondContact N-O 2.81Å; I176-I198 HydrophobicContact CD1-CD1 3.74Å; I176-I198 HydrophobicContact CD1-CG1 4.36Å; I176-I198 HydrophobicContact CD1-CG2 4.07Å; I176-I198 HydrophobicContact CG1-CD1 4.35Å; I176-I198 HydrophobicContact CG1-CG1 4.49Å; I176-I198 HydrophobicContact CG1-CG2 4.14Å; I193-I198 HydrophobicContact CG2-CD1 4.11Å; K194-I198 WeakPolarHBondContact O-CD1 3.4Å; K194-I198 WeakPolarHBondContact O-CG1 3.47Å; K194-I198 PolarHBondContact O-N 2.82Å; E196-I198 VanDerWaalsContact C-N 3.29Å; E196-I198 PolarHBondContact O-N 3.29Å; I198-I200 HydrophobicContact CG2-CG1 4.4Å; I198-V206 HydrophobicContact CG2-CG1 3.75Å; I198-L208 HydrophobicContact CG1-CD1 3.92Å; I198-V257 HydrophobicContact CD1-CG1 3.76Å; I198-V257 HydrophobicContact CD1-CG2 4.26Å
199	L	97	Very high	94.1	Very high	34 Å²	34	29.6 Å²	29.6	18%	0.178	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	143.2	178.8	-50.1	178.5	0	0	0	110.2	I149 N151 V206 K207 C209	I149-L199 HydrophobicContact CB-CB 3.93Å; I149-L199 HydrophobicContact CB-CD1 4.19Å; I149-L199 HydrophobicContact CG1-CB 4.29Å; I149-L199 HydrophobicContact CG1-CD1 4.35Å; I149-L199 HydrophobicContact CG2-CB 3.77Å; N151-L199 WeakPolarHBondContact O-CA 3.34Å; L199-V206 CarbonylContact O-C 3.59Å; L199-V206 WeakPolarHBondContact O-CA 3.28Å; L199-K207 HydrophobicContact CB-CB 4.14Å; L199-K207 VanDerWaalsContact CB-O 3.31Å; L199-K207 WeakPolarHBondContact CB-O 3.18Å; L199-K207 PolarHBondContact N-O 3.26Å; L199-K207 PolarHBondContact O-N 3.2Å; L199-C209 HydrophobicContact CD1-CB 3.97Å; L199-C209 HydrophobicContact CG-CB 4.24Å
200	I	95.6	Very high	93.6	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	129.2	-177	-58.1	-174.1	0	0	0	109.2	I149 N151 L153 I172 I198 E205 V206	I149-I200 VanDerWaalsContact CG2-C 3.48Å; I149-I200 WeakPolarHBondContact CG2-O 3.24Å; N151-I200 WeakPolarHBondContact CB-O 3.36Å; N151-I200 PolarHBondContact N-O 3.24Å; N151-I200 PolarHBondContact O-N 3.33Å; L153-I200 HydrophobicContact CB-CD1 3.86Å; L153-I200 HydrophobicContact CB-CG1 4.48Å; L153-I200 HydrophobicContact CD1-CD1 3.83Å; L153-I200 HydrophobicContact CG-CD1 4.4Å; I172-I200 HydrophobicContact CD1-CD1 3.73Å; I172-I200 HydrophobicContact CG1-CD1 4.02Å; I172-I200 HydrophobicContact CG2-CD1 4.38Å; I198-I200 HydrophobicContact CG2-CG1 4.4Å; I200-E205 WeakPolarHBondContact CA-O 3.4Å; I200-V206 HydrophobicContact CG1-CG2 4.32Å
201	N	93.9	Very high	92.9	Very high	38 Å²	38	32.4 Å²	32.4	20%	0.203	17%	0.167	C	C	.	.			trans	-92.6	175.8	174.6	79.1	7	0	0	0	112.6	I149 A203 N204 E205	I149-N201 HydrophobicContact CD1-CB 4.42Å; I149-N201 HydrophobicContact CG2-CB 4.17Å; N201-A203 PolarHBondContact O-N 3.2Å; N201-A203 WeakPolarHBondContact OD1-CA 3.25Å; N201-A203 WeakPolarHBondContact OD1-CB 3.35Å; N201-A203 PolarHBondContact OD1-N 2.88Å; N201-N204 WeakPolarHBondContact O-CA 3.44Å; N201-N204 PolarHBondContact O-N 3.44Å; N201-N204 PolarHBondContact OD1-N 3.3Å; N201-E205 PolarHBondContact N-O 2.81Å; N201-E205 VanDerWaalsContact N-O 3.15Å; N201-E205 PolarHBondContact ND2-OE2 2.86Å; N201-E205 WeakPolarHBondContact OD1-CB 3.36Å; N201-E205 PolarHBondContact OD1-N 3.31Å
202	K	90.5	Very high	91.7	Very high	174 Å²	174	32.3 Å²	32.3	76%	0.757	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.9	-178.9	-69.9	166	176.3	141.5	0	114.4	D150 N204	D150-K202 VanDerWaalsContact OD2-CE 3.26Å; D150-K202 WeakPolarHBondContact OD2-CE 3.49Å; D150-K202 IonicContact OD2-NZ 3.41Å; D150-K202 PolarHBondContact OD2-NZ 3Å; K202-N204 VanDerWaalsContact C-N 3.3Å
203	A	92.4	Very high	90.5	Very high	67 Å²	67	33.6 Å²	33.6	55%	0.554	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-4.4	173.1	0	0	0	0	0	113.2	N201 E205	N201-A203 PolarHBondContact O-N 3.2Å; N201-A203 WeakPolarHBondContact OD1-CA 3.25Å; N201-A203 WeakPolarHBondContact OD1-CB 3.35Å; N201-A203 PolarHBondContact OD1-N 2.88Å; A203-E205 VanDerWaalsContact C-N 3.32Å; A203-E205 HydrophobicContact CB-CG 4.09Å
204	N	91.4	Very high	88.8	Confident	62 Å²	62	33.6 Å²	33.6	33%	0.332	18%	0.176	S	C	.	.			trans	69.8	23.7	-171.1	-42.5	-93.6	0	0	0	113.8	K168 Q175 N201 K202	K168-N204 WeakPolarHBondContact CD-OD1 3.34Å; K168-N204 WeakPolarHBondContact CE-OD1 3.47Å; K168-N204 PolarHBondContact NZ-OD1 3.24Å; Q175-N204 PolarHBondContact NE2-O 2.89Å; N201-N204 WeakPolarHBondContact O-CA 3.44Å; N201-N204 PolarHBondContact O-N 3.44Å; N201-N204 PolarHBondContact OD1-N 3.3Å; K202-N204 VanDerWaalsContact C-N 3.3Å
205	E	96.1	Very high	87.6	Confident	102 Å²	102	36.6 Å²	36.6	48%	0.477	19%	0.187	S	C	.	.			trans	-75.9	130.5	169	-57	175.8	137.7	0	0	109.4	I200 N201 A203	I200-E205 WeakPolarHBondContact CA-O 3.4Å; N201-E205 PolarHBondContact N-O 2.81Å; N201-E205 VanDerWaalsContact N-O 3.15Å; N201-E205 PolarHBondContact ND2-OE2 2.86Å; N201-E205 WeakPolarHBondContact OD1-CB 3.36Å; N201-E205 PolarHBondContact OD1-N 3.31Å; A203-E205 VanDerWaalsContact C-N 3.32Å; A203-E205 HydrophobicContact CB-CG 4.09Å
206	V	97.8	Very high	86.6	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	140	179.6	174.7	0	0	0	0	110.7	N128 I172 Q175 I176 I198 L199 I200	N128-V206 VanDerWaalsContact CA-O 3.24Å; N128-V206 WeakPolarHBondContact CA-O 3.05Å; N128-V206 WeakPolarHBondContact CB-O 3.36Å; N128-V206 PolarHBondContact ND2-O 2.87Å; I172-V206 HydrophobicContact CB-CG2 4.28Å; I172-V206 HydrophobicContact CG1-CG2 4.2Å; I172-V206 HydrophobicContact CG2-CG2 4.06Å; Q175-V206 HydrophobicContact CB-CB 3.72Å; Q175-V206 HydrophobicContact CB-CG1 4.5Å; Q175-V206 HydrophobicContact CB-CG2 3.89Å; I176-V206 HydrophobicContact CG1-CG1 4.03Å; I198-V206 HydrophobicContact CG2-CG1 3.75Å; L199-V206 CarbonylContact O-C 3.59Å; L199-V206 WeakPolarHBondContact O-CA 3.28Å; I200-V206 HydrophobicContact CG1-CG2 4.32Å
207	K	97.1	Very high	85.6	Confident	27 Å²	27	39.6 Å²	39.6	12%	0.117	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	100.5	175.3	-70.3	-77.7	-177	172.5	0	109.2	P127 N128 L129 I149 L199	P127-K207 WeakPolarHBondContact O-CD 3.43Å; P127-K207 WeakPolarHBondContact O-CE 3.28Å; P127-K207 PolarHBondContact O-NZ 2.88Å; N128-K207 WeakPolarHBondContact O-CA 3.47Å; L129-K207 WeakPolarHBondContact O-CD 3.21Å; L129-K207 PolarHBondContact O-NZ 2.97Å; L129-K207 VanDerWaalsContact O-NZ 3.15Å; I149-K207 HydrophobicContact CD1-CG 3.87Å; I149-K207 HydrophobicContact CG1-CB 4.19Å; I149-K207 HydrophobicContact CG1-CG 4.06Å; L199-K207 HydrophobicContact CB-CB 4.14Å; L199-K207 VanDerWaalsContact CB-O 3.31Å; L199-K207 WeakPolarHBondContact CB-O 3.18Å; L199-K207 PolarHBondContact N-O 3.26Å; L199-K207 PolarHBondContact O-N 3.2Å
208	L	96.1	Very high	84.1	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	138.3	175	-171.9	70.1	0	0	0	110.2	N128 L129 V130 A179 I193 I198	N128-L208 PolarHBondContact O-N 2.83Å; L129-L208 HydrophobicContact CD2-CB 3.88Å; L129-L208 HydrophobicContact CD2-CD2 4.32Å; V130-L208 PolarHBondContact N-O 3.01Å; A179-L208 HydrophobicContact CB-CB 4.21Å; A179-L208 HydrophobicContact CB-CD2 4.34Å; I193-L208 HydrophobicContact CG1-CD1 4.42Å; I193-L208 HydrophobicContact CG2-CD1 4.48Å; I198-L208 HydrophobicContact CG1-CD1 3.92Å
209	C	91.8	Very high	82.2	Confident	18 Å²	18	45 Å²	45	12%	0.122	25%	0.245	C	C	.	.			trans	-140.6	176.8	-175.3	76	0	0	0	0	114.5	V130 H190 N197 L199	V130-C209 HydrophobicContact CB-CB 4.01Å; V130-C209 HydrophobicContact CG1-CB 3.53Å; H190-C209 PolarHBondContact CE1-O 2.93Å; H190-C209 PolarHBondContact NE2-O 2.68Å; N197-C209 PolarHBondContact O-N 2.87Å; N197-C209 PolarHBondContact O-SG 2.71Å; L199-C209 HydrophobicContact CD1-CB 3.97Å; L199-C209 HydrophobicContact CG-CB 4.24Å
210	D	82.2	Confident	80.3	Confident	55 Å²	55	50.2 Å²	50.2	29%	0.294	28%	0.281	S	S	.	.			trans	61.8	61.9	-177.6	-151	6.8	0	0	0	116.4	K99 G212	K99-D210 IonicContact NZ-OD1 3.29Å; K99-D210 PolarHBondContact NZ-OD1 3.05Å; D210-G212 PolarHBondContact O-N 3.26Å; D210-G212 PolarHBondContact OD1-N 2.97Å
211	F	77.9	Confident	78.3	Confident	3 Å²	3	53.3 Å²	53.3	1%	0.013	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-67.1	10.5	171.7	-73.6	-98.9	0	0	0	114.3	L121 L124 L129 H190 F213 A214	L121-F211 HydrophobicContact CD2-CB 4.19Å; L121-F211 HydrophobicContact CD2-CD2 3.79Å; L121-F211 HydrophobicContact CD2-CG 4.12Å; L121-F211 HydrophobicContact CG-CB 4.48Å; L124-F211 HydrophobicContact CD1-CD1 3.75Å; L124-F211 HydrophobicContact CD1-CE1 3.51Å; L124-F211 HydrophobicContact CD1-CZ 4.28Å; L129-F211 HydrophobicContact CD1-CZ 4.06Å; L129-F211 HydrophobicContact CD2-CE2 4.15Å; L129-F211 HydrophobicContact CD2-CZ 3.74Å; L129-F211 HydrophobicContact CG-CZ 4.47Å; H190-F211 AromaticContact CD2-CD1 3.9Å; H190-F211 AromaticContact CD2-CE1 3.59Å; H190-F211 AromaticContact CD2-CZ 3.67Å; H190-F211 AromaticContact NE2-CD2 3.96Å; H190-F211 AromaticContact NE2-CE2 3.85Å; H190-F211 AromaticContact NE2-CZ 3.95Å; F211-F213 PolarHBondContact O-N 2.88Å; F211-A214 HydrophobicContact CB-CB 4Å; F211-A214 HydrophobicContact CD1-CB 3.67Å; F211-A214 HydrophobicContact CG-CB 4.29Å; F211-A214 VanDerWaalsContact O-CB 3.31Å; F211-A214 WeakPolarHBondContact O-CB 3.46Å; F211-A214 PolarHBondContact O-N 2.74Å
212	G	65.8	Low	76.4	Confident	12 Å²	12	52.3 Å²	52.3	12%	0.124	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-57.7	-33.5	176	0	0	0	0	0	113	D210	D210-G212 PolarHBondContact O-N 3.26Å; D210-G212 PolarHBondContact OD1-N 2.97Å
213	F	64.2	Low	74.6	Confident	28 Å²	28	50.3 Å²	50.3	12%	0.123	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-88.1	-8.2	173.3	-68.6	-73.1	0	0	0	114.4	H190 R191 D192 F211 V228	H190-F213 CarbonylContact O-C 3.46Å; R191-F213 PolarHBondContact NE-O 2.87Å; R191-F213 PolarHBondContact NH2-O 3.07Å; D192-F213 HydrophobicContact CB-CB 4.04Å; D192-F213 HydrophobicContact CB-CD2 3.78Å; D192-F213 HydrophobicContact CB-CG 4.21Å; F211-F213 PolarHBondContact O-N 2.88Å; F213-V228 HydrophobicContact CD1-CB 4.08Å; F213-V228 HydrophobicContact CD1-CG1 3.88Å; F213-V228 HydrophobicContact CE1-CG1 4.44Å
214	A	61.6	Low	73.6	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.282	C	S	.	.			trans	-63.8	150.3	-172.7	0	0	0	0	0	113.1	R116 M120 I189 H190 F211	R116-A214 PolarHBondContact NH1-O 3.06Å; R116-A214 PolarHBondContact NH2-O 3.17Å; M120-A214 HydrophobicContact CE-CB 3.67Å; M120-A214 HydrophobicContact SD-CB 4.15Å; I189-A214 CarbonylContact O-C 3.43Å; I189-A214 WeakPolarHBondContact O-CA 3.31Å; I189-A214 WeakPolarHBondContact O-CB 3.32Å; H190-A214 WeakPolarHBondContact O-CA 3.12Å; H190-A214 PolarHBondContact O-N 2.83Å; F211-A214 HydrophobicContact CB-CB 4Å; F211-A214 HydrophobicContact CD1-CB 3.67Å; F211-A214 HydrophobicContact CG-CB 4.29Å; F211-A214 VanDerWaalsContact O-CB 3.31Å; F211-A214 WeakPolarHBondContact O-CB 3.46Å; F211-A214 PolarHBondContact O-N 2.74Å
215	R	69.6	Low	72.7	Confident	83 Å²	83	48.6 Å²	48.6	31%	0.313	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	130.9	175	-79.1	-77.4	167.3	168	-0.3	111.5	C188 I189 R191 Y224	C188-R215 CarbonylContact C-O 3.46Å; C188-R215 WeakPolarHBondContact CA-O 3.41Å; I189-R215 PolarHBondContact N-O 2.75Å; I189-R215 PolarHBondContact O-N 2.93Å; R191-R215 VanDerWaalsContact NE-CG 3.31Å; R215-Y224 HydrophobicContact CB-CD1 4.01Å; R215-Y224 HydrophobicContact CB-CE1 4.01Å; R215-Y224 HydrophobicContact CG-CD1 3.89Å; R215-Y224 HydrophobicContact CG-CE1 4.38Å
216	F	73.8	Confident	70.6	Confident	69 Å²	69	46 Å²	46	30%	0.303	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	142.1	158	-75.9	-56.1	0	0	0	108.4	M120 N187 T218	M120-F216 HydrophobicContact CB-CZ 4.44Å; M120-F216 HydrophobicContact CE-CD1 4.15Å; M120-F216 HydrophobicContact CE-CD2 4.34Å; M120-F216 HydrophobicContact CE-CE1 4.3Å; M120-F216 HydrophobicContact CE-CE2 4.49Å; M120-F216 HydrophobicContact CE-CG 4.16Å; M120-F216 HydrophobicContact CE-CZ 4.47Å; M120-F216 HydrophobicContact CG-CD2 4.05Å; M120-F216 HydrophobicContact CG-CE1 4.32Å; M120-F216 HydrophobicContact CG-CE2 3.47Å; M120-F216 VanDerWaalsContact CG-CE2 3.47Å; M120-F216 HydrophobicContact CG-CZ 3.63Å; M120-F216 HydrophobicContact SD-CD2 4.29Å; M120-F216 HydrophobicContact SD-CE2 4.31Å; N187-F216 CarbonylContact O-C 3.6Å; N187-F216 WeakPolarHBondContact O-CA 3.37Å; F216-T218 PolarHBondContact O-N 3.32Å; F216-T218 VanDerWaalsContact O-N 3.16Å
217	L	71.2	Confident	69.1	Low	45 Å²	45	48 Å²	48	24%	0.236	29%	0.286	C	S	.	.			trans	-64	113.9	173.8	-65.1	175.5	0	0	0	109.3	N187 I189 Y224 P247	N187-L217 HydrophobicContact CB-CB 4.2Å; N187-L217 HydrophobicContact CB-CD1 4.21Å; N187-L217 HydrophobicContact CB-CG 4.33Å; N187-L217 PolarHBondContact O-N 2.87Å; I189-L217 HydrophobicContact CD1-CD2 3.6Å; I189-L217 HydrophobicContact CG1-CD2 3.62Å; I189-L217 HydrophobicContact CG1-CG 4.49Å; L217-Y224 WeakPolarHBondContact CA-OH 3.3Å; L217-P247 HydrophobicContact CD1-CG 4.25Å; L217-P247 HydrophobicContact CD2-CG 4.21Å
218	T	62.5	Low	67.2	Low	75 Å²	75	47 Å²	47	46%	0.46	28%	0.282	S	S	.	.			trans	-69.3	151.3	154.5	36.8	0	0	0	0	108.3	F216 G222 Y224	F216-T218 PolarHBondContact O-N 3.32Å; F216-T218 VanDerWaalsContact O-N 3.16Å; T218-G222 WeakPolarHBondContact OG1-CA 3.35Å; T218-Y224 PolarHBondContact N-OH 2.99Å; T218-Y224 PolarHBondContact O-OH 3.47Å; T218-Y224 WeakPolarHBondContact OG1-CE1 3.47Å; T218-Y224 VanDerWaalsContact OG1-CZ 3.24Å; T218-Y224 PolarHBondContact OG1-OH 3Å; T218-Y224 VanDerWaalsContact OG1-OH 3.08Å
219	G	58.6	Low	65.4	Low	52 Å²	52	47.7 Å²	47.7	54%	0.536	29%	0.287	S	S	.	.			trans	-67.1	-172.5	-176	0	0	0	0	0	113.9	G221 G222	G219-G221 PolarHBondContact O-N 3.31Å; G219-G222 PolarHBondContact O-N 3.42Å
220	P	55.6	Low	64.6	Low	144 Å²	144	47 Å²	47	94%	0.935	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.3	127	177.6	-27.7	35.6	0	0	0	112.4
221	G	54.1	Low	65.1	Low	65 Å²	65	45.3 Å²	45.3	67%	0.67	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.8	3.8	-174.6	0	0	0	0	0	115.5	G219	G219-G221 PolarHBondContact O-N 3.31Å
222	G	53.5	Low	65.9	Low	18 Å²	18	45.7 Å²	45.7	19%	0.186	27%	0.273	C	S	.	.			trans	-70	126.2	176.6	0	0	0	0	0	113.6	T218 G219 Y224	T218-G222 WeakPolarHBondContact OG1-CA 3.35Å; G219-G222 PolarHBondContact O-N 3.42Å; G222-Y224 WeakPolarHBondContact O-CE2 3.34Å
223	E	54.1	Low	67.4	Low	131 Å²	131	45.4 Å²	45.4	61%	0.612	27%	0.268	S	S	*	.			trans	-93.4	148.4	178.6	-61.6	-163.1	124.4	0	0	113.6	T243	E223-T243 CarbonylContact C-O 3.57Å; E223-T243 WeakPolarHBondContact CA-O 3.42Å; E223-T243 PolarHBondContact OE1-OG1 3.34Å
224	Y	70.8	Confident	68.8	Low	18 Å²	18	44.2 Å²	44.2	7%	0.071	26%	0.263	C	S	.	.			trans	-129.4	155.3	177.9	-52.5	-82	0	0	0	112.3	R215 L217 T218 G222 T243 Y245	R215-Y224 HydrophobicContact CB-CD1 4.01Å; R215-Y224 HydrophobicContact CB-CE1 4.01Å; R215-Y224 HydrophobicContact CG-CD1 3.89Å; R215-Y224 HydrophobicContact CG-CE1 4.38Å; L217-Y224 WeakPolarHBondContact CA-OH 3.3Å; T218-Y224 PolarHBondContact N-OH 2.99Å; T218-Y224 PolarHBondContact O-OH 3.47Å; T218-Y224 WeakPolarHBondContact OG1-CE1 3.47Å; T218-Y224 VanDerWaalsContact OG1-CZ 3.24Å; T218-Y224 PolarHBondContact OG1-OH 3Å; T218-Y224 VanDerWaalsContact OG1-OH 3.08Å; G222-Y224 WeakPolarHBondContact O-CE2 3.34Å; Y224-T243 WeakPolarHBondContact CD2-O 3.47Å; Y224-T243 PolarHBondContact N-O 2.8Å; Y224-Y245 VanDerWaalsContact CB-CZ 3.43Å; Y224-Y245 WeakPolarHBondContact CB-OH 3.44Å; Y224-Y245 HydrophobicContact CD2-CD2 4.33Å; Y224-Y245 HydrophobicContact CD2-CE2 4.18Å; Y224-Y245 WeakPolarHBondContact CD2-O 3.38Å; Y224-Y245 VanDerWaalsContact CE2-O 3.23Å; Y224-Y245 WeakPolarHBondContact CE2-O 3.41Å; Y224-Y245 HydrophobicContact CG-CE2 4.12Å
225	T	71.3	Confident	70.5	Confident	75 Å²	75	44.2 Å²	44.2	46%	0.46	26%	0.263	S	S	.	.			trans	-67.6	130.3	175.4	-40.5	0	0	0	0	111.3	R191 Y245	R191-T225 PolarHBondContact NH1-O 3.36Å; T225-Y245 PolarHBondContact O-OH 3.12Å
226	D	53.8	Low	71.8	Confident	47 Å²	47	40.3 Å²	40.3	25%	0.251	25%	0.248	S	C	.	.	S	Bend	trans	-68.6	-52	-175.2	63.5	-10.4	0	0	0	114.4	V228 K627	D226-V228 PolarHBondContact O-N 2.83Å; D226-K627 IonicContact OD1-NZ 2.74Å; D226-K627 PolarHBondContact OD1-NZ 3.29Å; D226-K627 IonicContact OD2-NZ 3.84Å; D226-K627 PolarHBondContact OD2-NZ 2.91Å
227	Y	65.2	Low	72.8	Confident	44 Å²	44	37.1 Å²	37.1	17%	0.173	23%	0.234	C	C	.	.			trans	-82.3	84.2	-168.8	-162.1	-89.6	0	0	0	111.4	R234 K627	Y227-R234 VanDerWaalsContact CD2-NH1 3.26Å; Y227-K627 HydrophobicContact CD2-CD 3.81Å; Y227-K627 HydrophobicContact CG-CD 3.79Å
228	V	57.8	Low	73.9	Confident	6 Å²	6	35.4 Å²	35.4	4%	0.036	23%	0.225	C	C	.	.			trans	-135.1	165.1	176.9	-62.8	0	0	0	0	110.7	R191 F213 D226 R234 L238	R191-V228 HydrophobicContact CB-CG2 3.96Å; F213-V228 HydrophobicContact CD1-CB 4.08Å; F213-V228 HydrophobicContact CD1-CG1 3.88Å; F213-V228 HydrophobicContact CE1-CG1 4.44Å; D226-V228 PolarHBondContact O-N 2.83Å; V228-R234 PolarHBondContact O-NE 3.48Å; V228-R234 PolarHBondContact O-NH2 3.38Å; V228-L238 HydrophobicContact CG2-CD1 4.38Å; V228-L238 HydrophobicContact CG2-CD2 4.1Å
229	A	58.8	Low	75.4	Confident	13 Å²	13	32 Å²	32	11%	0.107	20%	0.204	C	C	.	.	S	Bend	trans	61.1	156.4	-168	0	0	0	0	0	115.9	R191 D192 R234	R191-A229 WeakPolarHBondContact O-CB 3.26Å; R191-A229 PolarHBondContact O-N 2.93Å; D192-A229 HydrophobicContact CB-CB 4.45Å; D192-A229 VanDerWaalsContact OD1-CA 3.31Å; D192-A229 WeakPolarHBondContact OD1-CA 3.23Å; A229-R234 HydrophobicContact CB-CG 4.23Å; A229-R234 PolarHBondContact O-NE 3.38Å; A229-R234 VanDerWaalsContact O-NE 3.16Å; A229-R234 PolarHBondContact O-NH2 2.98Å
230	T	75.4	Confident	77.1	Confident	3 Å²	3	29.7 Å²	29.7	2%	0.018	18%	0.18	C	C	.	.			trans	-64.1	135.2	161.5	-63.6	0	0	0	0	109.2	D192 K194 W232 Y233 D622	D192-T230 PolarHBondContact OD1-N 3.44Å; K194-T230 WeakPolarHBondContact CD-OG1 3.28Å; K194-T230 PolarHBondContact NZ-OG1 3.03Å; T230-W232 VanDerWaalsContact C-N 3.32Å; T230-W232 PolarHBondContact O-N 3.17Å; T230-W232 VanDerWaalsContact O-N 3.08Å; T230-Y233 HydrophobicContact CG2-CD2 4.49Å; T230-Y233 HydrophobicContact CG2-CE2 4.33Å; T230-Y233 PolarHBondContact O-N 3.39Å; T230-D622 WeakPolarHBondContact CA-OD1 3.47Å; T230-D622 WeakPolarHBondContact CG2-OD1 3.41Å; T230-D622 PolarHBondContact OG1-OD1 3.29Å; T230-D622 PolarHBondContact OG1-OD2 3.44Å
231	R	91.3	Very high	78.8	Confident	20 Å²	20	23.8 Å²	23.8	8%	0.075	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-49.7	-42.7	-162.6	-172.4	-178.1	-61.4	104.8	18.4	115.7	Y233 R234 L239 G270 S271 S272 D273 Q276 T621	R231-Y233 PolarHBondContact O-N 3.44Å; R231-R234 WeakPolarHBondContact O-CB 3.36Å; R231-R234 PolarHBondContact O-N 3.21Å; R231-L239 HydrophobicContact CG-CD2 4.4Å; R231-G270 PolarHBondContact NH1-O 2.82Å; R231-S271 PolarHBondContact NH1-O 2.86Å; R231-S272 VanDerWaalsContact CD-C 3.46Å; R231-S272 WeakPolarHBondContact CD-O 3.26Å; R231-D273 WeakPolarHBondContact CD-OD1 3.49Å; R231-D273 IonicContact CZ-OD1 3.9Å; R231-D273 IonicContact NE-OD1 3.08Å; R231-D273 PolarHBondContact NE-OD1 2.73Å; R231-D273 IonicContact NH2-OD1 2.74Å; R231-Q276 HydrophobicContact CG-CB 4.04Å; R231-Q276 HydrophobicContact CG-CG 3.99Å; R231-T621 PolarHBondContact NH2-O 3.14Å
232	W	95.2	Very high	80.6	Confident	11 Å²	11	21.1 Å²	21.1	4%	0.042	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-65.6	-13.7	-170.6	-54.1	-16.2	0	0	0	114.9	T230 P266 W268 P269 G270 M617 R618 T621	T230-W232 VanDerWaalsContact C-N 3.32Å; T230-W232 PolarHBondContact O-N 3.17Å; T230-W232 VanDerWaalsContact O-N 3.08Å; W232-P266 HydrophobicContact CD2-CB 4.42Å; W232-P266 HydrophobicContact CD2-CG 4.47Å; W232-P266 HydrophobicContact CE3-CB 3.72Å; W232-P266 HydrophobicContact CE3-CG 3.46Å; W232-P266 VanDerWaalsContact CE3-CG 3.46Å; W232-P266 HydrophobicContact CH2-CG 4.24Å; W232-P266 HydrophobicContact CZ3-CB 4.1Å; W232-P266 HydrophobicContact CZ3-CG 3.31Å; W232-W268 WeakPolarHBondContact CB-O 3.34Å; W232-P269 HydrophobicContact CD2-CB 4.08Å; W232-P269 HydrophobicContact CE3-CB 4.4Å; W232-P269 HydrophobicContact CH2-CB 4.25Å; W232-P269 HydrophobicContact CZ2-CB 3.92Å; W232-P269 HydrophobicContact CZ3-CB 4.47Å; W232-G270 VanDerWaalsContact CD1-N 3.35Å; W232-G270 PolarHBondContact NE1-O 2.82Å; W232-M617 HydrophobicContact CH2-CB 3.84Å; W232-M617 HydrophobicContact CZ2-CB 4.44Å; W232-R618 HydrophobicContact CE3-CG 3.96Å; W232-R618 HydrophobicContact CH2-CG 3.58Å; W232-R618 HydrophobicContact CZ2-CG 4.49Å; W232-R618 HydrophobicContact CZ3-CG 3.26Å; W232-T621 HydrophobicContact CZ2-CG2 3.83Å
233	Y	96.5	Very high	82.2	Confident	6 Å²	6	22.4 Å²	22.4	2%	0.024	12%	0.12	C	C	.	.	G	3₁₀ helix	trans	-109.2	0.7	178.4	-47.1	-81.8	0	0	0	112.9	K194 P195 T230 R231 C256 V257 E260 R618	K194-Y233 HydrophobicContact CB-CD1 4.46Å; K194-Y233 HydrophobicContact CB-CD2 3.6Å; K194-Y233 HydrophobicContact CB-CE1 4.44Å; K194-Y233 HydrophobicContact CB-CE2 3.56Å; K194-Y233 HydrophobicContact CB-CG 4.08Å; P195-Y233 VanDerWaalsContact CD-CZ 3.49Å; P195-Y233 VanDerWaalsContact CD-OH 3.28Å; P195-Y233 WeakPolarHBondContact CD-OH 3.49Å; P195-Y233 HydrophobicContact CG-CE1 4.46Å; T230-Y233 HydrophobicContact CG2-CD2 4.49Å; T230-Y233 HydrophobicContact CG2-CE2 4.33Å; T230-Y233 PolarHBondContact O-N 3.39Å; R231-Y233 PolarHBondContact O-N 3.44Å; Y233-C256 HydrophobicContact CD1-CB 3.82Å; Y233-C256 HydrophobicContact CE1-CB 4.41Å; Y233-V257 HydrophobicContact CD1-CG2 3.87Å; Y233-V257 HydrophobicContact CE1-CG2 3.82Å; Y233-E260 PolarHBondContact OH-OE2 3.26Å; Y233-R618 PolarHBondContact OH-NH1 2.97Å; Y233-R618 PolarHBondContact OH-NH2 2.92Å
234	R	95.3	Very high	83.9	Confident	4 Å²	4	21 Å²	21	2%	0.015	11%	0.113	C	C	.	.			trans	-69.1	137.3	175.5	-66.8	-179.4	-178.5	173.9	-0.1	110.3	Y227 V228 A229 R231 L238 L239 W252 D273	Y227-R234 VanDerWaalsContact CD2-NH1 3.26Å; V228-R234 PolarHBondContact O-NE 3.48Å; V228-R234 PolarHBondContact O-NH2 3.38Å; A229-R234 HydrophobicContact CB-CG 4.23Å; A229-R234 PolarHBondContact O-NE 3.38Å; A229-R234 VanDerWaalsContact O-NE 3.16Å; A229-R234 PolarHBondContact O-NH2 2.98Å; R231-R234 WeakPolarHBondContact O-CB 3.36Å; R231-R234 PolarHBondContact O-N 3.21Å; R234-L238 HydrophobicContact CB-CB 4.16Å; R234-L238 HydrophobicContact CG-CB 4.45Å; R234-L239 HydrophobicContact CB-CD1 4.26Å; R234-L239 HydrophobicContact CB-CD2 3.87Å; R234-L239 HydrophobicContact CB-CG 3.78Å; R234-L239 HydrophobicContact CG-CD2 4.46Å; R234-W252 PolarHBondContact O-NE1 2.9Å; R234-D273 IonicContact NH1-OD1 3.95Å; R234-D273 PolarHBondContact NH1-OD1 3.35Å; R234-D273 IonicContact NH1-OD2 3.91Å; R234-D273 PolarHBondContact NH1-OD2 2.98Å
235	S	96.7	Very high	84.8	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.113	C	C	.	.			trans	-79.1	162.3	170.1	53.6	0	0	0	0	111.8	E237 L238 L239 W252	S235-E237 VanDerWaalsContact C-N 3.27Å; S235-E237 VanDerWaalsContact CB-CD 3.44Å; S235-E237 WeakPolarHBondContact CB-OE1 3.25Å; S235-E237 WeakPolarHBondContact CB-OE2 3.48Å; S235-E237 PolarHBondContact O-N 2.78Å; S235-E237 PolarHBondContact OG-OE1 3.3Å; S235-E237 PolarHBondContact OG-OE2 2.99Å; S235-L238 PolarHBondContact O-N 3.25Å; S235-L239 PolarHBondContact O-N 3.15Å; S235-W252 VanDerWaalsContact CA-CD1 3.48Å
236	P	96.6	Very high	85.9	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-53.7	-40.8	-178.3	-28.4	36.6	0	0	0	113.4	L238 L239 V240 W252 I280 L287 M341	P236-L238 VanDerWaalsContact C-N 3.33Å; P236-L238 PolarHBondContact O-N 2.87Å; P236-L239 PolarHBondContact O-N 3.13Å; P236-L239 VanDerWaalsContact O-N 3.13Å; P236-V240 PolarHBondContact O-N 2.93Å; P236-W252 HydrophobicContact CG-CH2 3.69Å; P236-W252 HydrophobicContact CG-CZ2 4.13Å; P236-W252 HydrophobicContact CG-CZ3 3.92Å; P236-I280 HydrophobicContact CG-CG2 4.31Å; P236-L287 HydrophobicContact CB-CD2 4.41Å; P236-M341 HydrophobicContact CG-SD 4.02Å
237	E	95.8	Very high	87.9	Confident	3 Å²	3	17.6 Å²	17.6	1%	0.014	10%	0.099	C	C	.	.	H	α-helix	trans	-61.8	-36.1	177.8	62.1	-80.5	-175	0	0	113.5	S235 G241 D242 V249 H291 P343 R346	S235-E237 VanDerWaalsContact C-N 3.27Å; S235-E237 VanDerWaalsContact CB-CD 3.44Å; S235-E237 WeakPolarHBondContact CB-OE1 3.25Å; S235-E237 WeakPolarHBondContact CB-OE2 3.48Å; S235-E237 PolarHBondContact O-N 2.78Å; S235-E237 PolarHBondContact OG-OE1 3.3Å; S235-E237 PolarHBondContact OG-OE2 2.99Å; E237-G241 PolarHBondContact O-N 3.45Å; E237-D242 HydrophobicContact CB-CB 4.1Å; E237-D242 PolarHBondContact O-N 3.41Å; E237-V249 HydrophobicContact CG-CG1 4.16Å; E237-V249 WeakPolarHBondContact OE1-CG1 3.4Å; E237-H291 IonicContact OE2-CE1 3.69Å; E237-P343 HydrophobicContact CG-CG 4.44Å; E237-R346 IonicContact OE1-CZ 3.43Å; E237-R346 IonicContact OE1-NH1 3.69Å; E237-R346 PolarHBondContact OE1-NH1 3.49Å; E237-R346 IonicContact OE1-NH2 2.78Å; E237-R346 IonicContact OE2-CZ 2.67Å; E237-R346 IonicContact OE2-NH1 3.87Å; E237-R346 PolarHBondContact OE2-NH1 2.91Å; E237-R346 IonicContact OE2-NH2 3.15Å; E237-R346 PolarHBondContact OE2-NH2 2.85Å
238	L	93.6	Very high	89.4	Confident	8 Å²	8	17 Å²	17	4%	0.042	10%	0.1	C	C	.	.	H	α-helix	trans	-73.3	-28.1	175.2	-67.9	178.1	0	0	0	112.5	V228 R234 S235 P236 Y245 V249	V228-L238 HydrophobicContact CG2-CD1 4.38Å; V228-L238 HydrophobicContact CG2-CD2 4.1Å; R234-L238 HydrophobicContact CB-CB 4.16Å; R234-L238 HydrophobicContact CG-CB 4.45Å; S235-L238 PolarHBondContact O-N 3.25Å; P236-L238 VanDerWaalsContact C-N 3.33Å; P236-L238 PolarHBondContact O-N 2.87Å; L238-Y245 HydrophobicContact CD2-CD1 3.59Å; L238-Y245 HydrophobicContact CD2-CD2 4.3Å; L238-Y245 HydrophobicContact CD2-CE1 3.31Å; L238-Y245 HydrophobicContact CD2-CE2 4.06Å; L238-Y245 HydrophobicContact CD2-CG 4.07Å; L238-V249 HydrophobicContact CD1-CB 4.03Å; L238-V249 HydrophobicContact CD1-CG1 4.06Å; L238-V249 HydrophobicContact CD2-CG1 4.28Å; L238-V249 HydrophobicContact CG-CG1 4Å
239	L	93.9	Very high	91.2	Very high	4 Å²	4	16.9 Å²	16.9	2%	0.021	10%	0.1	C	C	.	.	H	α-helix	trans	-82.7	-35	-179.3	-69.2	164.9	0	0	0	112.8	R231 R234 S235 P236 G241 D273 Q276 L277 I280	R231-L239 HydrophobicContact CG-CD2 4.4Å; R234-L239 HydrophobicContact CB-CD1 4.26Å; R234-L239 HydrophobicContact CB-CD2 3.87Å; R234-L239 HydrophobicContact CB-CG 3.78Å; R234-L239 HydrophobicContact CG-CD2 4.46Å; S235-L239 PolarHBondContact O-N 3.15Å; P236-L239 PolarHBondContact O-N 3.13Å; P236-L239 VanDerWaalsContact O-N 3.13Å; L239-G241 VanDerWaalsContact C-N 3.34Å; L239-D273 HydrophobicContact CD2-CB 4.05Å; L239-Q276 HydrophobicContact CD1-CB 4.15Å; L239-Q276 HydrophobicContact CD1-CG 3.51Å; L239-Q276 HydrophobicContact CD2-CB 4.07Å; L239-Q276 HydrophobicContact CD2-CG 3.87Å; L239-Q276 HydrophobicContact CG-CG 4.36Å; L239-L277 HydrophobicContact CB-CD1 4.18Å; L239-L277 HydrophobicContact CB-CD2 3.7Å; L239-L277 HydrophobicContact CB-CG 3.81Å; L239-L277 HydrophobicContact CD1-CD2 4.08Å; L239-L277 HydrophobicContact CD1-CG 4.23Å; L239-I280 HydrophobicContact CD1-CD1 3.59Å
240	V	93.8	Very high	93.1	Very high	3 Å²	3	16.3 Å²	16.3	2%	0.018	10%	0.095	C	C	.	.	H	α-helix	trans	-78.5	-20.2	173.1	-55.8	0	0	0	0	112.9	P236 L277 L287 H291 I294 F295	P236-V240 PolarHBondContact O-N 2.93Å; V240-L277 HydrophobicContact CG1-CD1 4.31Å; V240-L277 HydrophobicContact CG1-CD2 4.17Å; V240-L287 HydrophobicContact CG1-CD1 4.02Å; V240-H291 HydrophobicContact CG1-CB 4.19Å; V240-H291 HydrophobicContact CG2-CB 3.98Å; V240-I294 HydrophobicContact CB-CG2 4.31Å; V240-I294 HydrophobicContact CG2-CB 4.22Å; V240-I294 HydrophobicContact CG2-CG2 3.93Å; V240-F295 HydrophobicContact CB-CB 4.25Å; V240-F295 HydrophobicContact CG1-CB 4.03Å; V240-F295 HydrophobicContact CG1-CD2 4.22Å
241	G	91.1	Very high	94.2	Very high	21 Å²	21	16.3 Å²	16.3	22%	0.216	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.3	32.1	179.1	0	0	0	0	0	114.9	E237 L239	E237-G241 PolarHBondContact O-N 3.45Å; L239-G241 VanDerWaalsContact C-N 3.34Å
242	D	92.3	Very high	94.5	Very high	8 Å²	8	15.3 Å²	15.3	4%	0.043	9%	0.091	C	C	.	.			trans	-63.9	134.3	169.5	-162.5	-27.8	0	0	0	109.5	E237 Q244 Y245 R290 I294	E237-D242 HydrophobicContact CB-CB 4.1Å; E237-D242 PolarHBondContact O-N 3.41Å; D242-Q244 PolarHBondContact OD1-N 2.87Å; D242-Y245 VanDerWaalsContact O-CD1 3.24Å; D242-Y245 WeakPolarHBondContact O-CD1 3.4Å; D242-R290 VanDerWaalsContact CG-NH2 3.3Å; D242-R290 IonicContact OD1-CZ 2.71Å; D242-R290 IonicContact OD1-NH2 2.83Å; D242-R290 PolarHBondContact OD1-NH2 3.08Å; D242-R290 IonicContact OD2-CZ 2.74Å; D242-R290 VanDerWaalsContact OD2-CZ 3.27Å; D242-R290 IonicContact OD2-NE 3.85Å; D242-R290 PolarHBondContact OD2-NE 3.42Å; D242-R290 IonicContact OD2-NH2 2.78Å; D242-R290 PolarHBondContact OD2-NH2 2.74Å; D242-I294 HydrophobicContact CB-CD1 3.73Å; D242-I294 WeakPolarHBondContact OD2-CD1 3.39Å
243	T	87.8	Confident	94.7	Very high	45 Å²	45	15 Å²	15	28%	0.276	9%	0.09	S	C	.	.	S	Bend	trans	-90.2	-13.5	177.3	57.6	0	0	0	0	112.8	E223 Y224	E223-T243 CarbonylContact C-O 3.57Å; E223-T243 WeakPolarHBondContact CA-O 3.42Å; E223-T243 PolarHBondContact OE1-OG1 3.34Å; Y224-T243 WeakPolarHBondContact CD2-O 3.47Å; Y224-T243 PolarHBondContact N-O 2.8Å
244	Q	88.4	Confident	94.8	Very high	102 Å²	102	14.8 Å²	14.8	48%	0.477	9%	0.09	S	C	.	.			trans	-107.1	31	-169.7	-53.3	176.9	-13.6	0	0	113	D242	D242-Q244 PolarHBondContact OD1-N 2.87Å
245	Y	90.8	Very high	95	Very high	15 Å²	15	14.6 Å²	14.6	6%	0.059	9%	0.089	C	C	.	.			trans	-74.2	168.7	174.6	61.4	-102.1	0	0	0	112.7	I189 R191 Y224 T225 L238 D242 V249	I189-Y245 HydrophobicContact CD1-CD2 4.49Å; R191-Y245 HydrophobicContact CG-CE2 4.48Å; R191-Y245 PolarHBondContact NH1-OH 3.48Å; Y224-Y245 VanDerWaalsContact CB-CZ 3.43Å; Y224-Y245 WeakPolarHBondContact CB-OH 3.44Å; Y224-Y245 HydrophobicContact CD2-CD2 4.33Å; Y224-Y245 HydrophobicContact CD2-CE2 4.18Å; Y224-Y245 WeakPolarHBondContact CD2-O 3.38Å; Y224-Y245 VanDerWaalsContact CE2-O 3.23Å; Y224-Y245 WeakPolarHBondContact CE2-O 3.41Å; Y224-Y245 HydrophobicContact CG-CE2 4.12Å; T225-Y245 PolarHBondContact O-OH 3.12Å; L238-Y245 HydrophobicContact CD2-CD1 3.59Å; L238-Y245 HydrophobicContact CD2-CD2 4.3Å; L238-Y245 HydrophobicContact CD2-CE1 3.31Å; L238-Y245 HydrophobicContact CD2-CE2 4.06Å; L238-Y245 HydrophobicContact CD2-CG 4.07Å; D242-Y245 VanDerWaalsContact O-CD1 3.24Å; D242-Y245 WeakPolarHBondContact O-CD1 3.4Å; Y245-V249 HydrophobicContact CD2-CG1 3.65Å; Y245-V249 HydrophobicContact CD2-CG2 4.48Å; Y245-V249 HydrophobicContact CE2-CG1 4.41Å; Y245-V249 HydrophobicContact CG-CG1 3.88Å
246	G	93.1	Very high	95	Very high	19 Å²	19	14.7 Å²	14.7	20%	0.196	9%	0.09	C	C	.	.			trans	-139.7	-158.8	-178.1	0	0	0	0	0	113.5	P248 V249	G246-P248 VanDerWaalsContact C-N 3.26Å; G246-P248 WeakPolarHBondContact O-CD 3.4Å; G246-P248 VanDerWaalsContact O-N 3.11Å; G246-V249 WeakPolarHBondContact O-CG2 3.42Å; G246-V249 PolarHBondContact O-N 3.36Å
247	P	95.8	Very high	95.1	Very high	35 Å²	35	14.8 Å²	14.8	23%	0.227	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-30.5	176.9	-27.4	36.2	0	0	0	116.9	H184 I189 L217 V249 D250	H184-P247 PolarHBondContact CE1-O 3.36Å; I189-P247 HydrophobicContact CG1-CG 4.41Å; L217-P247 HydrophobicContact CD1-CG 4.25Å; L217-P247 HydrophobicContact CD2-CG 4.21Å; P247-V249 PolarHBondContact O-N 3.29Å; P247-D250 PolarHBondContact O-N 2.92Å
248	P	97.4	Very high	95.2	Very high	30 Å²	30	14.7 Å²	14.7	20%	0.195	9%	0.09	C	C	.	.	H	α-helix	trans	-58.2	-12.7	176.7	-30.4	38.6	0	0	0	117.2	G246 D250 I251 W252 P343 R346	G246-P248 VanDerWaalsContact C-N 3.26Å; G246-P248 WeakPolarHBondContact O-CD 3.4Å; G246-P248 VanDerWaalsContact O-N 3.11Å; P248-D250 VanDerWaalsContact C-N 3.33Å; P248-I251 PolarHBondContact O-N 3.27Å; P248-W252 PolarHBondContact O-N 2.99Å; P248-P343 HydrophobicContact CB-CB 4.03Å; P248-P343 WeakPolarHBondContact CB-O 3.38Å; P248-P343 HydrophobicContact CG-CB 4.49Å; P248-P343 VanDerWaalsContact CG-O 3.26Å; P248-P343 WeakPolarHBondContact CG-O 3.49Å; P248-R346 HydrophobicContact CB-CB 4.31Å; P248-R346 PolarHBondContact O-NH1 3.3Å
249	V	96.7	Very high	95.3	Very high	4 Å²	4	14.3 Å²	14.3	2%	0.024	9%	0.088	C	C	.	.	H	α-helix	trans	-65.7	-36.6	171.1	-55.4	0	0	0	0	111.8	I189 R191 E237 L238 Y245 G246 P247 A253	I189-V249 HydrophobicContact CG2-CG2 3.43Å; I189-V249 VanDerWaalsContact CG2-CG2 3.43Å; R191-V249 HydrophobicContact CG-CG2 4.31Å; E237-V249 HydrophobicContact CG-CG1 4.16Å; E237-V249 WeakPolarHBondContact OE1-CG1 3.4Å; L238-V249 HydrophobicContact CD1-CB 4.03Å; L238-V249 HydrophobicContact CD1-CG1 4.06Å; L238-V249 HydrophobicContact CD2-CG1 4.28Å; L238-V249 HydrophobicContact CG-CG1 4Å; Y245-V249 HydrophobicContact CD2-CG1 3.65Å; Y245-V249 HydrophobicContact CD2-CG2 4.48Å; Y245-V249 HydrophobicContact CE2-CG1 4.41Å; Y245-V249 HydrophobicContact CG-CG1 3.88Å; G246-V249 WeakPolarHBondContact O-CG2 3.42Å; G246-V249 PolarHBondContact O-N 3.36Å; P247-V249 PolarHBondContact O-N 3.29Å; V249-A253 PolarHBondContact O-N 3.32Å
250	D	97.5	Very high	95.3	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-72.8	-35.2	179.4	-67.8	-29.2	0	0	0	110.7	T180 H184 I189 H190 R191 I193 P247 P248 A253 I254	T180-D250 HydrophobicContact CG2-CB 3.88Å; H184-D250 IonicContact CD2-OD2 2.83Å; H184-D250 IonicContact CE1-OD2 3.24Å; H184-D250 IonicContact NE2-OD2 3.6Å; H184-D250 PolarHBondContact NE2-OD2 3.32Å; I189-D250 WeakPolarHBondContact CA-OD2 3.39Å; I189-D250 VanDerWaalsContact CG2-OD2 3.23Å; I189-D250 WeakPolarHBondContact CG2-OD2 3.47Å; H190-D250 WeakPolarHBondContact CB-OD1 3.31Å; H190-D250 PolarHBondContact N-OD1 2.95Å; H190-D250 PolarHBondContact N-OD2 3.01Å; R191-D250 PolarHBondContact N-OD1 3.04Å; I193-D250 HydrophobicContact CD1-CB 3.76Å; P247-D250 PolarHBondContact O-N 2.92Å; P248-D250 VanDerWaalsContact C-N 3.33Å; D250-A253 PolarHBondContact O-N 2.99Å; D250-I254 VanDerWaalsContact O-CG1 3.25Å; D250-I254 WeakPolarHBondContact O-CG1 3.38Å; D250-I254 PolarHBondContact O-N 2.97Å
251	I	98.7	Very high	95.4	Very high	3 Å²	3	14.1 Å²	14.1	2%	0.015	9%	0.087	C	C	.	.	H	α-helix	trans	-60.2	-45.9	176.2	-56.6	-58.9	0	0	0	111	P248 I254 G255 C338 R346 W347 C349 L352	P248-I251 PolarHBondContact O-N 3.27Å; I251-I254 PolarHBondContact O-N 3.17Å; I251-G255 PolarHBondContact O-N 3.36Å; I251-C338 HydrophobicContact CG2-CB 4.22Å; I251-R346 HydrophobicContact CG2-CB 4.15Å; I251-W347 WeakPolarHBondContact CD1-O 3.2Å; I251-W347 WeakPolarHBondContact CG2-O 3.34Å; I251-C349 WeakPolarHBondContact CD1-SG 3.49Å; I251-L352 HydrophobicContact CD1-CD1 4.19Å; I251-L352 HydrophobicContact CG2-CD1 3.95Å
252	W	98.6	Very high	95.5	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-59.2	-48.3	175.8	178.9	-83.8	0	0	0	111.8	R234 S235 P236 P248 I254 G255 C256 W268 I280 L284 V339 M341	R234-W252 PolarHBondContact O-NE1 2.9Å; S235-W252 VanDerWaalsContact CA-CD1 3.48Å; P236-W252 HydrophobicContact CG-CH2 3.69Å; P236-W252 HydrophobicContact CG-CZ2 4.13Å; P236-W252 HydrophobicContact CG-CZ3 3.92Å; P248-W252 PolarHBondContact O-N 2.99Å; W252-I254 VanDerWaalsContact C-N 3.31Å; W252-I254 PolarHBondContact O-N 2.96Å; W252-G255 WeakPolarHBondContact O-CA 3.43Å; W252-G255 PolarHBondContact O-N 2.97Å; W252-C256 PolarHBondContact O-N 2.67Å; W252-W268 AromaticContact CE2-CZ3 3.9Å; W252-W268 HydrophobicContact CH2-CH2 4.12Å; W252-W268 HydrophobicContact CH2-CZ3 4.03Å; W252-W268 HydrophobicContact CZ2-CE3 4.08Å; W252-W268 AromaticContact CZ2-CH2 3.93Å; W252-W268 HydrophobicContact CZ2-CH2 3.93Å; W252-W268 AromaticContact CZ2-CZ3 3.38Å; W252-W268 HydrophobicContact CZ2-CZ3 3.38Å; W252-I280 HydrophobicContact CH2-CG2 3.65Å; W252-I280 HydrophobicContact CZ2-CD1 3.77Å; W252-I280 HydrophobicContact CZ2-CG1 3.98Å; W252-I280 HydrophobicContact CZ2-CG2 3.9Å; W252-L284 HydrophobicContact CH2-CD1 3.58Å; W252-L284 HydrophobicContact CZ3-CD1 4.01Å; W252-V339 HydrophobicContact CD2-CG1 4.47Å; W252-V339 HydrophobicContact CE3-CB 3.97Å; W252-V339 HydrophobicContact CE3-CG1 4.35Å; W252-V339 HydrophobicContact CH2-CB 4.29Å; W252-V339 HydrophobicContact CZ3-CB 3.85Å; W252-V339 WeakPolarHBondContact CZ3-O 2.89Å; W252-M341 HydrophobicContact CH2-SD 4.19Å; W252-M341 HydrophobicContact CZ3-SD 4.4Å
253	A	98.3	Very high	95.4	Very high	4 Å²	4	13.2 Å²	13.2	3%	0.033	8%	0.077	C	C	.	.	H	α-helix	trans	-60.6	-38.8	178.1	0	0	0	0	0	112.3	I193 V249 D250 G255 C256 V257	I193-A253 HydrophobicContact CB-CB 3.93Å; V249-A253 PolarHBondContact O-N 3.32Å; D250-A253 PolarHBondContact O-N 2.99Å; A253-G255 VanDerWaalsContact C-N 3.34Å; A253-C256 PolarHBondContact O-N 3.27Å; A253-V257 WeakPolarHBondContact O-CG2 3.31Å; A253-V257 PolarHBondContact O-N 3.48Å
254	I	98.8	Very high	95.4	Very high	2 Å²	2	12.5 Å²	12.5	1%	0.01	8%	0.078	C	C	.	.	H	α-helix	trans	-62.4	-40	172.1	-68.5	167.6	0	0	0	111.2	I176 L177 T180 I193 D250 I251 W252 V257 F258	I176-I254 HydrophobicContact CG2-CD1 3.95Å; I176-I254 HydrophobicContact CG2-CG1 3.77Å; L177-I254 HydrophobicContact CD2-CD1 4.17Å; L177-I254 HydrophobicContact CD2-CG2 4.24Å; T180-I254 HydrophobicContact CG2-CD1 3.99Å; I193-I254 HydrophobicContact CD1-CD1 4.11Å; I193-I254 HydrophobicContact CD1-CG1 4.03Å; I193-I254 HydrophobicContact CG2-CG1 4.23Å; D250-I254 VanDerWaalsContact O-CG1 3.25Å; D250-I254 WeakPolarHBondContact O-CG1 3.38Å; D250-I254 PolarHBondContact O-N 2.97Å; I251-I254 PolarHBondContact O-N 3.17Å; W252-I254 VanDerWaalsContact C-N 3.31Å; W252-I254 PolarHBondContact O-N 2.96Å; I254-V257 PolarHBondContact O-N 3.27Å; I254-F258 VanDerWaalsContact O-CB 3.27Å; I254-F258 WeakPolarHBondContact O-CB 3.33Å; I254-F258 PolarHBondContact O-N 2.81Å
255	G	98.6	Very high	95.5	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-58.7	-49.4	172	0	0	0	0	0	112.8	I251 W252 A253 V257 F258 A259 L335	I251-G255 PolarHBondContact O-N 3.36Å; W252-G255 WeakPolarHBondContact O-CA 3.43Å; W252-G255 PolarHBondContact O-N 2.97Å; A253-G255 VanDerWaalsContact C-N 3.34Å; G255-V257 PolarHBondContact O-N 3.5Å; G255-F258 PolarHBondContact O-N 3.45Å; G255-A259 WeakPolarHBondContact O-CB 3.4Å; G255-A259 PolarHBondContact O-N 3.15Å; G255-L335 WeakPolarHBondContact O-CD1 3.4Å
256	C	98.3	Very high	95.6	Very high	2 Å²	2	9.8 Å²	9.8	1%	0.014	7%	0.072	C	C	.	.	H	α-helix	trans	-59.2	-44.1	175.5	-72.4	0	0	0	0	112.6	Y233 W252 A253 A259 E260	Y233-C256 HydrophobicContact CD1-CB 3.82Å; Y233-C256 HydrophobicContact CE1-CB 4.41Å; W252-C256 PolarHBondContact O-N 2.67Å; A253-C256 PolarHBondContact O-N 3.27Å; C256-A259 PolarHBondContact O-N 2.63Å; C256-E260 WeakPolarHBondContact O-CB 3.41Å; C256-E260 PolarHBondContact O-N 3.37Å
257	V	97.8	Very high	95.6	Very high	2 Å²	2	9 Å²	9	1%	0.012	6%	0.064	C	C	.	.	H	α-helix	trans	-67.5	-39.7	178.2	171.3	0	0	0	0	111.9	L153 I176 P195 I198 Y233 A253 I254 G255 E260 M261	L153-V257 HydrophobicContact CD2-CG1 3.67Å; I176-V257 HydrophobicContact CD1-CG1 4.44Å; P195-V257 HydrophobicContact CG-CG2 4.29Å; I198-V257 HydrophobicContact CD1-CG1 3.76Å; I198-V257 HydrophobicContact CD1-CG2 4.26Å; Y233-V257 HydrophobicContact CD1-CG2 3.87Å; Y233-V257 HydrophobicContact CE1-CG2 3.82Å; A253-V257 WeakPolarHBondContact O-CG2 3.31Å; A253-V257 PolarHBondContact O-N 3.48Å; I254-V257 PolarHBondContact O-N 3.27Å; G255-V257 PolarHBondContact O-N 3.5Å; V257-E260 PolarHBondContact O-N 2.77Å; V257-M261 HydrophobicContact CG1-CE 4.22Å; V257-M261 WeakPolarHBondContact O-CG 3.13Å; V257-M261 PolarHBondContact O-N 2.87Å
258	F	97.9	Very high	95.7	Very high	1 Å²	1	7.4 Å²	7.4	0%	0.004	5%	0.053	C	C	.	.	H	α-helix	trans	-61.7	-46.4	174.6	173.2	-104.8	0	0	0	111.8	I169 T173 I254 G255 M261 L262 E331 F334 L335 Y357	I169-F258 HydrophobicContact CG2-CD2 4.04Å; I169-F258 HydrophobicContact CG2-CE2 4Å; T173-F258 HydrophobicContact CG2-CB 4.49Å; T173-F258 HydrophobicContact CG2-CD2 3.91Å; T173-F258 WeakPolarHBondContact OG1-CD2 3.42Å; I254-F258 VanDerWaalsContact O-CB 3.27Å; I254-F258 WeakPolarHBondContact O-CB 3.33Å; I254-F258 PolarHBondContact O-N 2.81Å; G255-F258 PolarHBondContact O-N 3.45Å; F258-M261 PolarHBondContact O-N 3.36Å; F258-L262 HydrophobicContact CD1-CD1 4.07Å; F258-L262 HydrophobicContact CE1-CD1 3.53Å; F258-L262 HydrophobicContact CE2-CD1 4.09Å; F258-L262 HydrophobicContact CZ-CD1 3.57Å; F258-L262 PolarHBondContact O-N 3.37Å; F258-E331 HydrophobicContact CE1-CB 4.45Å; F258-E331 WeakPolarHBondContact CE1-O 3.47Å; F258-E331 HydrophobicContact CZ-CB 4.15Å; F258-E331 HydrophobicContact CZ-CG 4.2Å; F258-F334 HydrophobicContact CB-CE1 4.22Å; F258-F334 AromaticContact CD1-CD1 3.64Å; F258-F334 HydrophobicContact CD1-CD1 3.64Å; F258-F334 AromaticContact CD1-CE1 3.95Å; F258-F334 HydrophobicContact CD1-CE1 3.95Å; F258-F334 HydrophobicContact CD2-CD1 4.13Å; F258-F334 AromaticContact CD2-CE1 3.95Å; F258-F334 HydrophobicContact CD2-CE1 3.95Å; F258-F334 AromaticContact CE1-CD1 3.55Å; F258-F334 HydrophobicContact CE1-CD1 3.55Å; F258-F334 HydrophobicContact CE1-CE1 4.27Å; F258-F334 HydrophobicContact CE1-CG 4.5Å; F258-F334 HydrophobicContact CE2-CD1 4.04Å; F258-F334 HydrophobicContact CE2-CE1 4.25Å; F258-F334 AromaticContact CG-CD1 3.91Å; F258-F334 HydrophobicContact CG-CD1 3.91Å; F258-F334 AromaticContact CG-CE1 3.77Å; F258-F334 HydrophobicContact CG-CE1 3.77Å; F258-F334 AromaticContact CZ-CD1 3.74Å; F258-F334 HydrophobicContact CZ-CD1 3.74Å; F258-F334 HydrophobicContact CZ-CE1 4.39Å; F258-L335 HydrophobicContact CD1-CB 4.27Å; F258-L335 HydrophobicContact CD1-CD1 4.44Å; F258-L335 HydrophobicContact CE1-CB 4.27Å; F258-Y357 HydrophobicContact CE2-CD1 4.49Å; F258-Y357 AromaticContact CE2-CE1 3.69Å; F258-Y357 HydrophobicContact CE2-CE1 3.69Å; F258-Y357 HydrophobicContact CE2-CE2 4.42Å; F258-Y357 AromaticContact CE2-CZ 3.66Å; F258-Y357 HydrophobicContact CZ-CE1 4.17Å; F258-Y357 HydrophobicContact CZ-CE2 4.3Å; F258-Y357 AromaticContact CZ-CZ 3.97Å
259	A	95.9	Very high	95.5	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-62.7	-44.9	175.3	0	0	0	0	0	112.1	G255 C256 M261 L262 L263 L267 F319 L335	G255-A259 WeakPolarHBondContact O-CB 3.4Å; G255-A259 PolarHBondContact O-N 3.15Å; C256-A259 PolarHBondContact O-N 2.63Å; A259-M261 PolarHBondContact O-N 2.89Å; A259-L262 PolarHBondContact O-N 3.43Å; A259-L262 VanDerWaalsContact O-N 3.14Å; A259-L263 WeakPolarHBondContact O-CB 3.44Å; A259-L263 VanDerWaalsContact O-CG 3.32Å; A259-L263 WeakPolarHBondContact O-CG 3.27Å; A259-L263 PolarHBondContact O-N 3.31Å; A259-L267 HydrophobicContact CB-CB 3.93Å; A259-L267 HydrophobicContact CB-CD1 4.07Å; A259-L267 HydrophobicContact CB-CD2 3.7Å; A259-L267 HydrophobicContact CB-CG 4.1Å; A259-F319 HydrophobicContact CB-CE2 4.36Å; A259-F319 HydrophobicContact CB-CZ 3.83Å; A259-L335 HydrophobicContact CB-CD1 3.98Å; A259-L335 HydrophobicContact CB-CD2 4.05Å
260	E	94.8	Very high	95.4	Very high	1 Å²	1	8.2 Å²	8.2	1%	0.005	6%	0.058	C	C	.	.	H	α-helix	trans	-61.8	-40.6	177.1	173.8	164.2	-133.7	0	0	112.1	M157 P195 Y233 C256 V257 L262 L263 G264 C265 P266 R618	M157-E260 HydrophobicContact CE-CG 3.68Å; M157-E260 WeakPolarHBondContact CE-O 3.18Å; P195-E260 VanDerWaalsContact CG-OE2 3.31Å; P195-E260 WeakPolarHBondContact CG-OE2 3.41Å; Y233-E260 PolarHBondContact OH-OE2 3.26Å; C256-E260 WeakPolarHBondContact O-CB 3.41Å; C256-E260 PolarHBondContact O-N 3.37Å; V257-E260 PolarHBondContact O-N 2.77Å; E260-L262 VanDerWaalsContact C-N 3.26Å; E260-L262 PolarHBondContact O-N 2.69Å; E260-L263 PolarHBondContact O-N 3.27Å; E260-G264 WeakPolarHBondContact O-CA 3.42Å; E260-G264 PolarHBondContact O-N 3.47Å; E260-C265 WeakPolarHBondContact CA-O 3.41Å; E260-C265 WeakPolarHBondContact CG-O 3.46Å; E260-P266 WeakPolarHBondContact OE1-CA 3.49Å; E260-P266 VanDerWaalsContact OE1-CD 3.23Å; E260-P266 WeakPolarHBondContact OE1-CD 3.17Å; E260-P266 VanDerWaalsContact OE1-CG 3.24Å; E260-P266 WeakPolarHBondContact OE1-CG 3.3Å; E260-P266 VanDerWaalsContact OE1-N 3.13Å; E260-R618 IonicContact OE1-CZ 2.71Å; E260-R618 IonicContact OE1-NH2 2.66Å; E260-R618 PolarHBondContact OE1-NH2 3.46Å; E260-R618 IonicContact OE2-CZ 2.91Å; E260-R618 IonicContact OE2-NH2 2.62Å; E260-R618 PolarHBondContact OE2-NH2 3.22Å
261	M	94.8	Very high	95.1	Very high	1 Å²	1	12.1 Å²	12.1	1%	0.005	9%	0.085	C	C	.	.	H	α-helix	trans	-58.8	-35	174.3	-79.4	-167	-71.3	0	0	113.3	L153 M157 L164 I169 I172 T173 V257 F258 A259	L153-M261 HydrophobicContact CD1-CG 4.12Å; L153-M261 HydrophobicContact CD1-SD 3.86Å; L153-M261 HydrophobicContact CD2-CG 4.09Å; L153-M261 HydrophobicContact CD2-SD 3.87Å; M157-M261 HydrophobicContact SD-CG 3.9Å; L164-M261 HydrophobicContact CD1-CB 4.36Å; L164-M261 HydrophobicContact CD1-CG 3.97Å; L164-M261 HydrophobicContact CD1-SD 4.14Å; I169-M261 HydrophobicContact CD1-CB 4.14Å; I169-M261 WeakPolarHBondContact CD1-O 3.42Å; I169-M261 HydrophobicContact CG1-CB 4.04Å; I169-M261 HydrophobicContact CG2-CB 4.07Å; I169-M261 HydrophobicContact CG2-CE 4.06Å; I169-M261 HydrophobicContact CG2-SD 4.34Å; I172-M261 HydrophobicContact CB-CE 4.49Å; I172-M261 HydrophobicContact CB-SD 4.11Å; I172-M261 HydrophobicContact CD1-SD 4.25Å; I172-M261 HydrophobicContact CG2-CE 4.02Å; I172-M261 HydrophobicContact CG2-SD 3.7Å; T173-M261 WeakPolarHBondContact OG1-CE 3.07Å; V257-M261 HydrophobicContact CG1-CE 4.22Å; V257-M261 WeakPolarHBondContact O-CG 3.13Å; V257-M261 PolarHBondContact O-N 2.87Å; F258-M261 PolarHBondContact O-N 3.36Å; A259-M261 PolarHBondContact O-N 2.89Å
262	L	92.8	Very high	94.7	Very high	4 Å²	4	14.4 Å²	14.4	2%	0.021	10%	0.102	C	C	.	.	H	α-helix	trans	-80.1	-36.9	176.2	-71.1	166.2	0	0	0	112.5	K163 K166 I169 F258 A259 E260 F319 L325 L327 E331	K163-L262 VanDerWaalsContact CD-O 3.3Å; K163-L262 WeakPolarHBondContact CD-O 3.3Å; K163-L262 PolarHBondContact NZ-O 3.28Å; K166-L262 HydrophobicContact CG-CD2 4.28Å; I169-L262 HydrophobicContact CD1-CD2 3.71Å; I169-L262 HydrophobicContact CD1-CG 4.12Å; I169-L262 HydrophobicContact CG2-CG 4.46Å; F258-L262 HydrophobicContact CD1-CD1 4.07Å; F258-L262 HydrophobicContact CE1-CD1 3.53Å; F258-L262 HydrophobicContact CE2-CD1 4.09Å; F258-L262 HydrophobicContact CZ-CD1 3.57Å; F258-L262 PolarHBondContact O-N 3.37Å; A259-L262 PolarHBondContact O-N 3.43Å; A259-L262 VanDerWaalsContact O-N 3.14Å; E260-L262 VanDerWaalsContact C-N 3.26Å; E260-L262 PolarHBondContact O-N 2.69Å; L262-F319 HydrophobicContact CB-CE1 3.85Å; L262-F319 HydrophobicContact CD1-CE1 4.38Å; L262-L325 HydrophobicContact CB-CD2 4.46Å; L262-L325 WeakPolarHBondContact O-CD2 3.01Å; L262-L327 HydrophobicContact CD1-CD2 3.92Å; L262-E331 HydrophobicContact CD1-CB 4.47Å
263	L	90.2	Very high	94.3	Very high	6 Å²	6	15.1 Å²	15.1	3%	0.031	11%	0.105	C	C	.	.	H	α-helix	trans	-77.1	-36.2	-179.1	-71.8	171.8	0	0	0	112.6	K163 A259 E260 C265 L267 F319 T322	K163-L263 WeakPolarHBondContact CE-O 3.29Å; K163-L263 PolarHBondContact NZ-O 3.28Å; A259-L263 WeakPolarHBondContact O-CB 3.44Å; A259-L263 VanDerWaalsContact O-CG 3.32Å; A259-L263 WeakPolarHBondContact O-CG 3.27Å; A259-L263 PolarHBondContact O-N 3.31Å; E260-L263 PolarHBondContact O-N 3.27Å; L263-C265 VanDerWaalsContact C-N 3.26Å; L263-C265 WeakPolarHBondContact CB-O 3.49Å; L263-L267 HydrophobicContact CD1-CD1 3.97Å; L263-F319 HydrophobicContact CD1-CE1 4.38Å; L263-F319 HydrophobicContact CD1-CE2 4Å; L263-F319 HydrophobicContact CD1-CZ 3.91Å; L263-F319 HydrophobicContact CD2-CD1 3.57Å; L263-F319 HydrophobicContact CD2-CD2 4.04Å; L263-F319 HydrophobicContact CD2-CE1 3.66Å; L263-F319 HydrophobicContact CD2-CE2 4.15Å; L263-F319 HydrophobicContact CD2-CG 3.79Å; L263-F319 HydrophobicContact CD2-CZ 3.97Å; L263-F319 HydrophobicContact CG-CD1 4.12Å; L263-F319 HydrophobicContact CG-CE1 3.65Å; L263-F319 HydrophobicContact CG-CE2 4.14Å; L263-F319 HydrophobicContact CG-CZ 3.68Å; L263-T322 HydrophobicContact CD2-CG2 4.02Å
264	G	89	Confident	94.1	Very high	30 Å²	30	17.6 Å²	17.6	31%	0.309	12%	0.118	S	C	.	.	S	Bend	trans	80.4	4.9	-165.3	0	0	0	0	0	113.6	E260	E260-G264 WeakPolarHBondContact O-CA 3.42Å; E260-G264 PolarHBondContact O-N 3.47Å
265	C	89.4	Confident	93.8	Very high	44 Å²	44	19 Å²	19	30%	0.297	13%	0.126	S	C	.	.	S	Bend	trans	-153.1	161.6	176.8	63.5	0	0	0	0	110.5	E260 L263 T322	E260-C265 WeakPolarHBondContact CA-O 3.41Å; E260-C265 WeakPolarHBondContact CG-O 3.46Å; L263-C265 VanDerWaalsContact C-N 3.26Å; L263-C265 WeakPolarHBondContact CB-O 3.49Å; C265-T322 VanDerWaalsContact SG-CG2 3.6Å
266	P	92.5	Very high	93.6	Very high	17 Å²	17	19 Å²	19	11%	0.11	13%	0.126	C	C	.	.			trans	-60.9	141.5	-173.2	-18.9	26.5	0	0	0	112.9	W232 E260 W268 P269	W232-P266 HydrophobicContact CD2-CB 4.42Å; W232-P266 HydrophobicContact CD2-CG 4.47Å; W232-P266 HydrophobicContact CE3-CB 3.72Å; W232-P266 HydrophobicContact CE3-CG 3.46Å; W232-P266 VanDerWaalsContact CE3-CG 3.46Å; W232-P266 HydrophobicContact CH2-CG 4.24Å; W232-P266 HydrophobicContact CZ3-CB 4.1Å; W232-P266 HydrophobicContact CZ3-CG 3.31Å; E260-P266 WeakPolarHBondContact OE1-CA 3.49Å; E260-P266 VanDerWaalsContact OE1-CD 3.23Å; E260-P266 WeakPolarHBondContact OE1-CD 3.17Å; E260-P266 VanDerWaalsContact OE1-CG 3.24Å; E260-P266 WeakPolarHBondContact OE1-CG 3.3Å; E260-P266 VanDerWaalsContact OE1-N 3.13Å; P266-W268 PolarHBondContact O-N 3.11Å; P266-P269 HydrophobicContact CB-CB 4.06Å; P266-P269 HydrophobicContact CG-CB 4.25Å
267	L	95	Very high	93.5	Very high	3 Å²	3	19 Å²	19	2%	0.016	13%	0.125	C	C	.	.	S	Bend	trans	-61.3	-46.2	178.5	-179.3	59.8	0	0	0	111.8	A259 L263 L315 R318 F319 L335	A259-L267 HydrophobicContact CB-CB 3.93Å; A259-L267 HydrophobicContact CB-CD1 4.07Å; A259-L267 HydrophobicContact CB-CD2 3.7Å; A259-L267 HydrophobicContact CB-CG 4.1Å; L263-L267 HydrophobicContact CD1-CD1 3.97Å; L267-L315 HydrophobicContact CD1-CD2 4.39Å; L267-R318 PolarHBondContact O-NE 3.01Å; L267-R318 PolarHBondContact O-NH2 2.93Å; L267-F319 HydrophobicContact CD1-CE2 4.01Å; L267-L335 HydrophobicContact CD2-CD1 4.49Å
268	W	95.8	Very high	93.3	Very high	1 Å²	1	23.1 Å²	23.1	0%	0.004	14%	0.141	C	C	.	.			trans	-137.3	90.4	178.3	-62.1	-59.7	0	0	0	110.8	W232 W252 P266 G270 Q276 L279 I280 N283 L284 L315 V339	W232-W268 WeakPolarHBondContact CB-O 3.34Å; W252-W268 AromaticContact CE2-CZ3 3.9Å; W252-W268 HydrophobicContact CH2-CH2 4.12Å; W252-W268 HydrophobicContact CH2-CZ3 4.03Å; W252-W268 HydrophobicContact CZ2-CE3 4.08Å; W252-W268 AromaticContact CZ2-CH2 3.93Å; W252-W268 HydrophobicContact CZ2-CH2 3.93Å; W252-W268 AromaticContact CZ2-CZ3 3.38Å; W252-W268 HydrophobicContact CZ2-CZ3 3.38Å; P266-W268 PolarHBondContact O-N 3.11Å; W268-G270 PolarHBondContact O-N 3.46Å; W268-G270 VanDerWaalsContact O-N 3.15Å; W268-Q276 VanDerWaalsContact CB-NE2 3.33Å; W268-Q276 PolarHBondContact O-NE2 2.94Å; W268-Q276 PolarHBondContact O-OE1 2.63Å; W268-L279 HydrophobicContact CB-CB 4.17Å; W268-L279 HydrophobicContact CG-CB 4.26Å; W268-L279 PolarHBondContact NE1-O 3.41Å; W268-L279 VanDerWaalsContact NE1-O 3.14Å; W268-I280 HydrophobicContact CD2-CG1 3.8Å; W268-I280 HydrophobicContact CE3-CG1 3.85Å; W268-I280 HydrophobicContact CG-CG1 4.15Å; W268-I280 HydrophobicContact CZ3-CG1 4.33Å; W268-N283 HydrophobicContact CZ2-CB 4.14Å; W268-N283 PolarHBondContact NE1-OD1 2.94Å; W268-L284 HydrophobicContact CH2-CD1 3.82Å; W268-L284 HydrophobicContact CH2-CG 4.34Å; W268-L284 HydrophobicContact CZ2-CD1 4.08Å; W268-L284 HydrophobicContact CZ2-CG 4.13Å; W268-L315 HydrophobicContact CZ2-CD2 3.99Å; W268-V339 HydrophobicContact CH2-CB 4.19Å; W268-V339 HydrophobicContact CH2-CG1 4.22Å; W268-V339 HydrophobicContact CH2-CG2 4.27Å; W268-V339 HydrophobicContact CZ3-CG1 4.3Å
269	P	94.5	Very high	93.1	Very high	50 Å²	50	24.4 Å²	24.4	33%	0.325	15%	0.148	S	C	.	.			trans	-86.1	67.8	-178.8	33.7	-33.8	0	0	0	112.5	W232 P266	W232-P269 HydrophobicContact CD2-CB 4.08Å; W232-P269 HydrophobicContact CE3-CB 4.4Å; W232-P269 HydrophobicContact CH2-CB 4.25Å; W232-P269 HydrophobicContact CZ2-CB 3.92Å; W232-P269 HydrophobicContact CZ3-CB 4.47Å; P266-P269 HydrophobicContact CB-CB 4.06Å; P266-P269 HydrophobicContact CG-CB 4.25Å
270	G	94.6	Very high	93.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	15%	0.148	C	C	.	.			trans	-68	136.5	-177.9	0	0	0	0	0	114.1	R231 W232 W268 Q276	R231-G270 PolarHBondContact NH1-O 2.82Å; W232-G270 VanDerWaalsContact CD1-N 3.35Å; W232-G270 PolarHBondContact NE1-O 2.82Å; W268-G270 PolarHBondContact O-N 3.46Å; W268-G270 VanDerWaalsContact O-N 3.15Å; G270-Q276 VanDerWaalsContact CA-OE1 3.23Å
271	S	91.3	Very high	93.1	Very high	83 Å²	83	24.4 Å²	24.4	58%	0.58	15%	0.148	S	C	*	.	S	Bend	trans	-73.2	-35.5	175.8	60.6	0	0	0	0	113	R231 D275	R231-S271 PolarHBondContact NH1-O 2.86Å; S271-D275 WeakPolarHBondContact CB-OD2 3.41Å; S271-D275 PolarHBondContact N-OD2 3.4Å; S271-D275 WeakPolarHBondContact OG-CB 3.18Å; S271-D275 PolarHBondContact OG-OD2 3.22Å
272	S	90.7	Very high	93.1	Very high	51 Å²	51	27.5 Å²	27.5	36%	0.357	16%	0.161	S	C	.	.	S	Bend	trans	-136.9	165.7	178.6	66.3	0	0	0	0	110.6	R231 L274 D275 Q276	R231-S272 VanDerWaalsContact CD-C 3.46Å; R231-S272 WeakPolarHBondContact CD-O 3.26Å; S272-L274 PolarHBondContact O-N 2.94Å; S272-D275 PolarHBondContact O-N 2.77Å; S272-D275 WeakPolarHBondContact OG-CB 3.49Å; S272-D275 PolarHBondContact OG-N 2.85Å; S272-Q276 WeakPolarHBondContact O-CB 3.47Å; S272-Q276 PolarHBondContact O-N 2.8Å
273	D	90.3	Very high	93.2	Very high	15 Å²	15	27.5 Å²	27.5	8%	0.08	16%	0.162	C	C	.	.	H	α-helix	trans	-63.9	-27.6	-179.9	-69	12.2	0	0	0	111.6	R231 R234 L239 L277	R231-D273 WeakPolarHBondContact CD-OD1 3.49Å; R231-D273 IonicContact CZ-OD1 3.9Å; R231-D273 IonicContact NE-OD1 3.08Å; R231-D273 PolarHBondContact NE-OD1 2.73Å; R231-D273 IonicContact NH2-OD1 2.74Å; R234-D273 IonicContact NH1-OD1 3.95Å; R234-D273 PolarHBondContact NH1-OD1 3.35Å; R234-D273 IonicContact NH1-OD2 3.91Å; R234-D273 PolarHBondContact NH1-OD2 2.98Å; L239-D273 HydrophobicContact CD2-CB 4.05Å; D273-L277 WeakPolarHBondContact O-CG 3.42Å; D273-L277 PolarHBondContact O-N 2.92Å; D273-L277 VanDerWaalsContact O-N 3.14Å
274	L	92.3	Very high	93.4	Very high	57 Å²	57	29.4 Å²	29.4	30%	0.298	17%	0.172	S	C	.	.	H	α-helix	trans	-73.4	-43.2	173.1	-173.6	69.5	0	0	0	112.8	S272 Q276 L277 Y278 F295 I304 P307	S272-L274 PolarHBondContact O-N 2.94Å; L274-Q276 VanDerWaalsContact C-N 3.34Å; L274-L277 WeakPolarHBondContact O-CB 3.33Å; L274-L277 PolarHBondContact O-N 3.16Å; L274-Y278 PolarHBondContact O-N 2.66Å; L274-F295 HydrophobicContact CD1-CE2 3.9Å; L274-F295 HydrophobicContact CD1-CZ 3.7Å; L274-I304 HydrophobicContact CD1-CG2 3.84Å; L274-I304 HydrophobicContact CD2-CD1 4.48Å; L274-I304 HydrophobicContact CD2-CG2 3.82Å; L274-P307 HydrophobicContact CD1-CG 3.57Å; L274-P307 HydrophobicContact CG-CG 4.25Å
275	D	93	Very high	93.6	Very high	32 Å²	32	28.6 Å²	28.6	17%	0.171	16%	0.163	C	C	.	.	H	α-helix	trans	-66.6	-37.2	175.1	177.9	39.1	0	0	0	111.2	S271 S272 L277 Y278 L279	S271-D275 WeakPolarHBondContact CB-OD2 3.41Å; S271-D275 PolarHBondContact N-OD2 3.4Å; S271-D275 WeakPolarHBondContact OG-CB 3.18Å; S271-D275 PolarHBondContact OG-OD2 3.22Å; S272-D275 PolarHBondContact O-N 2.77Å; S272-D275 WeakPolarHBondContact OG-CB 3.49Å; S272-D275 PolarHBondContact OG-N 2.85Å; D275-L277 VanDerWaalsContact C-N 3.35Å; D275-L277 PolarHBondContact O-N 2.62Å; D275-Y278 PolarHBondContact O-N 3.18Å; D275-L279 WeakPolarHBondContact O-CB 3.39Å; D275-L279 WeakPolarHBondContact O-CG 3.47Å; D275-L279 PolarHBondContact O-N 3.37Å
276	Q	95.1	Very high	93.8	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-58.7	-45	170.6	-169.5	71.8	41.2	0	0	111.4	R231 L239 W268 G270 S272 L274 L279 I280	R231-Q276 HydrophobicContact CG-CB 4.04Å; R231-Q276 HydrophobicContact CG-CG 3.99Å; L239-Q276 HydrophobicContact CD1-CB 4.15Å; L239-Q276 HydrophobicContact CD1-CG 3.51Å; L239-Q276 HydrophobicContact CD2-CB 4.07Å; L239-Q276 HydrophobicContact CD2-CG 3.87Å; L239-Q276 HydrophobicContact CG-CG 4.36Å; W268-Q276 VanDerWaalsContact CB-NE2 3.33Å; W268-Q276 PolarHBondContact O-NE2 2.94Å; W268-Q276 PolarHBondContact O-OE1 2.63Å; G270-Q276 VanDerWaalsContact CA-OE1 3.23Å; S272-Q276 WeakPolarHBondContact O-CB 3.47Å; S272-Q276 PolarHBondContact O-N 2.8Å; L274-Q276 VanDerWaalsContact C-N 3.34Å; Q276-L279 PolarHBondContact O-N 3.44Å; Q276-I280 HydrophobicContact CG-CD1 4.12Å; Q276-I280 WeakPolarHBondContact O-CD1 3.45Å; Q276-I280 WeakPolarHBondContact O-CG1 3.38Å; Q276-I280 PolarHBondContact O-N 3.43Å; Q276-I280 VanDerWaalsContact O-N 3.13Å
277	L	95.1	Very high	93.9	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.4	-44.6	174.2	-75.3	166.4	0	0	0	112	L239 V240 D273 L274 D275 I280 T281 L287 F295 F301 P307	L239-L277 HydrophobicContact CB-CD1 4.18Å; L239-L277 HydrophobicContact CB-CD2 3.7Å; L239-L277 HydrophobicContact CB-CG 3.81Å; L239-L277 HydrophobicContact CD1-CD2 4.08Å; L239-L277 HydrophobicContact CD1-CG 4.23Å; V240-L277 HydrophobicContact CG1-CD1 4.31Å; V240-L277 HydrophobicContact CG1-CD2 4.17Å; D273-L277 WeakPolarHBondContact O-CG 3.42Å; D273-L277 PolarHBondContact O-N 2.92Å; D273-L277 VanDerWaalsContact O-N 3.14Å; L274-L277 WeakPolarHBondContact O-CB 3.33Å; L274-L277 PolarHBondContact O-N 3.16Å; D275-L277 VanDerWaalsContact C-N 3.35Å; D275-L277 PolarHBondContact O-N 2.62Å; L277-I280 PolarHBondContact O-N 3.49Å; L277-T281 WeakPolarHBondContact O-CG2 3.27Å; L277-T281 PolarHBondContact O-N 3.17Å; L277-T281 PolarHBondContact O-OG1 2.84Å; L277-L287 HydrophobicContact CD2-CD2 4.02Å; L277-F295 HydrophobicContact CD1-CD2 3.89Å; L277-F295 HydrophobicContact CD1-CE2 3.77Å; L277-F301 HydrophobicContact CD1-CZ 4.4Å; L277-P307 HydrophobicContact CB-CG 4.28Å
278	Y	94.3	Very high	93.8	Very high	90 Å²	90	34 Å²	34	35%	0.353	18%	0.183	S	C	.	.	H	α-helix	trans	-59.6	-45.9	176.1	171.7	-100	0	0	0	112.7	L274 D275 I280 T281 K282 P307	L274-Y278 PolarHBondContact O-N 2.66Å; D275-Y278 PolarHBondContact O-N 3.18Å; Y278-I280 VanDerWaalsContact C-N 3.26Å; Y278-I280 PolarHBondContact O-N 3.16Å; Y278-T281 PolarHBondContact O-N 2.92Å; Y278-T281 PolarHBondContact O-OG1 2.86Å; Y278-K282 HydrophobicContact CE1-CD 3.99Å; Y278-K282 WeakPolarHBondContact O-CB 3.46Å; Y278-K282 PolarHBondContact O-N 3.43Å; Y278-K282 PolarHBondContact OH-NZ 2.99Å; Y278-P307 HydrophobicContact CD2-CB 4.28Å
279	L	94.4	Very high	93.8	Very high	27 Å²	27	38.5 Å²	38.5	14%	0.141	21%	0.213	C	C	.	.	H	α-helix	trans	-61.3	-37	177.5	-73.1	176.2	0	0	0	112	W268 D275 Q276 N283	W268-L279 HydrophobicContact CB-CB 4.17Å; W268-L279 HydrophobicContact CG-CB 4.26Å; W268-L279 PolarHBondContact NE1-O 3.41Å; W268-L279 VanDerWaalsContact NE1-O 3.14Å; D275-L279 WeakPolarHBondContact O-CB 3.39Å; D275-L279 WeakPolarHBondContact O-CG 3.47Å; D275-L279 PolarHBondContact O-N 3.37Å; Q276-L279 PolarHBondContact O-N 3.44Å; L279-N283 PolarHBondContact O-OD1 3.18Å
280	I	95.9	Very high	93.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-70	-53	176.5	-68.9	164.7	0	0	0	110.9	P236 L239 W252 W268 Q276 L277 Y278 K282 N283 L284 M341	P236-I280 HydrophobicContact CG-CG2 4.31Å; L239-I280 HydrophobicContact CD1-CD1 3.59Å; W252-I280 HydrophobicContact CH2-CG2 3.65Å; W252-I280 HydrophobicContact CZ2-CD1 3.77Å; W252-I280 HydrophobicContact CZ2-CG1 3.98Å; W252-I280 HydrophobicContact CZ2-CG2 3.9Å; W268-I280 HydrophobicContact CD2-CG1 3.8Å; W268-I280 HydrophobicContact CE3-CG1 3.85Å; W268-I280 HydrophobicContact CG-CG1 4.15Å; W268-I280 HydrophobicContact CZ3-CG1 4.33Å; Q276-I280 HydrophobicContact CG-CD1 4.12Å; Q276-I280 WeakPolarHBondContact O-CD1 3.45Å; Q276-I280 WeakPolarHBondContact O-CG1 3.38Å; Q276-I280 PolarHBondContact O-N 3.43Å; Q276-I280 VanDerWaalsContact O-N 3.13Å; L277-I280 PolarHBondContact O-N 3.49Å; Y278-I280 VanDerWaalsContact C-N 3.26Å; Y278-I280 PolarHBondContact O-N 3.16Å; I280-K282 VanDerWaalsContact C-N 3.29Å; I280-K282 PolarHBondContact O-N 3.44Å; I280-N283 PolarHBondContact O-N 3.09Å; I280-L284 HydrophobicContact CG2-CD1 4.08Å; I280-L284 PolarHBondContact O-N 2.84Å; I280-M341 HydrophobicContact CG2-CE 4.09Å; I280-M341 HydrophobicContact CG2-SD 3.85Å
281	T	95.1	Very high	93.9	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.006	22%	0.215	C	C	.	.	H	α-helix	trans	-66.1	-32.8	-176.7	57.6	0	0	0	0	112.1	L277 Y278 N283 L284 G285 L287 P307 M341	L277-T281 WeakPolarHBondContact O-CG2 3.27Å; L277-T281 PolarHBondContact O-N 3.17Å; L277-T281 PolarHBondContact O-OG1 2.84Å; Y278-T281 PolarHBondContact O-N 2.92Å; Y278-T281 PolarHBondContact O-OG1 2.86Å; T281-N283 PolarHBondContact O-N 3.5Å; T281-L284 PolarHBondContact O-N 3.06Å; T281-G285 WeakPolarHBondContact CA-O 3.35Å; T281-G285 VanDerWaalsContact CB-O 3.23Å; T281-G285 WeakPolarHBondContact CB-O 3.28Å; T281-G285 WeakPolarHBondContact CG2-O 3.25Å; T281-G285 WeakPolarHBondContact O-CA 3.37Å; T281-G285 PolarHBondContact O-N 3.44Å; T281-L287 HydrophobicContact CG2-CD2 3.72Å; T281-L287 HydrophobicContact CG2-CG 4.06Å; T281-P307 WeakPolarHBondContact CB-O 3.38Å; T281-P307 PolarHBondContact OG1-O 3.04Å; T281-M341 HydrophobicContact CG2-CE 4.15Å
282	K	93.8	Very high	94.1	Very high	66 Å²	66	40.2 Å²	40.2	29%	0.287	20%	0.2	S	C	.	.	H	α-helix	trans	-56.6	-29.9	170.3	-175.8	171.1	-168.4	159.1	0	113.8	Y278 I280 E313	Y278-K282 HydrophobicContact CE1-CD 3.99Å; Y278-K282 WeakPolarHBondContact O-CB 3.46Å; Y278-K282 PolarHBondContact O-N 3.43Å; Y278-K282 PolarHBondContact OH-NZ 2.99Å; I280-K282 VanDerWaalsContact C-N 3.29Å; I280-K282 PolarHBondContact O-N 3.44Å; K282-E313 PolarHBondContact O-N 3.46Å
283	N	94.5	Very high	94.3	Very high	5 Å²	5	42.5 Å²	42.5	3%	0.027	21%	0.205	C	C	.	.	H	α-helix	trans	-101.8	-21.4	-179.8	-70.5	129.5	0	0	0	115.1	W268 L279 I280 T281 E313 L315 R318	W268-N283 HydrophobicContact CZ2-CB 4.14Å; W268-N283 PolarHBondContact NE1-OD1 2.94Å; L279-N283 PolarHBondContact O-OD1 3.18Å; I280-N283 PolarHBondContact O-N 3.09Å; T281-N283 PolarHBondContact O-N 3.5Å; N283-E313 VanDerWaalsContact CA-O 3.32Å; N283-E313 WeakPolarHBondContact CA-O 3.38Å; N283-E313 PolarHBondContact ND2-O 2.97Å; N283-L315 HydrophobicContact CB-CD2 4.14Å; N283-R318 WeakPolarHBondContact OD1-CD 2.97Å
284	L	95.2	Very high	94.5	Very high	46 Å²	46	43.4 Å²	43.4	24%	0.241	21%	0.209	C	C	.	.	H	α-helix	trans	-122.9	-4.7	-173.1	-59.1	-179.4	0	0	0	114.9	W252 W268 I280 T281 L315 V339 M341	W252-L284 HydrophobicContact CH2-CD1 3.58Å; W252-L284 HydrophobicContact CZ3-CD1 4.01Å; W268-L284 HydrophobicContact CH2-CD1 3.82Å; W268-L284 HydrophobicContact CH2-CG 4.34Å; W268-L284 HydrophobicContact CZ2-CD1 4.08Å; W268-L284 HydrophobicContact CZ2-CG 4.13Å; I280-L284 HydrophobicContact CG2-CD1 4.08Å; I280-L284 PolarHBondContact O-N 2.84Å; T281-L284 PolarHBondContact O-N 3.06Å; L284-L315 HydrophobicContact CD2-CD1 4Å; L284-L315 HydrophobicContact CD2-CD2 4.34Å; L284-L315 HydrophobicContact CD2-CG 4.14Å; L284-V339 HydrophobicContact CD1-CB 4.26Å; L284-V339 HydrophobicContact CD1-CG2 4.13Å; L284-V339 VanDerWaalsContact CD1-O 3.3Å; L284-V339 WeakPolarHBondContact CD1-O 3.23Å; L284-V339 HydrophobicContact CD2-CG2 4.01Å; L284-M341 HydrophobicContact CB-CE 4.47Å; L284-M341 HydrophobicContact CB-CG 3.88Å; L284-M341 HydrophobicContact CB-SD 3.77Å; L284-M341 HydrophobicContact CD1-CG 4.23Å; L284-M341 HydrophobicContact CD1-SD 3.61Å; L284-M341 HydrophobicContact CG-SD 4.37Å
285	G	93.6	Very high	94.5	Very high	13 Å²	13	40.7 Å²	40.7	13%	0.134	20%	0.195	C	C	.	.			trans	86.8	-163.5	-174	0	0	0	0	0	113.6	T281	T281-G285 WeakPolarHBondContact CA-O 3.35Å; T281-G285 VanDerWaalsContact CB-O 3.23Å; T281-G285 WeakPolarHBondContact CB-O 3.28Å; T281-G285 WeakPolarHBondContact CG2-O 3.25Å; T281-G285 WeakPolarHBondContact O-CA 3.37Å; T281-G285 PolarHBondContact O-N 3.44Å
286	D	93	Very high	94.5	Very high	96 Å²	96	44.8 Å²	44.8	51%	0.513	21%	0.213	S	C	.	.	S	Bend	trans	-60.1	155.2	-173.4	-85.9	-70.1	0	0	0	115	Y288 R292 M341	D286-Y288 PolarHBondContact O-N 3.37Å; D286-R292 IonicContact OD1-CZ 3.06Å; D286-R292 IonicContact OD1-NH2 2.71Å; D286-R292 PolarHBondContact OD1-NH2 2.93Å; D286-M341 WeakPolarHBondContact O-CE 3.31Å
287	L	94.2	Very high	94.4	Very high	6 Å²	6	51.1 Å²	51.1	3%	0.031	24%	0.243	C	C	.	.			trans	-61	133.1	167.9	-64.5	-174.3	0	0	0	111	P236 V240 L277 T281 H291 R292 V306 M341	P236-L287 HydrophobicContact CB-CD2 4.41Å; V240-L287 HydrophobicContact CG1-CD1 4.02Å; L277-L287 HydrophobicContact CD2-CD2 4.02Å; T281-L287 HydrophobicContact CG2-CD2 3.72Å; T281-L287 HydrophobicContact CG2-CG 4.06Å; L287-H291 HydrophobicContact CB-CB 4.46Å; L287-R292 HydrophobicContact CB-CB 4.14Å; L287-V306 HydrophobicContact CD1-CG1 3.7Å; L287-V306 HydrophobicContact CG-CG1 4.05Å; L287-M341 HydrophobicContact CD2-CE 3.92Å
288	Y	94.2	Very high	94.1	Very high	75 Å²	75	52.7 Å²	52.7	29%	0.294	25%	0.254	S	S	.	.			trans	-45	132.6	166.3	172.4	-120.2	0	0	0	110.6	D286 R290 H291 R292 D342	D286-Y288 PolarHBondContact O-N 3.37Å; Y288-R290 VanDerWaalsContact C-N 3.26Å; Y288-R290 HydrophobicContact CD1-CB 3.82Å; Y288-R290 HydrophobicContact CE1-CB 3.48Å; Y288-R290 VanDerWaalsContact CE1-CB 3.48Å; Y288-R290 PolarHBondContact O-N 3.13Å; Y288-H291 AromaticContact CD1-CD2 3.91Å; Y288-H291 AromaticContact CD1-CE1 3.89Å; Y288-H291 AromaticContact CD1-NE2 3.74Å; Y288-H291 WeakPolarHBondContact O-CA 3.47Å; Y288-H291 WeakPolarHBondContact O-CB 3.46Å; Y288-H291 PolarHBondContact O-N 3.48Å; Y288-R292 PolarHBondContact O-N 2.93Å; Y288-D342 HydrophobicContact CD2-CB 3.75Å; Y288-D342 HydrophobicContact CE2-CB 3.98Å; Y288-D342 VanDerWaalsContact CE2-CG 3.48Å; Y288-D342 WeakPolarHBondContact CE2-OD2 3.49Å; Y288-D342 HydrophobicContact CG-CB 4.12Å; Y288-D342 VanDerWaalsContact CZ-OD2 3.22Å; Y288-D342 PolarHBondContact OH-OD2 3.25Å
289	P	95.4	Very high	93.7	Very high	96 Å²	96	57.8 Å²	57.8	62%	0.623	28%	0.278	S	S	*	.	H	α-helix	trans	-53.1	-34	-166.4	-33.7	37.9	0	0	0	116.1	R292 Q293	P289-R292 PolarHBondContact O-N 3.28Å; P289-Q293 WeakPolarHBondContact O-CB 3.38Å; P289-Q293 PolarHBondContact O-N 3.23Å
290	R	95.4	Very high	93.2	Very high	96 Å²	96	64 Å²	64	36%	0.362	30%	0.3	S	S	.	.	H	α-helix	trans	-63.5	-44.2	173.5	-179	-178.5	162.1	111.4	7.5	112.2	D242 Y288 Q293 I294	D242-R290 VanDerWaalsContact CG-NH2 3.3Å; D242-R290 IonicContact OD1-CZ 2.71Å; D242-R290 IonicContact OD1-NH2 2.83Å; D242-R290 PolarHBondContact OD1-NH2 3.08Å; D242-R290 IonicContact OD2-CZ 2.74Å; D242-R290 VanDerWaalsContact OD2-CZ 3.27Å; D242-R290 IonicContact OD2-NE 3.85Å; D242-R290 PolarHBondContact OD2-NE 3.42Å; D242-R290 IonicContact OD2-NH2 2.78Å; D242-R290 PolarHBondContact OD2-NH2 2.74Å; Y288-R290 VanDerWaalsContact C-N 3.26Å; Y288-R290 HydrophobicContact CD1-CB 3.82Å; Y288-R290 HydrophobicContact CE1-CB 3.48Å; Y288-R290 VanDerWaalsContact CE1-CB 3.48Å; Y288-R290 PolarHBondContact O-N 3.13Å; R290-Q293 PolarHBondContact O-N 3.42Å; R290-I294 HydrophobicContact CG-CD1 3.95Å; R290-I294 VanDerWaalsContact O-CG1 3.3Å; R290-I294 WeakPolarHBondContact O-CG1 3.46Å; R290-I294 PolarHBondContact O-N 3.44Å
291	H	95.6	Very high	92.7	Very high	3 Å²	3	64.4 Å²	64.4	1%	0.014	30%	0.302	C	S	.	.	H	α-helix	trans	-69.2	-37.6	179.8	-57	165.4	0	0	0	111.3	E237 V240 L287 Y288 I294 F295	E237-H291 IonicContact OE2-CE1 3.69Å; V240-H291 HydrophobicContact CG1-CB 4.19Å; V240-H291 HydrophobicContact CG2-CB 3.98Å; L287-H291 HydrophobicContact CB-CB 4.46Å; Y288-H291 AromaticContact CD1-CD2 3.91Å; Y288-H291 AromaticContact CD1-CE1 3.89Å; Y288-H291 AromaticContact CD1-NE2 3.74Å; Y288-H291 WeakPolarHBondContact O-CA 3.47Å; Y288-H291 WeakPolarHBondContact O-CB 3.46Å; Y288-H291 PolarHBondContact O-N 3.48Å; H291-I294 PolarHBondContact O-N 3.3Å; H291-F295 WeakPolarHBondContact O-CB 3Å; H291-F295 PolarHBondContact O-N 3.37Å
292	R	94.9	Very high	92.1	Very high	69 Å²	69	68 Å²	68	26%	0.26	33%	0.331	S	S	.	.	H	α-helix	trans	-56.4	-52	169.9	174	174.9	-76.6	-80.5	6.8	111.1	D286 L287 Y288 P289 I294 F295 E296 V306	D286-R292 IonicContact OD1-CZ 3.06Å; D286-R292 IonicContact OD1-NH2 2.71Å; D286-R292 PolarHBondContact OD1-NH2 2.93Å; L287-R292 HydrophobicContact CB-CB 4.14Å; Y288-R292 PolarHBondContact O-N 2.93Å; P289-R292 PolarHBondContact O-N 3.28Å; R292-I294 VanDerWaalsContact C-N 3.34Å; R292-I294 PolarHBondContact O-N 3.3Å; R292-F295 PolarHBondContact O-N 3.01Å; R292-E296 WeakPolarHBondContact CG-OE1 3.45Å; R292-E296 IonicContact NH1-OE1 3.44Å; R292-E296 PolarHBondContact NH1-OE1 2.72Å; R292-E296 VanDerWaalsContact NH1-OE1 3.08Å; R292-E296 WeakPolarHBondContact O-CB 3.32Å; R292-E296 VanDerWaalsContact O-CG 3.32Å; R292-E296 WeakPolarHBondContact O-CG 3.47Å; R292-E296 PolarHBondContact O-N 3.29Å; R292-V306 HydrophobicContact CG-CG2 4.37Å
293	Q	94.7	Very high	91.7	Very high	100 Å²	100	69.1 Å²	69.1	47%	0.467	36%	0.362	S	S	.	.	H	α-helix	trans	-58.3	-43.7	177.5	-171.4	-160.8	-51.5	0	0	112.2	P289 R290 E296 Q297	P289-Q293 WeakPolarHBondContact O-CB 3.38Å; P289-Q293 PolarHBondContact O-N 3.23Å; R290-Q293 PolarHBondContact O-N 3.42Å; Q293-E296 PolarHBondContact O-N 3.38Å; Q293-Q297 HydrophobicContact CG-CG 4.46Å; Q293-Q297 WeakPolarHBondContact O-CB 3.43Å; Q293-Q297 VanDerWaalsContact O-CG 3.26Å; Q293-Q297 WeakPolarHBondContact O-CG 3.4Å; Q293-Q297 PolarHBondContact O-N 2.71Å
294	I	94	Very high	91.3	Very high	33 Å²	33	72.7 Å²	72.7	17%	0.169	38%	0.38	C	S	.	.	H	α-helix	trans	-66.1	-40.7	179.9	-69.8	168.3	0	0	0	111.4	V240 D242 R290 H291 R292 Q297 S298	V240-I294 HydrophobicContact CB-CG2 4.31Å; V240-I294 HydrophobicContact CG2-CB 4.22Å; V240-I294 HydrophobicContact CG2-CG2 3.93Å; D242-I294 HydrophobicContact CB-CD1 3.73Å; D242-I294 WeakPolarHBondContact OD2-CD1 3.39Å; R290-I294 HydrophobicContact CG-CD1 3.95Å; R290-I294 VanDerWaalsContact O-CG1 3.3Å; R290-I294 WeakPolarHBondContact O-CG1 3.46Å; R290-I294 PolarHBondContact O-N 3.44Å; H291-I294 PolarHBondContact O-N 3.3Å; R292-I294 VanDerWaalsContact C-N 3.34Å; R292-I294 PolarHBondContact O-N 3.3Å; I294-Q297 PolarHBondContact O-N 2.78Å; I294-S298 WeakPolarHBondContact O-CB 3.34Å; I294-S298 PolarHBondContact O-N 2.99Å; I294-S298 VanDerWaalsContact O-N 3.07Å
295	F	94	Very high	90.8	Very high	1 Å²	1	78.8 Å²	78.8	0%	0.004	41%	0.408	C	S	.	.	H	α-helix	trans	-60.5	-50.2	173.1	-176.2	-78.4	0	0	0	111.1	V240 L274 L277 H291 R292 Q297 S298 F301 I304 V306	V240-F295 HydrophobicContact CB-CB 4.25Å; V240-F295 HydrophobicContact CG1-CB 4.03Å; V240-F295 HydrophobicContact CG1-CD2 4.22Å; L274-F295 HydrophobicContact CD1-CE2 3.9Å; L274-F295 HydrophobicContact CD1-CZ 3.7Å; L277-F295 HydrophobicContact CD1-CD2 3.89Å; L277-F295 HydrophobicContact CD1-CE2 3.77Å; H291-F295 WeakPolarHBondContact O-CB 3Å; H291-F295 PolarHBondContact O-N 3.37Å; R292-F295 PolarHBondContact O-N 3.01Å; F295-Q297 PolarHBondContact O-N 2.98Å; F295-S298 VanDerWaalsContact O-CB 3.31Å; F295-S298 WeakPolarHBondContact O-CB 3.26Å; F295-S298 PolarHBondContact O-N 3.02Å; F295-F301 HydrophobicContact CD1-CB 4.08Å; F295-F301 HydrophobicContact CD1-CD2 4.5Å; F295-F301 HydrophobicContact CD1-CG 4.4Å; F295-F301 HydrophobicContact CD2-CB 4.3Å; F295-F301 HydrophobicContact CD2-CD1 4.2Å; F295-F301 AromaticContact CD2-CD2 3.4Å; F295-F301 HydrophobicContact CD2-CD2 3.4Å; F295-F301 VanDerWaalsContact CD2-CD2 3.4Å; F295-F301 HydrophobicContact CD2-CE1 4.38Å; F295-F301 AromaticContact CD2-CE2 3.65Å; F295-F301 HydrophobicContact CD2-CE2 3.65Å; F295-F301 AromaticContact CD2-CG 3.72Å; F295-F301 HydrophobicContact CD2-CG 3.72Å; F295-F301 HydrophobicContact CD2-CZ 4.13Å; F295-F301 HydrophobicContact CE1-CB 3.76Å; F295-F301 HydrophobicContact CE1-CG 4.13Å; F295-F301 HydrophobicContact CE2-CB 4Å; F295-F301 AromaticContact CE2-CD1 3.48Å; F295-F301 HydrophobicContact CE2-CD1 3.48Å; F295-F301 VanDerWaalsContact CE2-CD1 3.48Å; F295-F301 AromaticContact CE2-CD2 3.59Å; F295-F301 HydrophobicContact CE2-CD2 3.59Å; F295-F301 AromaticContact CE2-CE1 3.73Å; F295-F301 HydrophobicContact CE2-CE1 3.73Å; F295-F301 AromaticContact CE2-CE2 3.85Å; F295-F301 HydrophobicContact CE2-CE2 3.85Å; F295-F301 AromaticContact CE2-CG 3.41Å; F295-F301 HydrophobicContact CE2-CG 3.41Å; F295-F301 VanDerWaalsContact CE2-CG 3.41Å; F295-F301 AromaticContact CE2-CZ 3.91Å; F295-F301 HydrophobicContact CE2-CZ 3.91Å; F295-F301 HydrophobicContact CG-CB 4.35Å; F295-F301 AromaticContact CG-CD2 3.92Å; F295-F301 HydrophobicContact CG-CD2 3.92Å; F295-F301 HydrophobicContact CG-CG 4.22Å; F295-F301 HydrophobicContact CZ-CB 3.72Å; F295-F301 AromaticContact CZ-CD1 3.74Å; F295-F301 HydrophobicContact CZ-CD1 3.74Å; F295-F301 HydrophobicContact CZ-CD2 4.23Å; F295-F301 HydrophobicContact CZ-CE1 4.38Å; F295-F301 AromaticContact CZ-CG 3.64Å; F295-F301 HydrophobicContact CZ-CG 3.64Å; F295-I304 HydrophobicContact CZ-CG2 4.17Å; F295-V306 HydrophobicContact CB-CG2 4.37Å; F295-V306 HydrophobicContact CD1-CB 4.38Å; F295-V306 HydrophobicContact CD1-CG2 3.39Å; F295-V306 HydrophobicContact CE1-CB 4.42Å; F295-V306 HydrophobicContact CE1-CG2 3.84Å; F295-V306 HydrophobicContact CG-CG2 4.03Å
296	E	92.3	Very high	90.2	Very high	117 Å²	117	78.8 Å²	78.8	55%	0.547	41%	0.405	S	S	.	.	H	α-helix	trans	-65.2	-25.5	-178.9	-69.9	165.4	-176.1	0	0	112.8	R292 Q293 V306	R292-E296 WeakPolarHBondContact CG-OE1 3.45Å; R292-E296 IonicContact NH1-OE1 3.44Å; R292-E296 PolarHBondContact NH1-OE1 2.72Å; R292-E296 VanDerWaalsContact NH1-OE1 3.08Å; R292-E296 WeakPolarHBondContact O-CB 3.32Å; R292-E296 VanDerWaalsContact O-CG 3.32Å; R292-E296 WeakPolarHBondContact O-CG 3.47Å; R292-E296 PolarHBondContact O-N 3.29Å; Q293-E296 PolarHBondContact O-N 3.38Å; E296-V306 HydrophobicContact CG-CG2 3.86Å
297	Q	92.2	Very high	89.6	Confident	134 Å²	134	75 Å²	75	63%	0.626	39%	0.386	S	S	*	.	H	α-helix	trans	-90.7	-6.1	174.5	-69.7	173.6	-8.7	0	0	113.6	Q293 I294 F295	Q293-Q297 HydrophobicContact CG-CG 4.46Å; Q293-Q297 WeakPolarHBondContact O-CB 3.43Å; Q293-Q297 VanDerWaalsContact O-CG 3.26Å; Q293-Q297 WeakPolarHBondContact O-CG 3.4Å; Q293-Q297 PolarHBondContact O-N 2.71Å; I294-Q297 PolarHBondContact O-N 2.78Å; F295-Q297 PolarHBondContact O-N 2.98Å
298	S	88.8	Confident	88.6	Confident	32 Å²	32	78.4 Å²	78.4	22%	0.224	41%	0.41	C	S	.	.			trans	-80.4	124	-174.7	-177	0	0	0	0	112.6	I294 F295 Y300 F301 A302	I294-S298 WeakPolarHBondContact O-CB 3.34Å; I294-S298 PolarHBondContact O-N 2.99Å; I294-S298 VanDerWaalsContact O-N 3.07Å; F295-S298 VanDerWaalsContact O-CB 3.31Å; F295-S298 WeakPolarHBondContact O-CB 3.26Å; F295-S298 PolarHBondContact O-N 3.02Å; S298-Y300 PolarHBondContact O-N 2.93Å; S298-Y300 VanDerWaalsContact O-N 3.13Å; S298-Y300 PolarHBondContact OG-N 2.85Å; S298-F301 CarbonylContact O-C 3.54Å; S298-F301 PolarHBondContact O-N 3.33Å; S298-F301 VanDerWaalsContact O-N 3.09Å; S298-A302 PolarHBondContact O-N 2.94Å
299	K	87.3	Confident	87.5	Confident	197 Å²	197	76.1 Å²	76.1	86%	0.857	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.8	171.6	-65.7	-174.6	179.5	-177.8	0	113.5
300	Y	82.1	Confident	86.5	Confident	157 Å²	157	79 Å²	79	62%	0.616	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-27.3	178.1	-179.2	-105.2	0	0	0	112.6	S298	S298-Y300 PolarHBondContact O-N 2.93Å; S298-Y300 VanDerWaalsContact O-N 3.13Å; S298-Y300 PolarHBondContact OG-N 2.85Å
301	F	85.6	Confident	85.9	Confident	10 Å²	10	78.9 Å²	78.9	4%	0.044	44%	0.435	C	S	.	.	S	Bend	trans	-105.8	15.3	176.8	-58.8	-62.9	0	0	0	112.7	L277 F295 S298 G303 I304	L277-F301 HydrophobicContact CD1-CZ 4.4Å; F295-F301 HydrophobicContact CD1-CB 4.08Å; F295-F301 HydrophobicContact CD1-CD2 4.5Å; F295-F301 HydrophobicContact CD1-CG 4.4Å; F295-F301 HydrophobicContact CD2-CB 4.3Å; F295-F301 HydrophobicContact CD2-CD1 4.2Å; F295-F301 AromaticContact CD2-CD2 3.4Å; F295-F301 HydrophobicContact CD2-CD2 3.4Å; F295-F301 VanDerWaalsContact CD2-CD2 3.4Å; F295-F301 HydrophobicContact CD2-CE1 4.38Å; F295-F301 AromaticContact CD2-CE2 3.65Å; F295-F301 HydrophobicContact CD2-CE2 3.65Å; F295-F301 AromaticContact CD2-CG 3.72Å; F295-F301 HydrophobicContact CD2-CG 3.72Å; F295-F301 HydrophobicContact CD2-CZ 4.13Å; F295-F301 HydrophobicContact CE1-CB 3.76Å; F295-F301 HydrophobicContact CE1-CG 4.13Å; F295-F301 HydrophobicContact CE2-CB 4Å; F295-F301 AromaticContact CE2-CD1 3.48Å; F295-F301 HydrophobicContact CE2-CD1 3.48Å; F295-F301 VanDerWaalsContact CE2-CD1 3.48Å; F295-F301 AromaticContact CE2-CD2 3.59Å; F295-F301 HydrophobicContact CE2-CD2 3.59Å; F295-F301 AromaticContact CE2-CE1 3.73Å; F295-F301 HydrophobicContact CE2-CE1 3.73Å; F295-F301 AromaticContact CE2-CE2 3.85Å; F295-F301 HydrophobicContact CE2-CE2 3.85Å; F295-F301 AromaticContact CE2-CG 3.41Å; F295-F301 HydrophobicContact CE2-CG 3.41Å; F295-F301 VanDerWaalsContact CE2-CG 3.41Å; F295-F301 AromaticContact CE2-CZ 3.91Å; F295-F301 HydrophobicContact CE2-CZ 3.91Å; F295-F301 HydrophobicContact CG-CB 4.35Å; F295-F301 AromaticContact CG-CD2 3.92Å; F295-F301 HydrophobicContact CG-CD2 3.92Å; F295-F301 HydrophobicContact CG-CG 4.22Å; F295-F301 HydrophobicContact CZ-CB 3.72Å; F295-F301 AromaticContact CZ-CD1 3.74Å; F295-F301 HydrophobicContact CZ-CD1 3.74Å; F295-F301 HydrophobicContact CZ-CD2 4.23Å; F295-F301 HydrophobicContact CZ-CE1 4.38Å; F295-F301 AromaticContact CZ-CG 3.64Å; F295-F301 HydrophobicContact CZ-CG 3.64Å; S298-F301 CarbonylContact O-C 3.54Å; S298-F301 PolarHBondContact O-N 3.33Å; S298-F301 VanDerWaalsContact O-N 3.09Å; F301-G303 PolarHBondContact O-N 3.4Å; F301-I304 WeakPolarHBondContact O-CB 3.32Å; F301-I304 PolarHBondContact O-N 3.46Å
302	A	83.5	Confident	85.6	Confident	75 Å²	75	82.1 Å²	82.1	62%	0.62	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	122.8	-177.2	0	0	0	0	0	111.8	S298 I304	S298-A302 PolarHBondContact O-N 2.94Å; A302-I304 VanDerWaalsContact C-N 3.3Å
303	G	84.1	Confident	85.5	Confident	90 Å²	90	80.6 Å²	80.6	93%	0.928	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	-3.3	-175.9	0	0	0	0	0	115.1	F301	F301-G303 PolarHBondContact O-N 3.4Å
304	I	86.6	Confident	85.3	Confident	81 Å²	81	78.2 Å²	78.2	42%	0.415	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-96.8	134.4	175.2	-56.2	179.2	0	0	0	108.7	L274 F295 F301 A302	L274-I304 HydrophobicContact CD1-CG2 3.84Å; L274-I304 HydrophobicContact CD2-CD1 4.48Å; L274-I304 HydrophobicContact CD2-CG2 3.82Å; F295-I304 HydrophobicContact CZ-CG2 4.17Å; F301-I304 WeakPolarHBondContact O-CB 3.32Å; F301-I304 PolarHBondContact O-N 3.46Å; A302-I304 VanDerWaalsContact C-N 3.3Å
305	Q	84.5	Confident	85.2	Confident	174 Å²	174	76.8 Å²	76.8	81%	0.813	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-81	147.6	173.5	-65.3	-171.6	5.5	0	0	111.2
306	V	81.7	Confident	85.1	Confident	12 Å²	12	79.8 Å²	79.8	7%	0.073	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-57.3	128.2	173.7	172.8	0	0	0	0	109.6	L287 R292 F295 E296 S308	L287-V306 HydrophobicContact CD1-CG1 3.7Å; L287-V306 HydrophobicContact CG-CG1 4.05Å; R292-V306 HydrophobicContact CG-CG2 4.37Å; F295-V306 HydrophobicContact CB-CG2 4.37Å; F295-V306 HydrophobicContact CD1-CB 4.38Å; F295-V306 HydrophobicContact CD1-CG2 3.39Å; F295-V306 HydrophobicContact CE1-CB 4.42Å; F295-V306 HydrophobicContact CE1-CG2 3.84Å; F295-V306 HydrophobicContact CG-CG2 4.03Å; E296-V306 HydrophobicContact CG-CG2 3.86Å; V306-S308 PolarHBondContact O-N 3.31Å
307	P	79.3	Confident	84.9	Confident	17 Å²	17	80 Å²	80	11%	0.11	45%	0.449	C	S	.	.			trans	-61.8	99.8	179.4	-26.2	35.7	0	0	0	113.6	L274 L277 Y278 T281	L274-P307 HydrophobicContact CD1-CG 3.57Å; L274-P307 HydrophobicContact CG-CG 4.25Å; L277-P307 HydrophobicContact CB-CG 4.28Å; Y278-P307 HydrophobicContact CD2-CB 4.28Å; T281-P307 WeakPolarHBondContact CB-O 3.38Å; T281-P307 PolarHBondContact OG1-O 3.04Å
308	S	74.8	Confident	84.6	Confident	77 Å²	77	75.9 Å²	75.9	54%	0.538	43%	0.428	S	S	.	.			trans	-104.2	125.4	174.2	58.7	0	0	0	0	111.3	V306	V306-S308 PolarHBondContact O-N 3.31Å
309	S	69.7	Low	84.6	Confident	27 Å²	27	74.4 Å²	74.4	19%	0.189	42%	0.418	C	S	.	.			trans	-89.2	125.1	172.6	57.7	0	0	0	0	111.4	S311	S309-S311 PolarHBondContact O-N 3.2Å; S309-S311 VanDerWaalsContact O-N 3.08Å
310	T	74.5	Confident	84.6	Confident	157 Å²	157	70.3 Å²	70.3	96%	0.963	40%	0.402	S	S	*	.	S	Bend	trans	-58.7	-22.8	178.2	-34.3	0	0	0	0	113.7
311	S	84.1	Confident	84.5	Confident	94 Å²	94	69.4 Å²	69.4	66%	0.657	40%	0.401	S	S	*	.	S	Bend	trans	-140.8	133.8	166.8	55	0	0	0	0	110.1	S309	S309-S311 PolarHBondContact O-N 3.2Å; S309-S311 VanDerWaalsContact O-N 3.08Å
312	V	89.4	Confident	83.9	Confident	71 Å²	71	70.8 Å²	70.8	43%	0.43	41%	0.411	S	S	.	.			trans	-77.7	135.4	172.7	-176.3	0	0	0	0	108.8	P314	V312-P314 WeakPolarHBondContact O-CD 3.45Å
313	E	91.3	Very high	83.2	Confident	36 Å²	36	74.8 Å²	74.8	17%	0.168	41%	0.411	C	S	.	.			trans	-103.4	101.3	172.7	179.7	175.8	144.1	0	0	108.8	K282 N283 K317 K321	K282-E313 PolarHBondContact O-N 3.46Å; N283-E313 VanDerWaalsContact CA-O 3.32Å; N283-E313 WeakPolarHBondContact CA-O 3.38Å; N283-E313 PolarHBondContact ND2-O 2.97Å; E313-K317 HydrophobicContact CG-CB 4.08Å; E313-K321 WeakPolarHBondContact OE1-CD 3.31Å; E313-K321 WeakPolarHBondContact OE1-CE 3.14Å; E313-K321 IonicContact OE1-NZ 3.39Å; E313-K321 PolarHBondContact OE1-NZ 3.32Å; E313-K321 IonicContact OE2-NZ 2.61Å; E313-K321 PolarHBondContact OE2-NZ 3Å
314	P	91.3	Very high	82.5	Confident	50 Å²	50	76.4 Å²	76.4	33%	0.325	41%	0.405	S	S	.	.			trans	-56	150.8	-177	-26.3	35.3	0	0	0	113	V312 E316 K317 R318	V312-P314 WeakPolarHBondContact O-CD 3.45Å; P314-E316 WeakPolarHBondContact CB-OE2 3.28Å; P314-E316 PolarHBondContact O-N 2.76Å; P314-E316 VanDerWaalsContact O-N 3.13Å; P314-K317 PolarHBondContact O-N 2.77Å; P314-R318 PolarHBondContact O-N 3.27Å
315	L	92.5	Very high	82	Confident	4 Å²	4	74.2 Å²	74.2	2%	0.021	39%	0.394	C	S	.	.	H	α-helix	trans	-51.7	-38.5	-178.5	-68.7	171.6	0	0	0	111.9	L267 W268 N283 L284 K317 R318 F319 L332 L335 Q336 V339	L267-L315 HydrophobicContact CD1-CD2 4.39Å; W268-L315 HydrophobicContact CZ2-CD2 3.99Å; N283-L315 HydrophobicContact CB-CD2 4.14Å; L284-L315 HydrophobicContact CD2-CD1 4Å; L284-L315 HydrophobicContact CD2-CD2 4.34Å; L284-L315 HydrophobicContact CD2-CG 4.14Å; L315-K317 PolarHBondContact O-N 2.95Å; L315-R318 WeakPolarHBondContact O-CB 3.13Å; L315-R318 PolarHBondContact O-N 3.32Å; L315-R318 VanDerWaalsContact O-N 3.13Å; L315-F319 VanDerWaalsContact O-CD2 3.28Å; L315-F319 WeakPolarHBondContact O-CD2 3.49Å; L315-F319 PolarHBondContact O-N 3.06Å; L315-L332 HydrophobicContact CB-CD1 4.46Å; L315-L335 HydrophobicContact CD1-CD2 4Å; L315-L335 HydrophobicContact CD1-CG 4.07Å; L315-Q336 HydrophobicContact CD1-CG 4.13Å; L315-V339 HydrophobicContact CD1-CG2 3.95Å
316	E	90.9	Very high	81.9	Confident	64 Å²	64	71.5 Å²	71.5	30%	0.299	39%	0.389	S	S	.	.	H	α-helix	trans	-47.6	-54	172.6	-59.2	90	146.4	0	0	111.4	P314 R318 F319 E320 L332 Q336	P314-E316 WeakPolarHBondContact CB-OE2 3.28Å; P314-E316 PolarHBondContact O-N 2.76Å; P314-E316 VanDerWaalsContact O-N 3.13Å; E316-R318 VanDerWaalsContact C-N 3.34Å; E316-R318 PolarHBondContact O-N 2.96Å; E316-F319 PolarHBondContact O-N 2.82Å; E316-E320 WeakPolarHBondContact O-CG 3.38Å; E316-E320 PolarHBondContact O-N 3.44Å; E316-L332 HydrophobicContact CG-CD1 3.71Å; E316-L332 HydrophobicContact CG-CD2 3.57Å; E316-L332 HydrophobicContact CG-CG 4.28Å; E316-L332 WeakPolarHBondContact OE1-CD2 3.35Å; E316-Q336 PolarHBondContact OE1-NE2 3.39Å
317	K	88.3	Confident	82.2	Confident	120 Å²	120	71.9 Å²	71.9	52%	0.522	39%	0.391	S	S	.	.	H	α-helix	trans	-69.1	-30.8	-179.4	-64.4	-168.8	-179.3	179.3	0	112.8	E313 P314 L315 K321	E313-K317 HydrophobicContact CG-CB 4.08Å; P314-K317 PolarHBondContact O-N 2.77Å; L315-K317 PolarHBondContact O-N 2.95Å; K317-K321 WeakPolarHBondContact O-CG 3.37Å; K317-K321 PolarHBondContact O-N 3.23Å
318	R	86.4	Confident	82.9	Confident	48 Å²	48	73.3 Å²	73.3	18%	0.181	40%	0.401	C	S	.	.	H	α-helix	trans	-64.3	-44	172	-176.9	172	-171.8	72.2	1.1	110.7	L267 N283 P314 L315 E316 K321 T322	L267-R318 PolarHBondContact O-NE 3.01Å; L267-R318 PolarHBondContact O-NH2 2.93Å; N283-R318 WeakPolarHBondContact OD1-CD 2.97Å; P314-R318 PolarHBondContact O-N 3.27Å; L315-R318 WeakPolarHBondContact O-CB 3.13Å; L315-R318 PolarHBondContact O-N 3.32Å; L315-R318 VanDerWaalsContact O-N 3.13Å; E316-R318 VanDerWaalsContact C-N 3.34Å; E316-R318 PolarHBondContact O-N 2.96Å; R318-K321 PolarHBondContact O-N 2.97Å; R318-T322 PolarHBondContact O-N 3.29Å; R318-T322 PolarHBondContact O-OG1 3.2Å
319	F	88.7	Confident	83.8	Confident	1 Å²	1	74.8 Å²	74.8	0%	0.004	41%	0.409	C	S	.	.	H	α-helix	trans	-68.8	-34	177.3	-87	-110.2	0	0	0	113.1	A259 L262 L263 L267 L315 E316 L325 L327 L335	A259-F319 HydrophobicContact CB-CE2 4.36Å; A259-F319 HydrophobicContact CB-CZ 3.83Å; L262-F319 HydrophobicContact CB-CE1 3.85Å; L262-F319 HydrophobicContact CD1-CE1 4.38Å; L263-F319 HydrophobicContact CD1-CE1 4.38Å; L263-F319 HydrophobicContact CD1-CE2 4Å; L263-F319 HydrophobicContact CD1-CZ 3.91Å; L263-F319 HydrophobicContact CD2-CD1 3.57Å; L263-F319 HydrophobicContact CD2-CD2 4.04Å; L263-F319 HydrophobicContact CD2-CE1 3.66Å; L263-F319 HydrophobicContact CD2-CE2 4.15Å; L263-F319 HydrophobicContact CD2-CG 3.79Å; L263-F319 HydrophobicContact CD2-CZ 3.97Å; L263-F319 HydrophobicContact CG-CD1 4.12Å; L263-F319 HydrophobicContact CG-CE1 3.65Å; L263-F319 HydrophobicContact CG-CE2 4.14Å; L263-F319 HydrophobicContact CG-CZ 3.68Å; L267-F319 HydrophobicContact CD1-CE2 4.01Å; L315-F319 VanDerWaalsContact O-CD2 3.28Å; L315-F319 WeakPolarHBondContact O-CD2 3.49Å; L315-F319 PolarHBondContact O-N 3.06Å; E316-F319 PolarHBondContact O-N 2.82Å; F319-L325 HydrophobicContact CD1-CD2 4.07Å; F319-L327 HydrophobicContact CB-CD1 4.14Å; F319-L327 HydrophobicContact CB-CG 4.16Å; F319-L327 HydrophobicContact CD1-CD1 3.78Å; F319-L327 HydrophobicContact CD1-CD2 3.58Å; F319-L327 HydrophobicContact CD1-CG 3.57Å; F319-L327 HydrophobicContact CD2-CD1 3.94Å; F319-L327 HydrophobicContact CE1-CD1 4.11Å; F319-L327 HydrophobicContact CE1-CD2 3.6Å; F319-L327 HydrophobicContact CE1-CG 4.05Å; F319-L327 HydrophobicContact CE2-CD1 4.24Å; F319-L327 HydrophobicContact CG-CD1 3.68Å; F319-L327 HydrophobicContact CG-CD2 4.35Å; F319-L327 HydrophobicContact CG-CG 3.87Å; F319-L327 HydrophobicContact CZ-CD1 4.31Å; F319-L327 HydrophobicContact CZ-CD2 4.35Å; F319-L335 HydrophobicContact CE2-CD2 3.91Å; F319-L335 HydrophobicContact CZ-CD2 4.05Å
320	E	86.5	Confident	85	Confident	111 Å²	111	80.2 Å²	80.2	52%	0.519	43%	0.425	S	S	.	.	H	α-helix	trans	-65.7	-34.3	173.9	-72.8	166.9	173.4	0	0	113.2	E316 Y323 P324	E316-E320 WeakPolarHBondContact O-CG 3.38Å; E316-E320 PolarHBondContact O-N 3.44Å; E320-Y323 CarbonylContact O-C 3.54Å; E320-P324 WeakPolarHBondContact O-CA 3.46Å
321	K	80.9	Confident	86.1	Confident	138 Å²	138	72.8 Å²	72.8	60%	0.6	38%	0.38	S	S	*	.	H	α-helix	trans	-73.4	-38.6	176.7	-71.7	172.2	-177.1	-177.3	0	112.9	E313 K317 R318 Y323	E313-K321 WeakPolarHBondContact OE1-CD 3.31Å; E313-K321 WeakPolarHBondContact OE1-CE 3.14Å; E313-K321 IonicContact OE1-NZ 3.39Å; E313-K321 PolarHBondContact OE1-NZ 3.32Å; E313-K321 IonicContact OE2-NZ 2.61Å; E313-K321 PolarHBondContact OE2-NZ 3Å; K317-K321 WeakPolarHBondContact O-CG 3.37Å; K317-K321 PolarHBondContact O-N 3.23Å; R318-K321 PolarHBondContact O-N 2.97Å; K321-Y323 VanDerWaalsContact C-N 3.28Å; K321-Y323 PolarHBondContact O-N 3.04Å
322	T	73	Confident	86.6	Confident	40 Å²	40	69.7 Å²	69.7	25%	0.245	36%	0.356	C	S	.	.	S	Bend	trans	-86.6	68.8	-171.2	-55	0	0	0	0	111.6	K163 L263 C265 R318	K163-T322 PolarHBondContact NZ-O 3.17Å; L263-T322 HydrophobicContact CD2-CG2 4.02Å; C265-T322 VanDerWaalsContact SG-CG2 3.6Å; R318-T322 PolarHBondContact O-N 3.29Å; R318-T322 PolarHBondContact O-OG1 3.2Å
323	Y	67.6	Low	87	Confident	158 Å²	158	69.9 Å²	69.9	62%	0.62	35%	0.354	S	S	*	.	S	Bend	trans	62.9	147.7	-151.9	-62.7	-98.2	0	0	0	111.3	E320 K321 L325	E320-Y323 CarbonylContact O-C 3.54Å; K321-Y323 VanDerWaalsContact C-N 3.28Å; K321-Y323 PolarHBondContact O-N 3.04Å; Y323-L325 PolarHBondContact O-N 3.04Å
324	P	69.8	Low	87.4	Confident	125 Å²	125	68.1 Å²	68.1	81%	0.812	35%	0.346	S	S	*	.	S	Bend	trans	-69.2	77.7	178.1	28.8	-35.6	0	0	0	111.2	E320	E320-P324 WeakPolarHBondContact O-CA 3.46Å
325	L	75.9	Confident	87.7	Confident	35 Å²	35	65.8 Å²	65.8	18%	0.183	33%	0.331	C	S	.	.			trans	-107.4	95.3	-176.8	-179.8	73.1	0	0	0	109.5	K163 L262 F319 Y323 L327	K163-L325 HydrophobicContact CD-CD2 4.45Å; L262-L325 HydrophobicContact CB-CD2 4.46Å; L262-L325 WeakPolarHBondContact O-CD2 3.01Å; F319-L325 HydrophobicContact CD1-CD2 4.07Å; Y323-L325 PolarHBondContact O-N 3.04Å; L325-L327 PolarHBondContact O-N 3.25Å; L325-L327 VanDerWaalsContact O-N 3.14Å
326	T	82.9	Confident	87.9	Confident	116 Å²	116	68.6 Å²	68.6	71%	0.712	34%	0.344	S	S	*	.			trans	-63.2	115.7	170.4	-40.9	0	0	0	0	110
327	L	89.3	Confident	88.3	Confident	20 Å²	20	65.7 Å²	65.7	11%	0.105	33%	0.331	C	S	.	.			trans	-65.4	134.1	162.2	-75.1	174.7	0	0	0	108.7	L262 F319 L325 E331 L332	L262-L327 HydrophobicContact CD1-CD2 3.92Å; F319-L327 HydrophobicContact CB-CD1 4.14Å; F319-L327 HydrophobicContact CB-CG 4.16Å; F319-L327 HydrophobicContact CD1-CD1 3.78Å; F319-L327 HydrophobicContact CD1-CD2 3.58Å; F319-L327 HydrophobicContact CD1-CG 3.57Å; F319-L327 HydrophobicContact CD2-CD1 3.94Å; F319-L327 HydrophobicContact CE1-CD1 4.11Å; F319-L327 HydrophobicContact CE1-CD2 3.6Å; F319-L327 HydrophobicContact CE1-CG 4.05Å; F319-L327 HydrophobicContact CE2-CD1 4.24Å; F319-L327 HydrophobicContact CG-CD1 3.68Å; F319-L327 HydrophobicContact CG-CD2 4.35Å; F319-L327 HydrophobicContact CG-CG 3.87Å; F319-L327 HydrophobicContact CZ-CD1 4.31Å; F319-L327 HydrophobicContact CZ-CD2 4.35Å; L325-L327 PolarHBondContact O-N 3.25Å; L325-L327 VanDerWaalsContact O-N 3.14Å; L327-E331 HydrophobicContact CD2-CB 3.91Å; L327-L332 HydrophobicContact CB-CB 4.31Å; L327-L332 HydrophobicContact CD1-CB 4.29Å; L327-L332 HydrophobicContact CD1-CD1 4Å
328	S	92.5	Very high	88.8	Confident	48 Å²	48	60 Å²	60	34%	0.336	31%	0.306	S	S	.	.			trans	-70.1	151.4	164.2	66.4	0	0	0	0	109.3	R330 E331 L332	S328-R330 PolarHBondContact O-N 2.94Å; S328-E331 VanDerWaalsContact CB-OE2 3.29Å; S328-E331 WeakPolarHBondContact CB-OE2 3.44Å; S328-E331 PolarHBondContact N-OE2 3.37Å; S328-E331 PolarHBondContact O-N 2.95Å; S328-E331 WeakPolarHBondContact OG-CG 3.33Å; S328-E331 PolarHBondContact OG-OE2 2.96Å; S328-L332 PolarHBondContact O-N 3.07Å; S328-L332 VanDerWaalsContact O-N 3.13Å
329	P	94.2	Very high	89.4	Confident	108 Å²	108	57.8 Å²	57.8	70%	0.701	30%	0.298	S	S	*	.	H	α-helix	trans	-52.7	-32.3	-178.8	-30.1	36	0	0	0	113.9	D333	P329-D333 WeakPolarHBondContact O-CB 3.41Å; P329-D333 PolarHBondContact O-N 3.08Å
330	R	95.8	Very high	89.8	Confident	140 Å²	140	62.8 Å²	62.8	53%	0.528	32%	0.317	S	S	.	.	H	α-helix	trans	-76.2	-25.2	178.7	-61.6	-177.3	-177.7	-136.3	-2.9	114.3	S328 F334 H355 P356 Y357	S328-R330 PolarHBondContact O-N 2.94Å; R330-F334 VanDerWaalsContact O-CB 3.28Å; R330-F334 WeakPolarHBondContact O-CB 3.44Å; R330-F334 PolarHBondContact O-N 2.74Å; R330-H355 PolarHBondContact O-CE1 3.42Å; R330-P356 PolarHBondContact NH1-O 3.41Å; R330-Y357 HydrophobicContact CB-CD2 4.47Å
331	E	96	Very high	90.3	Very high	2 Å²	2	58.6 Å²	58.6	1%	0.009	30%	0.298	C	S	.	.	H	α-helix	trans	-78.4	-39.5	173.4	-70.2	161.3	137.1	0	0	110.4	K166 F258 L262 L327 S328 L335 Y357	K166-E331 WeakPolarHBondContact CD-OE1 3.41Å; K166-E331 WeakPolarHBondContact CE-OE1 3.26Å; K166-E331 IonicContact NZ-OE1 2.78Å; K166-E331 PolarHBondContact NZ-OE1 3.49Å; K166-E331 IonicContact NZ-OE2 2.7Å; K166-E331 PolarHBondContact NZ-OE2 2.95Å; F258-E331 HydrophobicContact CE1-CB 4.45Å; F258-E331 WeakPolarHBondContact CE1-O 3.47Å; F258-E331 HydrophobicContact CZ-CB 4.15Å; F258-E331 HydrophobicContact CZ-CG 4.2Å; L262-E331 HydrophobicContact CD1-CB 4.47Å; L327-E331 HydrophobicContact CD2-CB 3.91Å; S328-E331 VanDerWaalsContact CB-OE2 3.29Å; S328-E331 WeakPolarHBondContact CB-OE2 3.44Å; S328-E331 PolarHBondContact N-OE2 3.37Å; S328-E331 PolarHBondContact O-N 2.95Å; S328-E331 WeakPolarHBondContact OG-CG 3.33Å; S328-E331 PolarHBondContact OG-OE2 2.96Å; E331-L335 WeakPolarHBondContact O-CB 3.38Å; E331-L335 PolarHBondContact O-N 3.38Å; E331-Y357 HydrophobicContact CG-CD2 3.81Å; E331-Y357 HydrophobicContact CG-CE2 3.41Å; E331-Y357 VanDerWaalsContact CG-CE2 3.41Å
332	L	96.4	Very high	91	Very high	28 Å²	28	53.3 Å²	53.3	15%	0.147	28%	0.276	C	S	.	.	H	α-helix	trans	-62.9	-52.6	174.4	177.7	63.1	0	0	0	112	L315 E316 L327 S328 F334 L335 Q336	L315-L332 HydrophobicContact CB-CD1 4.46Å; E316-L332 HydrophobicContact CG-CD1 3.71Å; E316-L332 HydrophobicContact CG-CD2 3.57Å; E316-L332 HydrophobicContact CG-CG 4.28Å; E316-L332 WeakPolarHBondContact OE1-CD2 3.35Å; L327-L332 HydrophobicContact CB-CB 4.31Å; L327-L332 HydrophobicContact CD1-CB 4.29Å; L327-L332 HydrophobicContact CD1-CD1 4Å; S328-L332 PolarHBondContact O-N 3.07Å; S328-L332 VanDerWaalsContact O-N 3.13Å; L332-F334 VanDerWaalsContact C-N 3.34Å; L332-F334 PolarHBondContact O-N 3.13Å; L332-L335 PolarHBondContact O-N 2.95Å; L332-L335 VanDerWaalsContact O-N 3.13Å; L332-Q336 HydrophobicContact CD1-CG 4.21Å; L332-Q336 WeakPolarHBondContact O-CB 3.36Å; L332-Q336 WeakPolarHBondContact O-CG 3.32Å; L332-Q336 PolarHBondContact O-N 3.07Å
333	D	97.4	Very high	92.2	Very high	75 Å²	75	52.6 Å²	52.6	40%	0.401	27%	0.272	S	S	.	.	H	α-helix	trans	-57.1	-44.7	177.4	-177.5	40.7	0	0	0	111.7	P329 L335 Q336 A337 H355	P329-D333 WeakPolarHBondContact O-CB 3.41Å; P329-D333 PolarHBondContact O-N 3.08Å; D333-L335 PolarHBondContact O-N 3.27Å; D333-Q336 PolarHBondContact O-N 3.41Å; D333-A337 WeakPolarHBondContact O-CB 3.17Å; D333-A337 PolarHBondContact O-N 2.94Å; D333-H355 IonicContact OD2-CE1 2.83Å; D333-H355 PolarHBondContact OD2-CE1 2.89Å; D333-H355 IonicContact OD2-NE2 2.97Å; D333-H355 PolarHBondContact OD2-NE2 3.26Å
334	F	98.3	Very high	93.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-61.4	-42.5	174.8	-179.6	-93.6	0	0	0	112.6	T173 L177 F258 R330 L332 C338 L352 H355 Y357 F358	T173-F334 HydrophobicContact CG2-CE1 3.73Å; T173-F334 HydrophobicContact CG2-CZ 3.63Å; L177-F334 HydrophobicContact CD1-CE2 4.09Å; L177-F334 HydrophobicContact CD1-CZ 4.04Å; F258-F334 HydrophobicContact CB-CE1 4.22Å; F258-F334 AromaticContact CD1-CD1 3.64Å; F258-F334 HydrophobicContact CD1-CD1 3.64Å; F258-F334 AromaticContact CD1-CE1 3.95Å; F258-F334 HydrophobicContact CD1-CE1 3.95Å; F258-F334 HydrophobicContact CD2-CD1 4.13Å; F258-F334 AromaticContact CD2-CE1 3.95Å; F258-F334 HydrophobicContact CD2-CE1 3.95Å; F258-F334 AromaticContact CE1-CD1 3.55Å; F258-F334 HydrophobicContact CE1-CD1 3.55Å; F258-F334 HydrophobicContact CE1-CE1 4.27Å; F258-F334 HydrophobicContact CE1-CG 4.5Å; F258-F334 HydrophobicContact CE2-CD1 4.04Å; F258-F334 HydrophobicContact CE2-CE1 4.25Å; F258-F334 AromaticContact CG-CD1 3.91Å; F258-F334 HydrophobicContact CG-CD1 3.91Å; F258-F334 AromaticContact CG-CE1 3.77Å; F258-F334 HydrophobicContact CG-CE1 3.77Å; F258-F334 AromaticContact CZ-CD1 3.74Å; F258-F334 HydrophobicContact CZ-CD1 3.74Å; F258-F334 HydrophobicContact CZ-CE1 4.39Å; R330-F334 VanDerWaalsContact O-CB 3.28Å; R330-F334 WeakPolarHBondContact O-CB 3.44Å; R330-F334 PolarHBondContact O-N 2.74Å; L332-F334 VanDerWaalsContact C-N 3.34Å; L332-F334 PolarHBondContact O-N 3.13Å; F334-C338 PolarHBondContact O-N 2.77Å; F334-C338 PolarHBondContact O-SG 3.3Å; F334-C338 VanDerWaalsContact O-SG 3.37Å; F334-L352 HydrophobicContact CD2-CD2 4.02Å; F334-L352 HydrophobicContact CE2-CB 4.06Å; F334-L352 HydrophobicContact CE2-CD2 3.75Å; F334-L352 HydrophobicContact CE2-CG 4.37Å; F334-L352 HydrophobicContact CZ-CD2 4.44Å; F334-H355 HydrophobicContact CD2-CB 4.09Å; F334-H355 AromaticContact CD2-CG 3.82Å; F334-H355 AromaticContact CD2-ND1 3.73Å; F334-H355 PolarHBondContact N-CE1 3.46Å; F334-Y357 HydrophobicContact CD2-CD1 4.48Å; F334-Y357 HydrophobicContact CG-CD1 4.41Å; F334-F358 HydrophobicContact CD2-CE2 4.16Å; F334-F358 AromaticContact CE2-CE2 3.59Å; F334-F358 HydrophobicContact CE2-CE2 3.59Å; F334-F358 AromaticContact CE2-CZ 3.89Å; F334-F358 HydrophobicContact CE2-CZ 3.89Å; F334-F358 HydrophobicContact CZ-CE2 4.31Å; F334-F358 HydrophobicContact CZ-CZ 4.17Å
335	L	98.2	Very high	94.9	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-66	-46.8	177.3	178.7	57.7	0	0	0	110.8	G255 F258 A259 L267 L315 F319 E331 L332 D333 A337 C338 V339	G255-L335 WeakPolarHBondContact O-CD1 3.4Å; F258-L335 HydrophobicContact CD1-CB 4.27Å; F258-L335 HydrophobicContact CD1-CD1 4.44Å; F258-L335 HydrophobicContact CE1-CB 4.27Å; A259-L335 HydrophobicContact CB-CD1 3.98Å; A259-L335 HydrophobicContact CB-CD2 4.05Å; L267-L335 HydrophobicContact CD2-CD1 4.49Å; L315-L335 HydrophobicContact CD1-CD2 4Å; L315-L335 HydrophobicContact CD1-CG 4.07Å; F319-L335 HydrophobicContact CE2-CD2 3.91Å; F319-L335 HydrophobicContact CZ-CD2 4.05Å; E331-L335 WeakPolarHBondContact O-CB 3.38Å; E331-L335 PolarHBondContact O-N 3.38Å; L332-L335 PolarHBondContact O-N 2.95Å; L332-L335 VanDerWaalsContact O-N 3.13Å; D333-L335 PolarHBondContact O-N 3.27Å; L335-A337 VanDerWaalsContact C-N 3.27Å; L335-A337 PolarHBondContact O-N 3.05Å; L335-C338 WeakPolarHBondContact O-CB 3.3Å; L335-C338 PolarHBondContact O-N 3.3Å; L335-V339 HydrophobicContact CD1-CG1 3.99Å; L335-V339 HydrophobicContact CD1-CG2 4.47Å; L335-V339 HydrophobicContact CG-CG2 4.47Å; L335-V339 WeakPolarHBondContact O-CG2 3.24Å; L335-V339 PolarHBondContact O-N 2.93Å
336	Q	97.8	Very high	95.9	Very high	63 Å²	63	47.7 Å²	47.7	29%	0.294	25%	0.253	S	S	.	.	H	α-helix	trans	-64.2	-27.3	178.6	-72.4	176.1	-10.5	0	0	113.2	L315 E316 L332 D333 R340	L315-Q336 HydrophobicContact CD1-CG 4.13Å; E316-Q336 PolarHBondContact OE1-NE2 3.39Å; L332-Q336 HydrophobicContact CD1-CG 4.21Å; L332-Q336 WeakPolarHBondContact O-CB 3.36Å; L332-Q336 WeakPolarHBondContact O-CG 3.32Å; L332-Q336 PolarHBondContact O-N 3.07Å; D333-Q336 PolarHBondContact O-N 3.41Å; Q336-R340 WeakPolarHBondContact O-CD 3.48Å; Q336-R340 WeakPolarHBondContact O-CG 3.41Å; Q336-R340 PolarHBondContact O-NE 2.71Å; Q336-R340 VanDerWaalsContact O-NE 3.11Å
337	A	98.4	Very high	96.7	Very high	3 Å²	3	46.8 Å²	46.8	3%	0.025	24%	0.237	C	C	.	.	H	α-helix	trans	-71.8	-30.6	170.5	0	0	0	0	0	113	D333 L335 W347 L352	D333-A337 WeakPolarHBondContact O-CB 3.17Å; D333-A337 PolarHBondContact O-N 2.94Å; L335-A337 VanDerWaalsContact C-N 3.27Å; L335-A337 PolarHBondContact O-N 3.05Å; A337-W347 HydrophobicContact CB-CB 4.4Å; A337-W347 HydrophobicContact CB-CD2 3.99Å; A337-W347 HydrophobicContact CB-CG 3.91Å; A337-W347 PolarHBondContact O-N 2.81Å; A337-L352 HydrophobicContact CB-CD2 4.03Å
338	C	98.7	Very high	97.1	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-80.6	-37.7	177.1	-68.6	0	0	0	0	113.5	I251 F334 L335 R346	I251-C338 HydrophobicContact CG2-CB 4.22Å; F334-C338 PolarHBondContact O-N 2.77Å; F334-C338 PolarHBondContact O-SG 3.3Å; F334-C338 VanDerWaalsContact O-SG 3.37Å; L335-C338 WeakPolarHBondContact O-CB 3.3Å; L335-C338 PolarHBondContact O-N 3.3Å; C338-R346 WeakPolarHBondContact O-CD 3.4Å
339	V	98.2	Very high	97.4	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.018	23%	0.232	C	C	.	.			trans	-103.6	34.9	-171.2	-53.8	0	0	0	0	114.7	W252 W268 L284 L315 L335	W252-V339 HydrophobicContact CD2-CG1 4.47Å; W252-V339 HydrophobicContact CE3-CB 3.97Å; W252-V339 HydrophobicContact CE3-CG1 4.35Å; W252-V339 HydrophobicContact CH2-CB 4.29Å; W252-V339 HydrophobicContact CZ3-CB 3.85Å; W252-V339 WeakPolarHBondContact CZ3-O 2.89Å; W268-V339 HydrophobicContact CH2-CB 4.19Å; W268-V339 HydrophobicContact CH2-CG1 4.22Å; W268-V339 HydrophobicContact CH2-CG2 4.27Å; W268-V339 HydrophobicContact CZ3-CG1 4.3Å; L284-V339 HydrophobicContact CD1-CB 4.26Å; L284-V339 HydrophobicContact CD1-CG2 4.13Å; L284-V339 VanDerWaalsContact CD1-O 3.3Å; L284-V339 WeakPolarHBondContact CD1-O 3.23Å; L284-V339 HydrophobicContact CD2-CG2 4.01Å; L315-V339 HydrophobicContact CD1-CG2 3.95Å; L335-V339 HydrophobicContact CD1-CG1 3.99Å; L335-V339 HydrophobicContact CD1-CG2 4.47Å; L335-V339 HydrophobicContact CG-CG2 4.47Å; L335-V339 WeakPolarHBondContact O-CG2 3.24Å; L335-V339 PolarHBondContact O-N 2.93Å
340	R	97.8	Very high	97.5	Very high	105 Å²	105	42.4 Å²	42.4	40%	0.396	21%	0.213	S	C	.	.			trans	-63.5	140.2	172.2	-63.7	-64.6	-178.4	119	-9.1	111.9	Q336 E345 R346	Q336-R340 WeakPolarHBondContact O-CD 3.48Å; Q336-R340 WeakPolarHBondContact O-CG 3.41Å; Q336-R340 PolarHBondContact O-NE 2.71Å; Q336-R340 VanDerWaalsContact O-NE 3.11Å; R340-E345 HydrophobicContact CB-CB 3.81Å; R340-E345 HydrophobicContact CG-CB 3.88Å; R340-E345 IonicContact CZ-OE2 2.98Å; R340-E345 IonicContact NH1-OE2 2.69Å; R340-E345 PolarHBondContact NH1-OE2 3.13Å; R340-R346 HydrophobicContact CB-CG 3.76Å; R340-R346 PolarHBondContact O-NE 3.41Å; R340-R346 PolarHBondContact O-NH2 2.96Å
341	M	96.4	Very high	97.6	Very high	24 Å²	24	39.9 Å²	39.9	12%	0.118	21%	0.207	C	C	.	.	S	Bend	trans	-71.1	-39.6	-177.8	-68.2	-65.4	-88	0	0	112.2	P236 W252 I280 T281 L284 D286 L287	P236-M341 HydrophobicContact CG-SD 4.02Å; W252-M341 HydrophobicContact CH2-SD 4.19Å; W252-M341 HydrophobicContact CZ3-SD 4.4Å; I280-M341 HydrophobicContact CG2-CE 4.09Å; I280-M341 HydrophobicContact CG2-SD 3.85Å; T281-M341 HydrophobicContact CG2-CE 4.15Å; L284-M341 HydrophobicContact CB-CE 4.47Å; L284-M341 HydrophobicContact CB-CG 3.88Å; L284-M341 HydrophobicContact CB-SD 3.77Å; L284-M341 HydrophobicContact CD1-CG 4.23Å; L284-M341 HydrophobicContact CD1-SD 3.61Å; L284-M341 HydrophobicContact CG-SD 4.37Å; D286-M341 WeakPolarHBondContact O-CE 3.31Å; L287-M341 HydrophobicContact CD2-CE 3.92Å
342	D	97.4	Very high	97.7	Very high	26 Å²	26	39.8 Å²	39.8	14%	0.139	21%	0.207	C	C	.	.	S	Bend	trans	-74.9	123.6	165.8	-171.9	-34.5	0	0	0	109.2	Y288 S344 E345	Y288-D342 HydrophobicContact CD2-CB 3.75Å; Y288-D342 HydrophobicContact CE2-CB 3.98Å; Y288-D342 VanDerWaalsContact CE2-CG 3.48Å; Y288-D342 WeakPolarHBondContact CE2-OD2 3.49Å; Y288-D342 HydrophobicContact CG-CB 4.12Å; Y288-D342 VanDerWaalsContact CZ-OD2 3.22Å; Y288-D342 PolarHBondContact OH-OD2 3.25Å; D342-S344 VanDerWaalsContact CG-OG 3.24Å; D342-S344 PolarHBondContact O-N 2.77Å; D342-S344 WeakPolarHBondContact OD1-CA 3.42Å; D342-S344 VanDerWaalsContact OD1-CB 3.31Å; D342-S344 WeakPolarHBondContact OD1-CB 3.49Å; D342-S344 PolarHBondContact OD1-N 2.97Å; D342-S344 PolarHBondContact OD1-OG 3.19Å; D342-S344 PolarHBondContact OD2-OG 3.09Å; D342-E345 HydrophobicContact CB-CB 4.38Å; D342-E345 HydrophobicContact CB-CG 4.14Å; D342-E345 PolarHBondContact O-N 3.28Å
343	P	97.3	Very high	97.8	Very high	26 Å²	26	39.1 Å²	39.1	17%	0.169	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-22.4	178.2	-19.9	33.2	0	0	0	113.8	E237 P248	E237-P343 HydrophobicContact CG-CG 4.44Å; P248-P343 HydrophobicContact CB-CB 4.03Å; P248-P343 WeakPolarHBondContact CB-O 3.38Å; P248-P343 HydrophobicContact CG-CB 4.49Å; P248-P343 VanDerWaalsContact CG-O 3.26Å; P248-P343 WeakPolarHBondContact CG-O 3.49Å
344	S	96.5	Very high	97.7	Very high	99 Å²	99	42.6 Å²	42.6	69%	0.692	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	-17.1	178.9	71.8	0	0	0	0	113.9	D342	D342-S344 VanDerWaalsContact CG-OG 3.24Å; D342-S344 PolarHBondContact O-N 2.77Å; D342-S344 WeakPolarHBondContact OD1-CA 3.42Å; D342-S344 VanDerWaalsContact OD1-CB 3.31Å; D342-S344 WeakPolarHBondContact OD1-CB 3.49Å; D342-S344 PolarHBondContact OD1-N 2.97Å; D342-S344 PolarHBondContact OD1-OG 3.19Å; D342-S344 PolarHBondContact OD2-OG 3.09Å
345	E	97.6	Very high	97.7	Very high	102 Å²	102	42.7 Å²	42.7	48%	0.477	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-14.5	170	-72.8	-165.8	-178.4	0	0	113.5	R340 D342 W347	R340-E345 HydrophobicContact CB-CB 3.81Å; R340-E345 HydrophobicContact CG-CB 3.88Å; R340-E345 IonicContact CZ-OE2 2.98Å; R340-E345 IonicContact NH1-OE2 2.69Å; R340-E345 PolarHBondContact NH1-OE2 3.13Å; D342-E345 HydrophobicContact CB-CB 4.38Å; D342-E345 HydrophobicContact CB-CG 4.14Å; D342-E345 PolarHBondContact O-N 3.28Å; E345-W347 PolarHBondContact O-N 3.15Å
346	R	98.1	Very high	97.6	Very high	14 Å²	14	45.6 Å²	45.6	5%	0.053	23%	0.234	C	C	.	.	S	Bend	trans	-70.1	131	-180	-65.4	-176.3	-157.2	140.3	16.2	110.5	E237 P248 I251 C338 R340	E237-R346 IonicContact OE1-CZ 3.43Å; E237-R346 IonicContact OE1-NH1 3.69Å; E237-R346 PolarHBondContact OE1-NH1 3.49Å; E237-R346 IonicContact OE1-NH2 2.78Å; E237-R346 IonicContact OE2-CZ 2.67Å; E237-R346 IonicContact OE2-NH1 3.87Å; E237-R346 PolarHBondContact OE2-NH1 2.91Å; E237-R346 IonicContact OE2-NH2 3.15Å; E237-R346 PolarHBondContact OE2-NH2 2.85Å; P248-R346 HydrophobicContact CB-CB 4.31Å; P248-R346 PolarHBondContact O-NH1 3.3Å; I251-R346 HydrophobicContact CG2-CB 4.15Å; C338-R346 WeakPolarHBondContact O-CD 3.4Å; R340-R346 HydrophobicContact CB-CG 3.76Å; R340-R346 PolarHBondContact O-NE 3.41Å; R340-R346 PolarHBondContact O-NH2 2.96Å
347	W	98.4	Very high	97.5	Very high	96 Å²	96	43 Å²	43	36%	0.364	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-66.3	138.3	179	-74.4	29.3	0	0	0	111.4	I251 A337 E345 E351 L352 H355	I251-W347 WeakPolarHBondContact CD1-O 3.2Å; I251-W347 WeakPolarHBondContact CG2-O 3.34Å; A337-W347 HydrophobicContact CB-CB 4.4Å; A337-W347 HydrophobicContact CB-CD2 3.99Å; A337-W347 HydrophobicContact CB-CG 3.91Å; A337-W347 PolarHBondContact O-N 2.81Å; E345-W347 PolarHBondContact O-N 3.15Å; W347-E351 HydrophobicContact CB-CB 4.18Å; W347-E351 HydrophobicContact CD2-CB 4.21Å; W347-E351 HydrophobicContact CE3-CB 3.75Å; W347-E351 HydrophobicContact CG-CB 4.42Å; W347-E351 HydrophobicContact CZ3-CB 4.47Å; W347-L352 HydrophobicContact CB-CD1 4.45Å; W347-L352 HydrophobicContact CB-CD2 3.82Å; W347-L352 HydrophobicContact CB-CG 3.79Å; W347-L352 HydrophobicContact CE3-CD2 4.14Å; W347-L352 HydrophobicContact CG-CD2 4.44Å; W347-H355 HydrophobicContact CZ3-CB 4.48Å; W347-H355 AromaticContact CZ3-CD2 3.64Å
348	S	98.4	Very high	97.4	Very high	46 Å²	46	43.1 Å²	43.1	32%	0.322	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-66.9	160.6	172.2	68.4	0	0	0	0	111.7	A350 E351 L352	S348-A350 PolarHBondContact O-N 3.1Å; S348-E351 VanDerWaalsContact CB-OE2 3.24Å; S348-E351 WeakPolarHBondContact CB-OE2 3.45Å; S348-E351 PolarHBondContact N-OE2 2.86Å; S348-E351 PolarHBondContact O-N 3.01Å; S348-E351 PolarHBondContact OG-N 2.9Å; S348-E351 PolarHBondContact OG-OE2 3.43Å; S348-L352 WeakPolarHBondContact O-CG 3.47Å; S348-L352 PolarHBondContact O-N 3.13Å
349	C	98.2	Very high	96.2	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.014	24%	0.244	C	C	.	.	H	α-helix	trans	-55.5	-35.5	172.7	-62.6	0	0	0	0	112.1	L177 D181 I251 E351 L352 L353	L177-C349 HydrophobicContact CD2-CB 4.19Å; D181-C349 HydrophobicContact CB-CB 3.69Å; I251-C349 WeakPolarHBondContact CD1-SG 3.49Å; C349-E351 PolarHBondContact O-N 3.35Å; C349-L352 PolarHBondContact O-N 3.04Å; C349-L353 VanDerWaalsContact O-CB 3.3Å; C349-L353 WeakPolarHBondContact O-CB 3.38Å; C349-L353 WeakPolarHBondContact O-CD1 3.37Å; C349-L353 WeakPolarHBondContact O-CG 3.38Å; C349-L353 PolarHBondContact O-N 3.43Å
350	A	96.8	Very high	94.2	Very high	36 Å²	36	53 Å²	53	30%	0.298	28%	0.282	S	S	.	.	H	α-helix	trans	-68.9	-17.4	177.8	0	0	0	0	0	114.2	S348 K354	S348-A350 PolarHBondContact O-N 3.1Å; A350-K354 WeakPolarHBondContact O-CD 3.1Å; A350-K354 WeakPolarHBondContact O-CE 3.17Å; A350-K354 PolarHBondContact O-NZ 3.49Å
351	E	97.8	Very high	92.2	Very high	88 Å²	88	50 Å²	50	41%	0.411	27%	0.272	S	S	.	.	H	α-helix	trans	-94.2	-42.2	172.2	-70.4	156.7	129.9	0	0	110.8	W347 S348 C349 L353 K354 H355	W347-E351 HydrophobicContact CB-CB 4.18Å; W347-E351 HydrophobicContact CD2-CB 4.21Å; W347-E351 HydrophobicContact CE3-CB 3.75Å; W347-E351 HydrophobicContact CG-CB 4.42Å; W347-E351 HydrophobicContact CZ3-CB 4.47Å; S348-E351 VanDerWaalsContact CB-OE2 3.24Å; S348-E351 WeakPolarHBondContact CB-OE2 3.45Å; S348-E351 PolarHBondContact N-OE2 2.86Å; S348-E351 PolarHBondContact O-N 3.01Å; S348-E351 PolarHBondContact OG-N 2.9Å; S348-E351 PolarHBondContact OG-OE2 3.43Å; C349-E351 PolarHBondContact O-N 3.35Å; E351-L353 VanDerWaalsContact C-N 3.29Å; E351-L353 PolarHBondContact O-N 3.33Å; E351-K354 CarbonylContact O-C 3.58Å; E351-K354 WeakPolarHBondContact O-CA 3.29Å; E351-K354 WeakPolarHBondContact O-CB 3.36Å; E351-K354 PolarHBondContact O-N 2.69Å; E351-H355 PolarHBondContact O-N 3.11Å
352	L	98.3	Very high	90	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.1	-36.2	174.1	-67.6	171.7	0	0	0	112.2	L177 I251 F334 A337 W347 S348 C349 K354 H355 F358	L177-L352 HydrophobicContact CD1-CB 3.84Å; L177-L352 HydrophobicContact CD2-CB 3.83Å; L177-L352 HydrophobicContact CD2-CD1 3.81Å; L177-L352 HydrophobicContact CD2-CG 4.49Å; I251-L352 HydrophobicContact CD1-CD1 4.19Å; I251-L352 HydrophobicContact CG2-CD1 3.95Å; F334-L352 HydrophobicContact CD2-CD2 4.02Å; F334-L352 HydrophobicContact CE2-CB 4.06Å; F334-L352 HydrophobicContact CE2-CD2 3.75Å; F334-L352 HydrophobicContact CE2-CG 4.37Å; F334-L352 HydrophobicContact CZ-CD2 4.44Å; A337-L352 HydrophobicContact CB-CD2 4.03Å; W347-L352 HydrophobicContact CB-CD1 4.45Å; W347-L352 HydrophobicContact CB-CD2 3.82Å; W347-L352 HydrophobicContact CB-CG 3.79Å; W347-L352 HydrophobicContact CE3-CD2 4.14Å; W347-L352 HydrophobicContact CG-CD2 4.44Å; S348-L352 WeakPolarHBondContact O-CG 3.47Å; S348-L352 PolarHBondContact O-N 3.13Å; C349-L352 PolarHBondContact O-N 3.04Å; L352-K354 PolarHBondContact O-N 2.98Å; L352-K354 VanDerWaalsContact O-N 3.13Å; L352-H355 WeakPolarHBondContact O-CB 3.29Å; L352-H355 PolarHBondContact O-N 2.94Å; L352-F358 VanDerWaalsContact O-CD2 3.28Å; L352-F358 WeakPolarHBondContact O-CD2 3.05Å; L352-F358 WeakPolarHBondContact O-CE2 3.37Å
353	L	97.2	Very high	87.4	Confident	13 Å²	13	54.5 Å²	54.5	7%	0.068	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-4.8	171.2	-72.4	168.2	0	0	0	114.3	W174 L177 L178 D181 C349 E351	W174-L353 HydrophobicContact CD2-CD2 3.8Å; W174-L353 HydrophobicContact CE3-CD2 3.54Å; W174-L353 HydrophobicContact CH2-CB 4.37Å; W174-L353 HydrophobicContact CH2-CD2 3.97Å; W174-L353 VanDerWaalsContact CH2-O 3.28Å; W174-L353 WeakPolarHBondContact CH2-O 3.43Å; W174-L353 HydrophobicContact CZ2-CD2 4.19Å; W174-L353 HydrophobicContact CZ3-CB 4.18Å; W174-L353 HydrophobicContact CZ3-CD2 3.65Å; W174-L353 WeakPolarHBondContact CZ3-O 3.34Å; L177-L353 HydrophobicContact CB-CD1 4.46Å; L177-L353 HydrophobicContact CB-CD2 3.63Å; L177-L353 HydrophobicContact CB-CG 3.88Å; L177-L353 HydrophobicContact CD1-CD2 4.28Å; L177-L353 HydrophobicContact CD1-CG 4.46Å; L178-L353 HydrophobicContact CD2-CD1 3.96Å; L178-L353 HydrophobicContact CD2-CD2 4Å; L178-L353 HydrophobicContact CG-CD2 4.13Å; D181-L353 HydrophobicContact CB-CD1 3.94Å; C349-L353 VanDerWaalsContact O-CB 3.3Å; C349-L353 WeakPolarHBondContact O-CB 3.38Å; C349-L353 WeakPolarHBondContact O-CD1 3.37Å; C349-L353 WeakPolarHBondContact O-CG 3.38Å; C349-L353 PolarHBondContact O-N 3.43Å; E351-L353 VanDerWaalsContact C-N 3.29Å; E351-L353 PolarHBondContact O-N 3.33Å
354	K	96.2	Very high	85.2	Confident	149 Å²	149	56.4 Å²	56.4	65%	0.648	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	-3.3	171.1	-56.3	168.4	-172.2	130.4	0	112.1	A350 E351 L352	A350-K354 WeakPolarHBondContact O-CD 3.1Å; A350-K354 WeakPolarHBondContact O-CE 3.17Å; A350-K354 PolarHBondContact O-NZ 3.49Å; E351-K354 CarbonylContact O-C 3.58Å; E351-K354 WeakPolarHBondContact O-CA 3.29Å; E351-K354 WeakPolarHBondContact O-CB 3.36Å; E351-K354 PolarHBondContact O-N 2.69Å; L352-K354 PolarHBondContact O-N 2.98Å; L352-K354 VanDerWaalsContact O-N 3.13Å
355	H	97.6	Very high	83.1	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.009	29%	0.29	C	S	.	.			trans	-63	140.1	-170.9	-169.3	-93.5	0	0	0	112.8	R330 D333 F334 W347 E351 L352 Y357 F358	R330-H355 PolarHBondContact O-CE1 3.42Å; D333-H355 IonicContact OD2-CE1 2.83Å; D333-H355 PolarHBondContact OD2-CE1 2.89Å; D333-H355 IonicContact OD2-NE2 2.97Å; D333-H355 PolarHBondContact OD2-NE2 3.26Å; F334-H355 HydrophobicContact CD2-CB 4.09Å; F334-H355 AromaticContact CD2-CG 3.82Å; F334-H355 AromaticContact CD2-ND1 3.73Å; F334-H355 PolarHBondContact N-CE1 3.46Å; W347-H355 HydrophobicContact CZ3-CB 4.48Å; W347-H355 AromaticContact CZ3-CD2 3.64Å; E351-H355 PolarHBondContact O-N 3.11Å; L352-H355 WeakPolarHBondContact O-CB 3.29Å; L352-H355 PolarHBondContact O-N 2.94Å; H355-Y357 VanDerWaalsContact ND1-CB 3.27Å; H355-Y357 WeakPolarHBondContact ND1-CB 3.45Å; H355-Y357 PolarHBondContact ND1-N 3.44Å; H355-Y357 VanDerWaalsContact ND1-N 3.18Å; H355-Y357 PolarHBondContact O-N 2.95Å; H355-F358 HydrophobicContact CB-CD2 4.26Å; H355-F358 PolarHBondContact O-N 3.35Å
356	P	95.9	Very high	80.8	Confident	61 Å²	61	54.9 Å²	54.9	40%	0.396	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-17.1	-179.1	-28.4	36.5	0	0	0	116.1	R330 F358 G359	R330-P356 PolarHBondContact NH1-O 3.41Å; P356-F358 VanDerWaalsContact C-N 3.28Å; P356-F358 PolarHBondContact O-N 2.99Å; P356-G359 PolarHBondContact O-N 3.3Å
357	Y	96.3	Very high	78.1	Confident	8 Å²	8	59.7 Å²	59.7	3%	0.031	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-32.5	171.6	176.3	-112.8	0	0	0	113.7	R170 F258 R330 E331 F334 H355	R170-Y357 HydrophobicContact CB-CE1 4.01Å; R170-Y357 HydrophobicContact CG-CD1 4.38Å; R170-Y357 HydrophobicContact CG-CE1 3.79Å; R170-Y357 PolarHBondContact NE-O 3.08Å; R170-Y357 VanDerWaalsContact NE-O 3.09Å; F258-Y357 HydrophobicContact CE2-CD1 4.49Å; F258-Y357 AromaticContact CE2-CE1 3.69Å; F258-Y357 HydrophobicContact CE2-CE1 3.69Å; F258-Y357 HydrophobicContact CE2-CE2 4.42Å; F258-Y357 AromaticContact CE2-CZ 3.66Å; F258-Y357 HydrophobicContact CZ-CE1 4.17Å; F258-Y357 HydrophobicContact CZ-CE2 4.3Å; F258-Y357 AromaticContact CZ-CZ 3.97Å; R330-Y357 HydrophobicContact CB-CD2 4.47Å; E331-Y357 HydrophobicContact CG-CD2 3.81Å; E331-Y357 HydrophobicContact CG-CE2 3.41Å; E331-Y357 VanDerWaalsContact CG-CE2 3.41Å; F334-Y357 HydrophobicContact CD2-CD1 4.48Å; F334-Y357 HydrophobicContact CG-CD1 4.41Å; H355-Y357 VanDerWaalsContact ND1-CB 3.27Å; H355-Y357 WeakPolarHBondContact ND1-CB 3.45Å; H355-Y357 PolarHBondContact ND1-N 3.44Å; H355-Y357 VanDerWaalsContact ND1-N 3.18Å; H355-Y357 PolarHBondContact O-N 2.95Å
358	F	95.6	Very high	75.7	Confident	6 Å²	6	59.9 Å²	59.9	3%	0.026	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-23.4	-179.6	-63.2	-66.1	0	0	0	113.4	R170 T173 W174 L177 F334 L352 H355 P356 M360 H361	R170-F358 HydrophobicContact CG-CD1 3.63Å; R170-F358 HydrophobicContact CG-CE1 3.93Å; T173-F358 HydrophobicContact CG2-CZ 4.14Å; W174-F358 HydrophobicContact CB-CD1 4.16Å; W174-F358 HydrophobicContact CB-CE1 3.82Å; W174-F358 HydrophobicContact CD2-CD1 4.28Å; W174-F358 HydrophobicContact CE3-CB 3.88Å; W174-F358 AromaticContact CE3-CD1 3.49Å; W174-F358 HydrophobicContact CE3-CD1 3.49Å; W174-F358 VanDerWaalsContact CE3-CD1 3.49Å; W174-F358 AromaticContact CE3-CD2 3.71Å; W174-F358 HydrophobicContact CE3-CD2 3.71Å; W174-F358 AromaticContact CE3-CE1 3.91Å; W174-F358 HydrophobicContact CE3-CE1 3.91Å; W174-F358 HydrophobicContact CE3-CE2 4.09Å; W174-F358 AromaticContact CE3-CG 3.39Å; W174-F358 HydrophobicContact CE3-CG 3.39Å; W174-F358 HydrophobicContact CE3-CZ 4.2Å; W174-F358 HydrophobicContact CZ3-CB 3.74Å; W174-F358 HydrophobicContact CZ3-CD1 4.23Å; W174-F358 AromaticContact CZ3-CD2 3.84Å; W174-F358 HydrophobicContact CZ3-CD2 3.84Å; W174-F358 AromaticContact CZ3-CG 3.66Å; W174-F358 HydrophobicContact CZ3-CG 3.66Å; L177-F358 HydrophobicContact CD1-CE2 3.66Å; L177-F358 HydrophobicContact CD1-CZ 3.66Å; F334-F358 HydrophobicContact CD2-CE2 4.16Å; F334-F358 AromaticContact CE2-CE2 3.59Å; F334-F358 HydrophobicContact CE2-CE2 3.59Å; F334-F358 AromaticContact CE2-CZ 3.89Å; F334-F358 HydrophobicContact CE2-CZ 3.89Å; F334-F358 HydrophobicContact CZ-CE2 4.31Å; F334-F358 HydrophobicContact CZ-CZ 4.17Å; L352-F358 VanDerWaalsContact O-CD2 3.28Å; L352-F358 WeakPolarHBondContact O-CD2 3.05Å; L352-F358 WeakPolarHBondContact O-CE2 3.37Å; H355-F358 HydrophobicContact CB-CD2 4.26Å; H355-F358 PolarHBondContact O-N 3.35Å; P356-F358 VanDerWaalsContact C-N 3.28Å; P356-F358 PolarHBondContact O-N 2.99Å; F358-M360 PolarHBondContact O-N 3.34Å; F358-H361 PolarHBondContact O-N 3.43Å
359	G	74.9	Confident	73.3	Confident	47 Å²	47	63 Å²	63	49%	0.485	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	-96.5	168.6	0	0	0	0	0	114.1	P356	P356-G359 PolarHBondContact O-N 3.3Å
360	M	55.9	Low	70.5	Confident	163 Å²	163	68.1 Å²	68.1	80%	0.803	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-22.8	-176.9	-63.5	166.9	70.5	0	0	114.4	F358 S362 L363 S364	F358-M360 PolarHBondContact O-N 3.34Å; M360-S362 PolarHBondContact O-N 3.48Å; M360-L363 WeakPolarHBondContact O-CB 3.16Å; M360-L363 PolarHBondContact O-N 2.78Å; M360-S364 PolarHBondContact O-N 2.88Å
361	H	55.8	Low	67.7	Low	41 Å²	41	69.2 Å²	69.2	19%	0.19	37%	0.368	C	S	.	.	H	α-helix	trans	-64	-30.6	-175.9	-119.9	-86.4	0	0	0	112.6	K171 F358 L363 S364 E365	K171-H361 VanDerWaalsContact CE-NE2 3.29Å; K171-H361 WeakPolarHBondContact CE-NE2 3.3Å; F358-H361 PolarHBondContact O-N 3.43Å; H361-L363 PolarHBondContact O-N 2.71Å; H361-S364 PolarHBondContact O-N 2.95Å; H361-S364 PolarHBondContact O-OG 2.95Å; H361-E365 IonicContact CE1-OE1 3.68Å; H361-E365 PolarHBondContact CE1-OE1 2.85Å; H361-E365 IonicContact ND1-OE1 2.93Å; H361-E365 PolarHBondContact ND1-OE1 3.14Å; H361-E365 PolarHBondContact O-N 2.87Å
362	S	50.9	Low	64.9	Low	31 Å²	31	67.4 Å²	67.4	22%	0.217	36%	0.364	C	S	.	.	H	α-helix	trans	-63.8	-17	174.1	-166.4	0	0	0	0	113.5	M360 K366	M360-S362 PolarHBondContact O-N 3.48Å; S362-K366 VanDerWaalsContact O-CD 3.28Å; S362-K366 WeakPolarHBondContact O-CD 3.39Å; S362-K366 VanDerWaalsContact O-CE 3.32Å; S362-K366 WeakPolarHBondContact O-CE 3.28Å; S362-K366 VanDerWaalsContact O-CG 3.27Å; S362-K366 WeakPolarHBondContact O-CG 3.31Å
363	L	42.5	Very low	62.1	Low	115 Å²	115	74.5 Å²	74.5	60%	0.602	40%	0.395	S	S	*	.	H	α-helix	trans	-93.4	-46.4	175.7	-62.4	175.7	0	0	0	111.7	M360 H361 E365 K366	M360-L363 WeakPolarHBondContact O-CB 3.16Å; M360-L363 PolarHBondContact O-N 2.78Å; H361-L363 PolarHBondContact O-N 2.71Å; L363-E365 VanDerWaalsContact C-N 3.3Å; L363-E365 PolarHBondContact O-N 2.88Å; L363-K366 PolarHBondContact O-N 3.19Å
364	S	49.7	Very low	59.4	Low	66 Å²	66	79.6 Å²	79.6	46%	0.462	42%	0.421	S	S	.	.	H	α-helix	trans	-62.1	-35.2	-179.1	50.7	0	0	0	0	113.3	M360 H361	M360-S364 PolarHBondContact O-N 2.88Å; H361-S364 PolarHBondContact O-N 2.95Å; H361-S364 PolarHBondContact O-OG 2.95Å
365	E	52.8	Low	56.6	Low	45 Å²	45	78.5 Å²	78.5	21%	0.21	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-3.8	-177.2	-73.8	178.7	-134.5	0	0	115.2	W174 H361 L363 N367 N368 K369	W174-E365 VanDerWaalsContact NE1-CD 3.29Å; W174-E365 PolarHBondContact NE1-OE1 3.15Å; W174-E365 PolarHBondContact NE1-OE2 3.13Å; H361-E365 IonicContact CE1-OE1 3.68Å; H361-E365 PolarHBondContact CE1-OE1 2.85Å; H361-E365 IonicContact ND1-OE1 2.93Å; H361-E365 PolarHBondContact ND1-OE1 3.14Å; H361-E365 PolarHBondContact O-N 2.87Å; L363-E365 VanDerWaalsContact C-N 3.3Å; L363-E365 PolarHBondContact O-N 2.88Å; E365-N367 PolarHBondContact O-N 3.08Å; E365-N368 PolarHBondContact O-N 3.25Å; E365-K369 PolarHBondContact O-N 3.14Å
366	K	48.9	Very low	54	Low	123 Å²	123	83.4 Å²	83.4	54%	0.535	44%	0.444	S	S	.	.	H	α-helix	trans	-59.4	-34.4	167.3	-87.1	169.7	-174.6	176.3	0	111.5	S362 L363 N368 K369 L370	S362-K366 VanDerWaalsContact O-CD 3.28Å; S362-K366 WeakPolarHBondContact O-CD 3.39Å; S362-K366 VanDerWaalsContact O-CE 3.32Å; S362-K366 WeakPolarHBondContact O-CE 3.28Å; S362-K366 VanDerWaalsContact O-CG 3.27Å; S362-K366 WeakPolarHBondContact O-CG 3.31Å; L363-K366 PolarHBondContact O-N 3.19Å; K366-N368 VanDerWaalsContact C-N 3.3Å; K366-N368 PolarHBondContact O-N 3.11Å; K366-K369 PolarHBondContact O-N 3.26Å; K366-L370 PolarHBondContact O-N 3.03Å
367	N	42	Very low	51.3	Low	115 Å²	115	86.2 Å²	86.2	62%	0.615	46%	0.455	S	S	*	.	H	α-helix	trans	-65.2	-32.9	173.4	-63	-5.6	0	0	0	112	E365 S371	E365-N367 PolarHBondContact O-N 3.08Å; N367-S371 PolarHBondContact O-N 3.46Å
368	N	48.6	Very low	48.4	Very low	100 Å²	100	87.5 Å²	87.5	54%	0.535	47%	0.471	S	S	.	.	H	α-helix	trans	-77.7	-37.2	176.2	-69.3	-5.8	0	0	0	112.4	E365 K366 L370 S371 C372	E365-N368 PolarHBondContact O-N 3.25Å; K366-N368 VanDerWaalsContact C-N 3.3Å; K366-N368 PolarHBondContact O-N 3.11Å; N368-L370 PolarHBondContact O-N 3.46Å; N368-S371 VanDerWaalsContact O-CB 3.32Å; N368-S371 WeakPolarHBondContact O-CB 3.32Å; N368-S371 PolarHBondContact O-N 2.9Å; N368-C372 PolarHBondContact O-N 3.05Å; N368-C372 VanDerWaalsContact O-N 3.17Å
369	K	47.1	Very low	45.8	Very low	111 Å²	111	91.4 Å²	91.4	48%	0.483	50%	0.496	S	S	.	.	H	α-helix	trans	-65.4	-21.3	173.4	-102.5	-175.5	173.4	-179.3	0	113.1	D181 E365 K366	D181-K369 IonicContact OD2-NZ 3.32Å; E365-K369 PolarHBondContact O-N 3.14Å; K366-K369 PolarHBondContact O-N 3.26Å
370	L	40.8	Very low	44	Very low	110 Å²	110	94.9 Å²	94.9	58%	0.576	50%	0.503	S	S	*	.	H	α-helix	trans	-70.5	-44.1	166.5	-80.8	159.6	0	0	0	112.1	K366 N368 C372 K373 I374	K366-L370 PolarHBondContact O-N 3.03Å; N368-L370 PolarHBondContact O-N 3.46Å; L370-C372 PolarHBondContact O-N 3.49Å; L370-K373 PolarHBondContact O-N 2.83Å; L370-I374 WeakPolarHBondContact O-CG1 3.42Å; L370-I374 PolarHBondContact O-N 3.03Å
371	S	36.9	Very low	43.2	Very low	60 Å²	60	92.7 Å²	92.7	42%	0.42	49%	0.493	S	S	.	.	H	α-helix	trans	-56.9	-46.4	176.7	179.7	0	0	0	0	112.7	N367 N368 K373 I374 Q375	N367-S371 PolarHBondContact O-N 3.46Å; N368-S371 VanDerWaalsContact O-CB 3.32Å; N368-S371 WeakPolarHBondContact O-CB 3.32Å; N368-S371 PolarHBondContact O-N 2.9Å; S371-K373 PolarHBondContact O-N 2.99Å; S371-I374 WeakPolarHBondContact O-CB 3.41Å; S371-I374 PolarHBondContact O-N 3.27Å; S371-I374 VanDerWaalsContact O-N 3.11Å; S371-Q375 PolarHBondContact O-N 3.22Å
372	C	39.4	Very low	42.2	Very low	49 Å²	49	96 Å²	96	33%	0.331	51%	0.511	S	S	.	.	H	α-helix	trans	-59.2	-44.5	179	-60.6	0	0	0	0	112.6	N368 L370 I374 Q375 D376	N368-C372 PolarHBondContact O-N 3.05Å; N368-C372 VanDerWaalsContact O-N 3.17Å; L370-C372 PolarHBondContact O-N 3.49Å; C372-I374 PolarHBondContact O-N 3.18Å; C372-Q375 PolarHBondContact O-N 2.97Å; C372-Q375 VanDerWaalsContact O-N 3.07Å; C372-D376 PolarHBondContact O-N 3.1Å; C372-D376 VanDerWaalsContact O-N 3.12Å
373	K	38.2	Very low	41.4	Very low	150 Å²	150	100 Å²	100	65%	0.652	53%	0.53	S	S	*	.	H	α-helix	trans	-63.1	-27.7	177.7	-77.2	-167	170.3	-167.4	0	113.7	L370 S371 L377	L370-K373 PolarHBondContact O-N 2.83Å; S371-K373 PolarHBondContact O-N 2.99Å; K373-L377 WeakPolarHBondContact O-CG 3.49Å; K373-L377 PolarHBondContact O-N 3.37Å
374	I	40.5	Very low	41	Very low	119 Å²	119	102.4 Å²	102.4	61%	0.61	54%	0.538	S	S	*	.	H	α-helix	trans	-72.5	-34.7	176	-66.4	165.4	0	0	0	110.5	L370 S371 C372 L377 G378	L370-I374 WeakPolarHBondContact O-CG1 3.42Å; L370-I374 PolarHBondContact O-N 3.03Å; S371-I374 WeakPolarHBondContact O-CB 3.41Å; S371-I374 PolarHBondContact O-N 3.27Å; S371-I374 VanDerWaalsContact O-N 3.11Å; C372-I374 PolarHBondContact O-N 3.18Å; I374-L377 PolarHBondContact O-N 3.23Å; I374-G378 PolarHBondContact O-N 2.85Å
375	Q	39.2	Very low	40.1	Very low	127 Å²	127	108.3 Å²	108.3	59%	0.593	56%	0.556	S	S	*	*	H	α-helix	trans	-69.7	-39.9	174.9	-66	-178.1	-16.5	0	0	112.3	S371 C372 L377 G378 T379	S371-Q375 PolarHBondContact O-N 3.22Å; C372-Q375 PolarHBondContact O-N 2.97Å; C372-Q375 VanDerWaalsContact O-N 3.07Å; Q375-L377 VanDerWaalsContact C-N 3.31Å; Q375-L377 PolarHBondContact O-N 3Å; Q375-G378 PolarHBondContact O-N 2.74Å; Q375-T379 WeakPolarHBondContact O-CB 3.33Å; Q375-T379 PolarHBondContact O-N 3.13Å; Q375-T379 PolarHBondContact O-OG1 2.94Å
376	D	41.3	Very low	39	Very low	104 Å²	104	110.1 Å²	110.1	56%	0.556	57%	0.574	S	S	*	*	H	α-helix	trans	-63.1	-35.9	175.2	-66.1	-35.5	0	0	0	112.2	C372 N380	C372-D376 PolarHBondContact O-N 3.1Å; C372-D376 VanDerWaalsContact O-N 3.12Å; D376-N380 PolarHBondContact O-ND2 3.43Å
377	L	39.5	Very low	38.1	Very low	121 Å²	121	109 Å²	109	63%	0.634	58%	0.581	S	S	*	*	H	α-helix	trans	-71.4	-45.1	173.6	-76.1	165.3	0	0	0	112.3	K373 I374 Q375 T379 N380	K373-L377 WeakPolarHBondContact O-CG 3.49Å; K373-L377 PolarHBondContact O-N 3.37Å; I374-L377 PolarHBondContact O-N 3.23Å; Q375-L377 VanDerWaalsContact C-N 3.31Å; Q375-L377 PolarHBondContact O-N 3Å; L377-T379 VanDerWaalsContact C-N 3.32Å; L377-T379 PolarHBondContact O-N 2.95Å; L377-N380 PolarHBondContact O-N 2.63Å
378	G	36.2	Very low	37.4	Very low	35 Å²	35	109.1 Å²	109.1	36%	0.361	59%	0.591	S	S	.	*	H	α-helix	trans	-63.5	-34.5	-179.5	0	0	0	0	0	113.9	I374 Q375	I374-G378 PolarHBondContact O-N 2.85Å; Q375-G378 PolarHBondContact O-N 2.74Å
379	T	41.1	Very low	36.3	Very low	88 Å²	88	109.3 Å²	109.3	54%	0.54	60%	0.601	S	S	.	*	H	α-helix	trans	-73.9	-28.4	-176	-49.4	0	0	0	0	113	Q375 L377	Q375-T379 WeakPolarHBondContact O-CB 3.33Å; Q375-T379 PolarHBondContact O-N 3.13Å; Q375-T379 PolarHBondContact O-OG1 2.94Å; L377-T379 VanDerWaalsContact C-N 3.32Å; L377-T379 PolarHBondContact O-N 2.95Å
380	N	37.2	Very low	35.4	Very low	119 Å²	119	111.5 Å²	111.5	64%	0.636	62%	0.618	S	S	*	*	H	α-helix	trans	-77.9	-31.5	-179.9	-76.2	-67.6	0	0	0	113.1	D376 L377 I382	D376-N380 PolarHBondContact O-ND2 3.43Å; L377-N380 PolarHBondContact O-N 2.63Å; N380-I382 PolarHBondContact O-N 2.91Å
381	I	37.6	Very low	34.9	Very low	118 Å²	118	114.5 Å²	114.5	61%	0.605	63%	0.633	S	S	*	*	H	α-helix	trans	-72.8	-27.1	-177.2	-65	172.6	0	0	0	112.4
382	I	36.1	Very low	34.3	Very low	110 Å²	110	119.9 Å²	119.9	56%	0.564	65%	0.654	S	S	*	*	H	α-helix	trans	-77.6	-25.5	-174.6	-65.5	170.8	0	0	0	112.8	N380 S386	N380-I382 PolarHBondContact O-N 2.91Å; I382-S386 PolarHBondContact O-OG 3.37Å
383	N	33.8	Very low	34	Very low	114 Å²	114	122.4 Å²	122.4	61%	0.61	67%	0.67	S	S	*	*	H	α-helix	trans	-83.5	-19.4	-176.7	-77.1	-24.6	0	0	0	114.6
384	E	33.7	Very low	33.7	Very low	167 Å²	167	123.5 Å²	123.5	78%	0.78	67%	0.674	S	S	*	*	H	α-helix	trans	-84.4	-25.8	175.7	-67.9	-169.4	136.2	0	0	113.1
385	F	31.1	Very low	33.1	Very low	189 Å²	189	124.7 Å²	124.7	83%	0.829	68%	0.682	S	S	*	*	S	Bend	trans	-91.3	-0.5	-178.9	-95.7	-87.7	0	0	0	115.5
386	S	30.1	Very low	32.7	Very low	83 Å²	83	125.2 Å²	125.2	58%	0.58	68%	0.684	S	S	*	*	S	Bend	trans	-99	-0.3	-173	-64.2	0	0	0	0	115	I382	I382-S386 PolarHBondContact O-OG 3.37Å
387	S	29.2	Very low	32.1	Very low	99 Å²	99	127.9 Å²	127.9	69%	0.692	69%	0.691	S	S	*	*	S	Bend	trans	-127.3	16	-163.1	-56.4	0	0	0	0	115.8
388	S	27.7	Very low	31.6	Very low	119 Å²	119	129.2 Å²	129.2	83%	0.832	70%	0.698	S	S	*	*			trans	-144.2	65.6	-176.9	-71.3	0	0	0	0	113.5
389	S	25.9	Very low	31.2	Very low	104 Å²	104	135.1 Å²	135.1	73%	0.727	72%	0.718	S	S	*	*			trans	-146.9	43.3	178.8	54.8	0	0	0	0	114.3
390	N	27.8	Very low	30.5	Very low	157 Å²	157	133.8 Å²	133.8	84%	0.84	72%	0.722	S	S	*	*			trans	-147.1	81.2	170.6	-95.9	-46.2	0	0	0	111.6
391	L	29.6	Very low	30.1	Very low	172 Å²	172	138.9 Å²	138.9	90%	0.901	73%	0.734	S	S	*	*			trans	-179.6	108.5	148.9	-102	159.2	0	0	0	111.4
392	M	24.4	Very low	29.6	Very low	173 Å²	173	142 Å²	142	85%	0.852	75%	0.746	S	S	*	*			trans	-132.1	140.9	154.4	-84.6	-165.5	77.8	0	0	105.9
393	P	34	Very low	29.1	Very low	103 Å²	103	142.8 Å²	142.8	67%	0.669	76%	0.756	S	S	*	*				-150.3	156.3	88.8	38	-20.2	0	0	0	117.6
394	K	32.1	Very low	28.8	Very low	172 Å²	172	143.3 Å²	143.3	75%	0.748	77%	0.769	S	S	*	*			trans	73.2	120.4	150.6	-71.1	165.3	-179.2	-180	0	120.9
395	N	26.9	Very low	28.4	Very low	144 Å²	144	141.1 Å²	141.1	77%	0.77	77%	0.772	S	S	*	*			trans	72.3	147.7	141.7	-61.4	12	0	0	0	117.4
396	E	30.4	Very low	28.3	Very low	138 Å²	138	141.6 Å²	141.6	65%	0.645	77%	0.774	S	S	*	*			cis	-152.3	158.3	12.2	-139.9	-174.5	173.3	0	0	113.6
397	K	29.9	Very low	28	Very low	161 Å²	161	147.6 Å²	147.6	70%	0.7	79%	0.789	S	S	*	*			trans	57.4	112.7	150	-82.5	160.7	-175.4	150.9	0	123.3
398	L	28.1	Very low	28.1	Very low	148 Å²	148	150.2 Å²	150.2	78%	0.775	79%	0.794	S	S	*	*				103.9	119.5	115	-151	75	0	0	0	122
399	M	28.3	Very low	28.2	Very low	159 Å²	159	150.8 Å²	150.8	78%	0.783	79%	0.788	S	S	*	*			trans	33.1	132.5	153.8	-64.7	-160	-61.9	0	0	124.8
400	G	27.5	Very low	28.3	Very low	61 Å²	61	153.7 Å²	153.7	63%	0.629	79%	0.789	S	S	*	*			trans	102.5	144.8	134.8	0	0	0	0	0	116.9
401	Y	29	Very low	28.3	Very low	226 Å²	226	156.2 Å²	156.2	89%	0.886	79%	0.793	S	S	*	*			cis	-151	-177	-2.3	-25.7	-93.3	0	0	0	109.1
402	E	26.1	Very low	28.2	Very low	182 Å²	182	154.8 Å²	154.8	85%	0.85	79%	0.791	S	S	*	*			trans	-86.5	158.3	-167.5	-62.3	-179.7	118.1	0	0	117
403	T	25.1	Very low	28.3	Very low	127 Å²	127	149.4 Å²	149.4	78%	0.779	78%	0.78	S	S	*	*			trans	4.9	137.6	156.6	61.9	0	0	0	0	121.5
404	S	28.4	Very low	27.9	Very low	125 Å²	125	152.3 Å²	152.3	87%	0.874	79%	0.79	S	S	*	*			trans	-160.5	138.7	131.1	-90.6	0	0	0	0	113.6
405	S	24	Very low	27.9	Very low	122 Å²	122	152 Å²	152	85%	0.853	80%	0.796	S	S	*	*			trans	-88.1	141.3	177.6	-56.9	0	0	0	0	112.1
406	K	30.4	Very low	28	Very low	199 Å²	199	154.2 Å²	154.2	87%	0.865	80%	0.799	S	S	*	*			trans	-137.9	125.6	156	-75.3	-167.4	176.1	-180	0	111.6
407	K	23.8	Very low	28	Very low	208 Å²	208	157.2 Å²	157.2	90%	0.904	81%	0.81	S	S	*	*			trans	-82.3	137.2	157.5	-64.7	175.8	176.9	178	0	108
408	I	31	Very low	28	Very low	154 Å²	154	157.2 Å²	157.2	79%	0.79	82%	0.816	S	S	*	*			trans	-138.7	151.7	154.5	-63.8	-172.4	0	0	0	107.9
409	D	29.4	Very low	28	Very low	132 Å²	132	156.6 Å²	156.6	71%	0.706	81%	0.814	S	S	*	*			trans	-80.1	161.4	-153.4	-59.6	-83	0	0	0	118.5
410	H	27.1	Very low	28.1	Very low	164 Å²	164	154.7 Å²	154.7	76%	0.759	81%	0.813	S	S	*	*			trans	21	104.5	143.1	-68.2	-83.4	0	0	0	119.1
411	K	29.6	Very low	28.2	Very low	210 Å²	210	159 Å²	159	91%	0.913	82%	0.821	S	S	*	*			trans	-127.2	102	134.6	-87.6	-174.4	175.7	174.2	0	110.4	G413	K411-G413 PolarHBondContact O-N 3.2Å
412	V	26.9	Very low	28.1	Very low	142 Å²	142	153.1 Å²	153.1	86%	0.861	81%	0.812	S	S	*	*			trans	-81.8	110.5	165.8	177.6	0	0	0	0	107.4
413	G	26.1	Very low	28.2	Very low	60 Å²	60	153.1 Å²	153.1	62%	0.619	81%	0.806	S	S	*	*			trans	-176	135.8	177.9	0	0	0	0	0	111.7	K411	K411-G413 PolarHBondContact O-N 3.2Å
414	N	26.5	Very low	28.5	Very low	164 Å²	164	152.3 Å²	152.3	88%	0.877	80%	0.803	S	S	*	*			trans	55.6	95	176.2	-60.8	-25.1	0	0	0	116.1
415	N	31.1	Very low	28.5	Very low	166 Å²	166	155.9 Å²	155.9	89%	0.888	80%	0.803	S	S	*	*			trans	-123.6	132.2	140.2	-130.8	-23.2	0	0	0	109.3
416	K	29.8	Very low	28.7	Very low	190 Å²	190	158.8 Å²	158.8	83%	0.826	80%	0.8	S	S	*	*			trans	-81.1	125	-165	-65.3	171.8	-179.2	173	0	110.3	I418	K416-I418 PolarHBondContact O-N 2.84Å
417	F	29.2	Very low	28.5	Very low	201 Å²	201	155 Å²	155	88%	0.882	79%	0.793	S	S	*	*			trans	-66	120.6	161.8	-88.2	-90.3	0	0	0	109	N419	F417-N419 PolarHBondContact O-N 3.26Å
418	I	30.1	Very low	28.8	Very low	161 Å²	161	150.8 Å²	150.8	83%	0.826	79%	0.786	S	S	*	*			trans	-79.5	106.3	171.2	-61.4	175.7	0	0	0	106.8	K416	K416-I418 PolarHBondContact O-N 2.84Å
419	N	29.1	Very low	28.4	Very low	135 Å²	135	151.3 Å²	151.3	72%	0.722	79%	0.789	S	S	*	*			trans	-64.6	138.5	174.7	-73.9	-24.1	0	0	0	110.4	F417	F417-N419 PolarHBondContact O-N 3.26Å
420	P	30.9	Very low	28.4	Very low	119 Å²	119	153 Å²	153	77%	0.773	79%	0.793	S	S	*	*			trans	-64.7	144.1	166.5	29.4	-33.9	0	0	0	109.8	S422	P420-S422 PolarHBondContact O-N 3.14Å
421	I	29.1	Very low	28.4	Very low	153 Å²	153	150.6 Å²	150.6	79%	0.785	79%	0.792	S	S	*	*			trans	-72.6	101.9	179.5	-60.7	174.1	0	0	0	108.8
422	S	27.1	Very low	28.4	Very low	101 Å²	101	152 Å²	152	71%	0.706	79%	0.792	S	S	*	*			trans	-79.3	135.9	166.4	-180	0	0	0	0	109.8	P420 P424	P420-S422 PolarHBondContact O-N 3.14Å; S422-P424 WeakPolarHBondContact O-CD 3.32Å
423	Y	27	Very low	28.6	Very low	183 Å²	183	153.3 Å²	153.3	72%	0.718	79%	0.792	S	S	*	*			trans	-86	111.9	172.6	-69.1	-86.9	0	0	0	109.7	F425	Y423-F425 PolarHBondContact O-N 3.3Å
424	P	31	Very low	28.4	Very low	109 Å²	109	160.5 Å²	160.5	71%	0.708	80%	0.8	S	S	*	*			trans	-89.8	88.5	-172.7	34.7	-33.1	0	0	0	111.9	S422 K426	S422-P424 WeakPolarHBondContact O-CD 3.32Å; P424-K426 PolarHBondContact O-N 2.91Å
425	F	29.9	Very low	28.3	Very low	201 Å²	201	160 Å²	160	88%	0.882	79%	0.794	S	S	*	*			trans	-74.4	103.5	163.9	-131.8	-83.2	0	0	0	109.2	Y423 T427	Y423-F425 PolarHBondContact O-N 3.3Å; F425-T427 PolarHBondContact O-N 2.8Å
426	K	27.4	Very low	28.4	Very low	182 Å²	182	157.6 Å²	157.6	79%	0.791	79%	0.788	S	S	*	*			trans	-80.7	93.5	-179.4	-77.9	-172.5	175.5	-178.9	0	111.8	P424 T428	P424-K426 PolarHBondContact O-N 2.91Å; K426-T428 PolarHBondContact O-N 3.03Å
427	T	27.1	Very low	28.1	Very low	119 Å²	119	151.9 Å²	151.9	73%	0.73	78%	0.783	S	S	*	*			trans	-77.3	96	159.3	34.7	0	0	0	0	110.1	F425 L429	F425-T427 PolarHBondContact O-N 2.8Å; T427-L429 VanDerWaalsContact C-N 3.34Å; T427-L429 PolarHBondContact O-N 3.23Å
428	T	28.7	Very low	28.1	Very low	121 Å²	121	152.9 Å²	152.9	74%	0.742	79%	0.787	S	S	*	*			trans	-75	82.2	179	-51	0	0	0	0	111.4	K426	K426-T428 PolarHBondContact O-N 3.03Å
429	L	24.2	Very low	27.7	Very low	164 Å²	164	149.8 Å²	149.8	86%	0.859	78%	0.78	S	S	*	*			trans	-82.7	113.4	165.8	-71.6	174.1	0	0	0	110	T427	T427-L429 VanDerWaalsContact C-N 3.34Å; T427-L429 PolarHBondContact O-N 3.23Å
430	Q	28.5	Very low	27.8	Very low	168 Å²	168	152.7 Å²	152.7	79%	0.785	79%	0.789	S	S	*	*			trans	-133.2	123.6	169.9	-87.9	-82.9	-14.9	0	0	107.9
431	P	27.3	Very low	27.7	Very low	114 Å²	114	156.8 Å²	156.8	74%	0.74	80%	0.795	S	S	*	*			trans	-87.5	139.7	-173.5	33.4	-33.9	0	0	0	112.3
432	R	30.3	Very low	28.1	Very low	240 Å²	240	154.7 Å²	154.7	91%	0.906	79%	0.792	S	S	*	*			trans	-139.1	103.9	160.2	-98.9	-175.6	-179.2	-179.7	0.2	112.9
433	I	29.5	Very low	28.2	Very low	169 Å²	169	157.9 Å²	157.9	87%	0.867	80%	0.799	S	S	*	*				34.2	133.9	125	-54.2	177.5	0	0	0	117.8
434	R	22.6	Very low	28.1	Very low	211 Å²	211	155.5 Å²	155.5	80%	0.796	80%	0.798	S	S	*	*			trans	-96.7	173.2	-167.7	-161.8	-173	-166.5	179.2	5.4	112.7
435	M	24.8	Very low	27.8	Very low	152 Å²	152	155.7 Å²	155.7	75%	0.749	80%	0.798	S	S	*	*			trans	90.8	153.4	162	-49.4	-57.7	-139.5	0	0	117
436	P	32	Very low	27.5	Very low	116 Å²	116	157 Å²	157	75%	0.753	80%	0.797	S	S	*	*				-140	149.8	-52.6	38.1	-22.8	0	0	0	115.2
437	G	23.5	Very low	27.5	Very low	70 Å²	70	155 Å²	155	72%	0.722	80%	0.795	S	S	*	*			trans	61.6	120.6	139.8	0	0	0	0	0	121.8
438	F	29	Very low	27.5	Very low	222 Å²	222	153.2 Å²	153.2	97%	0.974	79%	0.788	S	S	*	*				-148.3	163.1	128.1	-123.5	-85.5	0	0	0	109.8
439	S	23.4	Very low	27.5	Very low	97 Å²	97	155.4 Å²	155.4	68%	0.678	79%	0.793	S	S	*	*			trans	-124.5	139.9	-172.5	175.2	0	0	0	0	111.6
440	Q	30.9	Very low	27.8	Very low	195 Å²	195	152.4 Å²	152.4	91%	0.911	78%	0.781	S	S	*	*			trans	-169.7	178.7	130.8	-103.5	166.9	36.9	0	0	112.4
441	K	27.4	Very low	27.8	Very low	205 Å²	205	154.5 Å²	154.5	89%	0.891	79%	0.788	S	S	*	*			trans	-114.4	172.5	-163.7	-103.2	-171.5	175.3	-177.5	0	112.8
442	P	39.2	Very low	27.9	Very low	110 Å²	110	158 Å²	158	71%	0.714	79%	0.791	S	S	*	*			trans	-98.2	174.5	-154.3	39.9	-39.6	0	0	0	115.3
443	I	28	Very low	28	Very low	168 Å²	168	151.4 Å²	151.4	86%	0.862	78%	0.779	S	S	*	*			trans	-158.8	169.6	144.7	-108.9	157.3	0	0	0	110.8
444	N	25.5	Very low	27.8	Very low	132 Å²	132	150.7 Å²	150.7	71%	0.706	78%	0.776	S	S	*	*			trans	-96.1	179.2	-159.4	-49.3	-42.9	0	0	0	115.8
445	T	24.9	Very low	28.5	Very low	114 Å²	114	145.5 Å²	145.5	70%	0.699	77%	0.77	S	S	*	*			trans	75.6	109.7	143.2	42.3	0	0	0	0	122.1
446	W	23.3	Very low	28.6	Very low	228 Å²	228	146 Å²	146	86%	0.864	78%	0.775	S	S	*	*			trans	51.6	157.6	148.2	-49.4	84.8	0	0	0	118.8
447	D	26.6	Very low	28.5	Very low	140 Å²	140	148.7 Å²	148.7	75%	0.749	78%	0.781	S	S	*	*			cis	-153.8	-164.4	19.6	-148.4	-24.6	0	0	0	114.2
448	S	27.8	Very low	28.6	Very low	82 Å²	82	149.8 Å²	149.8	57%	0.573	78%	0.778	S	S	*	*			trans	-109.3	146.5	-151.5	-46.5	0	0	0	0	116.2
449	I	29.2	Very low	28.6	Very low	167 Å²	167	144.7 Å²	144.7	86%	0.856	77%	0.765	S	S	*	*			trans	-142.8	119.1	154	-58.4	-176.2	0	0	0	107.2
450	V	29.9	Very low	28.9	Very low	100 Å²	100	147.6 Å²	147.6	61%	0.606	77%	0.768	S	S	*	*			cis	109.1	114.7	26.5	170.5	0	0	0	0	113.1	K452	V450-K452 HydrophobicContact CG1-CG 4.48Å
451	K	29.2	Very low	28.8	Very low	212 Å²	212	146.1 Å²	146.1	92%	0.922	76%	0.758	S	S	*	*			trans	-136.8	129.7	145	-72.1	-178.1	177.9	-179.5	0	106.3
452	K	28.5	Very low	28.9	Very low	189 Å²	189	141.5 Å²	141.5	82%	0.822	75%	0.747	S	S	*	*			cis	-173.3	148.5	-27.2	-127.1	-166	175	-170.4	0	103.5	V450	V450-K452 HydrophobicContact CG1-CG 4.48Å
453	P	33.6	Very low	28.3	Very low	100 Å²	100	143.9 Å²	143.9	65%	0.649	75%	0.747	S	S	*	*			trans	-137.3	175.5	-145	43.1	-27.4	0	0	0	118.7
454	L	25.6	Very low	28.2	Very low	154 Å²	154	146.8 Å²	146.8	81%	0.806	75%	0.749	S	S	*	*			trans	68.5	177.6	148	-78.6	164.5	0	0	0	118.5
455	P	36.5	Very low	28.1	Very low	103 Å²	103	149.8 Å²	149.8	67%	0.669	75%	0.75	S	S	*	*			cis	-138.6	161.3	-3.3	18.4	8.4	0	0	0	120.3
456	L	25.7	Very low	28.3	Very low	163 Å²	163	149.6 Å²	149.6	85%	0.853	75%	0.749	S	S	*	*			trans	71.2	166.3	134.8	-71.2	167.7	0	0	0	125.6
457	I	30.1	Very low	28.4	Very low	171 Å²	171	144.4 Å²	144.4	88%	0.877	74%	0.742	S	S	*	*			trans	104.5	155.5	176.6	-60.7	158.3	0	0	0	114.3
458	S	27.1	Very low	28.4	Very low	93 Å²	93	142 Å²	142	65%	0.65	74%	0.742	S	S	*	*				-157.4	153.3	-118.3	-164.6	0	0	0	0	118.8
459	T	27.5	Very low	28.4	Very low	116 Å²	116	143.9 Å²	143.9	71%	0.712	75%	0.75	S	S	*	*			trans	30.2	116.1	149.6	56	0	0	0	0	123.1
460	H	31	Very low	28.3	Very low	158 Å²	158	142.6 Å²	142.6	73%	0.731	75%	0.745	S	S	*	*				-176.8	137.3	125.7	-106.7	-140.8	0	0	0	109.3
461	K	28.1	Very low	28.2	Very low	164 Å²	164	144.8 Å²	144.8	71%	0.713	75%	0.753	S	S	*	*				61.6	135.4	77.7	-68.2	-171	179.5	170.1	0	113.7
462	T	29.3	Very low	28.3	Very low	108 Å²	108	141.1 Å²	141.1	66%	0.663	74%	0.743	S	S	*	*			cis	-167.9	164.7	12.2	-1.1	0	0	0	0	114.4
463	F	26.3	Very low	28.2	Very low	159 Å²	159	137 Å²	137	70%	0.697	74%	0.738	S	S	*	*			trans	65.8	150.6	157.7	-78.1	-66	0	0	0	118.5	R465	F463-R465 HydrophobicContact CD1-CB 4.44Å; F463-R465 HydrophobicContact CE1-CB 4.34Å
464	Y	26.4	Very low	28	Very low	230 Å²	230	138 Å²	138	90%	0.902	74%	0.742	S	S	*	*			cis	-110	164.9	29.1	-93.4	-101.5	0	0	0	118.5
465	R	23.9	Very low	28.2	Very low	195 Å²	195	137 Å²	137	74%	0.736	74%	0.743	S	S	*	*			trans	-116.4	174.9	165.6	-127.2	175	178.9	177.1	0.2	106.2	F463	F463-R465 HydrophobicContact CD1-CB 4.44Å; F463-R465 HydrophobicContact CE1-CB 4.34Å
466	T	28	Very low	28	Very low	110 Å²	110	137.9 Å²	137.9	68%	0.675	75%	0.749	S	S	*	*			cis	-169	138	40.4	-19.2	0	0	0	0	111.8
467	T	26.6	Very low	28.3	Very low	118 Å²	118	137.1 Å²	137.1	72%	0.724	75%	0.75	S	S	*	*			trans	35	125.7	141.1	55.7	0	0	0	0	124.4
468	A	25	Very low	28.2	Very low	89 Å²	89	134.7 Å²	134.7	74%	0.736	74%	0.743	S	S	*	*				34	143.8	120.2	0	0	0	0	0	120.9
469	T	28.4	Very low	28.2	Very low	122 Å²	122	139 Å²	139	75%	0.748	76%	0.755	S	S	*	*			cis	-162.4	159.4	42.6	49.3	0	0	0	0	114.9
470	N	28	Very low	28.2	Very low	141 Å²	141	137.4 Å²	137.4	75%	0.754	75%	0.754	S	S	*	*			trans	74.8	127.9	143.2	-84.2	-12.7	0	0	0	124.8
471	L	28.1	Very low	28.1	Very low	146 Å²	146	136.1 Å²	136.1	76%	0.764	76%	0.757	S	S	*	*			trans	85.8	130.3	140.1	-68.7	167.2	0	0	0	123
472	N	29.6	Very low	28.1	Very low	135 Å²	135	134.3 Å²	134.3	72%	0.722	76%	0.76	S	S	*	*			trans	74.2	97.9	150.7	-65.7	-4.2	0	0	0	122.3
473	S	27.2	Very low	27.9	Very low	103 Å²	103	134.6 Å²	134.6	72%	0.72	77%	0.765	S	S	*	*				112	145.2	110.5	75.2	0	0	0	0	120.9
474	T	29.2	Very low	28	Very low	120 Å²	120	133.2 Å²	133.2	74%	0.736	77%	0.77	S	S	*	*			trans	52.5	96.1	159.3	53.5	0	0	0	0	120.2
475	T	30	Very low	28	Very low	133 Å²	133	128.7 Å²	128.7	82%	0.816	77%	0.767	S	S	*	*				163.8	130	100.1	38.8	0	0	0	0	112.3
476	P	33.2	Very low	28.2	Very low	122 Å²	122	127 Å²	127	79%	0.792	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-97.4	144	161.4	35.1	-29.3	0	0	0	111.4
477	V	31.2	Very low	28	Very low	146 Å²	146	127.1 Å²	127.1	89%	0.885	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-81.3	126.2	179	175.3	0	0	0	0	111.2
478	T	27.6	Very low	28.1	Very low	120 Å²	120	128.1 Å²	128.1	74%	0.736	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-82.5	126.2	177.9	-50.8	0	0	0	0	111.9	A480	T478-A480 HydrophobicContact CG2-CB 4.39Å
479	M	27.7	Very low	28.3	Very low	183 Å²	183	130.9 Å²	130.9	90%	0.901	78%	0.779	S	S	*	*			trans	-130.3	96.7	148.3	-73.8	-150.9	95.5	0	0	109.8
480	A	27.8	Very low	28.2	Very low	83 Å²	83	129.2 Å²	129.2	69%	0.686	77%	0.772	S	S	*	*			trans	-100.4	120.9	166.7	0	0	0	0	0	108.4	T478	T478-A480 HydrophobicContact CG2-CB 4.39Å
481	V	28.2	Very low	28.3	Very low	132 Å²	132	128.7 Å²	128.7	80%	0.8	77%	0.77	S	S	*	*			trans	-87.5	112.4	169.8	176.3	0	0	0	0	108.1	C483	V481-C483 PolarHBondContact O-N 2.84Å
482	T	27.3	Very low	28.5	Very low	125 Å²	125	128.1 Å²	128.1	77%	0.767	77%	0.767	S	S	*	*			trans	-78.6	110.1	177.8	29.9	0	0	0	0	111.3
483	C	26.1	Very low	28.6	Very low	114 Å²	114	128.8 Å²	128.8	77%	0.77	77%	0.771	S	S	*	*			trans	-92.3	106.9	162.2	-68.9	0	0	0	0	109	V481 T485	V481-C483 PolarHBondContact O-N 2.84Å; C483-T485 PolarHBondContact O-N 3.41Å
484	T	28.9	Very low	28.5	Very low	131 Å²	131	128.9 Å²	128.9	80%	0.804	77%	0.772	S	S	*	*			trans	-78.5	105.2	-178.6	33.4	0	0	0	0	112.3
485	T	25.7	Very low	28.6	Very low	135 Å²	135	130.6 Å²	130.6	83%	0.828	78%	0.776	S	S	*	*			trans	-89.7	104.6	166.9	52	0	0	0	0	110.4	C483	C483-T485 PolarHBondContact O-N 3.41Å
486	N	28.8	Very low	28.5	Very low	160 Å²	160	131.3 Å²	131.3	86%	0.856	77%	0.772	S	S	*	*			trans	-100.2	129.2	167.4	-88.7	-0.5	0	0	0	110.5
487	S	24.2	Very low	28.5	Very low	111 Å²	111	136.2 Å²	136.2	78%	0.776	78%	0.777	S	S	*	*			trans	-159.8	158.4	167.9	-151	0	0	0	0	111.6
488	I	27.9	Very low	28.4	Very low	139 Å²	139	132.7 Å²	132.7	71%	0.713	77%	0.77	S	S	*	*			trans	81.2	118.8	164.1	-58.6	175.7	0	0	0	117.9
489	N	28.4	Very low	28.5	Very low	148 Å²	148	132.1 Å²	132.1	79%	0.791	76%	0.762	S	S	*	*			trans	73.6	145.4	152.5	-71.7	-2.7	0	0	0	121.6
490	S	27.1	Very low	28.8	Very low	86 Å²	86	128.8 Å²	128.8	60%	0.601	76%	0.757	S	S	*	*			cis	-163.7	-174.3	-13.8	53.3	0	0	0	0	111.8
491	N	30.6	Very low	28.9	Very low	131 Å²	131	134.5 Å²	134.5	70%	0.701	76%	0.761	S	S	*	*			trans	89	139.1	169.1	-50.1	-1.9	0	0	0	114.2
492	N	31.1	Very low	29.5	Very low	133 Å²	133	132.5 Å²	132.5	71%	0.711	75%	0.75	S	S	*	*			cis	-160.2	171.1	-5.8	-121.2	-3.3	0	0	0	114.1
493	N	32.2	Very low	29.8	Very low	149 Å²	149	134.7 Å²	134.7	80%	0.797	75%	0.751	S	S	*	*			trans	75.6	126	154.4	-65.3	-1.9	0	0	0	121.5
494	S	25.1	Very low	29.8	Very low	106 Å²	106	133 Å²	133	74%	0.741	75%	0.746	S	S	*	*			trans	-108.2	134.1	156.2	54.2	0	0	0	0	110.4
495	N	32.2	Very low	30.3	Very low	155 Å²	155	132.1 Å²	132.1	83%	0.829	74%	0.743	S	S	*	*			trans	-173.6	124.1	157.9	-94.3	-24.5	0	0	0	106.7
496	M	27.3	Very low	30.6	Very low	148 Å²	148	132.9 Å²	132.9	73%	0.729	74%	0.74	S	S	*	*				87.9	134.2	66.2	-81	-104.3	64.4	0	0	113.3
497	Y	32.5	Very low	30.5	Very low	226 Å²	226	129.4 Å²	129.4	89%	0.886	73%	0.728	S	S	*	*			trans	67.7	142.8	-171	-55.2	-87	0	0	0	115.4
498	G	29.5	Very low	30.6	Very low	72 Å²	72	131.4 Å²	131.4	74%	0.742	73%	0.729	S	S	*	*			cis	167.3	150.9	-15.5	0	0	0	0	0	113.1
499	D	30.9	Very low	30.6	Very low	107 Å²	107	131.3 Å²	131.3	57%	0.572	73%	0.729	S	S	*	*			cis	-105.2	-88.9	-8.1	-177.7	-43.9	0	0	0	110.5	R501	D499-R501 VanDerWaalsContact OD1-CG 3.25Å; D499-R501 WeakPolarHBondContact OD1-CG 3.23Å; D499-R501 PolarHBondContact OD1-N 2.98Å; D499-R501 VanDerWaalsContact OD2-CD 3.23Å; D499-R501 WeakPolarHBondContact OD2-CD 3.34Å; D499-R501 WeakPolarHBondContact OD2-CG 3.17Å; D499-R501 IonicContact OD2-CZ 3.86Å; D499-R501 IonicContact OD2-NE 2.8Å; D499-R501 PolarHBondContact OD2-NE 3.24Å
500	S	33.9	Very low	30.5	Very low	113 Å²	113	133.7 Å²	133.7	79%	0.79	73%	0.732	S	S	*	*			cis	-136.3	81.2	-9.2	-67.2	0	0	0	0	111.7
501	R	29.5	Very low	30.9	Very low	204 Å²	204	135.3 Å²	135.3	77%	0.77	74%	0.74	S	S	*	*				26.8	153.9	129.2	-91	179.4	-163	-127.8	0.2	121.7	D499	D499-R501 VanDerWaalsContact OD1-CG 3.25Å; D499-R501 WeakPolarHBondContact OD1-CG 3.23Å; D499-R501 PolarHBondContact OD1-N 2.98Å; D499-R501 VanDerWaalsContact OD2-CD 3.23Å; D499-R501 WeakPolarHBondContact OD2-CD 3.34Å; D499-R501 WeakPolarHBondContact OD2-CG 3.17Å; D499-R501 IonicContact OD2-CZ 3.86Å; D499-R501 IonicContact OD2-NE 2.8Å; D499-R501 PolarHBondContact OD2-NE 3.24Å
502	P	39.9	Very low	30.7	Very low	90 Å²	90	136.5 Å²	136.5	58%	0.584	75%	0.745	S	S	*	*				-131.7	-167.4	-61.8	26.2	-0.2	0	0	0	108.5
503	H	33.2	Very low	30.5	Very low	170 Å²	170	139 Å²	139	79%	0.787	75%	0.75	S	S	*	*			cis	-139.9	149.5	18.6	-75.7	-98.5	0	0	0	108.8
504	A	27.4	Very low	30.2	Very low	80 Å²	80	136.3 Å²	136.3	66%	0.661	74%	0.743	S	S	*	*			cis	91.7	147	36.7	0	0	0	0	0	113.2
505	P	39.9	Very low	30.3	Very low	112 Å²	112	137.9 Å²	137.9	73%	0.727	74%	0.743	S	S	*	*				-142.3	-147.4	-87.4	31.4	-6.9	0	0	0	113.7
506	I	30.4	Very low	30.2	Very low	151 Å²	151	139.2 Å²	139.2	77%	0.774	74%	0.744	S	S	*	*			trans	96.8	135.6	157.1	-57.9	162.5	0	0	0	116.6
507	S	28.1	Very low	30.2	Very low	86 Å²	86	137 Å²	137	60%	0.601	74%	0.738	S	S	*	*			cis	-169.6	150.6	-31.2	66.3	0	0	0	0	112.9
508	L	24.9	Very low	30.1	Very low	153 Å²	153	134.9 Å²	134.9	80%	0.801	74%	0.737	S	S	*	*			trans	64.4	147.2	134.6	-79.7	167.3	0	0	0	124.4
509	I	29.4	Very low	30.1	Very low	137 Å²	137	138.3 Å²	138.3	70%	0.703	74%	0.737	S	S	*	*			trans	83	94.4	152.8	-64.3	152.4	0	0	0	119.8
510	K	25.4	Very low	29.9	Very low	198 Å²	198	140.9 Å²	140.9	86%	0.861	75%	0.75	S	S	*	*			trans	55.2	149.1	130.3	-64.2	-175.6	177.2	179.9	0	122.3
511	P	35.7	Very low	29.6	Very low	120 Å²	120	143.1 Å²	143.1	78%	0.779	75%	0.749	S	S	*	*			trans	-101.2	160.2	-174.5	39.9	-36	0	0	0	115.1
512	I	26.2	Very low	29.8	Very low	157 Å²	157	140.8 Å²	140.8	81%	0.805	75%	0.751	S	S	*	*			trans	-166	147.5	145.5	-104.1	155.2	0	0	0	109.4
513	F	27.1	Very low	29.2	Very low	186 Å²	186	142.3 Å²	142.3	82%	0.816	75%	0.754	S	S	*	*			trans	-5.1	151.3	162.8	-64.4	-90.6	0	0	0	120.4
514	S	26.6	Very low	29.2	Very low	92 Å²	92	141.4 Å²	141.4	64%	0.643	75%	0.75	S	S	*	*			cis	-175.1	157.2	5	40.3	0	0	0	0	115.3
515	N	26.6	Very low	29.3	Very low	138 Å²	138	143.4 Å²	143.4	74%	0.738	75%	0.75	S	S	*	*			trans	47.2	126.8	140.1	-58.8	-6.4	0	0	0	124
516	H	30.1	Very low	28.7	Very low	184 Å²	184	145.1 Å²	145.1	85%	0.852	75%	0.752	S	S	*	*				-151.6	118.5	128.3	-92.6	-64.5	0	0	0	106.7
517	T	27.5	Very low	28.6	Very low	100 Å²	100	145.9 Å²	145.9	61%	0.613	75%	0.752	S	S	*	*				82.8	103.3	51.1	67.8	0	0	0	0	116
518	Q	28.9	Very low	28.3	Very low	182 Å²	182	149.5 Å²	149.5	85%	0.85	76%	0.764	S	S	*	*			trans	-134.7	114.7	132.8	-75.3	-163.5	-13.7	0	0	106.4
519	I	29.9	Very low	28.4	Very low	144 Å²	144	149.6 Å²	149.6	74%	0.738	76%	0.76	S	S	*	*				74.2	108.3	80.4	-66.4	166.4	0	0	0	112.3
520	N	27.6	Very low	28.5	Very low	161 Å²	161	148.7 Å²	148.7	86%	0.861	76%	0.763	S	S	*	*			trans	-147	139.8	138	-155.1	-9.1	0	0	0	107.4
521	Q	27.8	Very low	28.6	Very low	161 Å²	161	143.8 Å²	143.8	75%	0.752	75%	0.75	S	S	*	*			trans	-127.1	143.8	-174.4	-77.4	-175.5	-23.1	0	0	110.5
522	N	32.1	Very low	28.4	Very low	155 Å²	155	146 Å²	146	83%	0.829	75%	0.75	S	S	*	*			trans	-162.7	151	141.2	-104.9	-41.3	0	0	0	112.6
523	N	28.9	Very low	28.4	Very low	121 Å²	121	142.7 Å²	142.7	65%	0.647	74%	0.74	S	S	*	*			trans	-59.3	170.3	-168.4	-50	-32.3	0	0	0	114.6
524	H	32.7	Very low	28.5	Very low	152 Å²	152	140.9 Å²	140.9	70%	0.704	74%	0.739	S	S	*	*			cis	-157	157.6	33.6	-108.6	-71.1	0	0	0	114.1
525	N	29	Very low	28.7	Very low	121 Å²	121	144.5 Å²	144.5	65%	0.647	75%	0.75	S	S	*	*			trans	67.5	116.7	150.9	-61.8	-1.4	0	0	0	117.8
526	L	27.5	Very low	28.6	Very low	148 Å²	148	142.3 Å²	142.3	78%	0.775	75%	0.752	S	S	*	*				66.1	132.4	89.5	-66.6	164.5	0	0	0	113
527	Q	27.7	Very low	28.4	Very low	168 Å²	168	141 Å²	141	79%	0.785	75%	0.75	S	S	*	*			cis	-156.7	154.3	17.5	-159.1	165.6	-5.3	0	0	111.2
528	L	21.9	Very low	28.3	Very low	161 Å²	161	142.5 Å²	142.5	84%	0.843	76%	0.759	S	S	*	*			trans	-141.2	127	169.7	-112.7	175.3	0	0	0	110
529	H	28	Very low	28.1	Very low	156 Å²	156	139.4 Å²	139.4	72%	0.722	75%	0.753	S	S	*	*			trans	-159.7	112.7	173.8	-139	-84.2	0	0	0	110.8
530	P	30.3	Very low	27.9	Very low	117 Å²	117	140.3 Å²	140.3	76%	0.76	76%	0.757	S	S	*	*			trans	-114.9	119.1	173	34.2	-23	0	0	0	112
531	T	27.8	Very low	27.6	Very low	95 Å²	95	137.2 Å²	137.2	58%	0.583	75%	0.748	S	S	*	*			trans	-144	150.5	176.7	49.9	0	0	0	0	112.5
532	H	31.4	Very low	27.6	Very low	168 Å²	168	138 Å²	138	78%	0.778	75%	0.754	S	S	*	*			trans	67	120.8	176	-51.3	-68.1	0	0	0	116.8
533	S	27.3	Very low	27.3	Very low	87 Å²	87	134.5 Å²	134.5	61%	0.608	76%	0.755	S	S	*	*			cis	100.7	101.3	22.7	77.5	0	0	0	0	114.8
534	N	29.8	Very low	27.1	Very low	147 Å²	147	133.3 Å²	133.3	79%	0.786	76%	0.756	S	S	*	*				177.2	141.2	121.4	-96.5	-36.6	0	0	0	114.1
535	L	29.1	Very low	26.9	Very low	168 Å²	168	134.5 Å²	134.5	88%	0.88	77%	0.767	S	S	*	*			trans	62.3	148.2	157.9	-59.8	164.1	0	0	0	117.8
536	A	26.2	Very low	26.9	Very low	93 Å²	93	134.8 Å²	134.8	77%	0.769	77%	0.773	S	S	*	*			cis	-129.2	159.5	4.4	0	0	0	0	0	112.7
537	L	24.6	Very low	26.9	Very low	155 Å²	155	131.4 Å²	131.4	81%	0.812	77%	0.774	S	S	*	*			trans	-90.8	138.5	172.9	-78.6	150.9	0	0	0	110.8
538	T	25.8	Very low	26.9	Very low	133 Å²	133	133.4 Å²	133.4	82%	0.816	78%	0.78	S	S	*	*			trans	-141.6	96.7	148.1	-51.8	0	0	0	0	109.1
539	T	24	Very low	27.4	Very low	116 Å²	116	131.5 Å²	131.5	71%	0.712	78%	0.777	S	S	*	*			trans	-103.7	119.9	172.1	-54.3	0	0	0	0	108.7
540	I	26.3	Very low	27.2	Very low	163 Å²	163	128.6 Å²	128.6	84%	0.836	78%	0.78	S	S	*	*			trans	-113.6	130.8	159.8	-64.3	-179.6	0	0	0	107.1
541	S	22.1	Very low	27	Very low	96 Å²	96	131.4 Å²	131.4	67%	0.671	79%	0.788	S	S	*	*			trans	-139.6	166.6	-179.8	-175.2	0	0	0	0	109.6
542	M	27	Very low	26.8	Very low	177 Å²	177	133.8 Å²	133.8	87%	0.872	80%	0.797	S	S	*	*			trans	102.6	116.9	173.5	-57.4	-61.5	-80.1	0	0	115.5
543	G	25.6	Very low	26.7	Very low	83 Å²	83	134.9 Å²	134.9	86%	0.856	80%	0.802	S	S	*	*			trans	173.6	44	-175.8	0	0	0	0	0	111.7
544	S	25.4	Very low	26.6	Very low	96 Å²	96	133.4 Å²	133.4	67%	0.671	80%	0.8	S	S	*	*			trans	-81.9	134.4	-173.1	168.1	0	0	0	0	112.8
545	L	28.5	Very low	26.3	Very low	176 Å²	176	136.6 Å²	136.6	92%	0.921	81%	0.808	S	S	*	*			trans	-137.3	144.8	147.4	-99.2	173.1	0	0	0	110.4
546	T	29.2	Very low	26.1	Very low	128 Å²	128	138.7 Å²	138.7	79%	0.785	81%	0.805	S	S	*	*			trans	-111.5	143.4	-162.9	54.3	0	0	0	0	112.9
547	G	27.5	Very low	26	Very low	76 Å²	76	142.1 Å²	142.1	78%	0.784	81%	0.811	S	S	*	*			trans	-134.6	-23.7	-172.2	0	0	0	0	0	120.5
548	K	27.1	Very low	26	Very low	210 Å²	210	142 Å²	142	91%	0.913	81%	0.81	S	S	*	*			trans	62.2	165.6	-176.3	-74.9	-176	176.3	179.2	0	117.4
549	P	32	Very low	25.7	Very low	121 Å²	121	141 Å²	141	79%	0.786	81%	0.809	S	S	*	*			trans	-128.2	-176.2	-169	43.9	-29	0	0	0	116.1
550	A	23.4	Very low	25.9	Very low	95 Å²	95	141.5 Å²	141.5	79%	0.785	81%	0.806	S	S	*	*			trans	86	123	156.1	0	0	0	0	0	120.1
551	L	28	Very low	25.6	Very low	176 Å²	176	138.8 Å²	138.8	92%	0.921	80%	0.801	S	S	*	*				-156.8	167	127.8	-111.9	170.9	0	0	0	110.9
552	N	22.7	Very low	25.8	Very low	146 Å²	146	141.9 Å²	141.9	78%	0.781	81%	0.807	S	S	*	*			trans	-95.4	-176.8	-171.8	-107.3	-35.1	0	0	0	113.2
553	H	29.3	Very low	25.9	Very low	191 Å²	191	138.4 Å²	138.4	88%	0.884	80%	0.798	S	S	*	*			trans	91.5	139	-179.4	-53.5	-75.8	0	0	0	114.8
554	G	25.3	Very low	25.8	Very low	55 Å²	55	142.5 Å²	142.5	57%	0.567	80%	0.8	S	S	*	*			cis	-177.9	148.6	-6.5	0	0	0	0	0	111	Y556	G554-Y556 PolarHBondContact O-N 2.89Å
555	F	22.4	Very low	26.1	Very low	215 Å²	215	143.7 Å²	143.7	94%	0.943	80%	0.803	S	S	*	*			trans	-69.5	119.4	-179.2	-81.7	-92.3	0	0	0	111.8
556	Y	26.5	Very low	25.8	Very low	211 Å²	211	139.9 Å²	139.9	83%	0.827	80%	0.797	S	S	*	*			trans	-135.1	130.2	164.9	-74.4	-76.9	0	0	0	111.1	G554	G554-Y556 PolarHBondContact O-N 2.89Å
557	N	22.6	Very low	25.7	Very low	166 Å²	166	142 Å²	142	89%	0.888	80%	0.797	S	S	*	*			trans	-70.9	131.2	168.4	-70	-45.2	0	0	0	109
558	L	24.9	Very low	25.6	Very low	151 Å²	151	144.1 Å²	144.1	79%	0.791	80%	0.796	S	S	*	*			trans	-114.9	88.2	175.3	-116.2	165.2	0	0	0	110.4	I560	L558-I560 HydrophobicContact CD2-CG1 4.33Å; L558-I560 PolarHBondContact O-N 2.86Å; L558-I560 VanDerWaalsContact O-N 3.16Å
559	S	20.9	Very low	25.5	Very low	113 Å²	113	141.1 Å²	141.1	79%	0.79	79%	0.788	S	S	*	*			trans	-71	98.3	166.1	51.9	0	0	0	0	109.3	S561	S559-S561 PolarHBondContact O-N 3.14Å; S559-S561 VanDerWaalsContact O-N 3.14Å
560	I	26.3	Very low	25.1	Very low	127 Å²	127	140.6 Å²	140.6	65%	0.651	78%	0.783	S	S	*	*			trans	-78.8	99.7	177.2	-62.6	178.9	0	0	0	109.3	L558 M562	L558-I560 HydrophobicContact CD2-CG1 4.33Å; L558-I560 PolarHBondContact O-N 2.86Å; L558-I560 VanDerWaalsContact O-N 3.16Å; I560-M562 HydrophobicContact CG2-CE 3.94Å; I560-M562 HydrophobicContact CG2-CG 4.07Å
561	S	21.2	Very low	25.1	Very low	105 Å²	105	143.4 Å²	143.4	73%	0.734	78%	0.784	S	S	*	*			trans	-81.2	133.9	155.4	-176.6	0	0	0	0	108.6	S559	S559-S561 PolarHBondContact O-N 3.14Å; S559-S561 VanDerWaalsContact O-N 3.14Å
562	M	26.2	Very low	25	Very low	161 Å²	161	141.3 Å²	141.3	79%	0.793	78%	0.778	S	S	*	*			trans	-107.5	110.1	174.5	-84.7	-73.5	172.8	0	0	109.4	I560	I560-M562 HydrophobicContact CG2-CE 3.94Å; I560-M562 HydrophobicContact CG2-CG 4.07Å
563	P	29.3	Very low	25.1	Very low	105 Å²	105	140.6 Å²	140.6	68%	0.682	78%	0.779	S	S	*	*			trans	-79.7	160.8	174.9	33.3	-34.4	0	0	0	111.8
564	N	23.6	Very low	25.1	Very low	168 Å²	168	138.4 Å²	138.4	90%	0.898	78%	0.78	S	S	*	*			trans	-59.6	135.7	177.2	-65.5	-41.9	0	0	0	112.3
565	V	30.5	Very low	25.1	Very low	122 Å²	122	140.9 Å²	140.9	74%	0.739	79%	0.788	S	S	*	*			trans	-126.1	102.9	159.7	-178.5	0	0	0	0	108.4	Q567	V565-Q567 HydrophobicContact CG1-CG 4.15Å
566	A	22.7	Very low	25.4	Very low	95 Å²	95	136.2 Å²	136.2	79%	0.785	78%	0.778	S	S	*	*			trans	-82.5	126.5	163.3	0	0	0	0	0	108.5
567	Q	28.5	Very low	25.4	Very low	172 Å²	172	132.7 Å²	132.7	80%	0.804	78%	0.778	S	S	*	*			trans	-103.4	103.8	168.7	-75.2	-168.4	-16.7	0	0	110	V565 I569	V565-Q567 HydrophobicContact CG1-CG 4.15Å; Q567-I569 PolarHBondContact O-N 3.47Å
568	T	24	Very low	25.5	Very low	122 Å²	122	130.9 Å²	130.9	75%	0.748	77%	0.773	S	S	*	*			trans	-69.1	116.1	167.1	-56	0	0	0	0	109	T570	T568-T570 PolarHBondContact O-N 2.74Å
569	I	25.7	Very low	25.6	Very low	147 Å²	147	130.2 Å²	130.2	75%	0.754	78%	0.775	S	S	*	*			trans	-81.6	99.2	170.3	-60.6	178.2	0	0	0	108.2	Q567 L571	Q567-I569 PolarHBondContact O-N 3.47Å; I569-L571 PolarHBondContact O-N 2.92Å
570	T	23.4	Very low	25.8	Very low	109 Å²	109	131.1 Å²	131.1	67%	0.669	78%	0.776	S	S	*	*			trans	-79.4	106.6	173.1	-54.6	0	0	0	0	109.8	T568 T572	T568-T570 PolarHBondContact O-N 2.74Å; T570-T572 PolarHBondContact O-N 3.36Å
571	L	22.7	Very low	25.9	Very low	155 Å²	155	130.6 Å²	130.6	81%	0.812	78%	0.779	S	S	*	*			trans	-80.7	108.8	170.8	-74.5	167.7	0	0	0	110.2	I569	I569-L571 PolarHBondContact O-N 2.92Å
572	T	27.2	Very low	26.3	Very low	131 Å²	131	130.6 Å²	130.6	80%	0.804	78%	0.775	S	S	*	*			trans	-92.8	128.5	166.2	38.5	0	0	0	0	110.3	T570	T570-T572 PolarHBondContact O-N 3.36Å
573	T	23.5	Very low	26.6	Very low	131 Å²	131	129.4 Å²	129.4	80%	0.804	78%	0.777	S	S	*	*			trans	-104.2	122.2	-175	52.5	0	0	0	0	112.4
574	T	29.8	Very low	26.8	Very low	146 Å²	146	128.2 Å²	128.2	90%	0.896	77%	0.768	S	S	*	*			trans	-136	149.2	155.2	37.4	0	0	0	0	110.3
575	S	26.3	Very low	27.2	Very low	106 Å²	106	124.3 Å²	124.3	74%	0.741	75%	0.753	S	S	*	*			trans	-68	165.4	180	56.8	0	0	0	0	111.8
576	T	27	Very low	27.2	Very low	118 Å²	118	124.6 Å²	124.6	72%	0.724	75%	0.75	S	S	*	*			cis	-162.5	175.3	33.3	-31.7	0	0	0	0	111.8
577	T	28.2	Very low	27.7	Very low	137 Å²	137	125.3 Å²	125.3	84%	0.84	74%	0.74	S	S	*	*			trans	76.3	144.6	169.2	67.1	0	0	0	0	118.3
578	V	23.2	Very low	27.9	Very low	128 Å²	128	121.8 Å²	121.8	78%	0.776	73%	0.727	S	S	*	*			trans	-127.9	129.4	-172.2	173.7	0	0	0	0	109.1	T580	V578-T580 HydrophobicContact CG1-CG2 4.49Å
579	T	27.6	Very low	28.4	Very low	137 Å²	137	119.6 Å²	119.6	84%	0.84	71%	0.714	S	S	*	*			trans	-138.2	136	158	33.2	0	0	0	0	109.1
580	T	25.5	Very low	28.7	Very low	131 Å²	131	117.1 Å²	117.1	80%	0.804	70%	0.701	S	S	*	*			trans	-94.9	109.8	-169.3	48.2	0	0	0	0	111.9	V578	V578-T580 HydrophobicContact CG1-CG2 4.49Å
581	T	28	Very low	29.4	Very low	117 Å²	117	118.3 Å²	118.3	72%	0.718	70%	0.699	S	S	*	*			trans	-144.8	116.4	172.2	1.5	0	0	0	0	113.8
582	T	30.5	Very low	30	Very low	104 Å²	104	113.4 Å²	113.4	64%	0.638	68%	0.678	S	S	*	*			trans	57.6	117.9	146.2	49.8	0	0	0	0	120.7	T584	T582-T584 PolarHBondContact O-N 3Å; T582-T584 VanDerWaalsContact O-N 3.1Å
583	T	30.9	Very low	30.5	Very low	136 Å²	136	111.1 Å²	111.1	83%	0.834	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-0.7	170.9	35.5	0	0	0	0	115.9	S585	T583-S585 VanDerWaalsContact C-N 3.27Å; T583-S585 PolarHBondContact O-N 3.2Å
584	T	33.3	Very low	31.2	Very low	81 Å²	81	109 Å²	109	50%	0.497	65%	0.647	S	S	.	*	H	α-helix	trans	-68.1	-21.1	-175.3	-16.4	0	0	0	0	114.3	T582 L586	T582-T584 PolarHBondContact O-N 3Å; T582-T584 VanDerWaalsContact O-N 3.1Å; T584-L586 PolarHBondContact O-N 3.43Å
585	S	33.1	Very low	31.4	Very low	85 Å²	85	107.3 Å²	107.3	59%	0.594	63%	0.629	S	S	*	*	H	α-helix	trans	-63	-42.2	-177.2	-173	0	0	0	0	113.1	T583 L587 N588 T589	T583-S585 VanDerWaalsContact C-N 3.27Å; T583-S585 PolarHBondContact O-N 3.2Å; S585-L587 PolarHBondContact O-N 2.88Å; S585-N588 PolarHBondContact O-N 3.13Å; S585-T589 PolarHBondContact O-N 2.71Å; S585-T589 PolarHBondContact O-OG1 2.71Å
586	L	30.9	Very low	31.9	Very low	129 Å²	129	106.8 Å²	106.8	68%	0.675	62%	0.618	S	S	*	*	H	α-helix	trans	-67.9	-36	-174	-125.8	77.5	0	0	0	113.1	T584 T589 I590	T584-L586 PolarHBondContact O-N 3.43Å; L586-T589 PolarHBondContact O-N 2.92Å; L586-I590 WeakPolarHBondContact O-CG1 3.38Å; L586-I590 PolarHBondContact O-N 3.36Å
587	L	31.9	Very low	32.3	Very low	110 Å²	110	108.5 Å²	108.5	58%	0.576	61%	0.613	S	S	*	*	H	α-helix	trans	-64.2	-46	179.2	-83.5	162.1	0	0	0	111.4	S585 T589 I590 E591	S585-L587 PolarHBondContact O-N 2.88Å; L587-T589 PolarHBondContact O-N 3.37Å; L587-I590 WeakPolarHBondContact O-CA 3.47Å; L587-I590 PolarHBondContact O-N 3.25Å; L587-E591 PolarHBondContact O-N 3.22Å
588	N	33.9	Very low	32.5	Very low	97 Å²	97	108 Å²	108	52%	0.519	60%	0.596	S	S	.	*	H	α-helix	trans	-62	-29.3	178.2	-62.8	7.6	0	0	0	112.3	S585 S592	S585-N588 PolarHBondContact O-N 3.13Å; N588-S592 WeakPolarHBondContact O-CB 3.37Å; N588-S592 PolarHBondContact O-N 3.24Å; N588-S592 VanDerWaalsContact O-N 3.11Å; N588-S592 PolarHBondContact O-OG 2.83Å
589	T	34	Very low	33.1	Very low	77 Å²	77	106 Å²	106	47%	0.472	58%	0.577	S	S	.	*	H	α-helix	trans	-72.1	-33.6	172.8	-48.3	0	0	0	0	112.5	S585 L586 L587 S592 T593	S585-T589 PolarHBondContact O-N 2.71Å; S585-T589 PolarHBondContact O-OG1 2.71Å; L586-T589 PolarHBondContact O-N 2.92Å; L587-T589 PolarHBondContact O-N 3.37Å; T589-S592 PolarHBondContact O-OG 3.24Å; T589-T593 WeakPolarHBondContact O-CB 3.35Å; T589-T593 WeakPolarHBondContact O-CG2 3.24Å; T589-T593 PolarHBondContact O-N 2.61Å; T589-T593 VanDerWaalsContact O-N 3.17Å; T589-T593 PolarHBondContact O-OG1 3.4Å
590	I	32.7	Very low	33.4	Very low	94 Å²	94	103.6 Å²	103.6	48%	0.482	57%	0.566	S	S	.	*	H	α-helix	trans	-75.9	-36.5	176.4	-66	166.7	0	0	0	111.3	L586 L587 T593 N594	L586-I590 WeakPolarHBondContact O-CG1 3.38Å; L586-I590 PolarHBondContact O-N 3.36Å; L587-I590 WeakPolarHBondContact O-CA 3.47Å; L587-I590 PolarHBondContact O-N 3.25Å; I590-T593 WeakPolarHBondContact CA-OG1 3.48Å; I590-T593 PolarHBondContact O-OG1 3.14Å; I590-T593 VanDerWaalsContact O-OG1 3.14Å; I590-N594 PolarHBondContact O-N 2.92Å; I590-N594 PolarHBondContact O-ND2 3.25Å
591	E	36.5	Very low	33.8	Very low	134 Å²	134	101.5 Å²	101.5	63%	0.626	55%	0.549	S	S	*	.	H	α-helix	trans	-67.4	-47.3	174.1	-68.9	-170.5	142.3	0	0	111.7	L587 T593 N594 E595	L587-E591 PolarHBondContact O-N 3.22Å; E591-T593 PolarHBondContact O-N 2.87Å; E591-N594 PolarHBondContact O-N 3.4Å; E591-E595 PolarHBondContact O-N 2.93Å
592	S	36.4	Very low	34.2	Very low	53 Å²	53	102.5 Å²	102.5	37%	0.371	55%	0.55	S	S	.	.	H	α-helix	trans	-68.8	-28.9	-179.2	54.8	0	0	0	0	114.2	N588 T589 N596	N588-S592 WeakPolarHBondContact O-CB 3.37Å; N588-S592 PolarHBondContact O-N 3.24Å; N588-S592 VanDerWaalsContact O-N 3.11Å; N588-S592 PolarHBondContact O-OG 2.83Å; T589-S592 PolarHBondContact O-OG 3.24Å; S592-N596 WeakPolarHBondContact O-CB 3.33Å; S592-N596 PolarHBondContact O-N 2.93Å; S592-N596 VanDerWaalsContact O-N 3.12Å; S592-N596 PolarHBondContact O-ND2 3.18Å
593	T	37.7	Very low	34.2	Very low	83 Å²	83	103.5 Å²	103.5	51%	0.509	55%	0.551	S	S	.	*	H	α-helix	trans	-70.7	-40.8	172	42.8	0	0	0	0	112	T589 I590 E591 N596 Y597	T589-T593 WeakPolarHBondContact O-CB 3.35Å; T589-T593 WeakPolarHBondContact O-CG2 3.24Å; T589-T593 PolarHBondContact O-N 2.61Å; T589-T593 VanDerWaalsContact O-N 3.17Å; T589-T593 PolarHBondContact O-OG1 3.4Å; I590-T593 WeakPolarHBondContact CA-OG1 3.48Å; I590-T593 PolarHBondContact O-OG1 3.14Å; I590-T593 VanDerWaalsContact O-OG1 3.14Å; E591-T593 PolarHBondContact O-N 2.87Å; T593-N596 PolarHBondContact O-N 2.78Å; T593-Y597 PolarHBondContact O-N 2.94Å
594	N	37.5	Very low	34.1	Very low	86 Å²	86	102.6 Å²	102.6	46%	0.46	54%	0.54	S	S	.	.	H	α-helix	trans	-64.8	-42.8	172.7	-78.9	-59.4	0	0	0	112.4	I590 E591 N596 Y597 Y598	I590-N594 PolarHBondContact O-N 2.92Å; I590-N594 PolarHBondContact O-ND2 3.25Å; E591-N594 PolarHBondContact O-N 3.4Å; N594-N596 VanDerWaalsContact C-N 3.31Å; N594-N596 PolarHBondContact O-N 3.13Å; N594-Y597 WeakPolarHBondContact O-CB 3.1Å; N594-Y597 PolarHBondContact O-N 3.41Å; N594-Y597 VanDerWaalsContact O-N 3.15Å; N594-Y598 WeakPolarHBondContact O-CD2 3.02Å; N594-Y598 PolarHBondContact O-N 3.22Å; N594-Y598 VanDerWaalsContact O-N 3.09Å
595	E	35.2	Very low	33.8	Very low	110 Å²	110	103.9 Å²	103.9	51%	0.514	55%	0.552	S	S	.	*	H	α-helix	trans	-64.9	-36.4	179.7	-149.8	-155.6	-163.5	0	0	112	E591 Y598 K599	E591-E595 PolarHBondContact O-N 2.93Å; E595-Y598 PolarHBondContact O-N 3.43Å; E595-K599 WeakPolarHBondContact O-CB 3.15Å; E595-K599 WeakPolarHBondContact O-CG 3.35Å; E595-K599 PolarHBondContact O-N 2.91Å; E595-K599 IonicContact OE1-NZ 2.78Å; E595-K599 PolarHBondContact OE1-NZ 2.76Å; E595-K599 IonicContact OE2-NZ 3.55Å; E595-K599 PolarHBondContact OE2-NZ 3.08Å
596	N	35.3	Very low	33.4	Very low	96 Å²	96	104.8 Å²	104.8	51%	0.513	56%	0.559	S	S	.	*	H	α-helix	trans	-69.8	-32.1	173.2	-77.3	-48.3	0	0	0	113.1	S592 T593 N594 K599 S600	S592-N596 WeakPolarHBondContact O-CB 3.33Å; S592-N596 PolarHBondContact O-N 2.93Å; S592-N596 VanDerWaalsContact O-N 3.12Å; S592-N596 PolarHBondContact O-ND2 3.18Å; T593-N596 PolarHBondContact O-N 2.78Å; N594-N596 VanDerWaalsContact C-N 3.31Å; N594-N596 PolarHBondContact O-N 3.13Å; N596-K599 PolarHBondContact O-N 2.83Å; N596-S600 WeakPolarHBondContact O-CB 3.43Å; N596-S600 PolarHBondContact O-N 3.17Å
597	Y	35.2	Very low	33.2	Very low	154 Å²	154	107.7 Å²	107.7	60%	0.604	56%	0.562	S	S	*	*	H	α-helix	trans	-62.7	-44.8	172	-172.5	-98.7	0	0	0	111.6	T593 N594 S600 L601	T593-Y597 PolarHBondContact O-N 2.94Å; N594-Y597 WeakPolarHBondContact O-CB 3.1Å; N594-Y597 PolarHBondContact O-N 3.41Å; N594-Y597 VanDerWaalsContact O-N 3.15Å; Y597-S600 WeakPolarHBondContact O-CB 3.39Å; Y597-S600 PolarHBondContact O-N 3.26Å; Y597-L601 HydrophobicContact CD1-CD1 4.09Å; Y597-L601 HydrophobicContact CE1-CD1 3.74Å; Y597-L601 PolarHBondContact O-N 2.79Å
598	Y	33.3	Very low	32.8	Very low	125 Å²	125	107.6 Å²	107.6	49%	0.49	57%	0.571	S	S	.	*	H	α-helix	trans	-67.4	-38.1	174.2	-77.1	-69.3	0	0	0	113.2	N594 E595 S600 L601 L602	N594-Y598 WeakPolarHBondContact O-CD2 3.02Å; N594-Y598 PolarHBondContact O-N 3.22Å; N594-Y598 VanDerWaalsContact O-N 3.09Å; E595-Y598 PolarHBondContact O-N 3.43Å; Y598-S600 VanDerWaalsContact C-N 3.34Å; Y598-S600 PolarHBondContact O-N 3.13Å; Y598-L601 PolarHBondContact O-N 3.39Å; Y598-L602 WeakPolarHBondContact O-CG 3.46Å; Y598-L602 PolarHBondContact O-N 2.87Å
599	K	35.2	Very low	32.6	Very low	87 Å²	87	107.5 Å²	107.5	38%	0.378	58%	0.575	S	S	.	*	H	α-helix	trans	-63.9	-37.2	173.4	-75.2	166.6	177.7	168.3	0	112.2	E595 N596 L602 N603	E595-K599 WeakPolarHBondContact O-CB 3.15Å; E595-K599 WeakPolarHBondContact O-CG 3.35Å; E595-K599 PolarHBondContact O-N 2.91Å; E595-K599 IonicContact OE1-NZ 2.78Å; E595-K599 PolarHBondContact OE1-NZ 2.76Å; E595-K599 IonicContact OE2-NZ 3.55Å; E595-K599 PolarHBondContact OE2-NZ 3.08Å; N596-K599 PolarHBondContact O-N 2.83Å; K599-L602 PolarHBondContact O-N 3.3Å; K599-N603 WeakPolarHBondContact O-CB 3.32Å; K599-N603 PolarHBondContact O-N 3.19Å
600	S	34.9	Very low	32.2	Very low	87 Å²	87	111.7 Å²	111.7	61%	0.608	59%	0.594	S	S	*	*	H	α-helix	trans	-59.9	-45	174	-174.2	0	0	0	0	112.2	N596 Y597 Y598 L602	N596-S600 WeakPolarHBondContact O-CB 3.43Å; N596-S600 PolarHBondContact O-N 3.17Å; Y597-S600 WeakPolarHBondContact O-CB 3.39Å; Y597-S600 PolarHBondContact O-N 3.26Å; Y598-S600 VanDerWaalsContact C-N 3.34Å; Y598-S600 PolarHBondContact O-N 3.13Å; S600-L602 VanDerWaalsContact C-N 3.28Å; S600-L602 PolarHBondContact O-N 2.7Å
601	L	33.9	Very low	32.3	Very low	87 Å²	87	112.2 Å²	112.2	46%	0.455	59%	0.594	S	S	.	*	H	α-helix	trans	-68	-23.6	177.4	-72.1	168.3	0	0	0	113.9	Y597 Y598	Y597-L601 HydrophobicContact CD1-CD1 4.09Å; Y597-L601 HydrophobicContact CE1-CD1 3.74Å; Y597-L601 PolarHBondContact O-N 2.79Å; Y598-L601 PolarHBondContact O-N 3.39Å
602	L	35.6	Very low	32.1	Very low	138 Å²	138	110 Å²	110	72%	0.723	59%	0.586	S	S	*	*	H	α-helix	trans	-98.4	-25.8	-177.3	-69.4	169.8	0	0	0	114.1	Y598 K599 S600 L604	Y598-L602 WeakPolarHBondContact O-CG 3.46Å; Y598-L602 PolarHBondContact O-N 2.87Å; K599-L602 PolarHBondContact O-N 3.3Å; S600-L602 VanDerWaalsContact C-N 3.28Å; S600-L602 PolarHBondContact O-N 2.7Å; L602-L604 PolarHBondContact O-N 2.98Å
603	N	30.1	Very low	32.2	Very low	124 Å²	124	110.9 Å²	110.9	66%	0.663	59%	0.59	S	S	*	*			trans	-83.1	18.4	-178.3	-82.6	-5.6	0	0	0	114.8	K599 S605	K599-N603 WeakPolarHBondContact O-CB 3.32Å; K599-N603 PolarHBondContact O-N 3.19Å; N603-S605 PolarHBondContact O-N 2.78Å
604	L	30.1	Very low	32.7	Very low	117 Å²	117	107.8 Å²	107.8	61%	0.613	57%	0.57	S	S	*	*			trans	-74.9	38.1	167.9	-81.5	164.1	0	0	0	112.6	L602 S606 Y607	L602-L604 PolarHBondContact O-N 2.98Å; L604-S606 PolarHBondContact O-N 2.93Å; L604-Y607 PolarHBondContact O-N 2.7Å
605	S	25.6	Very low	33	Very low	108 Å²	108	108.8 Å²	108.8	76%	0.755	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	53.4	-177.3	64.2	0	0	0	0	112.9	N603	N603-S605 PolarHBondContact O-N 2.78Å
606	S	26.3	Very low	33	Very low	104 Å²	104	109.7 Å²	109.7	73%	0.727	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-161.3	-15.9	174.9	55.9	0	0	0	0	114	L604	L604-S606 PolarHBondContact O-N 2.93Å
607	Y	25.2	Very low	33.2	Very low	190 Å²	190	109.9 Å²	109.9	75%	0.745	57%	0.569	S	S	*	*	S	Bend	trans	-114.9	144.3	172.4	-81.9	-96.6	0	0	0	110.7	L604	L604-Y607 PolarHBondContact O-N 2.7Å
608	S	25.1	Very low	34	Very low	108 Å²	108	102.9 Å²	102.9	76%	0.755	54%	0.542	S	S	*	.			trans	-53.1	132.3	172.4	-172.4	0	0	0	0	109.3	L610	S608-L610 PolarHBondContact O-N 2.96Å
609	P	28.2	Very low	34.4	Very low	95 Å²	95	103.2 Å²	103.2	62%	0.617	55%	0.548	S	S	*	.			trans	-59.7	112.3	-169.9	23	-33.7	0	0	0	110.1	H611	P609-H611 PolarHBondContact O-N 3.5Å
610	L	26.7	Very low	34.5	Very low	166 Å²	166	105 Å²	105	87%	0.869	56%	0.561	S	S	*	*			trans	-58.5	107.5	171.4	-89.4	164.1	0	0	0	107.3	S608 I612	S608-L610 PolarHBondContact O-N 2.96Å; L610-I612 PolarHBondContact O-N 3.35Å
611	H	33.8	Very low	35	Very low	105 Å²	105	101.5 Å²	101.5	49%	0.486	54%	0.536	S	S	.	.			trans	-74.5	80	-172.3	-165.5	57.6	0	0	0	109	P609 P613	P609-H611 PolarHBondContact O-N 3.5Å; H611-P613 VanDerWaalsContact O-CD 3.24Å; H611-P613 WeakPolarHBondContact O-CD 3.5Å; H611-P613 VanDerWaalsContact O-N 3.11Å
612	I	33.1	Very low	35.5	Very low	88 Å²	88	100.6 Å²	100.6	45%	0.451	53%	0.532	S	S	.	.			trans	-53.3	115.8	169.6	-60.3	175.1	0	0	0	106	L610 I614 M617	L610-I612 PolarHBondContact O-N 3.35Å; I612-I614 PolarHBondContact O-N 3.09Å; I612-M617 HydrophobicContact CB-CE 4.49Å; I612-M617 HydrophobicContact CD1-CE 4.28Å; I612-M617 HydrophobicContact CG2-CE 4.14Å; I612-M617 HydrophobicContact CG2-CG 4.46Å
613	P	38.2	Very low	35.7	Very low	70 Å²	70	98.9 Å²	98.9	46%	0.455	52%	0.524	S	S	.	.			trans	-58	130.2	-176.8	-25.8	35.5	0	0	0	109.5	H611 R615 F616	H611-P613 VanDerWaalsContact O-CD 3.24Å; H611-P613 WeakPolarHBondContact O-CD 3.5Å; H611-P613 VanDerWaalsContact O-N 3.11Å; P613-R615 PolarHBondContact O-N 3.3Å; P613-R615 VanDerWaalsContact O-N 3.13Å; P613-F616 WeakPolarHBondContact O-CB 3.38Å; P613-F616 PolarHBondContact O-N 3.44Å
614	I	47.4	Very low	36.2	Very low	18 Å²	18	95.5 Å²	95.5	9%	0.092	50%	0.504	C	S	.	.	H	α-helix	trans	-56.1	-36	-177.6	-67.2	174.2	0	0	0	109.6	L154 E158 I612 F616 M617 R618	L154-I614 HydrophobicContact CD1-CB 4.35Å; L154-I614 HydrophobicContact CD1-CG2 4.1Å; E158-I614 HydrophobicContact CG-CB 4.46Å; E158-I614 PolarHBondContact OE1-N 3.27Å; I612-I614 PolarHBondContact O-N 3.09Å; I614-F616 VanDerWaalsContact C-N 3.27Å; I614-F616 PolarHBondContact O-N 3.22Å; I614-M617 PolarHBondContact O-N 3.36Å; I614-R618 HydrophobicContact CG2-CG 4.41Å; I614-R618 WeakPolarHBondContact O-CG 3.4Å; I614-R618 PolarHBondContact O-N 2.9Å; I614-R618 VanDerWaalsContact O-N 3.11Å
615	R	43.7	Very low	36.5	Very low	108 Å²	108	92.7 Å²	92.7	41%	0.408	49%	0.494	S	S	.	.	H	α-helix	trans	-48.6	-39.1	169.6	-167.6	-178.8	-159.5	116.2	1.9	114.7	E158 P613 R618 Q619	E158-R615 VanDerWaalsContact OE1-CB 3.29Å; E158-R615 WeakPolarHBondContact OE1-CB 3.34Å; E158-R615 PolarHBondContact OE1-N 3.3Å; P613-R615 PolarHBondContact O-N 3.3Å; P613-R615 VanDerWaalsContact O-N 3.13Å; R615-R618 PolarHBondContact O-N 3.44Å; R615-Q619 WeakPolarHBondContact O-CG 3.33Å; R615-Q619 PolarHBondContact O-N 2.96Å
616	F	35.1	Very low	36.9	Very low	128 Å²	128	94.9 Å²	94.9	56%	0.561	49%	0.49	S	S	*	.	H	α-helix	trans	-71	-37	-178.9	-171.7	-96	0	0	0	112.1	P613 I614	P613-F616 WeakPolarHBondContact O-CB 3.38Å; P613-F616 PolarHBondContact O-N 3.44Å; I614-F616 VanDerWaalsContact C-N 3.27Å; I614-F616 PolarHBondContact O-N 3.22Å
617	M	40.9	Very low	37.5	Very low	100 Å²	100	92.6 Å²	92.6	49%	0.493	47%	0.467	S	S	.	.	H	α-helix	trans	-68	-38.6	172.4	-66.9	-172.6	177.6	0	0	111.6	W232 I612 I614	W232-M617 HydrophobicContact CH2-CB 3.84Å; W232-M617 HydrophobicContact CZ2-CB 4.44Å; I612-M617 HydrophobicContact CB-CE 4.49Å; I612-M617 HydrophobicContact CD1-CE 4.28Å; I612-M617 HydrophobicContact CG2-CE 4.14Å; I612-M617 HydrophobicContact CG2-CG 4.46Å; I614-M617 PolarHBondContact O-N 3.36Å
618	R	51	Low	38.2	Very low	8 Å²	8	87.5 Å²	87.5	3%	0.03	45%	0.45	C	S	.	.	H	α-helix	trans	-68.9	-38.2	179.7	-68	-178.4	-169.1	-155.4	2.3	113.9	E196 W232 Y233 E260 I614 R615 N620 T621	E196-R618 WeakPolarHBondContact OE1-CD 3.24Å; E196-R618 IonicContact OE1-CZ 2.78Å; E196-R618 IonicContact OE1-NE 2.71Å; E196-R618 IonicContact OE1-NH1 3.64Å; E196-R618 PolarHBondContact OE1-NH1 3.4Å; E196-R618 IonicContact OE2-NH1 2.69Å; E196-R618 PolarHBondContact OE2-NH1 3.49Å; W232-R618 HydrophobicContact CE3-CG 3.96Å; W232-R618 HydrophobicContact CH2-CG 3.58Å; W232-R618 HydrophobicContact CZ2-CG 4.49Å; W232-R618 HydrophobicContact CZ3-CG 3.26Å; Y233-R618 PolarHBondContact OH-NH1 2.97Å; Y233-R618 PolarHBondContact OH-NH2 2.92Å; E260-R618 IonicContact OE1-CZ 2.71Å; E260-R618 IonicContact OE1-NH2 2.66Å; E260-R618 PolarHBondContact OE1-NH2 3.46Å; E260-R618 IonicContact OE2-CZ 2.91Å; E260-R618 IonicContact OE2-NH2 2.62Å; E260-R618 PolarHBondContact OE2-NH2 3.22Å; I614-R618 HydrophobicContact CG2-CG 4.41Å; I614-R618 WeakPolarHBondContact O-CG 3.4Å; I614-R618 PolarHBondContact O-N 2.9Å; I614-R618 VanDerWaalsContact O-N 3.11Å; R615-R618 PolarHBondContact O-N 3.44Å; R618-N620 PolarHBondContact O-N 3.15Å; R618-N620 VanDerWaalsContact O-N 3.1Å; R618-T621 PolarHBondContact O-N 3.05Å; R618-T621 PolarHBondContact O-OG1 3.19Å
619	Q	41.9	Very low	38.6	Very low	132 Å²	132	87.6 Å²	87.6	62%	0.617	44%	0.438	S	S	*	.	H	α-helix	trans	-62.1	-22.3	-175.8	-80.9	-180	-47.4	0	0	113.9	R615	R615-Q619 WeakPolarHBondContact O-CG 3.33Å; R615-Q619 PolarHBondContact O-N 2.96Å
620	N	37.2	Very low	39	Very low	124 Å²	124	89.9 Å²	89.9	66%	0.663	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-3.4	177.4	-63.5	-40.2	0	0	0	114.1	R618	R618-N620 PolarHBondContact O-N 3.15Å; R618-N620 VanDerWaalsContact O-N 3.1Å
621	T	45.6	Very low	39.5	Very low	13 Å²	13	85.8 Å²	85.8	8%	0.08	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-24.7	-179.2	56.6	0	0	0	0	114.4	R231 W232 R618 D623	R231-T621 PolarHBondContact NH2-O 3.14Å; W232-T621 HydrophobicContact CZ2-CG2 3.83Å; R618-T621 PolarHBondContact O-N 3.05Å; R618-T621 PolarHBondContact O-OG1 3.19Å; T621-D623 VanDerWaalsContact C-N 3.3Å; T621-D623 PolarHBondContact O-N 2.75Å
622	D	44.2	Very low	39.7	Very low	68 Å²	68	86.1 Å²	86.1	36%	0.364	42%	0.416	S	S	.	.			trans	-91.2	42.1	-173.3	-72.4	-15.9	0	0	0	112.7	T230 H624	T230-D622 WeakPolarHBondContact CA-OD1 3.47Å; T230-D622 WeakPolarHBondContact CG2-OD1 3.41Å; T230-D622 PolarHBondContact OG1-OD1 3.29Å; T230-D622 PolarHBondContact OG1-OD2 3.44Å; D622-H624 PolarHBondContact O-N 3.1Å
623	D	40.2	Very low	39.7	Very low	103 Å²	103	87.3 Å²	87.3	55%	0.551	42%	0.423	S	S	*	.			trans	-72.2	78.9	177.3	-166.3	-3.4	0	0	0	111.8	T621 S625	T621-D623 VanDerWaalsContact C-N 3.3Å; T621-D623 PolarHBondContact O-N 2.75Å; D623-S625 PolarHBondContact O-N 3.48Å; D623-S625 VanDerWaalsContact O-N 3.17Å; D623-S625 WeakPolarHBondContact OD1-CB 3.41Å; D623-S625 PolarHBondContact OD1-N 3.23Å; D623-S625 VanDerWaalsContact OD1-N 3.16Å
624	H	41.4	Very low	39.4	Very low	53 Å²	53	86.9 Å²	86.9	25%	0.245	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-14.7	178.6	-115	-61.3	0	0	0	113.3	D622 F626 Q628	D622-H624 PolarHBondContact O-N 3.1Å; H624-F626 PolarHBondContact O-N 2.91Å; H624-Q628 WeakPolarHBondContact O-CG 3.47Å; H624-Q628 PolarHBondContact O-N 3.19Å
625	S	36.4	Very low	38.9	Very low	58 Å²	58	93.6 Å²	93.6	41%	0.406	45%	0.453	S	S	.	.	H	α-helix	trans	-56.9	-50.5	-178	-173.3	0	0	0	0	111.5	D623 K627 Q628 Q629	D623-S625 PolarHBondContact O-N 3.48Å; D623-S625 VanDerWaalsContact O-N 3.17Å; D623-S625 WeakPolarHBondContact OD1-CB 3.41Å; D623-S625 PolarHBondContact OD1-N 3.23Å; D623-S625 VanDerWaalsContact OD1-N 3.16Å; S625-K627 PolarHBondContact O-N 3.36Å; S625-Q628 PolarHBondContact O-N 2.92Å; S625-Q629 PolarHBondContact O-N 2.61Å
626	F	33.7	Very low	38.5	Very low	153 Å²	153	96 Å²	96	67%	0.671	47%	0.466	S	S	*	.	H	α-helix	trans	-64.7	-46.9	-165.1	-152.8	-93.6	0	0	0	113.2	H624 Q629 Y630	H624-F626 PolarHBondContact O-N 2.91Å; F626-Q629 PolarHBondContact O-N 3.39Å; F626-Y630 WeakPolarHBondContact O-CB 3.35Å; F626-Y630 PolarHBondContact O-N 3.4Å
627	K	39.3	Very low	38.3	Very low	56 Å²	56	93.3 Å²	93.3	24%	0.243	46%	0.464	C	S	.	.	H	α-helix	trans	-78.6	-20.3	178.2	-146.2	177	-172	-177.5	0	112.9	D226 Y227 S625 N631	D226-K627 IonicContact OD1-NZ 2.74Å; D226-K627 PolarHBondContact OD1-NZ 3.29Å; D226-K627 IonicContact OD2-NZ 3.84Å; D226-K627 PolarHBondContact OD2-NZ 2.91Å; Y227-K627 HydrophobicContact CD2-CD 3.81Å; Y227-K627 HydrophobicContact CG-CD 3.79Å; S625-K627 PolarHBondContact O-N 3.36Å; K627-N631 WeakPolarHBondContact O-CB 3.49Å; K627-N631 VanDerWaalsContact O-CG 3.25Å; K627-N631 PolarHBondContact O-N 3.24Å; K627-N631 PolarHBondContact O-ND2 3.4Å
628	Q	39.1	Very low	37.8	Very low	84 Å²	84	97.7 Å²	97.7	39%	0.393	48%	0.48	S	S	.	.	H	α-helix	trans	-71.8	-45.4	167.9	-75.8	-166.6	16.7	0	0	111.6	H624 S625 Y630 N631 Q632	H624-Q628 WeakPolarHBondContact O-CG 3.47Å; H624-Q628 PolarHBondContact O-N 3.19Å; S625-Q628 PolarHBondContact O-N 2.92Å; Q628-Y630 VanDerWaalsContact C-N 3.34Å; Q628-Y630 PolarHBondContact O-N 3.45Å; Q628-N631 PolarHBondContact O-N 2.8Å; Q628-Q632 WeakPolarHBondContact O-CB 3.49Å; Q628-Q632 WeakPolarHBondContact O-CG 3.25Å; Q628-Q632 PolarHBondContact O-N 3.31Å
629	Q	33.7	Very low	36.7	Very low	109 Å²	109	102.4 Å²	102.4	51%	0.509	51%	0.51	S	S	.	.	H	α-helix	trans	-57.9	-46.8	171.2	-75.7	-173.8	-32	0	0	110.9	S625 F626 N631 Q632 L633	S625-Q629 PolarHBondContact O-N 2.61Å; F626-Q629 PolarHBondContact O-N 3.39Å; Q629-N631 PolarHBondContact O-N 2.87Å; Q629-Q632 PolarHBondContact O-N 2.71Å; Q629-L633 WeakPolarHBondContact O-CB 3.48Å; Q629-L633 VanDerWaalsContact O-CG 3.25Å; Q629-L633 WeakPolarHBondContact O-CG 3.45Å; Q629-L633 PolarHBondContact O-N 2.94Å
630	Y	35.5	Very low	36	Very low	143 Å²	143	102.4 Å²	102.4	56%	0.561	52%	0.519	S	S	*	.	H	α-helix	trans	-59.4	-43.5	176.9	-170.9	-93.4	0	0	0	112.9	F626 Q628 L633 S634	F626-Y630 WeakPolarHBondContact O-CB 3.35Å; F626-Y630 PolarHBondContact O-N 3.4Å; Q628-Y630 VanDerWaalsContact C-N 3.34Å; Q628-Y630 PolarHBondContact O-N 3.45Å; Y630-L633 PolarHBondContact O-N 2.88Å; Y630-S634 VanDerWaalsContact O-CB 3.24Å; Y630-S634 WeakPolarHBondContact O-CB 3.23Å; Y630-S634 PolarHBondContact O-N 2.89Å
631	N	37.6	Very low	35.5	Very low	80 Å²	80	103.1 Å²	103.1	43%	0.428	52%	0.521	S	S	.	.	H	α-helix	trans	-69.7	-36.1	178.1	-75.7	-20.3	0	0	0	112.7	K627 Q628 Q629 S634 Q635	K627-N631 WeakPolarHBondContact O-CB 3.49Å; K627-N631 VanDerWaalsContact O-CG 3.25Å; K627-N631 PolarHBondContact O-N 3.24Å; K627-N631 PolarHBondContact O-ND2 3.4Å; Q628-N631 PolarHBondContact O-N 2.8Å; Q629-N631 PolarHBondContact O-N 2.87Å; N631-S634 PolarHBondContact O-N 3.12Å; N631-Q635 WeakPolarHBondContact O-CG 3.39Å; N631-Q635 PolarHBondContact O-N 3.16Å
632	Q	38.9	Very low	34.5	Very low	112 Å²	112	110.7 Å²	110.7	52%	0.523	56%	0.555	S	S	.	*	H	α-helix	trans	-67.1	-38.3	172.6	-71.7	-179.9	14.7	0	0	111.9	Q628 Q629 K636	Q628-Q632 WeakPolarHBondContact O-CB 3.49Å; Q628-Q632 WeakPolarHBondContact O-CG 3.25Å; Q628-Q632 PolarHBondContact O-N 3.31Å; Q629-Q632 PolarHBondContact O-N 2.71Å; Q632-K636 WeakPolarHBondContact O-CB 3.41Å; Q632-K636 WeakPolarHBondContact O-CG 3.37Å; Q632-K636 PolarHBondContact O-N 3.35Å
633	L	32.6	Very low	33.8	Very low	113 Å²	113	114.6 Å²	114.6	59%	0.592	58%	0.576	S	S	*	*	H	α-helix	trans	-66	-44.3	173.5	-73.9	165.6	0	0	0	111.3	Q629 Y630 Q635 K636 S637	Q629-L633 WeakPolarHBondContact O-CB 3.48Å; Q629-L633 VanDerWaalsContact O-CG 3.25Å; Q629-L633 WeakPolarHBondContact O-CG 3.45Å; Q629-L633 PolarHBondContact O-N 2.94Å; Y630-L633 PolarHBondContact O-N 2.88Å; L633-Q635 VanDerWaalsContact C-N 3.33Å; L633-Q635 PolarHBondContact O-N 3.17Å; L633-K636 CarbonylContact O-C 3.51Å; L633-K636 PolarHBondContact O-N 3.14Å; L633-K636 VanDerWaalsContact O-N 3.11Å; L633-S637 WeakPolarHBondContact O-CB 3.36Å; L633-S637 PolarHBondContact O-N 3.19Å; L633-S637 PolarHBondContact O-OG 3.36Å
634	S	32.7	Very low	33.2	Very low	61 Å²	61	115 Å²	115	43%	0.427	58%	0.583	S	S	.	*	H	α-helix	trans	-64.2	-33.5	177.8	-177.5	0	0	0	0	113.1	Y630 N631 S637	Y630-S634 VanDerWaalsContact O-CB 3.24Å; Y630-S634 WeakPolarHBondContact O-CB 3.23Å; Y630-S634 PolarHBondContact O-N 2.89Å; N631-S634 PolarHBondContact O-N 3.12Å; S634-S637 WeakPolarHBondContact CA-OG 3.37Å; S634-S637 PolarHBondContact O-OG 3.11Å
635	Q	36.5	Very low	32.6	Very low	159 Å²	159	120.3 Å²	120.3	74%	0.743	61%	0.614	S	S	*	*	H	α-helix	trans	-74.4	-33.4	171.3	-72.3	-179.2	-1.1	0	0	112.6	N631 L633	N631-Q635 WeakPolarHBondContact O-CG 3.39Å; N631-Q635 PolarHBondContact O-N 3.16Å; L633-Q635 VanDerWaalsContact C-N 3.33Å; L633-Q635 PolarHBondContact O-N 3.17Å
636	K	35.7	Very low	32.3	Very low	158 Å²	158	128.8 Å²	128.8	69%	0.687	65%	0.652	S	S	*	*	H	α-helix	trans	-75.6	-23.2	172.9	-75	179	175.8	-178.2	0	113.5	Q632 L633 K638 T639	Q632-K636 WeakPolarHBondContact O-CB 3.41Å; Q632-K636 WeakPolarHBondContact O-CG 3.37Å; Q632-K636 PolarHBondContact O-N 3.35Å; L633-K636 CarbonylContact O-C 3.51Å; L633-K636 PolarHBondContact O-N 3.14Å; L633-K636 VanDerWaalsContact O-N 3.11Å; K636-K638 PolarHBondContact O-N 3.35Å; K636-K638 VanDerWaalsContact O-N 3.16Å; K636-T639 PolarHBondContact O-OG1 3.32Å
637	S	29.5	Very low	32.2	Very low	73 Å²	73	127.6 Å²	127.6	51%	0.51	65%	0.651	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.7	27.4	-178.9	72.8	0	0	0	0	114	L633 S634	L633-S637 WeakPolarHBondContact O-CB 3.36Å; L633-S637 PolarHBondContact O-N 3.19Å; L633-S637 PolarHBondContact O-OG 3.36Å; S634-S637 WeakPolarHBondContact CA-OG 3.37Å; S634-S637 PolarHBondContact O-OG 3.11Å
638	K	31.8	Very low	31.9	Very low	191 Å²	191	131.3 Å²	131.3	83%	0.83	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	1.8	162	-82	-167.6	172	-173.3	0	113.1	K636	K636-K638 PolarHBondContact O-N 3.35Å; K636-K638 VanDerWaalsContact O-N 3.16Å
639	T	27.8	Very low	31.5	Very low	108 Å²	108	133.9 Å²	133.9	66%	0.663	69%	0.688	S	S	*	*	S	Bend	trans	-84.5	127.8	170	-42.6	0	0	0	0	110.1	K636 I641	K636-T639 PolarHBondContact O-OG1 3.32Å; T639-I641 PolarHBondContact O-N 2.85Å; T639-I641 VanDerWaalsContact O-N 3.14Å
640	T	26.4	Very low	31.3	Very low	132 Å²	132	135.4 Å²	135.4	81%	0.81	70%	0.699	S	S	*	*			trans	-62.8	110.8	179.7	-52	0	0	0	0	111.6
641	I	27.5	Very low	31.1	Very low	139 Å²	139	134.9 Å²	134.9	71%	0.713	71%	0.707	S	S	*	*			trans	-100.7	111.2	170.7	-61.7	176.6	0	0	0	108.3	T639 L643	T639-I641 PolarHBondContact O-N 2.85Å; T639-I641 VanDerWaalsContact O-N 3.14Å; I641-L643 PolarHBondContact O-N 3.25Å
642	H	24.9	Very low	30.7	Very low	171 Å²	171	138.6 Å²	138.6	79%	0.792	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-67.3	120.8	163.2	-98.8	-86.1	0	0	0	109	P644	H642-P644 WeakPolarHBondContact O-CD 3.33Å
643	L	28.4	Very low	30.1	Very low	151 Å²	151	140.5 Å²	140.5	79%	0.791	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-73.8	124.4	163.4	-80.2	155.2	0	0	0	108.6	I641	I641-L643 PolarHBondContact O-N 3.25Å
644	P	27.3	Very low	29.9	Very low	110 Å²	110	142.6 Å²	142.6	71%	0.714	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-73.7	142.7	164.8	31.8	-32.5	0	0	0	109.6	H642 I646	H642-P644 WeakPolarHBondContact O-CD 3.33Å; P644-I646 PolarHBondContact O-N 3.43Å
645	N	28.7	Very low	29.6	Very low	165 Å²	165	149.4 Å²	149.4	88%	0.882	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-67.1	131.3	179.5	-66.2	-19.9	0	0	0	111.6
646	I	31.3	Very low	29	Very low	236 Å²	236	148.5 Å²	148.5	100%	1.21	78%	0.782	S	S	*	*			trans	-135.8	0	156.7	-59.3	-177.1	0	0	0	106.3	P644	P644-I646 PolarHBondContact O-N 3.43Å

Retrieved 646 of 646 residues in 533.2 ms (Link to these results)

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