A0A3Q0KSC6_SCHMA Loading...

PKD_channel domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KSC6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 752 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	30.9	Very low	27.8	Very low	228 Å²	228	167.2 Å²	167.2	100%	1.123	84%	0.844	S	S	*	*				0	111.3	0	-91.7	169.8	130.8	0	0	106.2
2	E	30	Very low	27.6	Very low	166 Å²	166	169.6 Å²	169.6	78%	0.776	84%	0.844	S	S	*	*			trans	54.9	127.9	154.7	-61.9	168.6	178.4	0	0	117.7
3	D	30.6	Very low	27.7	Very low	145 Å²	145	164.8 Å²	164.8	78%	0.775	84%	0.837	S	S	*	*			cis	-155.6	139.6	-3.8	-99.5	-35.6	0	0	0	106.5	D5	D3-D5 PolarHBondContact O-N 3.03Å
4	A	27	Very low	27.6	Very low	89 Å²	89	167.9 Å²	167.9	74%	0.736	85%	0.847	S	S	*	*			trans	-80.5	102.2	170.6	0	0	0	0	0	108.3
5	D	30.3	Very low	27.3	Very low	163 Å²	163	164.7 Å²	164.7	87%	0.872	84%	0.839	S	S	*	*			trans	-101.4	98	167.3	-125.4	-9.2	0	0	0	110	D3 S7	D3-D5 PolarHBondContact O-N 3.03Å; D5-S7 PolarHBondContact O-N 3.06Å
6	Y	25.9	Very low	27.1	Very low	213 Å²	213	162.6 Å²	162.6	84%	0.835	84%	0.837	S	S	*	*			trans	-74.3	108.9	169	-94.2	-97.1	0	0	0	108.8
7	S	27.4	Very low	27	Very low	109 Å²	109	159.8 Å²	159.8	76%	0.762	83%	0.829	S	S	*	*			trans	-134	119	153.2	79.2	0	0	0	0	111.5	D5 K9	D5-S7 PolarHBondContact O-N 3.06Å; S7-K9 PolarHBondContact O-N 3.43Å
8	V	25.6	Very low	27	Very low	137 Å²	137	161.2 Å²	161.2	83%	0.83	84%	0.837	S	S	*	*			trans	-70.6	110.4	179.7	173.2	0	0	0	0	108.8
9	K	27.7	Very low	27.1	Very low	187 Å²	187	159.4 Å²	159.4	81%	0.813	83%	0.828	S	S	*	*			trans	-132.5	108.7	160.3	-86.2	-175.3	177.7	174.8	0	111.2	S7	S7-K9 PolarHBondContact O-N 3.43Å
10	N	26.9	Very low	26.9	Very low	152 Å²	152	158.3 Å²	158.3	81%	0.813	83%	0.829	S	S	*	*			trans	53.4	83.7	145.1	-65.4	-11.1	0	0	0	119
11	R	24	Very low	27	Very low	250 Å²	250	157.2 Å²	157.2	94%	0.943	83%	0.829	S	S	*	*			trans	-101.2	81.2	146	-83.6	-174.6	176.3	179.8	0.1	109.9
12	K	24.6	Very low	26.6	Very low	196 Å²	196	154.8 Å²	154.8	85%	0.852	82%	0.815	S	S	*	*			trans	-160.3	102.4	156.4	-92.5	-167.9	-176.5	176.9	0	108.8
13	S	29.2	Very low	26.3	Very low	108 Å²	108	157.1 Å²	157.1	76%	0.755	82%	0.823	S	S	*	*			trans	146.6	81.6	145.8	62.6	0	0	0	0	111.5	V15	S13-V15 PolarHBondContact O-N 3.05Å
14	Q	26.2	Very low	26	Very low	207 Å²	207	158.1 Å²	158.1	97%	0.967	82%	0.823	S	S	*	*			trans	-70.8	80.6	154.5	-76.5	175.6	-23.2	0	0	108
15	V	23.8	Very low	25.9	Very low	120 Å²	120	161 Å²	161	73%	0.727	83%	0.826	S	S	*	*			trans	-147.4	87.7	167.9	-178.5	0	0	0	0	108.6	S13	S13-V15 PolarHBondContact O-N 3.05Å
16	T	24.1	Very low	25.7	Very low	132 Å²	132	161.1 Å²	161.1	81%	0.81	82%	0.821	S	S	*	*			trans	170.4	131.5	157.7	8.3	0	0	0	0	104.4
17	T	25.1	Very low	25.9	Very low	114 Å²	114	155.6 Å²	155.6	70%	0.699	81%	0.814	S	S	*	*			cis	-160.6	115.6	24.4	20.8	0	0	0	0	104.8	N19	T17-N19 PolarHBondContact O-N 3.48Å
18	L	27.5	Very low	25.9	Very low	185 Å²	185	158.6 Å²	158.6	97%	0.969	82%	0.816	S	S	*	*			trans	-84.7	109.9	165.8	-104.6	147.8	0	0	0	106.9
19	N	27.4	Very low	26.3	Very low	127 Å²	127	157.6 Å²	157.6	68%	0.679	81%	0.805	S	S	*	*			trans	-53.2	139.3	-175.3	-71.5	-27.5	0	0	0	112.8	T17 V21	T17-N19 PolarHBondContact O-N 3.48Å; N19-V21 PolarHBondContact O-N 2.82Å
20	T	23	Very low	26.4	Very low	138 Å²	138	158.5 Å²	158.5	85%	0.847	81%	0.809	S	S	*	*			trans	-31.2	115.7	149.9	44	0	0	0	0	112.3
21	V	28.7	Very low	26.6	Very low	135 Å²	135	156.2 Å²	156.2	82%	0.818	80%	0.8	S	S	*	*			trans	-119.7	122.7	159.2	179	0	0	0	0	106.8	N19	N19-V21 PolarHBondContact O-N 2.82Å
22	Q	22.9	Very low	27	Very low	177 Å²	177	149.2 Å²	149.2	83%	0.827	78%	0.782	S	S	*	*			trans	-54.8	143	-176	-72.6	163	-72.9	0	0	111.9	E24	Q22-E24 VanDerWaalsContact C-N 3.31Å; Q22-E24 PolarHBondContact O-N 2.55Å
23	F	24.1	Very low	27.8	Very low	215 Å²	215	144.4 Å²	144.4	94%	0.943	77%	0.771	S	S	*	*			trans	-64.5	90.2	165.9	-70.9	-92	0	0	0	108.7
24	E	24.6	Very low	28	Very low	167 Å²	167	146.6 Å²	146.6	78%	0.78	77%	0.766	S	S	*	*			trans	-86.7	125.9	160	-82	-175.3	160	0	0	109	Q22 Q26	Q22-E24 VanDerWaalsContact C-N 3.31Å; Q22-E24 PolarHBondContact O-N 2.55Å; E24-Q26 PolarHBondContact O-N 3.32Å
25	D	24	Very low	28.6	Very low	150 Å²	150	142.9 Å²	142.9	80%	0.802	75%	0.752	S	S	*	*			trans	-46.7	102.9	-179	-75.7	-44.4	0	0	0	112.8	S27	D25-S27 PolarHBondContact O-N 3.38Å
26	Q	27.7	Very low	29.2	Very low	164 Å²	164	142.2 Å²	142.2	77%	0.766	74%	0.744	S	S	*	*			trans	-76.5	41.1	172.7	-70.9	-159.2	-14.7	0	0	113.3	E24 Q28	E24-Q26 PolarHBondContact O-N 3.32Å; Q26-Q28 PolarHBondContact O-N 3.18Å; Q26-Q28 VanDerWaalsContact O-N 3.15Å
27	S	29.1	Very low	29.7	Very low	98 Å²	98	140.2 Å²	140.2	69%	0.685	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	1	170	62.7	0	0	0	0	113.5	D25	D25-S27 PolarHBondContact O-N 3.38Å
28	Q	28.5	Very low	30.1	Very low	172 Å²	172	139.6 Å²	139.6	80%	0.804	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.9	3	-172.6	-63	-150.8	2.4	0	0	118.2	Q26 K30	Q26-Q28 PolarHBondContact O-N 3.18Å; Q26-Q28 VanDerWaalsContact O-N 3.15Å; Q28-K30 VanDerWaalsContact C-N 3.3Å; Q28-K30 PolarHBondContact O-N 3.1Å
29	L	32.3	Very low	30.3	Very low	116 Å²	116	134.4 Å²	134.4	61%	0.607	70%	0.7	S	S	*	*			trans	-93.7	56.1	171.8	-78.7	161.3	0	0	0	112.6	T31	L29-T31 HydrophobicContact CD2-CG2 3.89Å; L29-T31 PolarHBondContact O-N 3.12Å
30	K	29.7	Very low	30.7	Very low	206 Å²	206	133.9 Å²	133.9	90%	0.896	69%	0.691	S	S	*	*			trans	-73.6	61.7	155.5	-78.3	-177.2	177.5	175.2	0	109.5	Q28 N32	Q28-K30 VanDerWaalsContact C-N 3.3Å; Q28-K30 PolarHBondContact O-N 3.1Å; K30-N32 PolarHBondContact O-N 3.21Å
31	T	31.8	Very low	31.1	Very low	103 Å²	103	131.6 Å²	131.6	63%	0.632	67%	0.674	S	S	*	*			trans	-100.6	88.8	175.8	47	0	0	0	0	111	L29	L29-T31 HydrophobicContact CD2-CG2 3.89Å; L29-T31 PolarHBondContact O-N 3.12Å
32	N	33.1	Very low	31.4	Very low	104 Å²	104	129.6 Å²	129.6	56%	0.556	66%	0.658	S	S	*	*			trans	42.5	107.8	148.1	-139	-22.1	0	0	0	118.6	K30 K34 I35	K30-N32 PolarHBondContact O-N 3.21Å; N32-K34 PolarHBondContact O-N 3.1Å; N32-I35 PolarHBondContact O-N 3.04Å
33	P	39.9	Very low	31.9	Very low	94 Å²	94	124.8 Å²	124.8	61%	0.61	64%	0.641	S	S	*	*	H	α-helix	trans	-61.8	-10.9	-174.9	23.3	-33.6	0	0	0	115.8	I35 N37	P33-I35 VanDerWaalsContact C-N 3.35Å; P33-I35 PolarHBondContact O-N 3.45Å; P33-N37 WeakPolarHBondContact O-CB 3.3Å; P33-N37 PolarHBondContact O-N 2.68Å; P33-N37 VanDerWaalsContact O-N 3.11Å
34	K	35	Very low	32.3	Very low	154 Å²	154	119.3 Å²	119.3	67%	0.67	62%	0.621	S	S	*	*	H	α-helix	trans	-65.4	-33	179.3	-68.3	-174.6	180	179.7	0	113.3	N32 N38	N32-K34 PolarHBondContact O-N 3.1Å; K34-N38 WeakPolarHBondContact O-CB 3.47Å; K34-N38 PolarHBondContact O-N 3.2Å; K34-N38 VanDerWaalsContact O-N 3.07Å
35	I	37.6	Very low	32.6	Very low	129 Å²	129	117.2 Å²	117.2	66%	0.662	61%	0.611	S	S	*	*	H	α-helix	trans	-76.5	-40.1	-178.6	-60.1	171.7	0	0	0	110.8	N32 P33 N37 N38 S39	N32-I35 PolarHBondContact O-N 3.04Å; P33-I35 VanDerWaalsContact C-N 3.35Å; P33-I35 PolarHBondContact O-N 3.45Å; I35-N37 VanDerWaalsContact C-N 3.35Å; I35-N37 PolarHBondContact O-N 3.12Å; I35-N38 PolarHBondContact O-N 3.39Å; I35-S39 PolarHBondContact O-N 2.7Å
36	L	36.1	Very low	32.8	Very low	107 Å²	107	117.5 Å²	117.5	56%	0.56	61%	0.606	S	S	*	*	H	α-helix	trans	-65.3	-39.3	176.1	-158.7	81.1	0	0	0	111.5	K40	L36-K40 WeakPolarHBondContact O-CB 3.27Å; L36-K40 WeakPolarHBondContact O-CG 3.22Å; L36-K40 PolarHBondContact O-N 3.11Å
37	N	36.6	Very low	33	Very low	89 Å²	89	115.8 Å²	115.8	48%	0.476	60%	0.601	S	S	.	*	H	α-helix	trans	-68.5	-38.2	175.8	-81.7	-5.7	0	0	0	112.5	P33 I35 N41	P33-N37 WeakPolarHBondContact O-CB 3.3Å; P33-N37 PolarHBondContact O-N 2.68Å; P33-N37 VanDerWaalsContact O-N 3.11Å; I35-N37 VanDerWaalsContact C-N 3.35Å; I35-N37 PolarHBondContact O-N 3.12Å; N37-N41 WeakPolarHBondContact O-CB 3.35Å; N37-N41 PolarHBondContact O-N 2.7Å; N37-N41 PolarHBondContact O-ND2 3.03Å
38	N	32.8	Very low	33.1	Very low	102 Å²	102	121 Å²	121	55%	0.545	61%	0.606	S	S	.	*	H	α-helix	trans	-67.9	-39.3	175.7	-82.7	-4.9	0	0	0	112.3	K34 I35 N41 I42	K34-N38 WeakPolarHBondContact O-CB 3.47Å; K34-N38 PolarHBondContact O-N 3.2Å; K34-N38 VanDerWaalsContact O-N 3.07Å; I35-N38 PolarHBondContact O-N 3.39Å; N38-N41 PolarHBondContact O-N 3.18Å; N38-I42 WeakPolarHBondContact O-CB 3.43Å; N38-I42 WeakPolarHBondContact O-CD1 3.4Å; N38-I42 WeakPolarHBondContact O-CG1 3.22Å; N38-I42 PolarHBondContact O-N 2.7Å
39	S	32.3	Very low	33.1	Very low	76 Å²	76	120.3 Å²	120.3	53%	0.531	60%	0.6	S	S	.	*	H	α-helix	trans	-62.8	-46.2	174.7	177.4	0	0	0	0	112.2	I35 N41 I42 T43	I35-S39 PolarHBondContact O-N 2.7Å; S39-N41 PolarHBondContact O-N 3.35Å; S39-I42 PolarHBondContact O-N 3.13Å; S39-T43 PolarHBondContact O-N 3.15Å; S39-T43 VanDerWaalsContact O-N 3.16Å; S39-T43 PolarHBondContact O-OG1 3.32Å
40	K	34.5	Very low	33.4	Very low	115 Å²	115	117.6 Å²	117.6	50%	0.5	59%	0.59	S	S	.	*	H	α-helix	trans	-64.8	-35.9	175.2	-75.1	-179.5	177.3	-180	0	112.7	L36 T43 N44	L36-K40 WeakPolarHBondContact O-CB 3.27Å; L36-K40 WeakPolarHBondContact O-CG 3.22Å; L36-K40 PolarHBondContact O-N 3.11Å; K40-T43 WeakPolarHBondContact CA-OG1 3.4Å; K40-T43 PolarHBondContact O-OG1 3.4Å; K40-N44 VanDerWaalsContact O-CB 3.25Å; K40-N44 WeakPolarHBondContact O-CB 3.34Å; K40-N44 VanDerWaalsContact O-CG 3.28Å; K40-N44 PolarHBondContact O-N 2.92Å; K40-N44 PolarHBondContact O-ND2 3.25Å
41	N	32	Very low	34.1	Very low	90 Å²	90	112.6 Å²	112.6	48%	0.481	58%	0.581	S	S	.	*	H	α-helix	trans	-71.6	-35.9	177.6	-75.2	-14.6	0	0	0	112.2	N37 N38 S39 N44 E45	N37-N41 WeakPolarHBondContact O-CB 3.35Å; N37-N41 PolarHBondContact O-N 2.7Å; N37-N41 PolarHBondContact O-ND2 3.03Å; N38-N41 PolarHBondContact O-N 3.18Å; S39-N41 PolarHBondContact O-N 3.35Å; N41-N44 PolarHBondContact O-N 2.84Å; N41-E45 WeakPolarHBondContact O-CB 3.39Å; N41-E45 WeakPolarHBondContact O-CG 3.28Å; N41-E45 PolarHBondContact O-N 3.28Å
42	I	35	Very low	34.8	Very low	94 Å²	94	108.3 Å²	108.3	48%	0.482	56%	0.555	S	S	.	*	H	α-helix	trans	-69.5	-39.5	177.1	-67.1	162.4	0	0	0	111.3	N38 S39 K46	N38-I42 WeakPolarHBondContact O-CB 3.43Å; N38-I42 WeakPolarHBondContact O-CD1 3.4Å; N38-I42 WeakPolarHBondContact O-CG1 3.22Å; N38-I42 PolarHBondContact O-N 2.7Å; S39-I42 PolarHBondContact O-N 3.13Å; I42-K46 WeakPolarHBondContact O-CG 3.33Å; I42-K46 PolarHBondContact O-N 3.3Å
43	T	34	Very low	35.6	Very low	76 Å²	76	108.6 Å²	108.6	47%	0.466	56%	0.563	S	S	.	*	H	α-helix	trans	-67.8	-42	173.6	30.8	0	0	0	0	111.6	S39 K40 K46 L47	S39-T43 PolarHBondContact O-N 3.15Å; S39-T43 VanDerWaalsContact O-N 3.16Å; S39-T43 PolarHBondContact O-OG1 3.32Å; K40-T43 WeakPolarHBondContact CA-OG1 3.4Å; K40-T43 PolarHBondContact O-OG1 3.4Å; T43-K46 PolarHBondContact O-N 2.93Å; T43-L47 WeakPolarHBondContact O-CB 3.31Å; T43-L47 PolarHBondContact O-N 2.82Å
44	N	31.1	Very low	36.1	Very low	100 Å²	100	108.6 Å²	108.6	54%	0.535	56%	0.557	S	S	.	*	H	α-helix	trans	-66.4	-36.1	175.2	-77.8	-19.1	0	0	0	112.9	K40 N41 L47 R48	K40-N44 VanDerWaalsContact O-CB 3.25Å; K40-N44 WeakPolarHBondContact O-CB 3.34Å; K40-N44 VanDerWaalsContact O-CG 3.28Å; K40-N44 PolarHBondContact O-N 2.92Å; K40-N44 PolarHBondContact O-ND2 3.25Å; N41-N44 PolarHBondContact O-N 2.84Å; N44-L47 PolarHBondContact O-N 3.14Å; N44-R48 WeakPolarHBondContact O-CB 3.48Å; N44-R48 PolarHBondContact O-N 3.5Å
45	E	31.1	Very low	36.8	Very low	122 Å²	122	102.6 Å²	102.6	57%	0.57	53%	0.532	S	S	*	.	H	α-helix	trans	-69.9	-37	174.7	-87.3	-165.9	150.9	0	0	112.9	N41 L47 R48 K49	N41-E45 WeakPolarHBondContact O-CB 3.39Å; N41-E45 WeakPolarHBondContact O-CG 3.28Å; N41-E45 PolarHBondContact O-N 3.28Å; E45-L47 VanDerWaalsContact C-N 3.31Å; E45-R48 PolarHBondContact O-N 2.93Å; E45-K49 WeakPolarHBondContact O-CG 3.06Å; E45-K49 PolarHBondContact O-N 2.89Å
46	K	29.1	Very low	37	Very low	157 Å²	157	106.9 Å²	106.9	68%	0.683	54%	0.54	S	S	*	.	H	α-helix	trans	-67.4	-33.1	173.5	-75.6	-178	-179.7	-179.3	0	111.8	I42 T43	I42-K46 WeakPolarHBondContact O-CG 3.33Å; I42-K46 PolarHBondContact O-N 3.3Å; T43-K46 PolarHBondContact O-N 2.93Å
47	L	32.5	Very low	37.5	Very low	127 Å²	127	106.6 Å²	106.6	67%	0.665	54%	0.539	S	S	*	.	H	α-helix	trans	-78	-24.6	173.4	-82.1	156.2	0	0	0	113.8	T43 N44 E45 K49	T43-L47 WeakPolarHBondContact O-CB 3.31Å; T43-L47 PolarHBondContact O-N 2.82Å; N44-L47 PolarHBondContact O-N 3.14Å; E45-L47 VanDerWaalsContact C-N 3.31Å; L47-K49 VanDerWaalsContact C-N 3.33Å
48	R	29.7	Very low	37.9	Very low	208 Å²	208	113 Å²	113	79%	0.785	56%	0.556	S	S	*	*	H	α-helix	trans	-75	-19.1	177.5	-127.2	178.3	-178	-178.4	1.6	113.8	N44 E45 S50	N44-R48 WeakPolarHBondContact O-CB 3.48Å; N44-R48 PolarHBondContact O-N 3.5Å; E45-R48 PolarHBondContact O-N 2.93Å; R48-S50 PolarHBondContact O-N 3.4Å; R48-S50 VanDerWaalsContact O-N 3.15Å
49	K	28.9	Very low	38.5	Very low	158 Å²	158	115.1 Å²	115.1	69%	0.687	56%	0.561	S	S	*	*	S	Bend	trans	-78.8	96.5	-179.1	-71.4	174.5	-172.3	-177.6	0	108.9	E45 L47 S51	E45-K49 WeakPolarHBondContact O-CG 3.06Å; E45-K49 PolarHBondContact O-N 2.89Å; L47-K49 VanDerWaalsContact C-N 3.33Å; K49-S51 PolarHBondContact O-N 2.83Å
50	S	38.5	Very low	39.2	Very low	58 Å²	58	115.6 Å²	115.6	41%	0.406	55%	0.553	S	S	.	*			trans	-53.4	133.3	167.9	59.5	0	0	0	0	109.3	R48 V52	R48-S50 PolarHBondContact O-N 3.4Å; R48-S50 VanDerWaalsContact O-N 3.15Å; S50-V52 PolarHBondContact O-N 3.01Å
51	S	44.8	Very low	40	Very low	101 Å²	101	116.9 Å²	116.9	71%	0.706	56%	0.555	S	S	*	*	S	Bend	trans	-64.3	-6.8	-178.2	51.9	0	0	0	0	114.5	K49	K49-S51 PolarHBondContact O-N 2.83Å
52	V	45.7	Very low	41	Very low	13 Å²	13	116.7 Å²	116.7	8%	0.079	56%	0.557	C	S	.	*			trans	-108.9	124.5	-177.1	-174.9	0	0	0	0	110.6	S50 I54 L55 L365 V369	S50-V52 PolarHBondContact O-N 3.01Å; V52-I54 VanDerWaalsContact C-N 3.32Å; V52-I54 HydrophobicContact CG1-CB 4.18Å; V52-I54 PolarHBondContact O-N 2.94Å; V52-L55 HydrophobicContact CB-CB 4.36Å; V52-L55 HydrophobicContact CB-CD1 3.94Å; V52-L55 HydrophobicContact CB-CG 4.42Å; V52-L55 HydrophobicContact CG1-CD1 4.45Å; V52-L55 HydrophobicContact CG2-CD1 4.18Å; V52-L55 PolarHBondContact O-N 3.43Å; V52-L365 HydrophobicContact CG1-CD2 4.12Å; V52-V369 HydrophobicContact CG2-CG2 3.28Å
53	P	50.2	Low	42	Very low	111 Å²	111	115.6 Å²	115.6	72%	0.721	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-64.6	-30.5	-179.1	21.9	-30.4	0	0	0	113.8	L55 R56	P53-L55 VanDerWaalsContact C-N 3.31Å; P53-L55 PolarHBondContact O-N 2.84Å; P53-R56 WeakPolarHBondContact O-CB 3.3Å; P53-R56 PolarHBondContact O-N 3.25Å
54	I	50.8	Low	43.2	Very low	94 Å²	94	114 Å²	114	48%	0.482	54%	0.537	S	S	.	.	G	3₁₀ helix	trans	-66.9	-31.6	179.1	-63	163.9	0	0	0	111.7	V52 R56 F60 L365	V52-I54 VanDerWaalsContact C-N 3.32Å; V52-I54 HydrophobicContact CG1-CB 4.18Å; V52-I54 PolarHBondContact O-N 2.94Å; I54-R56 PolarHBondContact O-N 2.95Å; I54-F60 HydrophobicContact CG2-CB 4.45Å; I54-F60 HydrophobicContact CG2-CD1 4.39Å; I54-F60 HydrophobicContact CG2-CG 4.5Å; I54-F60 WeakPolarHBondContact O-CB 3.44Å; I54-L365 HydrophobicContact CD1-CD2 4.28Å
55	L	48.6	Very low	44.5	Very low	28 Å²	28	110.3 Å²	110.3	15%	0.147	52%	0.519	C	S	.	.	G	3₁₀ helix	trans	-75.4	-1.9	177.3	-80.6	163.5	0	0	0	113.6	V52 P53 R61	V52-L55 HydrophobicContact CB-CB 4.36Å; V52-L55 HydrophobicContact CB-CD1 3.94Å; V52-L55 HydrophobicContact CB-CG 4.42Å; V52-L55 HydrophobicContact CG1-CD1 4.45Å; V52-L55 HydrophobicContact CG2-CD1 4.18Å; V52-L55 PolarHBondContact O-N 3.43Å; P53-L55 VanDerWaalsContact C-N 3.31Å; P53-L55 PolarHBondContact O-N 2.84Å; L55-R61 HydrophobicContact CD2-CB 4.4Å; L55-R61 HydrophobicContact CD2-CG 4.26Å
56	R	43	Very low	46	Very low	218 Å²	218	104.8 Å²	104.8	82%	0.823	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-73.1	-27.9	178	-172.8	174.8	150	-176.6	-7.4	112.8	P53 I54	P53-R56 WeakPolarHBondContact O-CB 3.3Å; P53-R56 PolarHBondContact O-N 3.25Å; I54-R56 PolarHBondContact O-N 2.95Å
57	N	47.1	Very low	47.6	Very low	101 Å²	101	98.9 Å²	98.9	54%	0.54	47%	0.466	S	S	.	.	S	Bend	trans	-81.1	128.8	176.7	-87.2	-12.8	0	0	0	111.1	F59 F60 R61	N57-F59 VanDerWaalsContact C-N 3.27Å; N57-F59 PolarHBondContact O-N 2.91Å; N57-F60 HydrophobicContact CB-CB 4.32Å; N57-F60 HydrophobicContact CB-CD2 3.63Å; N57-F60 HydrophobicContact CB-CG 4.44Å; N57-F60 PolarHBondContact O-N 3.01Å; N57-R61 WeakPolarHBondContact O-CB 3.39Å; N57-R61 PolarHBondContact O-N 3.14Å
58	R	44.4	Very low	48.8	Very low	223 Å²	223	95.2 Å²	95.2	84%	0.842	45%	0.447	S	S	*	.	H	α-helix	trans	-54.6	-38.2	-178.9	-77.7	-173.1	-171.7	170.6	3.3	113.5	T62	R58-T62 PolarHBondContact O-N 2.87Å; R58-T62 PolarHBondContact O-OG1 3Å
59	F	44.5	Very low	50.1	Low	147 Å²	147	87.9 Å²	87.9	65%	0.645	43%	0.426	S	S	*	.	H	α-helix	trans	-65.3	-50.1	179.3	-170.7	-101.5	0	0	0	111.6	N57 R61 T62 I63	N57-F59 VanDerWaalsContact C-N 3.27Å; N57-F59 PolarHBondContact O-N 2.91Å; F59-R61 PolarHBondContact O-N 2.94Å; F59-T62 PolarHBondContact O-N 3.44Å; F59-T62 VanDerWaalsContact O-N 3.17Å; F59-I63 HydrophobicContact CD1-CD1 3.79Å; F59-I63 HydrophobicContact CE1-CD1 3.33Å; F59-I63 HydrophobicContact CE2-CD1 4.29Å; F59-I63 HydrophobicContact CG-CD1 4.45Å; F59-I63 HydrophobicContact CZ-CD1 3.62Å; F59-I63 PolarHBondContact O-N 2.91Å
60	F	48.3	Very low	51.4	Low	86 Å²	86	82.2 Å²	82.2	38%	0.377	40%	0.404	S	S	.	.	H	α-helix	trans	-65.8	-38.5	177	-69.7	-82.4	0	0	0	112	I54 N57 T62 I63 W64	I54-F60 HydrophobicContact CG2-CB 4.45Å; I54-F60 HydrophobicContact CG2-CD1 4.39Å; I54-F60 HydrophobicContact CG2-CG 4.5Å; I54-F60 WeakPolarHBondContact O-CB 3.44Å; N57-F60 HydrophobicContact CB-CB 4.32Å; N57-F60 HydrophobicContact CB-CD2 3.63Å; N57-F60 HydrophobicContact CB-CG 4.44Å; N57-F60 PolarHBondContact O-N 3.01Å; F60-T62 VanDerWaalsContact C-N 3.27Å; F60-T62 PolarHBondContact O-N 3.34Å; F60-I63 PolarHBondContact O-N 3.31Å; F60-W64 AromaticContact CD1-NE1 3.86Å; F60-W64 WeakPolarHBondContact O-CB 3.38Å; F60-W64 PolarHBondContact O-N 2.87Å
61	R	50.7	Low	51.9	Low	143 Å²	143	85.1 Å²	85.1	54%	0.54	42%	0.415	S	S	.	.	H	α-helix	trans	-60	-38.5	173	-167	175.7	175.3	-162.6	-1.9	112	L55 N57 F59 T65	L55-R61 HydrophobicContact CD2-CB 4.4Å; L55-R61 HydrophobicContact CD2-CG 4.26Å; N57-R61 WeakPolarHBondContact O-CB 3.39Å; N57-R61 PolarHBondContact O-N 3.14Å; F59-R61 PolarHBondContact O-N 2.94Å; R61-T65 HydrophobicContact CG-CG2 3.84Å; R61-T65 WeakPolarHBondContact O-CB 3.33Å; R61-T65 WeakPolarHBondContact O-CG2 3.18Å; R61-T65 PolarHBondContact O-N 3.39Å; R61-T65 PolarHBondContact O-OG1 3.15Å
62	T	52.9	Low	52.2	Low	85 Å²	85	84 Å²	84	52%	0.521	41%	0.413	S	S	.	.	H	α-helix	trans	-70.1	-40.8	-178.6	-49.7	0	0	0	0	111.6	R58 F59 F60 R84	R58-T62 PolarHBondContact O-N 2.87Å; R58-T62 PolarHBondContact O-OG1 3Å; F59-T62 PolarHBondContact O-N 3.44Å; F59-T62 VanDerWaalsContact O-N 3.17Å; F60-T62 VanDerWaalsContact C-N 3.27Å; F60-T62 PolarHBondContact O-N 3.34Å; T62-R84 PolarHBondContact O-NH1 2.89Å; T62-R84 PolarHBondContact O-NH2 3.42Å
63	I	57.1	Low	52.5	Low	72 Å²	72	89.3 Å²	89.3	37%	0.369	45%	0.445	S	S	.	.	H	α-helix	trans	-74.8	-42.4	-177	-67.8	165.3	0	0	0	111.6	F59 F60 Y358	F59-I63 HydrophobicContact CD1-CD1 3.79Å; F59-I63 HydrophobicContact CE1-CD1 3.33Å; F59-I63 HydrophobicContact CE2-CD1 4.29Å; F59-I63 HydrophobicContact CG-CD1 4.45Å; F59-I63 HydrophobicContact CZ-CD1 3.62Å; F59-I63 PolarHBondContact O-N 2.91Å; F60-I63 PolarHBondContact O-N 3.31Å; I63-Y358 HydrophobicContact CG2-CE2 4.22Å
64	W	58.8	Low	52.9	Low	41 Å²	41	88.7 Å²	88.7	16%	0.155	44%	0.436	C	S	.	.	H	α-helix	trans	-97.9	-0.5	-168.2	-62.7	91.9	0	0	0	114.9	F60 T66 Y358 I361 E362 L365	F60-W64 AromaticContact CD1-NE1 3.86Å; F60-W64 WeakPolarHBondContact O-CB 3.38Å; F60-W64 PolarHBondContact O-N 2.87Å; W64-T66 PolarHBondContact O-N 3.24Å; W64-T66 VanDerWaalsContact O-N 3.12Å; W64-Y358 HydrophobicContact CD2-CE2 4.32Å; W64-Y358 HydrophobicContact CE3-CD2 4.36Å; W64-Y358 AromaticContact CE3-CE2 3.94Å; W64-Y358 HydrophobicContact CE3-CE2 3.94Å; W64-Y358 AromaticContact CH2-CD2 3.56Å; W64-Y358 HydrophobicContact CH2-CD2 3.56Å; W64-Y358 AromaticContact CH2-CE2 3.99Å; W64-Y358 HydrophobicContact CH2-CE2 3.99Å; W64-Y358 HydrophobicContact CH2-CG 4.3Å; W64-Y358 HydrophobicContact CZ2-CD2 4.06Å; W64-Y358 HydrophobicContact CZ2-CE2 4.39Å; W64-Y358 AromaticContact CZ3-CD2 3.73Å; W64-Y358 HydrophobicContact CZ3-CD2 3.73Å; W64-Y358 AromaticContact CZ3-CE2 3.75Å; W64-Y358 HydrophobicContact CZ3-CE2 3.75Å; W64-Y358 HydrophobicContact CZ3-CG 4.41Å; W64-Y358 VanDerWaalsContact CZ3-O 3.25Å; W64-Y358 WeakPolarHBondContact CZ3-O 3.43Å; W64-I361 HydrophobicContact CE3-CG2 4.26Å; W64-I361 HydrophobicContact CH2-CB 3.49Å; W64-I361 VanDerWaalsContact CH2-CB 3.49Å; W64-I361 HydrophobicContact CH2-CD1 4.09Å; W64-I361 HydrophobicContact CH2-CG1 4.4Å; W64-I361 HydrophobicContact CH2-CG2 3.36Å; W64-I361 HydrophobicContact CZ2-CB 4.44Å; W64-I361 HydrophobicContact CZ2-CG2 3.96Å; W64-I361 HydrophobicContact CZ3-CB 3.71Å; W64-I361 HydrophobicContact CZ3-CG2 3.53Å; W64-E362 HydrophobicContact CE3-CB 4.3Å; W64-E362 HydrophobicContact CZ3-CB 4.02Å; W64-L365 HydrophobicContact CD2-CD1 4.42Å; W64-L365 HydrophobicContact CE3-CD1 4.14Å
65	T	57.2	Low	53.6	Low	24 Å²	24	90.7 Å²	90.7	15%	0.147	44%	0.437	C	S	.	.			trans	-69.8	111.3	173.8	50.5	0	0	0	0	110.6	R61 V70 R84	R61-T65 HydrophobicContact CG-CG2 3.84Å; R61-T65 WeakPolarHBondContact O-CB 3.33Å; R61-T65 WeakPolarHBondContact O-CG2 3.18Å; R61-T65 PolarHBondContact O-N 3.39Å; R61-T65 PolarHBondContact O-OG1 3.15Å; T65-V70 HydrophobicContact CG2-CG2 4.17Å; T65-R84 PolarHBondContact O-NH2 2.83Å; T65-R84 VanDerWaalsContact O-NH2 3.11Å; T65-R84 PolarHBondContact OG1-NH2 2.67Å; T65-R84 VanDerWaalsContact OG1-NH2 3.09Å
66	T	62.5	Low	54.4	Low	5 Å²	5	98 Å²	98	3%	0.031	46%	0.463	C	S	.	.			trans	-88.6	159.1	168.4	67.1	0	0	0	0	111.3	W64 N68 T69 V70 E85 E362 E366	W64-T66 PolarHBondContact O-N 3.24Å; W64-T66 VanDerWaalsContact O-N 3.12Å; T66-N68 PolarHBondContact O-N 3.08Å; T66-T69 PolarHBondContact N-OG1 2.53Å; T66-T69 PolarHBondContact O-N 3.34Å; T66-T69 PolarHBondContact O-OG1 3.21Å; T66-T69 WeakPolarHBondContact OG1-CG2 3.47Å; T66-T69 PolarHBondContact OG1-N 3.46Å; T66-T69 PolarHBondContact OG1-OG1 3.5Å; T66-V70 PolarHBondContact O-N 2.71Å; T66-E85 VanDerWaalsContact C-OE1 3.23Å; T66-E85 WeakPolarHBondContact CA-OE1 3.42Å; T66-E362 HydrophobicContact CG2-CG 3.9Å; T66-E362 WeakPolarHBondContact CG2-OE1 3.38Å; T66-E366 PolarHBondContact OG1-OE1 3.25Å
67	R	62.5	Low	55.6	Low	34 Å²	34	90.3 Å²	90.3	13%	0.128	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-27.3	172.4	76.2	176.1	-166.7	171	-0.9	113.3	F78 T82 E85 K448	R67-F78 HydrophobicContact CB-CD2 4.28Å; R67-F78 HydrophobicContact CB-CE2 3.82Å; R67-F78 HydrophobicContact CG-CE2 4.45Å; R67-T82 HydrophobicContact CB-CG2 3.9Å; R67-E85 PolarHBondContact N-OE1 3.48Å; R67-K448 VanDerWaalsContact CZ-CG 3.5Å; R67-K448 PolarHBondContact NH1-O 3.01Å
68	N	58.8	Low	56.7	Low	49 Å²	49	88.5 Å²	88.5	26%	0.262	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-19.7	-178.7	-68.7	-17	0	0	0	113.3	T66 E366 K370 N380	T66-N68 PolarHBondContact O-N 3.08Å; N68-E366 PolarHBondContact ND2-OE1 3.05Å; N68-E366 PolarHBondContact ND2-OE2 2.82Å; N68-K370 VanDerWaalsContact CB-NZ 3.34Å; N68-K370 PolarHBondContact ND2-NZ 3.01Å; N68-N380 PolarHBondContact ND2-OD1 2.89Å
69	T	56.1	Low	58	Low	55 Å²	55	78.6 Å²	78.6	34%	0.337	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-14.8	-176.1	53.4	0	0	0	0	113	T66	T66-T69 PolarHBondContact N-OG1 2.53Å; T66-T69 PolarHBondContact O-N 3.34Å; T66-T69 PolarHBondContact O-OG1 3.21Å; T66-T69 WeakPolarHBondContact OG1-CG2 3.47Å; T66-T69 PolarHBondContact OG1-N 3.46Å; T66-T69 PolarHBondContact OG1-OG1 3.5Å
70	V	57	Low	59.3	Low	39 Å²	39	73.7 Å²	73.7	24%	0.236	38%	0.375	C	S	.	.	S	Bend	trans	-84.8	124.3	174.3	-179.5	0	0	0	0	109.6	T65 T66 A72 V77	T65-V70 HydrophobicContact CG2-CG2 4.17Å; T66-V70 PolarHBondContact O-N 2.71Å; V70-A72 PolarHBondContact O-N 3.22Å; V70-A72 VanDerWaalsContact O-N 3.13Å; V70-V77 HydrophobicContact CG1-CG1 3.99Å
71	N	49.5	Very low	60.6	Low	119 Å²	119	70.1 Å²	70.1	64%	0.636	36%	0.36	S	S	*	.			trans	-59.9	117.7	169.6	-74.3	-11.2	0	0	0	108.9	T73	N71-T73 PolarHBondContact O-N 2.8Å
72	A	50.3	Low	61.9	Low	78 Å²	78	63.4 Å²	63.4	65%	0.645	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	24.9	-169.8	0	0	0	0	0	115.2	V70 D74	V70-A72 PolarHBondContact O-N 3.22Å; V70-A72 VanDerWaalsContact O-N 3.13Å; A72-D74 PolarHBondContact O-N 3.29Å
73	T	52.8	Low	63.2	Low	124 Å²	124	60.9 Å²	60.9	76%	0.761	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-29.2	-179.8	54.4	0	0	0	0	111.9	N71	N71-T73 PolarHBondContact O-N 2.8Å
74	D	59.1	Low	64.3	Low	98 Å²	98	62 Å²	62	52%	0.524	32%	0.318	S	S	.	.			trans	-112.4	102.2	177.7	-68.4	-29.4	0	0	0	112.3	A72 R76 V77 F78	A72-D74 PolarHBondContact O-N 3.29Å; D74-R76 PolarHBondContact O-N 3.49Å; D74-R76 VanDerWaalsContact O-N 3.16Å; D74-V77 HydrophobicContact CB-CB 4.06Å; D74-V77 HydrophobicContact CB-CG2 3.68Å; D74-V77 WeakPolarHBondContact O-CB 3.44Å; D74-V77 PolarHBondContact O-N 3.09Å; D74-F78 PolarHBondContact O-N 2.98Å; D74-F78 VanDerWaalsContact O-N 3.13Å
75	R	64.3	Low	65.6	Low	135 Å²	135	61 Å²	61	51%	0.509	32%	0.315	S	S	.	.	H	α-helix	trans	-58	-29.6	178.1	-166.1	169.5	-174.5	158.8	-0.6	113.5	F78 I79 D570	R75-F78 PolarHBondContact O-N 3.34Å; R75-I79 HydrophobicContact CG-CD1 4.17Å; R75-I79 WeakPolarHBondContact O-CG1 3.48Å; R75-I79 PolarHBondContact O-N 2.61Å; R75-D570 VanDerWaalsContact CZ-CG 3.49Å; R75-D570 IonicContact CZ-OD1 2.74Å; R75-D570 VanDerWaalsContact CZ-OD1 3.22Å; R75-D570 IonicContact CZ-OD2 2.9Å; R75-D570 VanDerWaalsContact NH1-CG 3.31Å; R75-D570 IonicContact NH1-OD1 3.87Å; R75-D570 PolarHBondContact NH1-OD1 3.41Å; R75-D570 IonicContact NH1-OD2 2.63Å; R75-D570 IonicContact NH2-OD1 2.95Å; R75-D570 PolarHBondContact NH2-OD1 3.23Å; R75-D570 IonicContact NH2-OD2 3.82Å; R75-D570 PolarHBondContact NH2-OD2 3.16Å
76	R	66.2	Low	67	Low	182 Å²	182	61.7 Å²	61.7	69%	0.687	32%	0.317	S	S	*	.	H	α-helix	trans	-65.4	-41.6	174	-68.6	-173.1	-178.5	-173.4	7.2	112.3	D74 S80	D74-R76 PolarHBondContact O-N 3.49Å; D74-R76 VanDerWaalsContact O-N 3.16Å; R76-S80 WeakPolarHBondContact O-CB 3.4Å; R76-S80 PolarHBondContact O-N 3.48Å; R76-S80 PolarHBondContact O-OG 3.47Å
77	V	67.7	Low	68.1	Low	56 Å²	56	67.1 Å²	67.1	34%	0.339	35%	0.346	S	S	.	.	H	α-helix	trans	-64.4	-47.4	176.8	178	0	0	0	0	108.6	V70 D74 I79 S80 T81	V70-V77 HydrophobicContact CG1-CG1 3.99Å; D74-V77 HydrophobicContact CB-CB 4.06Å; D74-V77 HydrophobicContact CB-CG2 3.68Å; D74-V77 WeakPolarHBondContact O-CB 3.44Å; D74-V77 PolarHBondContact O-N 3.09Å; V77-I79 PolarHBondContact O-N 2.84Å; V77-S80 PolarHBondContact O-N 3.48Å; V77-S80 VanDerWaalsContact O-N 3.12Å; V77-S80 PolarHBondContact O-OG 2.96Å; V77-T81 HydrophobicContact CG1-CG2 4.29Å; V77-T81 WeakPolarHBondContact O-CG2 3.31Å; V77-T81 PolarHBondContact O-N 3.28Å; V77-T81 PolarHBondContact O-OG1 3.15Å
78	F	69.9	Low	69.3	Low	63 Å²	63	68.6 Å²	68.6	28%	0.276	36%	0.356	S	S	.	.	H	α-helix	trans	-52.8	-51.8	176.7	-179.3	-95.9	0	0	0	112.6	R67 D74 R75 S80 T81 T82	R67-F78 HydrophobicContact CB-CD2 4.28Å; R67-F78 HydrophobicContact CB-CE2 3.82Å; R67-F78 HydrophobicContact CG-CE2 4.45Å; D74-F78 PolarHBondContact O-N 2.98Å; D74-F78 VanDerWaalsContact O-N 3.13Å; R75-F78 PolarHBondContact O-N 3.34Å; F78-S80 VanDerWaalsContact C-N 3.33Å; F78-S80 PolarHBondContact O-N 2.99Å; F78-T81 WeakPolarHBondContact CA-OG1 3.44Å; F78-T81 PolarHBondContact O-N 3.19Å; F78-T81 PolarHBondContact O-OG1 2.89Å; F78-T82 HydrophobicContact CD1-CG2 4.23Å; F78-T82 HydrophobicContact CE1-CG2 3.91Å; F78-T82 HydrophobicContact CE2-CG2 4.24Å; F78-T82 HydrophobicContact CZ-CG2 3.91Å; F78-T82 WeakPolarHBondContact O-CG2 3.4Å; F78-T82 PolarHBondContact O-N 3.38Å; F78-T82 PolarHBondContact O-OG1 3.19Å
79	I	71.8	Confident	70.9	Confident	15 Å²	15	66.3 Å²	66.3	8%	0.077	34%	0.343	C	S	.	.	H	α-helix	trans	-65.9	-36.5	179.9	-65.9	169.6	0	0	0	111.5	R75 V77 T82 L83 L573 I576	R75-I79 HydrophobicContact CG-CD1 4.17Å; R75-I79 WeakPolarHBondContact O-CG1 3.48Å; R75-I79 PolarHBondContact O-N 2.61Å; V77-I79 PolarHBondContact O-N 2.84Å; I79-T82 WeakPolarHBondContact CA-OG1 3.28Å; I79-T82 PolarHBondContact O-OG1 3.38Å; I79-L83 HydrophobicContact CG2-CD1 4.09Å; I79-L83 HydrophobicContact CG2-CG 4.48Å; I79-L83 WeakPolarHBondContact O-CB 3.29Å; I79-L83 VanDerWaalsContact O-CG 3.29Å; I79-L83 WeakPolarHBondContact O-CG 3.26Å; I79-L83 PolarHBondContact O-N 3.49Å; I79-L83 VanDerWaalsContact O-N 3.08Å; I79-L573 HydrophobicContact CG2-CD1 4.4Å; I79-I576 HydrophobicContact CB-CD1 4.49Å; I79-I576 HydrophobicContact CD1-CD1 3.26Å; I79-I576 HydrophobicContact CG1-CD1 4.43Å; I79-I576 HydrophobicContact CG2-CD1 4.2Å; I79-I576 HydrophobicContact CG2-CG2 4.26Å
80	S	71	Confident	72.5	Confident	45 Å²	45	67.5 Å²	67.5	32%	0.315	35%	0.347	S	S	.	.	H	α-helix	trans	-67.4	-37.3	176.9	76.2	0	0	0	0	112.8	R76 V77 F78 R84	R76-S80 WeakPolarHBondContact O-CB 3.4Å; R76-S80 PolarHBondContact O-N 3.48Å; R76-S80 PolarHBondContact O-OG 3.47Å; V77-S80 PolarHBondContact O-N 3.48Å; V77-S80 VanDerWaalsContact O-N 3.12Å; V77-S80 PolarHBondContact O-OG 2.96Å; F78-S80 VanDerWaalsContact C-N 3.33Å; F78-S80 PolarHBondContact O-N 2.99Å; S80-R84 PolarHBondContact O-N 3.46Å
81	T	76.1	Confident	74.2	Confident	11 Å²	11	69.1 Å²	69.1	7%	0.067	36%	0.356	C	S	.	.	H	α-helix	trans	-72.4	-42.5	177.2	45.5	0	0	0	0	111.5	V77 F78 L83 R84 E85	V77-T81 HydrophobicContact CG1-CG2 4.29Å; V77-T81 WeakPolarHBondContact O-CG2 3.31Å; V77-T81 PolarHBondContact O-N 3.28Å; V77-T81 PolarHBondContact O-OG1 3.15Å; F78-T81 WeakPolarHBondContact CA-OG1 3.44Å; F78-T81 PolarHBondContact O-N 3.19Å; F78-T81 PolarHBondContact O-OG1 2.89Å; T81-L83 PolarHBondContact O-N 3.14Å; T81-R84 PolarHBondContact O-N 3.36Å; T81-E85 WeakPolarHBondContact O-CG 3.48Å; T81-E85 PolarHBondContact O-N 2.97Å
82	T	78.3	Confident	76.3	Confident	2 Å²	2	63.9 Å²	63.9	1%	0.012	33%	0.328	C	S	.	.	H	α-helix	trans	-65.4	-38.5	178.1	55	0	0	0	0	112.1	R67 F78 I79 R84 E85 L86 I452	R67-T82 HydrophobicContact CB-CG2 3.9Å; F78-T82 HydrophobicContact CD1-CG2 4.23Å; F78-T82 HydrophobicContact CE1-CG2 3.91Å; F78-T82 HydrophobicContact CE2-CG2 4.24Å; F78-T82 HydrophobicContact CZ-CG2 3.91Å; F78-T82 WeakPolarHBondContact O-CG2 3.4Å; F78-T82 PolarHBondContact O-N 3.38Å; F78-T82 PolarHBondContact O-OG1 3.19Å; I79-T82 WeakPolarHBondContact CA-OG1 3.28Å; I79-T82 PolarHBondContact O-OG1 3.38Å; T82-R84 VanDerWaalsContact C-N 3.34Å; T82-R84 PolarHBondContact O-N 2.02Å; T82-E85 PolarHBondContact O-N 3.12Å; T82-L86 VanDerWaalsContact O-CB 3.27Å; T82-L86 WeakPolarHBondContact O-CB 3.47Å; T82-L86 PolarHBondContact O-N 3.08Å; T82-I452 WeakPolarHBondContact OG1-CD1 3.48Å
83	L	80.2	Confident	78.3	Confident	32 Å²	32	60.9 Å²	60.9	17%	0.168	30%	0.301	C	S	.	.	H	α-helix	trans	-64.5	-38.3	174.5	-75.7	172.6	0	0	0	112.3	I79 T81 L86 L87 L577	I79-L83 HydrophobicContact CG2-CD1 4.09Å; I79-L83 HydrophobicContact CG2-CG 4.48Å; I79-L83 WeakPolarHBondContact O-CB 3.29Å; I79-L83 VanDerWaalsContact O-CG 3.29Å; I79-L83 WeakPolarHBondContact O-CG 3.26Å; I79-L83 PolarHBondContact O-N 3.49Å; I79-L83 VanDerWaalsContact O-N 3.08Å; T81-L83 PolarHBondContact O-N 3.14Å; L83-L86 PolarHBondContact O-N 2.8Å; L83-L87 WeakPolarHBondContact O-CG 3.38Å; L83-L87 PolarHBondContact O-N 2.92Å; L83-L577 HydrophobicContact CD1-CD2 4.26Å
84	R	81	Confident	80.3	Confident	95 Å²	95	58.1 Å²	58.1	36%	0.358	28%	0.284	S	S	.	.	H	α-helix	trans	-66	-46.3	175.8	-178.7	-175	68.1	176.8	8	111.3	T62 T65 S80 T81 T82 L86 L87 L88	T62-R84 PolarHBondContact O-NH1 2.89Å; T62-R84 PolarHBondContact O-NH2 3.42Å; T65-R84 PolarHBondContact O-NH2 2.83Å; T65-R84 VanDerWaalsContact O-NH2 3.11Å; T65-R84 PolarHBondContact OG1-NH2 2.67Å; T65-R84 VanDerWaalsContact OG1-NH2 3.09Å; S80-R84 PolarHBondContact O-N 3.46Å; T81-R84 PolarHBondContact O-N 3.36Å; T82-R84 VanDerWaalsContact C-N 3.34Å; T82-R84 PolarHBondContact O-N 2.02Å; R84-L86 VanDerWaalsContact C-N 3.29Å; R84-L86 PolarHBondContact O-N 2.59Å; R84-L87 PolarHBondContact O-N 2.87Å; R84-L88 PolarHBondContact O-N 3.08Å
85	E	84.4	Confident	81.9	Confident	21 Å²	21	54.4 Å²	54.4	10%	0.098	26%	0.264	C	S	.	.	H	α-helix	trans	-59.3	-42.7	174.7	-72.9	168.3	-155.6	0	0	111.1	T66 R67 T81 T82 L87 L88 Y89 Y449	T66-E85 VanDerWaalsContact C-OE1 3.23Å; T66-E85 WeakPolarHBondContact CA-OE1 3.42Å; R67-E85 PolarHBondContact N-OE1 3.48Å; T81-E85 WeakPolarHBondContact O-CG 3.48Å; T81-E85 PolarHBondContact O-N 2.97Å; T82-E85 PolarHBondContact O-N 3.12Å; E85-L87 PolarHBondContact O-N 3.05Å; E85-L88 PolarHBondContact O-N 3.49Å; E85-Y89 WeakPolarHBondContact O-CB 3.46Å; E85-Y89 PolarHBondContact O-N 2.78Å; E85-Y449 HydrophobicContact CB-CE1 3.83Å
86	L	87.2	Confident	83.2	Confident	38 Å²	38	48.3 Å²	48.3	20%	0.199	24%	0.242	C	C	.	.	H	α-helix	trans	-60.1	-45.9	176.9	177	58.3	0	0	0	111.6	T82 L83 R84 Y89 I90 Y449	T82-L86 VanDerWaalsContact O-CB 3.27Å; T82-L86 WeakPolarHBondContact O-CB 3.47Å; T82-L86 PolarHBondContact O-N 3.08Å; L83-L86 PolarHBondContact O-N 2.8Å; R84-L86 VanDerWaalsContact C-N 3.29Å; R84-L86 PolarHBondContact O-N 2.59Å; L86-Y89 PolarHBondContact O-N 3.17Å; L86-I90 HydrophobicContact CD1-CD1 3.92Å; L86-I90 HydrophobicContact CD1-CG1 4.06Å; L86-I90 HydrophobicContact CG-CD1 3.89Å; L86-I90 HydrophobicContact CG-CG1 4.47Å; L86-I90 WeakPolarHBondContact O-CB 3.4Å; L86-I90 VanDerWaalsContact O-CG1 3.23Å; L86-I90 WeakPolarHBondContact O-CG1 3.42Å; L86-I90 PolarHBondContact O-N 2.87Å; L86-Y449 HydrophobicContact CB-CD1 4.13Å; L86-Y449 HydrophobicContact CB-CG 4.27Å; L86-Y449 HydrophobicContact CD1-CD2 4.03Å; L86-Y449 HydrophobicContact CD1-CG 3.84Å
87	L	86.7	Confident	84.5	Confident	119 Å²	119	42.3 Å²	42.3	62%	0.623	22%	0.223	S	C	*	.	H	α-helix	trans	-63	-44.8	178	-72.6	172.2	0	0	0	112.1	L83 R84 E85 Y89 I90 V91	L83-L87 WeakPolarHBondContact O-CG 3.38Å; L83-L87 PolarHBondContact O-N 2.92Å; R84-L87 PolarHBondContact O-N 2.87Å; E85-L87 PolarHBondContact O-N 3.05Å; L87-Y89 VanDerWaalsContact C-N 3.29Å; L87-Y89 PolarHBondContact O-N 2.77Å; L87-I90 PolarHBondContact O-N 3.1Å; L87-V91 WeakPolarHBondContact O-CG2 3.32Å; L87-V91 PolarHBondContact O-N 2.75Å
88	L	88	Confident	85.7	Confident	65 Å²	65	42.6 Å²	42.6	34%	0.34	22%	0.222	S	C	.	.	H	α-helix	trans	-61.2	-42	175.3	-171.6	78.4	0	0	0	111.1	R84 E85 V91 F92 F355 Y358	R84-L88 PolarHBondContact O-N 3.08Å; E85-L88 PolarHBondContact O-N 3.49Å; L88-V91 PolarHBondContact O-N 3.06Å; L88-F92 PolarHBondContact O-N 3.24Å; L88-F355 HydrophobicContact CD1-CE1 3.75Å; L88-F355 HydrophobicContact CD1-CZ 4.28Å; L88-F355 HydrophobicContact CG-CE1 3.96Å; L88-Y358 HydrophobicContact CD2-CE1 3.87Å
89	Y	90.5	Very high	86.6	Confident	1 Å²	1	40.3 Å²	40.3	0%	0.004	21%	0.213	C	C	.	.	H	α-helix	trans	-68.4	-37.3	-179.7	-173.1	-103.6	0	0	0	112.5	E85 L86 L87 V91 F92 L93 G442 K445 I446 Y449	E85-Y89 WeakPolarHBondContact O-CB 3.46Å; E85-Y89 PolarHBondContact O-N 2.78Å; L86-Y89 PolarHBondContact O-N 3.17Å; L87-Y89 VanDerWaalsContact C-N 3.29Å; L87-Y89 PolarHBondContact O-N 2.77Å; Y89-V91 VanDerWaalsContact C-N 3.33Å; Y89-V91 PolarHBondContact O-N 2.95Å; Y89-F92 HydrophobicContact CD2-CD1 4.07Å; Y89-F92 AromaticContact CE2-CD1 3.81Å; Y89-F92 HydrophobicContact CE2-CD1 3.81Å; Y89-F92 HydrophobicContact CE2-CE1 4.17Å; Y89-F92 WeakPolarHBondContact O-CB 3.43Å; Y89-F92 PolarHBondContact O-N 2.72Å; Y89-L93 WeakPolarHBondContact O-CB 3.36Å; Y89-L93 PolarHBondContact O-N 3.04Å; Y89-G442 VanDerWaalsContact OH-C 3.31Å; Y89-G442 VanDerWaalsContact OH-CA 3.23Å; Y89-G442 WeakPolarHBondContact OH-CA 3.23Å; Y89-G442 PolarHBondContact OH-O 3.1Å; Y89-K445 HydrophobicContact CD2-CD 4.48Å; Y89-K445 HydrophobicContact CE1-CG 4.24Å; Y89-K445 HydrophobicContact CE2-CD 3.58Å; Y89-K445 VanDerWaalsContact CE2-CE 3.44Å; Y89-K445 HydrophobicContact CE2-CG 4.11Å; Y89-K445 WeakPolarHBondContact OH-CB 3.23Å; Y89-K445 WeakPolarHBondContact OH-CD 3.18Å; Y89-I446 HydrophobicContact CE1-CG1 4.11Å; Y89-Y449 HydrophobicContact CD1-CD2 4.07Å; Y89-Y449 AromaticContact CD1-CE2 3.43Å; Y89-Y449 HydrophobicContact CD1-CE2 3.43Å; Y89-Y449 VanDerWaalsContact CD1-CE2 3.43Å; Y89-Y449 HydrophobicContact CD2-CE2 4.26Å; Y89-Y449 AromaticContact CE1-CE2 3.95Å; Y89-Y449 HydrophobicContact CE1-CE2 3.95Å; Y89-Y449 AromaticContact CG-CE2 3.62Å; Y89-Y449 HydrophobicContact CG-CE2 3.62Å; Y89-Y449 AromaticContact CG-CZ 3.93Å
90	I	91.3	Very high	87.5	Confident	80 Å²	80	40.1 Å²	40.1	41%	0.41	21%	0.213	S	C	.	.	H	α-helix	trans	-60.6	-44.2	173.5	-73.4	164.4	0	0	0	110.1	L86 L87 F92 L93 T94	L86-I90 HydrophobicContact CD1-CD1 3.92Å; L86-I90 HydrophobicContact CD1-CG1 4.06Å; L86-I90 HydrophobicContact CG-CD1 3.89Å; L86-I90 HydrophobicContact CG-CG1 4.47Å; L86-I90 WeakPolarHBondContact O-CB 3.4Å; L86-I90 VanDerWaalsContact O-CG1 3.23Å; L86-I90 WeakPolarHBondContact O-CG1 3.42Å; L86-I90 PolarHBondContact O-N 2.87Å; L87-I90 PolarHBondContact O-N 3.1Å; I90-F92 VanDerWaalsContact C-N 3.35Å; I90-F92 PolarHBondContact O-N 3.1Å; I90-L93 PolarHBondContact O-N 3.21Å; I90-T94 HydrophobicContact CG2-CG2 4.36Å; I90-T94 VanDerWaalsContact O-CG2 3.31Å; I90-T94 WeakPolarHBondContact O-CG2 3.45Å; I90-T94 PolarHBondContact O-N 2.81Å; I90-T94 PolarHBondContact O-OG1 2.78Å
91	V	92.6	Very high	88.3	Confident	72 Å²	72	44.1 Å²	44.1	44%	0.436	23%	0.23	S	C	.	.	H	α-helix	trans	-62.7	-42.6	176.3	175.6	0	0	0	0	111.4	L87 L88 Y89 T94 L95 F355	L87-V91 WeakPolarHBondContact O-CG2 3.32Å; L87-V91 PolarHBondContact O-N 2.75Å; L88-V91 PolarHBondContact O-N 3.06Å; Y89-V91 VanDerWaalsContact C-N 3.33Å; Y89-V91 PolarHBondContact O-N 2.95Å; V91-T94 WeakPolarHBondContact CA-OG1 3.46Å; V91-T94 PolarHBondContact O-OG1 3Å; V91-L95 HydrophobicContact CG1-CD1 4.33Å; V91-L95 WeakPolarHBondContact O-CG 3.32Å; V91-L95 PolarHBondContact O-N 2.55Å; V91-L95 VanDerWaalsContact O-N 3.09Å; V91-F355 HydrophobicContact CG1-CE2 4.25Å; V91-F355 HydrophobicContact CG1-CZ 4.03Å
92	F	92.7	Very high	88.8	Confident	10 Å²	10	46.4 Å²	46.4	4%	0.044	24%	0.244	C	C	.	.	H	α-helix	trans	-61.6	-44.6	174.6	167.8	-101.4	0	0	0	112.2	L88 Y89 I90 L95 L96 Y352 F355 Y359 M386	L88-F92 PolarHBondContact O-N 3.24Å; Y89-F92 HydrophobicContact CD2-CD1 4.07Å; Y89-F92 AromaticContact CE2-CD1 3.81Å; Y89-F92 HydrophobicContact CE2-CD1 3.81Å; Y89-F92 HydrophobicContact CE2-CE1 4.17Å; Y89-F92 WeakPolarHBondContact O-CB 3.43Å; Y89-F92 PolarHBondContact O-N 2.72Å; I90-F92 VanDerWaalsContact C-N 3.35Å; I90-F92 PolarHBondContact O-N 3.1Å; F92-L95 WeakPolarHBondContact O-CB 3.28Å; F92-L95 PolarHBondContact O-N 2.91Å; F92-L96 PolarHBondContact O-N 2.91Å; F92-Y352 HydrophobicContact CD2-CD2 4.24Å; F92-Y352 HydrophobicContact CD2-CE2 4.07Å; F92-Y352 AromaticContact CE2-CD2 3.83Å; F92-Y352 HydrophobicContact CE2-CD2 3.83Å; F92-Y352 AromaticContact CE2-CE2 3.26Å; F92-Y352 HydrophobicContact CE2-CE2 3.26Å; F92-Y352 AromaticContact CE2-CZ 3.97Å; F92-Y352 AromaticContact CZ-CE2 3.74Å; F92-Y352 HydrophobicContact CZ-CE2 3.74Å; F92-F355 HydrophobicContact CB-CD1 4.28Å; F92-F355 HydrophobicContact CB-CE1 4.47Å; F92-F355 HydrophobicContact CD2-CB 3.75Å; F92-F355 HydrophobicContact CD2-CD1 4.41Å; F92-F355 HydrophobicContact CD2-CG 4.08Å; F92-F355 HydrophobicContact CE2-CB 4.25Å; F92-Y359 HydrophobicContact CB-CE2 4.2Å; F92-Y359 HydrophobicContact CD1-CE2 4.01Å; F92-Y359 HydrophobicContact CD2-CD2 4.27Å; F92-Y359 AromaticContact CD2-CE2 3.58Å; F92-Y359 HydrophobicContact CD2-CE2 3.58Å; F92-Y359 HydrophobicContact CE1-CE2 4.27Å; F92-Y359 HydrophobicContact CE2-CD2 4.11Å; F92-Y359 AromaticContact CE2-CE2 3.83Å; F92-Y359 HydrophobicContact CE2-CE2 3.83Å; F92-Y359 AromaticContact CG-CE2 3.64Å; F92-Y359 HydrophobicContact CG-CE2 3.64Å; F92-Y359 HydrophobicContact CZ-CD2 4.43Å; F92-Y359 HydrophobicContact CZ-CE2 4.18Å; F92-M386 HydrophobicContact CE1-CE 4.12Å
93	L	93.4	Very high	88.9	Confident	15 Å²	15	47.7 Å²	47.7	8%	0.079	25%	0.252	C	S	.	.	H	α-helix	trans	-68.1	-39.4	-178.6	-176.5	67.3	0	0	0	111.7	Y89 I90 L95 L96 L97 I446	Y89-L93 WeakPolarHBondContact O-CB 3.36Å; Y89-L93 PolarHBondContact O-N 3.04Å; I90-L93 PolarHBondContact O-N 3.21Å; L93-L95 VanDerWaalsContact C-N 3.33Å; L93-L96 HydrophobicContact CD1-CD2 4.46Å; L93-L96 PolarHBondContact O-N 2.83Å; L93-L97 HydrophobicContact CG-CD1 4.17Å; L93-L97 WeakPolarHBondContact O-CB 2.96Å; L93-L97 WeakPolarHBondContact O-CG 3.22Å; L93-L97 PolarHBondContact O-N 3.35Å; L93-I446 HydrophobicContact CD2-CD1 3.55Å; L93-I446 HydrophobicContact CD2-CG1 3.99Å
94	T	93.4	Very high	88.9	Confident	65 Å²	65	50.2 Å²	50.2	40%	0.399	27%	0.266	S	S	.	.	H	α-helix	trans	-64.7	-39.6	175.1	55	0	0	0	0	111.1	I90 V91 L97 I98	I90-T94 HydrophobicContact CG2-CG2 4.36Å; I90-T94 VanDerWaalsContact O-CG2 3.31Å; I90-T94 WeakPolarHBondContact O-CG2 3.45Å; I90-T94 PolarHBondContact O-N 2.81Å; I90-T94 PolarHBondContact O-OG1 2.78Å; V91-T94 WeakPolarHBondContact CA-OG1 3.46Å; V91-T94 PolarHBondContact O-OG1 3Å; T94-L97 PolarHBondContact O-N 3.48Å; T94-I98 WeakPolarHBondContact O-CB 3.39Å; T94-I98 WeakPolarHBondContact O-CD1 3.21Å; T94-I98 WeakPolarHBondContact O-CG1 3.01Å; T94-I98 PolarHBondContact O-N 2.8Å
95	L	93.2	Very high	88.9	Confident	20 Å²	20	50.1 Å²	50.1	11%	0.105	27%	0.272	C	S	.	.	H	α-helix	trans	-61	-46.4	172.2	-75.4	168.3	0	0	0	112.1	V91 F92 L93 L97 I98 I99 C348 V351 F355	V91-L95 HydrophobicContact CG1-CD1 4.33Å; V91-L95 WeakPolarHBondContact O-CG 3.32Å; V91-L95 PolarHBondContact O-N 2.55Å; V91-L95 VanDerWaalsContact O-N 3.09Å; F92-L95 WeakPolarHBondContact O-CB 3.28Å; F92-L95 PolarHBondContact O-N 2.91Å; L93-L95 VanDerWaalsContact C-N 3.33Å; L95-L97 VanDerWaalsContact C-N 3.33Å; L95-L97 PolarHBondContact O-N 2.59Å; L95-I98 PolarHBondContact O-N 3.29Å; L95-I99 VanDerWaalsContact O-CG1 3.32Å; L95-I99 WeakPolarHBondContact O-CG1 3.29Å; L95-I99 PolarHBondContact O-N 3.01Å; L95-C348 HydrophobicContact CD2-CB 4.09Å; L95-V351 HydrophobicContact CD1-CB 4.4Å; L95-V351 HydrophobicContact CD1-CG1 3.6Å; L95-F355 HydrophobicContact CD1-CD2 3.78Å; L95-F355 HydrophobicContact CD1-CE2 3.6Å
96	L	92.5	Very high	89.1	Confident	8 Å²	8	53.1 Å²	53.1	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-59.6	-43.7	177.1	179.9	64.6	0	0	0	111.5	F92 L93 I99 A100 Y352 C438 V439	F92-L96 PolarHBondContact O-N 2.91Å; L93-L96 HydrophobicContact CD1-CD2 4.46Å; L93-L96 PolarHBondContact O-N 2.83Å; L96-I99 PolarHBondContact O-N 2.88Å; L96-A100 VanDerWaalsContact O-CB 3.29Å; L96-A100 WeakPolarHBondContact O-CB 3.32Å; L96-A100 PolarHBondContact O-N 3.29Å; L96-Y352 HydrophobicContact CB-CE2 4.15Å; L96-Y352 HydrophobicContact CD1-CE2 3.84Å; L96-C438 HydrophobicContact CD1-CB 4.5Å; L96-V439 HydrophobicContact CD1-CG2 4.37Å; L96-V439 HydrophobicContact CD2-CG2 4.19Å; L96-V439 HydrophobicContact CG-CG2 3.95Å
97	L	93.2	Very high	89.2	Confident	56 Å²	56	53.8 Å²	53.8	29%	0.293	30%	0.301	S	S	.	.	H	α-helix	trans	-65.2	-42.9	176.5	-74.1	168.1	0	0	0	112	L93 T94 L95 I99 A100 L101 V439	L93-L97 HydrophobicContact CG-CD1 4.17Å; L93-L97 WeakPolarHBondContact O-CB 2.96Å; L93-L97 WeakPolarHBondContact O-CG 3.22Å; L93-L97 PolarHBondContact O-N 3.35Å; T94-L97 PolarHBondContact O-N 3.48Å; L95-L97 VanDerWaalsContact C-N 3.33Å; L95-L97 PolarHBondContact O-N 2.59Å; L97-I99 VanDerWaalsContact C-N 3.35Å; L97-I99 PolarHBondContact O-N 3.16Å; L97-A100 PolarHBondContact O-N 2.91Å; L97-L101 VanDerWaalsContact O-CB 3.25Å; L97-L101 WeakPolarHBondContact O-CB 3.48Å; L97-L101 VanDerWaalsContact O-CG 3.23Å; L97-L101 WeakPolarHBondContact O-CG 3.18Å; L97-L101 PolarHBondContact O-N 2.85Å; L97-V439 HydrophobicContact CD2-CG1 3.92Å
98	I	91.9	Very high	89.3	Confident	61 Å²	61	49.7 Å²	49.7	31%	0.313	28%	0.281	S	S	.	.	H	α-helix	trans	-59.1	-47.6	176.1	-71.7	163.6	0	0	0	110	T94 L95 T102 F344	T94-I98 WeakPolarHBondContact O-CB 3.39Å; T94-I98 WeakPolarHBondContact O-CD1 3.21Å; T94-I98 WeakPolarHBondContact O-CG1 3.01Å; T94-I98 PolarHBondContact O-N 2.8Å; L95-I98 PolarHBondContact O-N 3.29Å; I98-T102 VanDerWaalsContact O-CB 3.32Å; I98-T102 WeakPolarHBondContact O-CB 3.5Å; I98-T102 PolarHBondContact O-N 2.83Å; I98-T102 PolarHBondContact O-OG1 2.85Å; I98-F344 HydrophobicContact CG2-CE1 4.15Å
99	I	90.4	Very high	89.5	Confident	16 Å²	16	53.6 Å²	53.6	8%	0.082	29%	0.292	C	S	.	.	H	α-helix	trans	-64	-46.6	179.6	-65.5	165.6	0	0	0	110.5	L95 L96 L97 T102 T103 C348 E349 Y352	L95-I99 VanDerWaalsContact O-CG1 3.32Å; L95-I99 WeakPolarHBondContact O-CG1 3.29Å; L95-I99 PolarHBondContact O-N 3.01Å; L96-I99 PolarHBondContact O-N 2.88Å; L97-I99 VanDerWaalsContact C-N 3.35Å; L97-I99 PolarHBondContact O-N 3.16Å; I99-T102 PolarHBondContact O-N 3.26Å; I99-T103 HydrophobicContact CG2-CG2 4.47Å; I99-T103 WeakPolarHBondContact O-CB 3.35Å; I99-T103 VanDerWaalsContact O-CG2 3.25Å; I99-T103 WeakPolarHBondContact O-CG2 3.32Å; I99-T103 PolarHBondContact O-N 2.83Å; I99-T103 VanDerWaalsContact O-N 3.08Å; I99-T103 PolarHBondContact O-OG1 2.82Å; I99-C348 HydrophobicContact CD1-CB 4.45Å; I99-C348 HydrophobicContact CG1-CB 4.15Å; I99-E349 HydrophobicContact CD1-CG 4.22Å; I99-E349 HydrophobicContact CG1-CG 4.33Å; I99-E349 HydrophobicContact CG2-CG 4.44Å; I99-Y352 HydrophobicContact CD1-CD2 4.19Å; I99-Y352 HydrophobicContact CD1-CG 3.89Å
100	A	89.9	Confident	89.5	Confident	11 Å²	11	60.2 Å²	60.2	9%	0.091	32%	0.321	C	S	.	.	H	α-helix	trans	-66	-41	-178.3	0	0	0	0	0	113.2	L96 L97 T103 M435 V439	L96-A100 VanDerWaalsContact O-CB 3.29Å; L96-A100 WeakPolarHBondContact O-CB 3.32Å; L96-A100 PolarHBondContact O-N 3.29Å; L97-A100 PolarHBondContact O-N 2.91Å; A100-T103 PolarHBondContact O-OG1 2.78Å; A100-M435 HydrophobicContact CB-CE 4.32Å; A100-M435 HydrophobicContact CB-CG 4.1Å; A100-M435 HydrophobicContact CB-SD 4.04Å; A100-V439 HydrophobicContact CB-CG2 3.68Å
101	L	88.5	Confident	89.5	Confident	128 Å²	128	57 Å²	57	67%	0.67	30%	0.304	S	S	*	.	H	α-helix	trans	-76.4	-26.4	179	-66.5	172.4	0	0	0	112.6	L97	L97-L101 VanDerWaalsContact O-CB 3.25Å; L97-L101 WeakPolarHBondContact O-CB 3.48Å; L97-L101 VanDerWaalsContact O-CG 3.23Å; L97-L101 WeakPolarHBondContact O-CG 3.18Å; L97-L101 PolarHBondContact O-N 2.85Å
102	T	85.5	Confident	89.5	Confident	60 Å²	60	55.8 Å²	55.8	37%	0.368	30%	0.295	S	S	.	.	H	α-helix	trans	-81.3	-28.8	177.2	-45.9	0	0	0	0	112.4	I98 I99 L104 V345	I98-T102 VanDerWaalsContact O-CB 3.32Å; I98-T102 WeakPolarHBondContact O-CB 3.5Å; I98-T102 PolarHBondContact O-N 2.83Å; I98-T102 PolarHBondContact O-OG1 2.85Å; I99-T102 PolarHBondContact O-N 3.26Å; T102-L104 VanDerWaalsContact C-N 3.31Å; T102-L104 PolarHBondContact O-N 3.28Å; T102-V345 HydrophobicContact CG2-CG2 3.31Å
103	T	81.6	Confident	89.4	Confident	28 Å²	28	56.9 Å²	56.9	17%	0.172	30%	0.303	C	S	.	.	H	α-helix	trans	-72.6	-22.6	178.5	46.3	0	0	0	0	113.3	I99 A100 M435	I99-T103 HydrophobicContact CG2-CG2 4.47Å; I99-T103 WeakPolarHBondContact O-CB 3.35Å; I99-T103 VanDerWaalsContact O-CG2 3.25Å; I99-T103 WeakPolarHBondContact O-CG2 3.32Å; I99-T103 PolarHBondContact O-N 2.83Å; I99-T103 VanDerWaalsContact O-N 3.08Å; I99-T103 PolarHBondContact O-OG1 2.82Å; A100-T103 PolarHBondContact O-OG1 2.78Å; T103-M435 WeakPolarHBondContact OG1-CE 3.47Å
104	L	80.2	Confident	89.2	Confident	86 Å²	86	59 Å²	59	45%	0.45	32%	0.319	S	S	.	.			trans	-116.1	123.8	-179.3	-63.2	172.9	0	0	0	110.5	T102 I432 M435	T102-L104 VanDerWaalsContact C-N 3.31Å; T102-L104 PolarHBondContact O-N 3.28Å; L104-I432 HydrophobicContact CD1-CG2 4.45Å; L104-I432 HydrophobicContact CD2-CD1 3.94Å; L104-I432 HydrophobicContact CD2-CG1 4.34Å; L104-I432 HydrophobicContact CD2-CG2 4.25Å; L104-M435 HydrophobicContact CD1-CE 4.28Å; L104-M435 HydrophobicContact CG-CE 4.39Å
105	N	81.1	Confident	89	Confident	92 Å²	92	56.3 Å²	56.3	49%	0.492	30%	0.302	S	S	.	.			trans	-119.1	145.9	178.9	-172.7	-10.5	0	0	0	110.5	V107 T108	N105-V107 PolarHBondContact O-N 3.09Å; N105-V107 PolarHBondContact OD1-N 3.13Å; N105-T108 WeakPolarHBondContact O-CB 3.16Å; N105-T108 PolarHBondContact O-N 2.92Å; N105-T108 PolarHBondContact O-OG1 2.8Å
106	S	87.9	Confident	88.9	Confident	84 Å²	84	59.2 Å²	59.2	59%	0.587	31%	0.312	S	S	*	.	H	α-helix	trans	-60	-29.4	173.4	61.7	0	0	0	0	112.8	T108 Y109 F110	S106-T108 PolarHBondContact O-N 3.34Å; S106-Y109 WeakPolarHBondContact O-CB 3.27Å; S106-Y109 PolarHBondContact O-N 3.2Å; S106-F110 WeakPolarHBondContact O-CD2 3.34Å; S106-F110 PolarHBondContact O-N 3.43Å
107	V	88.3	Confident	88.7	Confident	53 Å²	53	64.7 Å²	64.7	32%	0.321	34%	0.336	S	S	.	.	H	α-helix	trans	-55.4	-34.7	173.5	177.5	0	0	0	0	111.6	N105 Y109 F110 Y111 I305	N105-V107 PolarHBondContact O-N 3.09Å; N105-V107 PolarHBondContact OD1-N 3.13Å; V107-Y109 VanDerWaalsContact C-N 3.27Å; V107-Y109 PolarHBondContact O-N 3.36Å; V107-F110 PolarHBondContact O-N 3.37Å; V107-Y111 WeakPolarHBondContact O-CB 3.4Å; V107-Y111 PolarHBondContact O-N 3.46Å; V107-I305 HydrophobicContact CG1-CB 4.29Å; V107-I305 HydrophobicContact CG1-CD1 3.99Å; V107-I305 HydrophobicContact CG1-CG2 3.81Å
108	T	89.8	Confident	88.3	Confident	32 Å²	32	66.7 Å²	66.7	20%	0.196	34%	0.34	C	S	.	.	H	α-helix	trans	-60.2	-36.6	176.9	-54.2	0	0	0	0	112.2	N105 S106 N112 P331	N105-T108 WeakPolarHBondContact O-CB 3.16Å; N105-T108 PolarHBondContact O-N 2.92Å; N105-T108 PolarHBondContact O-OG1 2.8Å; S106-T108 PolarHBondContact O-N 3.34Å; T108-N112 VanDerWaalsContact O-CB 3.27Å; T108-N112 WeakPolarHBondContact O-CB 3.4Å; T108-N112 PolarHBondContact O-N 2.64Å; T108-P331 HydrophobicContact CG2-CB 3.53Å; T108-P331 HydrophobicContact CG2-CG 3.31Å
109	Y	91.5	Very high	88	Confident	148 Å²	148	64 Å²	64	58%	0.58	33%	0.325	S	S	*	.	H	α-helix	trans	-67.9	-46.5	176.5	168.9	-96.6	0	0	0	112	S106 V107 Y111 N112 T113	S106-Y109 WeakPolarHBondContact O-CB 3.27Å; S106-Y109 PolarHBondContact O-N 3.2Å; V107-Y109 VanDerWaalsContact C-N 3.27Å; V107-Y109 PolarHBondContact O-N 3.36Å; Y109-Y111 VanDerWaalsContact C-N 3.31Å; Y109-Y111 PolarHBondContact O-N 3.17Å; Y109-N112 PolarHBondContact O-N 2.74Å; Y109-T113 WeakPolarHBondContact O-CB 3.44Å; Y109-T113 PolarHBondContact O-N 2.75Å; Y109-T113 PolarHBondContact O-OG1 2.9Å
110	F	91.5	Very high	87.6	Confident	140 Å²	140	63.5 Å²	63.5	61%	0.614	32%	0.323	S	S	*	.	H	α-helix	trans	-64.3	-38.8	179.2	-70.5	-70.7	0	0	0	111.7	S106 V107 T113 S114	S106-F110 WeakPolarHBondContact O-CD2 3.34Å; S106-F110 PolarHBondContact O-N 3.43Å; V107-F110 PolarHBondContact O-N 3.37Å; F110-T113 PolarHBondContact O-N 3.04Å; F110-S114 WeakPolarHBondContact O-CB 3.45Å; F110-S114 PolarHBondContact O-N 3.45Å; F110-S114 PolarHBondContact O-OG 2.88Å
111	Y	91.2	Very high	86.9	Confident	11 Å²	11	65.9 Å²	65.9	4%	0.043	34%	0.336	C	S	.	.	H	α-helix	trans	-68.1	-43.7	176.3	-174.9	-143.9	0	0	0	112.3	V107 Y109 T113 S114 V115 N178 I300 N302 I305 I307 I309	V107-Y111 WeakPolarHBondContact O-CB 3.4Å; V107-Y111 PolarHBondContact O-N 3.46Å; Y109-Y111 VanDerWaalsContact C-N 3.31Å; Y109-Y111 PolarHBondContact O-N 3.17Å; Y111-T113 VanDerWaalsContact C-N 3.32Å; Y111-T113 PolarHBondContact O-N 2.87Å; Y111-S114 PolarHBondContact O-N 2.94Å; Y111-S114 PolarHBondContact O-OG 2.9Å; Y111-V115 HydrophobicContact CD2-CG2 4.13Å; Y111-V115 HydrophobicContact CE2-CG2 3.74Å; Y111-V115 PolarHBondContact O-N 3.33Å; Y111-V115 VanDerWaalsContact O-N 3.16Å; Y111-N178 WeakPolarHBondContact CE2-OD1 3.23Å; Y111-I300 WeakPolarHBondContact OH-CG2 3.41Å; Y111-N302 HydrophobicContact CE1-CB 4.07Å; Y111-N302 HydrophobicContact CE2-CB 4.16Å; Y111-I305 HydrophobicContact CD1-CD1 3.64Å; Y111-I305 HydrophobicContact CD2-CD1 4.44Å; Y111-I305 HydrophobicContact CE1-CD1 4.22Å; Y111-I305 HydrophobicContact CG-CD1 3.77Å; Y111-I307 HydrophobicContact CD1-CB 4.06Å; Y111-I307 HydrophobicContact CD1-CG2 3.77Å; Y111-I307 HydrophobicContact CE1-CB 4.08Å; Y111-I307 HydrophobicContact CE1-CG2 3.88Å; Y111-I309 HydrophobicContact CD1-CD1 3.21Å; Y111-I309 HydrophobicContact CD1-CG1 3.68Å; Y111-I309 HydrophobicContact CD2-CD1 3.81Å; Y111-I309 HydrophobicContact CE1-CB 4.21Å; Y111-I309 HydrophobicContact CE1-CD1 3.24Å; Y111-I309 HydrophobicContact CE1-CG1 3.37Å; Y111-I309 HydrophobicContact CE2-CD1 3.8Å; Y111-I309 HydrophobicContact CG-CD1 3.52Å; Y111-I309 HydrophobicContact CG-CG1 4.46Å
112	N	91.7	Very high	85.7	Confident	48 Å²	48	61.1 Å²	61.1	26%	0.257	31%	0.312	S	S	.	.	H	α-helix	trans	-57.8	-46.5	173.2	-176.5	23.5	0	0	0	111.4	T108 Y109 S114 V115 Y116 V329 P331	T108-N112 VanDerWaalsContact O-CB 3.27Å; T108-N112 WeakPolarHBondContact O-CB 3.4Å; T108-N112 PolarHBondContact O-N 2.64Å; Y109-N112 PolarHBondContact O-N 2.74Å; N112-S114 PolarHBondContact O-N 2.95Å; N112-V115 PolarHBondContact O-N 3.17Å; N112-Y116 VanDerWaalsContact O-CB 3.27Å; N112-Y116 WeakPolarHBondContact O-CB 3.34Å; N112-Y116 PolarHBondContact O-N 3.15Å; N112-V329 WeakPolarHBondContact OD1-CB 3.36Å; N112-V329 WeakPolarHBondContact OD1-CG1 3.36Å; N112-P331 HydrophobicContact CB-CG 4.37Å
113	T	90.8	Very high	84.2	Confident	33 Å²	33	64.8 Å²	64.8	20%	0.202	33%	0.33	C	S	.	.	H	α-helix	trans	-65.8	-38.8	-178.7	-56.4	0	0	0	0	112.2	Y109 F110 Y111 Y116 K117	Y109-T113 WeakPolarHBondContact O-CB 3.44Å; Y109-T113 PolarHBondContact O-N 2.75Å; Y109-T113 PolarHBondContact O-OG1 2.9Å; F110-T113 PolarHBondContact O-N 3.04Å; Y111-T113 VanDerWaalsContact C-N 3.32Å; Y111-T113 PolarHBondContact O-N 2.87Å; T113-Y116 PolarHBondContact O-N 2.86Å; T113-K117 HydrophobicContact CG2-CD 4.18Å; T113-K117 HydrophobicContact CG2-CG 4.37Å; T113-K117 WeakPolarHBondContact O-CB 3.3Å; T113-K117 WeakPolarHBondContact O-CG 3.39Å; T113-K117 PolarHBondContact O-N 2.84Å
114	S	89	Confident	82.5	Confident	60 Å²	60	66.8 Å²	66.8	42%	0.42	36%	0.356	S	S	.	.	H	α-helix	trans	-66.3	-43	179	66.4	0	0	0	0	111.6	F110 Y111 N112 R118	F110-S114 WeakPolarHBondContact O-CB 3.45Å; F110-S114 PolarHBondContact O-N 3.45Å; F110-S114 PolarHBondContact O-OG 2.88Å; Y111-S114 PolarHBondContact O-N 2.94Å; Y111-S114 PolarHBondContact O-OG 2.9Å; N112-S114 PolarHBondContact O-N 2.95Å; S114-R118 WeakPolarHBondContact O-CB 3.46Å; S114-R118 PolarHBondContact O-N 3.29Å; S114-R118 VanDerWaalsContact O-N 3.09Å
115	V	90.4	Very high	80.8	Confident	8 Å²	8	66 Å²	66	5%	0.048	36%	0.358	C	S	.	.	H	α-helix	trans	-66	-47.3	174.6	174.8	0	0	0	0	110.9	Y111 N112 K117 R118 F119 I300 I309 V311 V329	Y111-V115 HydrophobicContact CD2-CG2 4.13Å; Y111-V115 HydrophobicContact CE2-CG2 3.74Å; Y111-V115 PolarHBondContact O-N 3.33Å; Y111-V115 VanDerWaalsContact O-N 3.16Å; N112-V115 PolarHBondContact O-N 3.17Å; V115-K117 PolarHBondContact O-N 3.12Å; V115-R118 PolarHBondContact O-N 3.34Å; V115-R118 VanDerWaalsContact O-N 3.15Å; V115-F119 HydrophobicContact CG1-CD2 3.72Å; V115-F119 HydrophobicContact CG1-CE2 3.87Å; V115-F119 WeakPolarHBondContact O-CD2 3.28Å; V115-F119 PolarHBondContact O-N 2.99Å; V115-F119 VanDerWaalsContact O-N 3.14Å; V115-I300 HydrophobicContact CG1-CD1 4.28Å; V115-I309 HydrophobicContact CB-CD1 4.12Å; V115-I309 HydrophobicContact CG1-CG2 4.06Å; V115-I309 HydrophobicContact CG2-CD1 3.67Å; V115-V311 HydrophobicContact CG1-CG2 3.78Å; V115-V329 HydrophobicContact CB-CG1 4.45Å; V115-V329 HydrophobicContact CG1-CG1 4.15Å
116	Y	90	Very high	78.9	Confident	81 Å²	81	68.4 Å²	68.4	32%	0.318	38%	0.376	S	S	.	.	H	α-helix	trans	-56.2	-49.1	178.2	179.8	-91.4	0	0	0	111.8	N112 T113 R118 F119 I120 V121 V329	N112-Y116 VanDerWaalsContact O-CB 3.27Å; N112-Y116 WeakPolarHBondContact O-CB 3.34Å; N112-Y116 PolarHBondContact O-N 3.15Å; T113-Y116 PolarHBondContact O-N 2.86Å; Y116-R118 VanDerWaalsContact C-N 3.31Å; Y116-R118 PolarHBondContact O-N 2.96Å; Y116-F119 PolarHBondContact O-N 2.91Å; Y116-I120 HydrophobicContact CD2-CB 4.45Å; Y116-I120 HydrophobicContact CD2-CG1 4.13Å; Y116-I120 HydrophobicContact CE1-CB 4.42Å; Y116-I120 HydrophobicContact CE1-CG2 4.42Å; Y116-I120 HydrophobicContact CE2-CB 4.22Å; Y116-I120 HydrophobicContact CE2-CG1 4.13Å; Y116-I120 HydrophobicContact CE2-CG2 4.12Å; Y116-I120 VanDerWaalsContact O-CB 3.27Å; Y116-I120 WeakPolarHBondContact O-CB 3.48Å; Y116-I120 PolarHBondContact O-N 3.48Å; Y116-V121 HydrophobicContact CD1-CG2 3.98Å; Y116-V121 HydrophobicContact CE1-CG2 3.61Å; Y116-V329 HydrophobicContact CD2-CG2 4.15Å
117	K	87.7	Confident	76.9	Confident	123 Å²	123	68.7 Å²	68.7	54%	0.535	37%	0.374	S	S	.	.	H	α-helix	trans	-60.7	-41.8	178	-75.3	-177.5	178.2	-172.3	0	111.6	T113 V115 F119 V121	T113-K117 HydrophobicContact CG2-CD 4.18Å; T113-K117 HydrophobicContact CG2-CG 4.37Å; T113-K117 WeakPolarHBondContact O-CB 3.3Å; T113-K117 WeakPolarHBondContact O-CG 3.39Å; T113-K117 PolarHBondContact O-N 2.84Å; V115-K117 PolarHBondContact O-N 3.12Å; K117-F119 PolarHBondContact O-N 2.87Å; K117-V121 HydrophobicContact CB-CB 4.41Å; K117-V121 HydrophobicContact CG-CB 4.39Å; K117-V121 HydrophobicContact CG-CG2 4.3Å; K117-V121 CarbonylContact O-C 3.13Å; K117-V121 PolarHBondContact O-N 3.41Å; K117-V121 VanDerWaalsContact O-N 3.12Å
118	R	84.4	Confident	75.2	Confident	98 Å²	98	72 Å²	72	37%	0.37	40%	0.4	S	S	.	.	H	α-helix	trans	-62.1	-45	-177.8	-175.1	62.7	172.9	114.3	-1.9	113.4	S114 V115 Y116 N153 S154	S114-R118 WeakPolarHBondContact O-CB 3.46Å; S114-R118 PolarHBondContact O-N 3.29Å; S114-R118 VanDerWaalsContact O-N 3.09Å; V115-R118 PolarHBondContact O-N 3.34Å; V115-R118 VanDerWaalsContact O-N 3.15Å; Y116-R118 VanDerWaalsContact C-N 3.31Å; Y116-R118 PolarHBondContact O-N 2.96Å; R118-N153 PolarHBondContact NH2-O 3.12Å; R118-S154 PolarHBondContact NH1-OG 3Å; R118-S154 VanDerWaalsContact NH1-OG 3.16Å
119	F	86.8	Confident	73.3	Confident	3 Å²	3	77.8 Å²	77.8	1%	0.013	43%	0.429	C	S	.	.	H	α-helix	trans	-88.2	-29.9	-175	-71.7	-77.8	0	0	0	113.6	V115 Y116 K117 Y146 L151 L155 I174 F298 I300	V115-F119 HydrophobicContact CG1-CD2 3.72Å; V115-F119 HydrophobicContact CG1-CE2 3.87Å; V115-F119 WeakPolarHBondContact O-CD2 3.28Å; V115-F119 PolarHBondContact O-N 2.99Å; V115-F119 VanDerWaalsContact O-N 3.14Å; Y116-F119 PolarHBondContact O-N 2.91Å; K117-F119 PolarHBondContact O-N 2.87Å; F119-Y146 WeakPolarHBondContact O-CE2 3.18Å; F119-Y146 PolarHBondContact O-OH 3.31Å; F119-L151 HydrophobicContact CD1-CD1 3.94Å; F119-L151 HydrophobicContact CE1-CD1 4.19Å; F119-L155 HydrophobicContact CE1-CD2 3.83Å; F119-L155 HydrophobicContact CE1-CG 4.02Å; F119-L155 HydrophobicContact CZ-CD2 4.02Å; F119-I174 HydrophobicContact CZ-CD1 4.07Å; F119-F298 HydrophobicContact CD1-CE2 4.44Å; F119-F298 AromaticContact CD1-CZ 3.72Å; F119-F298 HydrophobicContact CD1-CZ 3.72Å; F119-F298 HydrophobicContact CD2-CE2 4.35Å; F119-F298 HydrophobicContact CD2-CZ 4.1Å; F119-F298 HydrophobicContact CE1-CE1 4.43Å; F119-F298 AromaticContact CE1-CE2 3.85Å; F119-F298 HydrophobicContact CE1-CE2 3.85Å; F119-F298 AromaticContact CE1-CZ 3.49Å; F119-F298 HydrophobicContact CE1-CZ 3.49Å; F119-F298 VanDerWaalsContact CE1-CZ 3.49Å; F119-F298 AromaticContact CE2-CE2 3.76Å; F119-F298 HydrophobicContact CE2-CE2 3.76Å; F119-F298 AromaticContact CE2-CZ 3.92Å; F119-F298 HydrophobicContact CE2-CZ 3.92Å; F119-F298 HydrophobicContact CG-CZ 4.03Å; F119-F298 AromaticContact CZ-CE2 3.47Å; F119-F298 HydrophobicContact CZ-CE2 3.47Å; F119-F298 VanDerWaalsContact CZ-CE2 3.47Å; F119-F298 AromaticContact CZ-CZ 3.6Å; F119-F298 HydrophobicContact CZ-CZ 3.6Å; F119-I300 HydrophobicContact CE2-CD1 3.59Å; F119-I300 HydrophobicContact CZ-CD1 3.89Å
120	I	82.3	Confident	71.4	Confident	6 Å²	6	72.8 Å²	72.8	3%	0.031	42%	0.416	C	S	.	.	H	α-helix	trans	-114.3	-40.9	-166.5	-51.1	-49.7	0	0	0	112.7	Y116 F134 I313 T327	Y116-I120 HydrophobicContact CD2-CB 4.45Å; Y116-I120 HydrophobicContact CD2-CG1 4.13Å; Y116-I120 HydrophobicContact CE1-CB 4.42Å; Y116-I120 HydrophobicContact CE1-CG2 4.42Å; Y116-I120 HydrophobicContact CE2-CB 4.22Å; Y116-I120 HydrophobicContact CE2-CG1 4.13Å; Y116-I120 HydrophobicContact CE2-CG2 4.12Å; Y116-I120 VanDerWaalsContact O-CB 3.27Å; Y116-I120 WeakPolarHBondContact O-CB 3.48Å; Y116-I120 PolarHBondContact O-N 3.48Å; I120-F134 HydrophobicContact CD1-CD2 4.3Å; I120-F134 HydrophobicContact CD1-CG 4.43Å; I120-F134 HydrophobicContact CG2-CB 3.62Å; I120-F134 HydrophobicContact CG2-CD1 3.86Å; I120-F134 HydrophobicContact CG2-CG 3.83Å; I120-F134 WeakPolarHBondContact O-CB 3.48Å; I120-I313 HydrophobicContact CD1-CD1 4.31Å; I120-I313 HydrophobicContact CD1-CG1 4.39Å; I120-T327 HydrophobicContact CD1-CG2 3.24Å; I120-T327 HydrophobicContact CG1-CG2 3.74Å; I120-T327 HydrophobicContact CG2-CG2 4.37Å
121	V	73.9	Confident	69.4	Low	61 Å²	61	69.2 Å²	69.2	37%	0.37	41%	0.407	S	S	.	.			trans	-93	109.6	-175.8	-176.7	0	0	0	0	109.2	Y116 K117	Y116-V121 HydrophobicContact CD1-CG2 3.98Å; Y116-V121 HydrophobicContact CE1-CG2 3.61Å; K117-V121 HydrophobicContact CB-CB 4.41Å; K117-V121 HydrophobicContact CG-CB 4.39Å; K117-V121 HydrophobicContact CG-CG2 4.3Å; K117-V121 CarbonylContact O-C 3.13Å; K117-V121 PolarHBondContact O-N 3.41Å; K117-V121 VanDerWaalsContact O-N 3.12Å
122	T	64.5	Low	67.8	Low	28 Å²	28	74.4 Å²	74.4	17%	0.172	43%	0.432	C	S	.	.			trans	-83.3	115.5	166.7	-43.8	0	0	0	0	107.8	G124 P131 Q150	T122-G124 PolarHBondContact O-N 3.49Å; T122-G124 VanDerWaalsContact O-N 3.13Å; T122-P131 HydrophobicContact CG2-CB 3.97Å; T122-P131 HydrophobicContact CG2-CG 4.01Å; T122-P131 WeakPolarHBondContact CG2-O 3.28Å; T122-Q150 PolarHBondContact OG1-NE2 2.86Å; T122-Q150 PolarHBondContact OG1-OE1 2.96Å
123	D	53.9	Low	66.5	Low	138 Å²	138	74.7 Å²	74.7	74%	0.738	44%	0.436	S	S	*	.			trans	-57.5	120.3	167.2	-74.5	-28.1	0	0	0	106.9	S125	D123-S125 PolarHBondContact O-N 2.81Å
124	G	45.9	Very low	65.6	Low	69 Å²	69	73.5 Å²	73.5	71%	0.711	43%	0.428	S	S	*	.			trans	-67.6	63	-171	0	0	0	0	0	113.6	T122 T126	T122-G124 PolarHBondContact O-N 3.49Å; T122-G124 VanDerWaalsContact O-N 3.13Å; G124-T126 VanDerWaalsContact C-N 3.33Å; G124-T126 PolarHBondContact O-N 3.32Å
125	S	45.1	Very low	64.8	Low	71 Å²	71	77.7 Å²	77.7	50%	0.497	44%	0.441	S	S	.	.			trans	-62.6	101.3	161.6	61.3	0	0	0	0	106.7	D123 T127 S130	D123-S125 PolarHBondContact O-N 2.81Å; S125-T127 PolarHBondContact O-N 2.78Å; S125-S130 WeakPolarHBondContact O-CB 3.04Å; S125-S130 PolarHBondContact O-OG 2.8Å
126	T	41.1	Very low	64.1	Low	141 Å²	141	80.7 Å²	80.7	87%	0.865	46%	0.457	S	S	*	.			trans	-69.5	54.1	-179.8	51.7	0	0	0	0	112.3	G124	G124-T126 VanDerWaalsContact C-N 3.33Å; G124-T126 PolarHBondContact O-N 3.32Å
127	T	45.2	Very low	63.8	Low	90 Å²	90	77 Å²	77	55%	0.552	44%	0.443	S	S	*	.			trans	-97.2	145.2	163.1	55.5	0	0	0	0	108.3	S125 D129 S130	S125-T127 PolarHBondContact O-N 2.78Å; T127-D129 PolarHBondContact O-N 3.49Å; T127-S130 VanDerWaalsContact O-CB 3.28Å; T127-S130 WeakPolarHBondContact O-CB 3.09Å; T127-S130 PolarHBondContact O-N 2.79Å; T127-S130 PolarHBondContact O-OG 3.25Å
128	S	52.6	Low	63.7	Low	124 Å²	124	76 Å²	76	87%	0.867	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-18	-178.9	45	0	0	0	0	114.5
129	D	49.6	Very low	63.9	Low	152 Å²	152	76.4 Å²	76.4	81%	0.813	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	13.6	177.5	-66.4	-27.8	0	0	0	113.6	T127	T127-D129 PolarHBondContact O-N 3.49Å
130	S	51.1	Low	64.1	Low	44 Å²	44	79.9 Å²	79.9	31%	0.308	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-76.4	140.7	179.6	56.9	0	0	0	0	112.6	S125 T127 Q132	S125-S130 WeakPolarHBondContact O-CB 3.04Å; S125-S130 PolarHBondContact O-OG 2.8Å; T127-S130 VanDerWaalsContact O-CB 3.28Å; T127-S130 WeakPolarHBondContact O-CB 3.09Å; T127-S130 PolarHBondContact O-N 2.79Å; T127-S130 PolarHBondContact O-OG 3.25Å; S130-Q132 PolarHBondContact O-N 3.36Å
131	P	50.9	Low	64.5	Low	65 Å²	65	84.4 Å²	84.4	42%	0.422	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-60.4	129.8	176.1	-15.9	25.6	0	0	0	111	T122	T122-P131 HydrophobicContact CG2-CB 3.97Å; T122-P131 HydrophobicContact CG2-CG 4.01Å; T122-P131 WeakPolarHBondContact CG2-O 3.28Å
132	Q	56.2	Low	65.3	Low	119 Å²	119	82.9 Å²	82.9	56%	0.556	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-56.8	143.9	172.1	-66.7	-115.5	-11.7	0	0	110.1	S130 F134 N136	S130-Q132 PolarHBondContact O-N 3.36Å; Q132-F134 PolarHBondContact O-N 3.48Å; Q132-N136 HydrophobicContact CB-CB 4.48Å
133	P	65.3	Low	66.6	Low	54 Å²	54	81.5 Å²	81.5	35%	0.351	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-59.2	143.2	173.2	25.9	-32.8	0	0	0	109.2	Q135 N136	P133-Q135 PolarHBondContact O-N 3.12Å; P133-N136 HydrophobicContact CG-CB 4.07Å; P133-N136 WeakPolarHBondContact CG-ND2 3.42Å; P133-N136 WeakPolarHBondContact O-CB 3.34Å; P133-N136 PolarHBondContact O-N 2.9Å
134	F	71.3	Confident	68.5	Low	8 Å²	8	75.8 Å²	75.8	4%	0.035	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-52	-29.7	-176.8	-177.8	-95.3	0	0	0	113.7	I120 Q132 N136 I137 Y146 I313 F315 G325 T327	I120-F134 HydrophobicContact CD1-CD2 4.3Å; I120-F134 HydrophobicContact CD1-CG 4.43Å; I120-F134 HydrophobicContact CG2-CB 3.62Å; I120-F134 HydrophobicContact CG2-CD1 3.86Å; I120-F134 HydrophobicContact CG2-CG 3.83Å; I120-F134 WeakPolarHBondContact O-CB 3.48Å; Q132-F134 PolarHBondContact O-N 3.48Å; F134-N136 PolarHBondContact O-N 2.9Å; F134-I137 HydrophobicContact CB-CD1 4.5Å; F134-I137 HydrophobicContact CD2-CD1 3.67Å; F134-I137 HydrophobicContact CE2-CD1 4.19Å; F134-I137 HydrophobicContact CG-CD1 4.27Å; F134-I137 WeakPolarHBondContact O-CG1 3.39Å; F134-I137 PolarHBondContact O-N 2.81Å; F134-Y146 HydrophobicContact CD2-CD2 4.42Å; F134-Y146 HydrophobicContact CD2-CE1 4.2Å; F134-Y146 AromaticContact CD2-CE2 3.96Å; F134-Y146 HydrophobicContact CD2-CE2 3.96Å; F134-Y146 AromaticContact CD2-CZ 3.84Å; F134-Y146 HydrophobicContact CE2-CE1 4.14Å; F134-I313 HydrophobicContact CE2-CG2 3.42Å; F134-I313 VanDerWaalsContact CE2-CG2 3.42Å; F134-I313 HydrophobicContact CZ-CG2 3.6Å; F134-F315 HydrophobicContact CD2-CE1 4.46Å; F134-F315 HydrophobicContact CD2-CZ 4.45Å; F134-F315 AromaticContact CE2-CE1 3.62Å; F134-F315 HydrophobicContact CE2-CE1 3.62Å; F134-F315 HydrophobicContact CE2-CE2 4.49Å; F134-F315 AromaticContact CE2-CZ 3.56Å; F134-F315 HydrophobicContact CE2-CZ 3.56Å; F134-F315 AromaticContact CZ-CE1 3.98Å; F134-F315 HydrophobicContact CZ-CE1 3.98Å; F134-F315 HydrophobicContact CZ-CZ 4.21Å; F134-G325 VanDerWaalsContact CE1-C 3.43Å; F134-T327 HydrophobicContact CD1-CG2 4.12Å; F134-T327 HydrophobicContact CE1-CG2 3.51Å; F134-T327 HydrophobicContact CE2-CG2 4.36Å; F134-T327 HydrophobicContact CZ-CG2 3.66Å
135	Q	71.9	Confident	70.7	Confident	148 Å²	148	77.7 Å²	77.7	69%	0.692	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-66.2	-20.7	176.6	-64.9	177.5	-6.4	0	0	114.1	P133 H138	P133-Q135 PolarHBondContact O-N 3.12Å; Q135-H138 PolarHBondContact O-CE1 2.88Å
136	N	75.8	Confident	72.9	Confident	72 Å²	72	74.8 Å²	74.8	39%	0.385	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-98.1	8.8	-179	-68.4	3.8	0	0	0	113.1	Q132 P133 F134 H138	Q132-N136 HydrophobicContact CB-CB 4.48Å; P133-N136 HydrophobicContact CG-CB 4.07Å; P133-N136 WeakPolarHBondContact CG-ND2 3.42Å; P133-N136 WeakPolarHBondContact O-CB 3.34Å; P133-N136 PolarHBondContact O-N 2.9Å; F134-N136 PolarHBondContact O-N 2.9Å; N136-H138 PolarHBondContact O-CD2 2.9Å; N136-H138 PolarHBondContact O-N 2.9Å
137	I	84.4	Confident	75.4	Confident	4 Å²	4	68.1 Å²	68.1	2%	0.021	38%	0.378	C	S	.	.			trans	-79.2	95.6	176.9	-52.8	175.4	0	0	0	108.4	F134 A142 M143 Y146 F315 L323	F134-I137 HydrophobicContact CB-CD1 4.5Å; F134-I137 HydrophobicContact CD2-CD1 3.67Å; F134-I137 HydrophobicContact CE2-CD1 4.19Å; F134-I137 HydrophobicContact CG-CD1 4.27Å; F134-I137 WeakPolarHBondContact O-CG1 3.39Å; F134-I137 PolarHBondContact O-N 2.81Å; I137-A142 HydrophobicContact CG2-CB 3.9Å; I137-M143 HydrophobicContact CG2-CB 3.95Å; I137-Y146 HydrophobicContact CD1-CD1 4.27Å; I137-Y146 HydrophobicContact CD1-CD2 3.94Å; I137-Y146 HydrophobicContact CD1-CG 3.7Å; I137-F315 HydrophobicContact CB-CE1 4.47Å; I137-F315 HydrophobicContact CD1-CE1 3.91Å; I137-F315 HydrophobicContact CD1-CZ 4.28Å; I137-F315 HydrophobicContact CG2-CE1 4.14Å; I137-L323 HydrophobicContact CB-CD2 4.42Å; I137-L323 HydrophobicContact CG2-CD2 3.49Å; I137-L323 VanDerWaalsContact CG2-CD2 3.49Å
138	H	85.6	Confident	77.6	Confident	100 Å²	100	66.6 Å²	66.6	46%	0.463	37%	0.366	S	S	.	.			trans	-106.2	-14.2	-178.6	-58.6	-47.4	0	0	0	114.1	Q135 N136 L323	Q135-H138 PolarHBondContact O-CE1 2.88Å; N136-H138 PolarHBondContact O-CD2 2.9Å; N136-H138 PolarHBondContact O-N 2.9Å; H138-L323 VanDerWaalsContact O-CB 3.27Å; H138-L323 WeakPolarHBondContact O-CB 3.39Å; H138-L323 PolarHBondContact O-N 2.74Å; H138-L323 VanDerWaalsContact O-N 3.12Å
139	D	88.6	Confident	79.4	Confident	108 Å²	108	61.7 Å²	61.7	58%	0.578	34%	0.335	S	S	*	.	S	Bend	trans	-126.6	154.1	-173.7	-67.8	-35.1	0	0	0	112.5	T141 A142 M143	D139-T141 VanDerWaalsContact C-N 3.26Å; D139-T141 PolarHBondContact O-N 2.9Å; D139-A142 PolarHBondContact O-N 3.49Å; D139-A142 VanDerWaalsContact O-N 3.15Å; D139-M143 PolarHBondContact O-N 2.99Å
140	H	91	Very high	81.2	Confident	76 Å²	76	55.4 Å²	55.4	35%	0.352	30%	0.301	S	S	.	.	H	α-helix	trans	-58.3	-37.1	176.8	-64.8	85	0	0	0	112.5	M143 W144	H140-M143 WeakPolarHBondContact O-CB 3.45Å; H140-M143 PolarHBondContact O-N 3.2Å; H140-W144 VanDerWaalsContact O-CD1 3.24Å; H140-W144 PolarHBondContact O-N 3.29Å
141	T	90.6	Very high	83.1	Confident	100 Å²	100	53.4 Å²	53.4	61%	0.613	29%	0.287	S	S	*	.	H	α-helix	trans	-64.6	-44.5	177.2	-49.2	0	0	0	0	111.2	D139 M143 W144 N145	D139-T141 VanDerWaalsContact C-N 3.26Å; D139-T141 PolarHBondContact O-N 2.9Å; T141-M143 VanDerWaalsContact C-N 3.3Å; T141-M143 PolarHBondContact O-N 2.86Å; T141-W144 PolarHBondContact O-N 3.11Å; T141-N145 WeakPolarHBondContact O-CB 3.32Å; T141-N145 PolarHBondContact O-N 3.12Å; T141-N145 PolarHBondContact O-ND2 2.89Å
142	A	90.3	Very high	85	Confident	29 Å²	29	50.5 Å²	50.5	24%	0.24	27%	0.268	C	S	.	.	H	α-helix	trans	-63.8	-37.6	176.7	0	0	0	0	0	111.5	I137 D139 N145 Y146	I137-A142 HydrophobicContact CG2-CB 3.9Å; D139-A142 PolarHBondContact O-N 3.49Å; D139-A142 VanDerWaalsContact O-N 3.15Å; A142-N145 PolarHBondContact O-N 3.34Å; A142-Y146 WeakPolarHBondContact O-CB 3.5Å; A142-Y146 PolarHBondContact O-N 3.46Å
143	M	92.6	Very high	86.5	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.9	-48.2	175.4	-178	-169.3	68	0	0	112	I137 D139 H140 T141 N145 Y146 I147 I287 L294 F315 M317 L323	I137-M143 HydrophobicContact CG2-CB 3.95Å; D139-M143 PolarHBondContact O-N 2.99Å; H140-M143 WeakPolarHBondContact O-CB 3.45Å; H140-M143 PolarHBondContact O-N 3.2Å; T141-M143 VanDerWaalsContact C-N 3.3Å; T141-M143 PolarHBondContact O-N 2.86Å; M143-N145 VanDerWaalsContact C-N 3.34Å; M143-N145 PolarHBondContact O-N 3.26Å; M143-Y146 WeakPolarHBondContact O-CB 3.49Å; M143-Y146 PolarHBondContact O-N 3.08Å; M143-I147 HydrophobicContact CG-CD1 4.05Å; M143-I147 VanDerWaalsContact O-CG1 3.3Å; M143-I147 WeakPolarHBondContact O-CG1 3.46Å; M143-I147 PolarHBondContact O-N 3.47Å; M143-I287 HydrophobicContact CE-CD1 3.48Å; M143-I287 VanDerWaalsContact CE-CD1 3.48Å; M143-I287 HydrophobicContact CE-CG2 4.23Å; M143-L294 HydrophobicContact CE-CD2 4.44Å; M143-L294 HydrophobicContact SD-CD2 3.97Å; M143-F315 HydrophobicContact CG-CD1 4.01Å; M143-F315 HydrophobicContact CG-CD2 3.92Å; M143-F315 HydrophobicContact CG-CE1 3.99Å; M143-F315 HydrophobicContact CG-CE2 3.9Å; M143-F315 HydrophobicContact CG-CG 3.96Å; M143-F315 HydrophobicContact CG-CZ 3.92Å; M143-F315 HydrophobicContact SD-CB 3.97Å; M143-F315 HydrophobicContact SD-CD1 4.31Å; M143-F315 HydrophobicContact SD-CD2 3.96Å; M143-F315 HydrophobicContact SD-CG 3.82Å; M143-M317 HydrophobicContact CE-CE 3.9Å; M143-M317 HydrophobicContact SD-CE 3.61Å; M143-L323 HydrophobicContact CB-CD2 3.72Å; M143-L323 HydrophobicContact CG-CD2 4.16Å; M143-L323 HydrophobicContact SD-CD1 4.15Å; M143-L323 HydrophobicContact SD-CD2 4.21Å
144	W	93.8	Very high	87.6	Confident	17 Å²	17	47 Å²	47	6%	0.064	25%	0.251	C	S	.	.	H	α-helix	trans	-64.9	-37.3	176.4	-79.8	111.4	0	0	0	112.5	H140 T141 Y146 I147 N148 L278 L281 F282 I287	H140-W144 VanDerWaalsContact O-CD1 3.24Å; H140-W144 PolarHBondContact O-N 3.29Å; T141-W144 PolarHBondContact O-N 3.11Å; W144-Y146 VanDerWaalsContact C-N 3.33Å; W144-Y146 PolarHBondContact O-N 2.83Å; W144-I147 HydrophobicContact CE3-CD1 4.45Å; W144-I147 PolarHBondContact O-N 3.5Å; W144-N148 WeakPolarHBondContact O-CB 3.29Å; W144-N148 PolarHBondContact O-N 2.98Å; W144-L278 HydrophobicContact CZ3-CD2 4.03Å; W144-L281 HydrophobicContact CH2-CB 4.06Å; W144-F282 HydrophobicContact CB-CD2 4.39Å; W144-F282 HydrophobicContact CB-CE2 4.34Å; W144-F282 AromaticContact CD1-CD2 3.9Å; W144-F282 AromaticContact CD1-CE2 3.96Å; W144-F282 AromaticContact CD2-CD2 3.7Å; W144-F282 HydrophobicContact CD2-CD2 3.7Å; W144-F282 HydrophobicContact CD2-CE2 4.41Å; W144-F282 AromaticContact CE2-CD2 3.81Å; W144-F282 HydrophobicContact CE3-CD2 4.2Å; W144-F282 AromaticContact CG-CD2 3.77Å; W144-F282 HydrophobicContact CG-CD2 3.77Å; W144-F282 AromaticContact CG-CE2 4Å; W144-F282 HydrophobicContact CG-CE2 4Å; W144-F282 HydrophobicContact CH2-CB 4.3Å; W144-F282 HydrophobicContact CZ2-CB 4.46Å; W144-F282 HydrophobicContact CZ2-CD2 4.4Å; W144-F282 HydrophobicContact CZ3-CB 4.33Å; W144-F282 AromaticContact NE1-CD2 3.92Å; W144-I287 HydrophobicContact CH2-CD1 4.44Å; W144-I287 HydrophobicContact CZ2-CB 4.41Å; W144-I287 HydrophobicContact CZ2-CD1 3.68Å; W144-I287 HydrophobicContact CZ2-CG1 4.02Å
145	N	91.7	Very high	88.5	Confident	109 Å²	109	47 Å²	47	58%	0.583	25%	0.251	S	S	*	.	H	α-helix	trans	-63.3	-38.9	173.3	-71.2	-11.5	0	0	0	111.9	T141 A142 M143 G149	T141-N145 WeakPolarHBondContact O-CB 3.32Å; T141-N145 PolarHBondContact O-N 3.12Å; T141-N145 PolarHBondContact O-ND2 2.89Å; A142-N145 PolarHBondContact O-N 3.34Å; M143-N145 VanDerWaalsContact C-N 3.34Å; M143-N145 PolarHBondContact O-N 3.26Å; N145-G149 WeakPolarHBondContact O-CA 3.26Å; N145-G149 PolarHBondContact O-N 3.34Å
146	Y	91.7	Very high	89.3	Confident	10 Å²	10	41.3 Å²	41.3	4%	0.039	22%	0.223	C	C	.	.	H	α-helix	trans	-64	-46.8	173.5	169.4	-95.3	0	0	0	111.6	F119 F134 I137 A142 M143 W144 G149 Q150 L151 I313 F315	F119-Y146 WeakPolarHBondContact O-CE2 3.18Å; F119-Y146 PolarHBondContact O-OH 3.31Å; F134-Y146 HydrophobicContact CD2-CD2 4.42Å; F134-Y146 HydrophobicContact CD2-CE1 4.2Å; F134-Y146 AromaticContact CD2-CE2 3.96Å; F134-Y146 HydrophobicContact CD2-CE2 3.96Å; F134-Y146 AromaticContact CD2-CZ 3.84Å; F134-Y146 HydrophobicContact CE2-CE1 4.14Å; I137-Y146 HydrophobicContact CD1-CD1 4.27Å; I137-Y146 HydrophobicContact CD1-CD2 3.94Å; I137-Y146 HydrophobicContact CD1-CG 3.7Å; A142-Y146 WeakPolarHBondContact O-CB 3.5Å; A142-Y146 PolarHBondContact O-N 3.46Å; M143-Y146 WeakPolarHBondContact O-CB 3.49Å; M143-Y146 PolarHBondContact O-N 3.08Å; W144-Y146 VanDerWaalsContact C-N 3.33Å; W144-Y146 PolarHBondContact O-N 2.83Å; Y146-G149 PolarHBondContact O-N 3.04Å; Y146-Q150 HydrophobicContact CD2-CB 3.94Å; Y146-Q150 HydrophobicContact CD2-CG 4.39Å; Y146-Q150 HydrophobicContact CE2-CB 4.02Å; Y146-Q150 HydrophobicContact CE2-CG 4.02Å; Y146-Q150 PolarHBondContact O-N 3.21Å; Y146-L151 HydrophobicContact CE1-CB 4.13Å; Y146-L151 PolarHBondContact O-N 3.46Å; Y146-I313 HydrophobicContact CE1-CD1 4.36Å; Y146-I313 HydrophobicContact CE1-CG2 4.32Å; Y146-I313 WeakPolarHBondContact OH-CD1 3.42Å; Y146-F315 HydrophobicContact CD1-CE2 4.38Å; Y146-F315 AromaticContact CD1-CZ 3.72Å; Y146-F315 HydrophobicContact CD1-CZ 3.72Å; Y146-F315 AromaticContact CE1-CZ 3.99Å; Y146-F315 HydrophobicContact CE1-CZ 3.99Å
147	I	93.1	Very high	89.4	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.01	21%	0.214	C	C	.	.	I	π-helix	trans	-61	-56.1	179.4	-68.1	167.9	0	0	0	110	M143 W144 G149 L151 L152 L278 L294 I296	M143-I147 HydrophobicContact CG-CD1 4.05Å; M143-I147 VanDerWaalsContact O-CG1 3.3Å; M143-I147 WeakPolarHBondContact O-CG1 3.46Å; M143-I147 PolarHBondContact O-N 3.47Å; W144-I147 HydrophobicContact CE3-CD1 4.45Å; W144-I147 PolarHBondContact O-N 3.5Å; I147-G149 VanDerWaalsContact C-N 3.28Å; I147-G149 PolarHBondContact O-N 3.01Å; I147-L151 HydrophobicContact CG1-CD2 4.43Å; I147-L151 HydrophobicContact CG2-CD2 4.31Å; I147-L151 WeakPolarHBondContact O-CB 3.19Å; I147-L152 WeakPolarHBondContact O-CG 3.25Å; I147-L152 PolarHBondContact O-N 3.44Å; I147-L278 HydrophobicContact CG2-CD1 4.03Å; I147-L278 HydrophobicContact CG2-CD2 3.89Å; I147-L294 HydrophobicContact CD1-CD2 3.95Å; I147-I296 HydrophobicContact CD1-CD1 3.94Å; I147-I296 HydrophobicContact CG1-CD1 3.82Å
148	N	92.3	Very high	89.1	Confident	57 Å²	57	43.9 Å²	43.9	31%	0.305	23%	0.233	S	C	.	.	I	π-helix	trans	-71.1	-21.4	-177.6	-75.4	-22.1	0	0	0	113.8	W144 L278	W144-N148 WeakPolarHBondContact O-CB 3.29Å; W144-N148 PolarHBondContact O-N 2.98Å; N148-L278 WeakPolarHBondContact OD1-CD1 2.97Å
149	G	88.8	Confident	88.6	Confident	21 Å²	21	41.2 Å²	41.2	22%	0.216	23%	0.228	C	C	.	.	I	π-helix	trans	-100	-91.8	-179.7	0	0	0	0	0	111.8	N145 Y146 I147 L151 N153	N145-G149 WeakPolarHBondContact O-CA 3.26Å; N145-G149 PolarHBondContact O-N 3.34Å; Y146-G149 PolarHBondContact O-N 3.04Å; I147-G149 VanDerWaalsContact C-N 3.28Å; I147-G149 PolarHBondContact O-N 3.01Å; G149-L151 PolarHBondContact O-N 3.12Å; G149-N153 VanDerWaalsContact O-CB 3.22Å; G149-N153 WeakPolarHBondContact O-CB 3.21Å; G149-N153 PolarHBondContact O-N 2.9Å; G149-N153 PolarHBondContact O-ND2 2.79Å
150	Q	87.8	Confident	88.1	Confident	21 Å²	21	40.1 Å²	40.1	10%	0.098	22%	0.216	C	C	.	.	I	π-helix	trans	-60.9	-41.5	-169.1	-177.6	170.5	9.5	0	0	113.4	T122 Y146 S154	T122-Q150 PolarHBondContact OG1-NE2 2.86Å; T122-Q150 PolarHBondContact OG1-OE1 2.96Å; Y146-Q150 HydrophobicContact CD2-CB 3.94Å; Y146-Q150 HydrophobicContact CD2-CG 4.39Å; Y146-Q150 HydrophobicContact CE2-CB 4.02Å; Y146-Q150 HydrophobicContact CE2-CG 4.02Å; Y146-Q150 PolarHBondContact O-N 3.21Å; Q150-S154 VanDerWaalsContact O-CB 3.24Å; Q150-S154 WeakPolarHBondContact O-CB 2.94Å; Q150-S154 PolarHBondContact O-N 2.77Å; Q150-S154 VanDerWaalsContact O-N 3.12Å; Q150-S154 PolarHBondContact O-OG 3.15Å
151	L	91.3	Very high	87.3	Confident	1 Å²	1	46 Å²	46	1%	0.005	24%	0.237	C	C	.	.	I	π-helix	trans	-68.3	-52.8	-178.7	175.5	67	0	0	0	111.5	F119 Y146 I147 G149 N153 S154 L155 I296 F298 I313	F119-L151 HydrophobicContact CD1-CD1 3.94Å; F119-L151 HydrophobicContact CE1-CD1 4.19Å; Y146-L151 HydrophobicContact CE1-CB 4.13Å; Y146-L151 PolarHBondContact O-N 3.46Å; I147-L151 HydrophobicContact CG1-CD2 4.43Å; I147-L151 HydrophobicContact CG2-CD2 4.31Å; I147-L151 WeakPolarHBondContact O-CB 3.19Å; G149-L151 PolarHBondContact O-N 3.12Å; L151-N153 PolarHBondContact O-N 2.69Å; L151-S154 WeakPolarHBondContact O-CB 3.18Å; L151-S154 PolarHBondContact O-N 3.01Å; L151-S154 VanDerWaalsContact O-N 3.08Å; L151-L155 HydrophobicContact CD1-CD1 3.83Å; L151-L155 HydrophobicContact CD1-CG 4.13Å; L151-L155 HydrophobicContact CG-CD1 3.91Å; L151-L155 WeakPolarHBondContact O-CG 3.38Å; L151-L155 PolarHBondContact O-N 2.7Å; L151-I296 HydrophobicContact CD2-CD1 3.8Å; L151-I296 HydrophobicContact CD2-CG2 3.9Å; L151-F298 HydrophobicContact CD1-CE1 4.06Å; L151-F298 HydrophobicContact CD1-CZ 4.49Å; L151-I313 HydrophobicContact CD1-CD1 3.84Å
152	L	90.7	Very high	87.1	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-60.4	-46.2	178	-70.4	-174.3	0	0	0	112.3	I147 S154 L155 Y156 T274 V275 L278	I147-L152 WeakPolarHBondContact O-CG 3.25Å; I147-L152 PolarHBondContact O-N 3.44Å; L152-S154 PolarHBondContact O-N 3.25Å; L152-S154 VanDerWaalsContact O-N 3.12Å; L152-L155 PolarHBondContact O-N 3.22Å; L152-L155 VanDerWaalsContact O-N 3.11Å; L152-Y156 HydrophobicContact CB-CD2 4.46Å; L152-Y156 HydrophobicContact CD2-CD2 3.92Å; L152-Y156 HydrophobicContact CD2-CE2 3.62Å; L152-Y156 PolarHBondContact O-N 3.44Å; L152-T274 HydrophobicContact CD2-CG2 3.54Å; L152-V275 HydrophobicContact CD1-CG2 3.78Å; L152-L278 HydrophobicContact CD1-CD1 3.7Å; L152-L278 HydrophobicContact CD2-CD1 3.85Å; L152-L278 HydrophobicContact CG-CD1 4.06Å
153	N	88.1	Confident	86.5	Confident	100 Å²	100	54 Å²	54	54%	0.535	26%	0.255	S	S	.	.	H	α-helix	trans	-64	-18	177.3	-67.7	-18.1	0	0	0	113.1	R118 G149 L151	R118-N153 PolarHBondContact NH2-O 3.12Å; G149-N153 VanDerWaalsContact O-CB 3.22Å; G149-N153 WeakPolarHBondContact O-CB 3.21Å; G149-N153 PolarHBondContact O-N 2.9Å; G149-N153 PolarHBondContact O-ND2 2.79Å; L151-N153 PolarHBondContact O-N 2.69Å
154	S	88.1	Confident	86	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.007	28%	0.283	C	S	.	.	H	α-helix	trans	-90.2	-34.5	174.6	-60.9	0	0	0	0	112.3	R118 Q150 L151 L152 W157	R118-S154 PolarHBondContact NH1-OG 3Å; R118-S154 VanDerWaalsContact NH1-OG 3.16Å; Q150-S154 VanDerWaalsContact O-CB 3.24Å; Q150-S154 WeakPolarHBondContact O-CB 2.94Å; Q150-S154 PolarHBondContact O-N 2.77Å; Q150-S154 VanDerWaalsContact O-N 3.12Å; Q150-S154 PolarHBondContact O-OG 3.15Å; L151-S154 WeakPolarHBondContact O-CB 3.18Å; L151-S154 PolarHBondContact O-N 3.01Å; L151-S154 VanDerWaalsContact O-N 3.08Å; L152-S154 PolarHBondContact O-N 3.25Å; L152-S154 VanDerWaalsContact O-N 3.12Å; S154-W157 PolarHBondContact O-NE1 2.88Å
155	L	90.1	Very high	85.3	Confident	8 Å²	8	65.1 Å²	65.1	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-78.9	-42	179.5	-73.1	173.9	0	0	0	113.4	F119 L151 L152 I174 A184 F298	F119-L155 HydrophobicContact CE1-CD2 3.83Å; F119-L155 HydrophobicContact CE1-CG 4.02Å; F119-L155 HydrophobicContact CZ-CD2 4.02Å; L151-L155 HydrophobicContact CD1-CD1 3.83Å; L151-L155 HydrophobicContact CD1-CG 4.13Å; L151-L155 HydrophobicContact CG-CD1 3.91Å; L151-L155 WeakPolarHBondContact O-CG 3.38Å; L151-L155 PolarHBondContact O-N 2.7Å; L152-L155 PolarHBondContact O-N 3.22Å; L152-L155 VanDerWaalsContact O-N 3.11Å; L155-I174 HydrophobicContact CD2-CD1 4.44Å; L155-A184 HydrophobicContact CD1-CB 4.28Å; L155-F298 HydrophobicContact CD2-CD1 4.29Å; L155-F298 HydrophobicContact CD2-CD2 3.83Å; L155-F298 HydrophobicContact CD2-CE1 4.32Å; L155-F298 HydrophobicContact CD2-CE2 3.87Å; L155-F298 HydrophobicContact CD2-CG 4.05Å; L155-F298 HydrophobicContact CD2-CZ 4.11Å
156	Y	87.9	Confident	84.6	Confident	27 Å²	27	60.4 Å²	60.4	11%	0.106	29%	0.291	C	S	.	.			trans	-115.1	123.3	-172.8	-55.7	-82	0	0	0	110.8	L152 S268 R269 N271 T274	L152-Y156 HydrophobicContact CB-CD2 4.46Å; L152-Y156 HydrophobicContact CD2-CD2 3.92Å; L152-Y156 HydrophobicContact CD2-CE2 3.62Å; L152-Y156 PolarHBondContact O-N 3.44Å; Y156-S268 VanDerWaalsContact CE1-O 3.32Å; Y156-S268 WeakPolarHBondContact CE1-O 3.41Å; Y156-S268 PolarHBondContact OH-O 2.9Å; Y156-R269 WeakPolarHBondContact CE1-O 3.44Å; Y156-N271 HydrophobicContact CD1-CB 4.4Å; Y156-N271 HydrophobicContact CG-CB 4.02Å; Y156-T274 HydrophobicContact CE2-CG2 3.89Å; Y156-T274 PolarHBondContact OH-OG1 2.95Å; Y156-T274 VanDerWaalsContact OH-OG1 3.09Å
157	W	79.1	Confident	83.9	Confident	52 Å²	52	62.7 Å²	62.7	20%	0.197	31%	0.308	C	S	.	.			trans	-116.1	119.1	-177.7	-74.5	20.6	0	0	0	110.7	S154 I174 A175	S154-W157 PolarHBondContact O-NE1 2.88Å; W157-I174 HydrophobicContact CZ2-CG2 4.12Å; W157-A175 HydrophobicContact CH2-CB 3.87Å; W157-A175 HydrophobicContact CZ2-CB 4.18Å; W157-A175 VanDerWaalsContact CZ3-CA 3.48Å
158	D	77	Confident	82.8	Confident	79 Å²	79	68.8 Å²	68.8	42%	0.422	33%	0.334	S	S	.	.			trans	-98.4	-25.8	-179.6	-60.8	-38.2	0	0	0	112.6	N165 V166	D158-N165 WeakPolarHBondContact O-CA 3.19Å; D158-V166 PolarHBondContact O-N 2.94Å
159	A	76.7	Confident	81.7	Confident	44 Å²	44	71.8 Å²	71.8	36%	0.364	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-138.3	146.6	-175.6	0	0	0	0	0	113.5	L164	A159-L164 CarbonylContact C-O 3.54Å; A159-L164 VanDerWaalsContact CA-O 3.27Å; A159-L164 WeakPolarHBondContact CA-O 3.46Å
160	W	76.4	Confident	81	Confident	85 Å²	85	74.5 Å²	74.5	32%	0.322	36%	0.357	S	S	.	.			trans	-70.9	170.5	170.6	-74.4	93.3	0	0	0	111.8	N162 R163 L164 V166 H176	W160-N162 WeakPolarHBondContact CB-OD1 3.26Å; W160-N162 PolarHBondContact O-N 3.48Å; W160-R163 WeakPolarHBondContact O-CA 3.35Å; W160-R163 PolarHBondContact O-N 2.93Å; W160-L164 PolarHBondContact N-O 3.37Å; W160-V166 HydrophobicContact CG-CG2 4.23Å; W160-H176 AromaticContact CE3-CE1 3.52Å; W160-H176 AromaticContact CE3-ND1 3.55Å; W160-H176 AromaticContact CH2-ND1 3.65Å; W160-H176 AromaticContact CZ3-CE1 3.36Å; W160-H176 WeakPolarHBondContact CZ3-CE1 3.27Å; W160-H176 AromaticContact CZ3-ND1 2.92Å; W160-H176 WeakPolarHBondContact CZ3-ND1 3.4Å
161	Y	76.1	Confident	80.4	Confident	198 Å²	198	78.7 Å²	78.7	78%	0.776	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-22.5	177.4	67.9	-93.6	0	0	0	113.7	R163	Y161-R163 VanDerWaalsContact C-N 3.35Å
162	N	84.6	Confident	79.7	Confident	78 Å²	78	79.8 Å²	79.8	42%	0.417	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	10.3	174.5	64.7	0.2	0	0	0	113.6	W160 L164	W160-N162 WeakPolarHBondContact CB-OD1 3.26Å; W160-N162 PolarHBondContact O-N 3.48Å; N162-L164 WeakPolarHBondContact ND2-CD1 3.45Å; N162-L164 PolarHBondContact O-N 2.89Å; N162-L164 WeakPolarHBondContact OD1-CB 3.42Å; N162-L164 PolarHBondContact OD1-N 3.49Å; N162-L164 VanDerWaalsContact OD1-N 3.16Å
163	R	78.4	Confident	79.2	Confident	221 Å²	221	83 Å²	83	83%	0.834	39%	0.392	S	S	*	.	S	Bend	trans	64.4	15.9	-178.1	-51.1	-177.6	-178.2	-179.7	-0.4	115.4	W160 Y161	W160-R163 WeakPolarHBondContact O-CA 3.35Å; W160-R163 PolarHBondContact O-N 2.93Å; Y161-R163 VanDerWaalsContact C-N 3.35Å
164	L	81.4	Confident	78.7	Confident	110 Å²	110	78.5 Å²	78.5	58%	0.576	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-80	141.2	170.1	-64.6	-179.6	0	0	0	110.4	A159 W160 N162	A159-L164 CarbonylContact C-O 3.54Å; A159-L164 VanDerWaalsContact CA-O 3.27Å; A159-L164 WeakPolarHBondContact CA-O 3.46Å; W160-L164 PolarHBondContact N-O 3.37Å; N162-L164 WeakPolarHBondContact ND2-CD1 3.45Å; N162-L164 PolarHBondContact O-N 2.89Å; N162-L164 WeakPolarHBondContact OD1-CB 3.42Å; N162-L164 PolarHBondContact OD1-N 3.49Å; N162-L164 VanDerWaalsContact OD1-N 3.16Å
165	N	80.7	Confident	77.8	Confident	139 Å²	139	80.4 Å²	80.4	74%	0.743	38%	0.383	S	S	*	.	B	Isolated β-bridge	trans	-65.2	138.5	-179.9	-70.1	-9.3	0	0	0	111.4	D158	D158-N165 WeakPolarHBondContact O-CA 3.19Å
166	V	77.2	Confident	77	Confident	11 Å²	11	84.4 Å²	84.4	7%	0.067	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-76.8	139.1	176	-177.7	0	0	0	0	109.3	D158 W160 E170 R171	D158-V166 PolarHBondContact O-N 2.94Å; W160-V166 HydrophobicContact CG-CG2 4.23Å; V166-E170 VanDerWaalsContact CG1-C 3.45Å; V166-E170 HydrophobicContact CG1-CB 3.19Å; V166-E170 HydrophobicContact CG1-CG 4.45Å; V166-R171 HydrophobicContact CG1-CG 4.32Å
167	S	76.9	Confident	76.8	Confident	57 Å²	57	87 Å²	87	40%	0.399	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-68.4	158.6	176.7	70.6	0	0	0	0	111.6	N169 E170 R171	S167-N169 VanDerWaalsContact C-N 3.25Å; S167-N169 PolarHBondContact O-N 2.89Å; S167-N169 VanDerWaalsContact O-N 3.17Å; S167-E170 WeakPolarHBondContact CB-OE2 3.49Å; S167-E170 PolarHBondContact N-OE2 2.83Å; S167-E170 PolarHBondContact O-N 2.92Å; S167-E170 WeakPolarHBondContact OG-CB 3.33Å; S167-E170 WeakPolarHBondContact OG-CG 3.36Å; S167-E170 PolarHBondContact OG-OE2 3.23Å; S167-R171 PolarHBondContact O-N 2.81Å; S167-R171 VanDerWaalsContact O-N 3.15Å
168	F	68.3	Low	77.3	Confident	130 Å²	130	85.3 Å²	85.3	57%	0.57	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-39	-176.5	-178.1	-96.6	0	0	0	113.4	E170	F168-E170 VanDerWaalsContact C-N 3.33Å
169	N	69.9	Low	77.9	Confident	120 Å²	120	84.6 Å²	84.6	64%	0.642	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-24.1	179.1	-69	-10.1	0	0	0	113.1	S167	S167-N169 VanDerWaalsContact C-N 3.25Å; S167-N169 PolarHBondContact O-N 2.89Å; S167-N169 VanDerWaalsContact O-N 3.17Å
170	E	73.7	Confident	78.6	Confident	78 Å²	78	83.3 Å²	83.3	36%	0.364	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-16.3	-180	-70.3	166.9	159	0	0	112.4	V166 S167 F168 E172 F173	V166-E170 VanDerWaalsContact CG1-C 3.45Å; V166-E170 HydrophobicContact CG1-CB 3.19Å; V166-E170 HydrophobicContact CG1-CG 4.45Å; S167-E170 WeakPolarHBondContact CB-OE2 3.49Å; S167-E170 PolarHBondContact N-OE2 2.83Å; S167-E170 PolarHBondContact O-N 2.92Å; S167-E170 WeakPolarHBondContact OG-CB 3.33Å; S167-E170 WeakPolarHBondContact OG-CG 3.36Å; S167-E170 PolarHBondContact OG-OE2 3.23Å; F168-E170 VanDerWaalsContact C-N 3.33Å; E170-E172 PolarHBondContact O-N 2.69Å; E170-E172 VanDerWaalsContact O-N 3.12Å; E170-F173 WeakPolarHBondContact O-CB 3.42Å; E170-F173 PolarHBondContact O-N 3.06Å
171	R	75.6	Confident	79.2	Confident	109 Å²	109	80.2 Å²	80.2	41%	0.411	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-22.2	179.5	-72.5	-178.9	-174.7	-170.6	-3.9	114.1	V166 S167 F173	V166-R171 HydrophobicContact CG1-CG 4.32Å; S167-R171 PolarHBondContact O-N 2.81Å; S167-R171 VanDerWaalsContact O-N 3.15Å; R171-F173 VanDerWaalsContact C-N 3.26Å; R171-F173 PolarHBondContact O-N 2.82Å
172	E	76.9	Confident	79.9	Confident	25 Å²	25	71.2 Å²	71.2	12%	0.117	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-9.8	176.2	-56.6	-169.6	139.5	0	0	113.4	E170 K179 V180 R269	E170-E172 PolarHBondContact O-N 2.69Å; E170-E172 VanDerWaalsContact O-N 3.12Å; E172-K179 HydrophobicContact CB-CG 4.33Å; E172-K179 CarbonylContact O-C 3.58Å; E172-K179 WeakPolarHBondContact O-CA 2.73Å; E172-K179 WeakPolarHBondContact OE2-CE 3.27Å; E172-K179 IonicContact OE2-NZ 2.8Å; E172-K179 PolarHBondContact OE2-NZ 3.16Å; E172-V180 PolarHBondContact O-N 2.92Å; E172-R269 VanDerWaalsContact CD-NH2 3.35Å; E172-R269 IonicContact OE1-CZ 2.83Å; E172-R269 IonicContact OE1-NE 3.69Å; E172-R269 PolarHBondContact OE1-NE 3.3Å; E172-R269 IonicContact OE1-NH2 3.15Å; E172-R269 PolarHBondContact OE1-NH2 3.46Å
173	F	80.7	Confident	80.3	Confident	71 Å²	71	67.7 Å²	67.7	31%	0.311	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	125.1	-178.2	-68.5	-97	0	0	0	111.4	E170 R171 N178 K179	E170-F173 WeakPolarHBondContact O-CB 3.42Å; E170-F173 PolarHBondContact O-N 3.06Å; R171-F173 VanDerWaalsContact C-N 3.26Å; R171-F173 PolarHBondContact O-N 2.82Å; F173-N178 CarbonylContact C-O 3.58Å; F173-N178 WeakPolarHBondContact CA-O 3.4Å; F173-K179 HydrophobicContact CD1-CB 4.1Å; F173-K179 HydrophobicContact CE1-CB 3.96Å; F173-K179 HydrophobicContact CZ-CB 4.43Å; F173-K179 HydrophobicContact CZ-CD 4.25Å
174	I	76.3	Confident	81	Confident	6 Å²	6	57.3 Å²	57.3	3%	0.031	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	131.3	169.7	-57.4	173	0	0	0	108.7	F119 L155 W157 H176 N178 V180 I300	F119-I174 HydrophobicContact CZ-CD1 4.07Å; L155-I174 HydrophobicContact CD2-CD1 4.44Å; W157-I174 HydrophobicContact CZ2-CG2 4.12Å; I174-H176 VanDerWaalsContact C-N 3.25Å; I174-H176 PolarHBondContact O-N 3.06Å; I174-N178 HydrophobicContact CB-CB 4.48Å; I174-N178 PolarHBondContact N-O 3Å; I174-N178 WeakPolarHBondContact O-CB 3.37Å; I174-N178 PolarHBondContact O-N 2.82Å; I174-N178 VanDerWaalsContact O-N 3.09Å; I174-N178 PolarHBondContact O-ND2 2.85Å; I174-N178 VanDerWaalsContact O-ND2 3.08Å; I174-V180 HydrophobicContact CD1-CG2 3.21Å; I174-V180 HydrophobicContact CG1-CG2 3.68Å; I174-I300 HydrophobicContact CD1-CD1 4.04Å; I174-I300 HydrophobicContact CD1-CG1 4.45Å
175	A	70.8	Confident	81.7	Confident	41 Å²	41	53.4 Å²	53.4	34%	0.339	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	43.6	176.5	0	0	0	0	0	113	W157 D177	W157-A175 HydrophobicContact CH2-CB 3.87Å; W157-A175 HydrophobicContact CZ2-CB 4.18Å; W157-A175 VanDerWaalsContact CZ3-CA 3.48Å; A175-D177 PolarHBondContact O-N 3.07Å
176	H	72.5	Confident	82.5	Confident	92 Å²	92	47 Å²	47	43%	0.426	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	-49.7	176	-46.3	-60.4	0	0	0	114.7	W160 I174	W160-H176 AromaticContact CE3-CE1 3.52Å; W160-H176 AromaticContact CE3-ND1 3.55Å; W160-H176 AromaticContact CH2-ND1 3.65Å; W160-H176 AromaticContact CZ3-CE1 3.36Å; W160-H176 WeakPolarHBondContact CZ3-CE1 3.27Å; W160-H176 AromaticContact CZ3-ND1 2.92Å; W160-H176 WeakPolarHBondContact CZ3-ND1 3.4Å; I174-H176 VanDerWaalsContact C-N 3.25Å; I174-H176 PolarHBondContact O-N 3.06Å
177	D	83.4	Confident	83.4	Confident	80 Å²	80	46.6 Å²	46.6	43%	0.428	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.2	-10.2	-168.4	-68	-48.2	0	0	0	115	A175 N304	A175-D177 PolarHBondContact O-N 3.07Å; D177-N304 PolarHBondContact OD1-ND2 3.33Å; D177-N304 VanDerWaalsContact OD1-ND2 3.07Å; D177-N304 PolarHBondContact OD2-ND2 2.72Å
178	N	89.9	Confident	84.3	Confident	18 Å²	18	43.9 Å²	43.9	10%	0.096	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	111.9	-172.9	-48	-74.5	0	0	0	111.1	Y111 F173 I174 I300 Y301 N302	Y111-N178 WeakPolarHBondContact CE2-OD1 3.23Å; F173-N178 CarbonylContact C-O 3.58Å; F173-N178 WeakPolarHBondContact CA-O 3.4Å; I174-N178 HydrophobicContact CB-CB 4.48Å; I174-N178 PolarHBondContact N-O 3Å; I174-N178 WeakPolarHBondContact O-CB 3.37Å; I174-N178 PolarHBondContact O-N 2.82Å; I174-N178 VanDerWaalsContact O-N 3.09Å; I174-N178 PolarHBondContact O-ND2 2.85Å; I174-N178 VanDerWaalsContact O-ND2 3.08Å; N178-I300 HydrophobicContact CB-CG2 3.5Å; N178-Y301 CarbonylContact C-O 3.6Å; N178-N302 PolarHBondContact OD1-ND2 3.31Å
179	K	89.9	Confident	85.7	Confident	63 Å²	63	37.8 Å²	37.8	27%	0.274	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	127.2	179.9	-176.7	171	179.5	158.4	0	111.6	E172 F173 L181 I300 Y301	E172-K179 HydrophobicContact CB-CG 4.33Å; E172-K179 CarbonylContact O-C 3.58Å; E172-K179 WeakPolarHBondContact O-CA 2.73Å; E172-K179 WeakPolarHBondContact OE2-CE 3.27Å; E172-K179 IonicContact OE2-NZ 2.8Å; E172-K179 PolarHBondContact OE2-NZ 3.16Å; F173-K179 HydrophobicContact CD1-CB 4.1Å; F173-K179 HydrophobicContact CE1-CB 3.96Å; F173-K179 HydrophobicContact CZ-CB 4.43Å; F173-K179 HydrophobicContact CZ-CD 4.25Å; K179-L181 HydrophobicContact CD-CD2 4.39Å; K179-L181 HydrophobicContact CG-CD2 4.35Å; K179-L181 PolarHBondContact O-N 3.08Å; K179-I300 CarbonylContact O-C 3.59Å; K179-I300 WeakPolarHBondContact O-CA 3.47Å; K179-Y301 PolarHBondContact N-O 3.5Å; K179-Y301 PolarHBondContact O-N 2.67Å
180	V	90.4	Very high	86.9	Confident	18 Å²	18	32.8 Å²	32.8	11%	0.109	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	127.2	165.5	-176.4	0	0	0	0	108.4	E172 I174	E172-V180 PolarHBondContact O-N 2.92Å; I174-V180 HydrophobicContact CD1-CG2 3.21Å; I174-V180 HydrophobicContact CG1-CG2 3.68Å
181	L	89.4	Confident	88	Confident	19 Å²	19	29.1 Å²	29.1	10%	0.099	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	124.4	176.9	-65.8	-174.4	0	0	0	109.9	K179 T299 Y301 F308 L411 P419 F421	K179-L181 HydrophobicContact CD-CD2 4.39Å; K179-L181 HydrophobicContact CG-CD2 4.35Å; K179-L181 PolarHBondContact O-N 3.08Å; L181-T299 HydrophobicContact CD1-CG2 4.28Å; L181-T299 PolarHBondContact N-O 2.92Å; L181-Y301 HydrophobicContact CD1-CG 4.47Å; L181-F308 HydrophobicContact CD1-CD1 3.53Å; L181-F308 HydrophobicContact CD1-CE1 3.33Å; L181-L411 HydrophobicContact CB-CD2 4.18Å; L181-L411 HydrophobicContact CD1-CD2 4.37Å; L181-P419 HydrophobicContact CB-CG 4.39Å; L181-P419 WeakPolarHBondContact O-CD 3.48Å; L181-P419 VanDerWaalsContact O-CG 3.29Å; L181-P419 WeakPolarHBondContact O-CG 3.48Å; L181-F421 HydrophobicContact CD1-CE2 4.31Å
182	G	90.3	Very high	88.9	Confident	9 Å²	9	25.6 Å²	25.6	9%	0.093	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	61.8	-137.8	-177.5	0	0	0	0	0	112.2	I415 S417	G182-I415 WeakPolarHBondContact CA-O 3.49Å; G182-S417 VanDerWaalsContact CA-O 3.26Å; G182-S417 WeakPolarHBondContact CA-O 3.35Å
183	V	92.8	Very high	89.6	Confident	5 Å²	5	26.2 Å²	26.2	3%	0.03	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	156.4	178.4	-63.8	0	0	0	0	111.3	D266 L267 R269 S416 Y418	V183-D266 HydrophobicContact CG2-CB 3.95Å; V183-L267 WeakPolarHBondContact CB-O 3.3Å; V183-L267 WeakPolarHBondContact CG1-O 3.3Å; V183-R269 HydrophobicContact CG1-CG 3.88Å; V183-S416 WeakPolarHBondContact CG2-O 3.44Å; V183-Y418 WeakPolarHBondContact O-CD2 3.25Å
184	A	94.9	Very high	90	Very high	2 Å²	2	26.6 Å²	26.6	2%	0.017	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	149.4	171.2	0	0	0	0	0	110.8	L155 L267 D297 F298	L155-A184 HydrophobicContact CD1-CB 4.28Å; A184-L267 HydrophobicContact CB-CD1 3.91Å; A184-L267 HydrophobicContact CB-CG 4.28Å; A184-L267 WeakPolarHBondContact O-CB 3.44Å; A184-L267 PolarHBondContact O-N 3.36Å; A184-D297 CarbonylContact C-O 3.54Å; A184-D297 WeakPolarHBondContact CA-O 3.36Å; A184-F298 HydrophobicContact CB-CB 3.78Å; A184-F298 HydrophobicContact CB-CD1 4.44Å; A184-F298 HydrophobicContact CB-CG 4.45Å
185	R	95.3	Very high	90.7	Very high	29 Å²	29	31.7 Å²	31.7	11%	0.109	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	128.8	-179.9	174.1	172.5	-73.4	-175.4	-5.2	110.8	T246 D266 I296 D297 Y418	R185-T246 PolarHBondContact NH1-O 2.97Å; R185-D266 WeakPolarHBondContact CB-OD1 3.48Å; R185-D266 WeakPolarHBondContact CG-OD1 3.33Å; R185-D266 IonicContact CZ-OD1 3.96Å; R185-D266 IonicContact CZ-OD2 3.34Å; R185-D266 IonicContact NE-OD1 2.78Å; R185-D266 PolarHBondContact NE-OD1 2.73Å; R185-D266 IonicContact NE-OD2 2.67Å; R185-D266 IonicContact NH2-OD1 3.75Å; R185-D266 PolarHBondContact NH2-OD1 3.2Å; R185-D266 VanDerWaalsContact NH2-OD1 3.15Å; R185-D266 IonicContact NH2-OD2 3.61Å; R185-D266 PolarHBondContact NH2-OD2 3.02Å; R185-I296 WeakPolarHBondContact O-CA 3.37Å; R185-D297 PolarHBondContact N-O 3.12Å; R185-D297 PolarHBondContact O-N 3.44Å; R185-Y418 HydrophobicContact CB-CD2 3.37Å; R185-Y418 HydrophobicContact CB-CE2 3.57Å; R185-Y418 HydrophobicContact CB-CG 3.95Å; R185-Y418 HydrophobicContact CG-CD2 4.43Å; R185-Y418 VanDerWaalsContact NH1-CD1 3.33Å
186	L	96.7	Very high	91.6	Very high	3 Å²	3	31.5 Å²	31.5	2%	0.016	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	131.9	164.7	-61.3	174.6	0	0	0	108.8	I264 Q265 L267 L278 L281 W286 F295 I296	L186-I264 CarbonylContact O-C 3.59Å; L186-I264 VanDerWaalsContact O-CA 3.29Å; L186-I264 WeakPolarHBondContact O-CA 3.16Å; L186-Q265 HydrophobicContact CB-CB 4.43Å; L186-Q265 PolarHBondContact N-O 3Å; L186-Q265 PolarHBondContact O-N 3.43Å; L186-L267 HydrophobicContact CD1-CD2 3.95Å; L186-L267 HydrophobicContact CG-CD2 4.18Å; L186-L278 HydrophobicContact CD1-CD2 3.76Å; L186-L281 HydrophobicContact CD1-CD1 3.72Å; L186-W286 HydrophobicContact CB-CH2 3.99Å; L186-W286 HydrophobicContact CB-CZ3 4.12Å; L186-F295 CarbonylContact C-O 3.52Å; L186-F295 WeakPolarHBondContact CA-O 3.46Å; L186-I296 HydrophobicContact CD2-CB 4.14Å; L186-I296 HydrophobicContact CD2-CD1 3.82Å; L186-I296 HydrophobicContact CD2-CG1 3.56Å; L186-I296 HydrophobicContact CD2-CG2 3.93Å
187	R	96.2	Very high	92.4	Very high	3 Å²	3	34 Å²	34	1%	0.011	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	121.7	174.2	-179.7	176.7	67.5	96	0.4	110.6	D259 G260 S261 Y263 I264 F295	R187-D259 PolarHBondContact NH1-O 3.09Å; R187-G260 PolarHBondContact NH1-O 3.01Å; R187-S261 PolarHBondContact NH1-O 3.49Å; R187-Y263 CarbonylContact C-O 3.22Å; R187-Y263 VanDerWaalsContact CA-O 3.3Å; R187-Y263 WeakPolarHBondContact CA-O 3.48Å; R187-I264 HydrophobicContact CB-CG2 4.07Å; R187-I264 HydrophobicContact CG-CG2 3.87Å; R187-F295 HydrophobicContact CB-CB 4.24Å; R187-F295 PolarHBondContact N-O 3.47Å; R187-F295 VanDerWaalsContact NH2-CD2 3.33Å; R187-F295 PolarHBondContact O-N 3.44Å
188	Q	96.4	Very high	92.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	136.8	-177.7	-177.1	-167	32.9	0	0	111	R190 G262 Y263 W286 T291 A293	Q188-R190 HydrophobicContact CG-CG 4.03Å; Q188-G262 CarbonylContact O-C 3.54Å; Q188-G262 VanDerWaalsContact O-CA 3.27Å; Q188-G262 WeakPolarHBondContact O-CA 3.43Å; Q188-Y263 PolarHBondContact N-O 2.89Å; Q188-Y263 PolarHBondContact O-N 2.86Å; Q188-W286 HydrophobicContact CB-CE3 4.48Å; Q188-W286 HydrophobicContact CB-CH2 3.39Å; Q188-W286 HydrophobicContact CB-CZ2 3.53Å; Q188-W286 HydrophobicContact CB-CZ3 3.9Å; Q188-W286 HydrophobicContact CG-CH2 4.49Å; Q188-W286 PolarHBondContact NE2-O 2.69Å; Q188-W286 VanDerWaalsContact OE1-CE2 3.28Å; Q188-W286 PolarHBondContact OE1-O 2.98Å; Q188-T291 HydrophobicContact CG-CG2 3.53Å; Q188-T291 PolarHBondContact NE2-OG1 3.5Å; Q188-A293 WeakPolarHBondContact CA-O 3.18Å
189	L	96.6	Very high	92.9	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	135.4	167.9	-63.9	105.3	0	0	0	111.1	Y213 D259 T291 R292 A293 F295	L189-Y213 HydrophobicContact CB-CD2 4.21Å; L189-Y213 HydrophobicContact CB-CE2 3.83Å; L189-Y213 HydrophobicContact CD2-CD2 4.45Å; L189-Y213 HydrophobicContact CD2-CE1 4.35Å; L189-Y213 HydrophobicContact CD2-CE2 3.45Å; L189-Y213 VanDerWaalsContact CD2-CE2 3.45Å; L189-Y213 VanDerWaalsContact CD2-CZ 3.4Å; L189-Y213 WeakPolarHBondContact CD2-OH 3.5Å; L189-Y213 HydrophobicContact CG-CE2 4.28Å; L189-D259 VanDerWaalsContact CD2-OD1 3.32Å; L189-D259 WeakPolarHBondContact CD2-OD1 3.29Å; L189-T291 WeakPolarHBondContact O-CA 3.47Å; L189-R292 PolarHBondContact O-N 3.37Å; L189-A293 HydrophobicContact CD1-CB 4.08Å; L189-A293 PolarHBondContact N-O 2.96Å; L189-F295 HydrophobicContact CD1-CD2 3.71Å; L189-F295 HydrophobicContact CD1-CE2 3.41Å; L189-F295 VanDerWaalsContact CD1-CE2 3.41Å
190	R	96.2	Very high	93	Very high	16 Å²	16	39.4 Å²	39.4	6%	0.06	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	153.3	-176	-62.7	174	67.9	102.4	-2	111	Q188 F219 I223 Y263 W286 D288 S290	Q188-R190 HydrophobicContact CG-CG 4.03Å; R190-F219 HydrophobicContact CB-CB 3.96Å; R190-F219 PolarHBondContact O-N 3.16Å; R190-I223 VanDerWaalsContact CD-CD1 3.49Å; R190-Y263 HydrophobicContact CB-CE2 4.22Å; R190-Y263 HydrophobicContact CG-CD2 4.22Å; R190-Y263 HydrophobicContact CG-CE2 4.2Å; R190-W286 PolarHBondContact NH1-O 3.13Å; R190-D288 IonicContact CZ-OD1 2.63Å; R190-D288 VanDerWaalsContact CZ-OD1 3.27Å; R190-D288 IonicContact CZ-OD2 2.87Å; R190-D288 IonicContact NH1-OD1 2.66Å; R190-D288 PolarHBondContact NH1-OD1 3.39Å; R190-D288 IonicContact NH1-OD2 2.77Å; R190-D288 IonicContact NH2-OD1 3.1Å; R190-D288 PolarHBondContact NH2-OD1 3.08Å; R190-D288 IonicContact NH2-OD2 2.97Å; R190-D288 PolarHBondContact NH2-OD2 3.12Å; R190-S290 CarbonylContact C-O 3.56Å; R190-S290 VanDerWaalsContact CA-O 3.29Å; R190-S290 WeakPolarHBondContact CA-O 3.23Å; R190-S290 PolarHBondContact NE-OG 3.14Å; R190-S290 VanDerWaalsContact NE-OG 3.08Å; R190-S290 PolarHBondContact NH2-OG 2.99Å
191	V	96.2	Very high	93.1	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-112.9	147.5	174.8	-68	0	0	0	0	112	P193 Y210 P211 Y213 A217 S290 R292	V191-P193 WeakPolarHBondContact O-CD 3.27Å; V191-Y210 HydrophobicContact CG2-CD1 4.46Å; V191-P211 HydrophobicContact CB-CG 4.05Å; V191-P211 HydrophobicContact CG2-CG 4.27Å; V191-Y213 HydrophobicContact CG1-CD2 4.07Å; V191-A217 CarbonylContact C-O 3.58Å; V191-A217 VanDerWaalsContact CA-O 3.22Å; V191-A217 WeakPolarHBondContact CA-O 3.45Å; V191-S290 WeakPolarHBondContact CG2-O 3.35Å; V191-S290 PolarHBondContact N-O 2.85Å; V191-R292 HydrophobicContact CB-CG 4.44Å; V191-R292 HydrophobicContact CG1-CG 3.67Å; V191-R292 HydrophobicContact CG2-CG 3.96Å
192	D	94.6	Very high	93.3	Very high	35 Å²	35	49.3 Å²	49.3	19%	0.187	26%	0.259	C	S	.	.			trans	-78.2	119.8	175.3	-170	-26.3	0	0	0	109.7	S194 Q195 P211 A217 F219	D192-S194 PolarHBondContact O-N 2.89Å; D192-S194 VanDerWaalsContact OD1-CB 3.28Å; D192-S194 WeakPolarHBondContact OD1-CB 3.38Å; D192-S194 PolarHBondContact OD1-N 2.9Å; D192-S194 PolarHBondContact OD1-OG 3.35Å; D192-S194 PolarHBondContact OD2-OG 3.24Å; D192-S194 VanDerWaalsContact OD2-OG 3.11Å; D192-Q195 HydrophobicContact CB-CG 4.18Å; D192-Q195 PolarHBondContact O-N 3.29Å; D192-P211 WeakPolarHBondContact O-CD 3.5Å; D192-A217 PolarHBondContact N-O 2.98Å; D192-F219 HydrophobicContact CB-CD2 4.16Å
193	P	92.1	Very high	93.2	Very high	39 Å²	39	55.7 Å²	55.7	25%	0.253	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-63.6	-17.8	177.8	26.4	-34.8	0	0	0	113.8	V191 Q195 C196 C209 Y210	V191-P193 WeakPolarHBondContact O-CD 3.27Å; P193-Q195 PolarHBondContact O-N 3.06Å; P193-C196 PolarHBondContact O-N 3.42Å; P193-C209 VanDerWaalsContact CA-O 3.28Å; P193-C209 WeakPolarHBondContact CA-O 3.38Å; P193-C209 WeakPolarHBondContact CB-O 3.45Å; P193-Y210 HydrophobicContact CB-CD1 3.89Å; P193-Y210 HydrophobicContact CB-CE1 3.81Å; P193-Y210 HydrophobicContact CG-CE1 4.19Å
194	S	89.8	Confident	93.2	Very high	78 Å²	78	59.1 Å²	59.1	55%	0.545	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-70.6	-17.2	176.8	67.5	0	0	0	0	113.7	D192 C196	D192-S194 PolarHBondContact O-N 2.89Å; D192-S194 VanDerWaalsContact OD1-CB 3.28Å; D192-S194 WeakPolarHBondContact OD1-CB 3.38Å; D192-S194 PolarHBondContact OD1-N 2.9Å; D192-S194 PolarHBondContact OD1-OG 3.35Å; D192-S194 PolarHBondContact OD2-OG 3.24Å; D192-S194 VanDerWaalsContact OD2-OG 3.11Å; S194-C196 PolarHBondContact O-N 2.96Å
195	Q	89.9	Confident	93.1	Very high	114 Å²	114	64.7 Å²	64.7	53%	0.533	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-87.9	18.8	179.4	-61.2	-66.5	-44.4	0	0	112.2	D192 P193 P211 A217	D192-Q195 HydrophobicContact CB-CG 4.18Å; D192-Q195 PolarHBondContact O-N 3.29Å; P193-Q195 PolarHBondContact O-N 3.06Å; Q195-P211 HydrophobicContact CB-CG 4.13Å; Q195-A217 HydrophobicContact CB-CB 4.07Å; Q195-A217 HydrophobicContact CG-CB 4.43Å
196	C	89.5	Confident	92.9	Very high	36 Å²	36	67 Å²	67	24%	0.243	36%	0.363	C	S	.	.			trans	-132.2	129.7	-179	178	0	0	0	0	111	P193 S194 C209 P211	P193-C196 PolarHBondContact O-N 3.42Å; S194-C196 PolarHBondContact O-N 2.96Å; C196-C209 HydrophobicContact CB-CB 4.14Å; C196-C209 WeakPolarHBondContact CB-SG 3.45Å; C196-C209 PolarHBondContact O-SG 2.83Å; C196-C209 VanDerWaalsContact O-SG 3.38Å; C196-C209 WeakPolarHBondContact SG-CB 3.31Å; C196-C209 CovalentContact SG-SG 2.02Å; C196-C209 PolarHBondContact SG-SG 3.45Å; C196-P211 HydrophobicContact CB-CB 4.14Å; C196-P211 HydrophobicContact CB-CG 4.33Å
197	D	90.3	Very high	92.5	Very high	145 Å²	145	76 Å²	76	78%	0.775	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-101.6	119.3	-177	-76.6	-49.3	0	0	0	112.1
198	I	91.2	Very high	92.2	Very high	23 Å²	23	82.6 Å²	82.6	12%	0.118	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-86.9	127.4	174.3	-54.3	173	0	0	0	109.2	K200 M202 R203 I206 C209	I198-K200 PolarHBondContact O-N 2.74Å; I198-M202 HydrophobicContact CG2-CB 3.97Å; I198-R203 HydrophobicContact CB-CG 4.21Å; I198-R203 HydrophobicContact CG2-CG 4.1Å; I198-R203 PolarHBondContact O-NE 2.69Å; I198-R203 VanDerWaalsContact O-NE 3.15Å; I198-I206 HydrophobicContact CD1-CG2 4.03Å; I198-I206 VanDerWaalsContact CD1-O 3.32Å; I198-I206 WeakPolarHBondContact CD1-O 3.41Å; I198-C209 HydrophobicContact CD1-CB 4.27Å; I198-C209 HydrophobicContact CG1-CB 3.9Å; I198-C209 WeakPolarHBondContact CG1-SG 3.36Å
199	P	92.9	Very high	92	Very high	81 Å²	81	83.9 Å²	83.9	53%	0.526	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-51.2	137.9	173.8	-27.5	34.9	0	0	0	111.9	Q201 M202 R203	P199-Q201 PolarHBondContact O-N 3.29Å; P199-M202 PolarHBondContact O-N 2.89Å; P199-R203 PolarHBondContact O-N 3.09Å
200	K	92	Very high	91.9	Very high	170 Å²	170	86 Å²	86	74%	0.739	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-51.9	-37	-172.3	-67.4	-177.6	-178.7	178	0	113	I198 M202	I198-K200 PolarHBondContact O-N 2.74Å; K200-M202 VanDerWaalsContact C-N 3.32Å; K200-M202 PolarHBondContact O-N 2.86Å
201	Q	92.7	Very high	91.8	Very high	163 Å²	163	86.2 Å²	86.2	76%	0.762	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-65.5	-32.2	179.7	-60	83.6	-11.7	0	0	112.7	P199	P199-Q201 PolarHBondContact O-N 3.29Å
202	M	93.4	Very high	91.7	Very high	83 Å²	83	90 Å²	90	41%	0.409	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-94	-8.3	-176	-68	-56.8	-64.4	0	0	113.8	I198 P199 K200 G204 V205 I206	I198-M202 HydrophobicContact CG2-CB 3.97Å; P199-M202 PolarHBondContact O-N 2.89Å; K200-M202 VanDerWaalsContact C-N 3.32Å; K200-M202 PolarHBondContact O-N 2.86Å; M202-G204 PolarHBondContact O-N 3.06Å; M202-G204 VanDerWaalsContact O-N 3.14Å; M202-V205 HydrophobicContact CE-CB 4.26Å; M202-V205 PolarHBondContact O-N 2.82Å; M202-I206 HydrophobicContact CE-CD1 4.08Å; M202-I206 HydrophobicContact CE-CG1 4.47Å; M202-I206 PolarHBondContact O-N 3.08Å
203	R	88.3	Confident	91.7	Very high	143 Å²	143	89.3 Å²	89.3	54%	0.54	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-22.8	179.8	-69.8	-177.2	-177	-171.9	-5.8	113.9	I198 P199 V205	I198-R203 HydrophobicContact CB-CG 4.21Å; I198-R203 HydrophobicContact CG2-CG 4.1Å; I198-R203 PolarHBondContact O-NE 2.69Å; I198-R203 VanDerWaalsContact O-NE 3.15Å; P199-R203 PolarHBondContact O-N 3.09Å; R203-V205 VanDerWaalsContact C-N 3.33Å
204	G	91.3	Very high	91.7	Very high	77 Å²	77	89.9 Å²	89.9	79%	0.794	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-28.3	173.8	0	0	0	0	0	113.6	M202	M202-G204 PolarHBondContact O-N 3.06Å; M202-G204 VanDerWaalsContact O-N 3.14Å
205	V	93.4	Very high	91.8	Very high	118 Å²	118	90.5 Å²	90.5	72%	0.715	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-44.6	-176.5	-177.4	0	0	0	0	111.1	M202 R203	M202-V205 HydrophobicContact CE-CB 4.26Å; M202-V205 PolarHBondContact O-N 2.82Å; R203-V205 VanDerWaalsContact C-N 3.33Å
206	I	90.3	Very high	91.9	Very high	77 Å²	77	94.2 Å²	94.2	40%	0.395	49%	0.489	S	S	.	.			trans	-115.8	120.7	-173.7	-55	176.3	0	0	0	108.6	I198 M202 K208	I198-I206 HydrophobicContact CD1-CG2 4.03Å; I198-I206 VanDerWaalsContact CD1-O 3.32Å; I198-I206 WeakPolarHBondContact CD1-O 3.41Å; M202-I206 HydrophobicContact CE-CD1 4.08Å; M202-I206 HydrophobicContact CE-CG1 4.47Å; M202-I206 PolarHBondContact O-N 3.08Å; I206-K208 WeakPolarHBondContact CG2-O 3.1Å
207	K	88.5	Confident	92.1	Very high	193 Å²	193	92.7 Å²	92.7	84%	0.839	48%	0.48	S	S	*	.			trans	-94.3	-26.9	-178.2	-64.7	-176.8	-179.7	179	0	113.8
208	K	90.1	Very high	92.3	Very high	142 Å²	142	88.1 Å²	88.1	62%	0.617	45%	0.451	S	S	*	.			trans	-133.9	142.4	-176.6	-66.3	-174.6	178.9	-177.2	0	109.7	I206	I206-K208 WeakPolarHBondContact CG2-O 3.1Å
209	C	92.9	Very high	92.4	Very high	27 Å²	27	89 Å²	89	18%	0.182	45%	0.454	C	S	.	.			trans	-133.4	162.7	167.2	65.1	0	0	0	0	109	P193 C196 I198	P193-C209 VanDerWaalsContact CA-O 3.28Å; P193-C209 WeakPolarHBondContact CA-O 3.38Å; P193-C209 WeakPolarHBondContact CB-O 3.45Å; C196-C209 HydrophobicContact CB-CB 4.14Å; C196-C209 WeakPolarHBondContact CB-SG 3.45Å; C196-C209 PolarHBondContact O-SG 2.83Å; C196-C209 VanDerWaalsContact O-SG 3.38Å; C196-C209 WeakPolarHBondContact SG-CB 3.31Å; C196-C209 CovalentContact SG-SG 2.02Å; C196-C209 PolarHBondContact SG-SG 3.45Å; I198-C209 HydrophobicContact CD1-CB 4.27Å; I198-C209 HydrophobicContact CG1-CB 3.9Å; I198-C209 WeakPolarHBondContact CG1-SG 3.36Å
210	Y	94.4	Very high	92.5	Very high	47 Å²	47	88.6 Å²	88.6	18%	0.184	45%	0.451	C	S	.	.			trans	-128.7	121.5	-173.5	-62.7	-83.4	0	0	0	108.1	V191 P193 Q289 S290 R292	V191-Y210 HydrophobicContact CG2-CD1 4.46Å; P193-Y210 HydrophobicContact CB-CD1 3.89Å; P193-Y210 HydrophobicContact CB-CE1 3.81Å; P193-Y210 HydrophobicContact CG-CE1 4.19Å; Y210-Q289 HydrophobicContact CD2-CB 4Å; Y210-Q289 HydrophobicContact CE2-CB 3.46Å; Y210-Q289 VanDerWaalsContact CE2-CB 3.46Å; Y210-Q289 HydrophobicContact CE2-CG 4.5Å; Y210-S290 VanDerWaalsContact CE1-CB 3.45Å; Y210-R292 VanDerWaalsContact C-NH2 3.27Å; Y210-R292 PolarHBondContact O-NH2 3.28Å
211	P	94.2	Very high	92.5	Very high	20 Å²	20	86.8 Å²	86.8	13%	0.13	44%	0.443	C	S	.	.			trans	-74.9	174.8	-174	32.1	-35.6	0	0	0	112.1	V191 D192 Q195 C196 A217 R292	V191-P211 HydrophobicContact CB-CG 4.05Å; V191-P211 HydrophobicContact CG2-CG 4.27Å; D192-P211 WeakPolarHBondContact O-CD 3.5Å; Q195-P211 HydrophobicContact CB-CG 4.13Å; C196-P211 HydrophobicContact CB-CB 4.14Å; C196-P211 HydrophobicContact CB-CG 4.33Å; P211-A217 HydrophobicContact CB-CB 4.47Å; P211-A217 HydrophobicContact CG-CB 3.82Å; P211-R292 PolarHBondContact O-NE 3.2Å; P211-R292 PolarHBondContact O-NH2 3.47Å; P211-R292 VanDerWaalsContact O-NH2 3.12Å
212	V	93.1	Very high	92.6	Very high	78 Å²	78	83 Å²	83	47%	0.473	43%	0.432	S	S	.	.			trans	-61.3	146.5	165.2	-177.9	0	0	0	0	108.9	S214 E319	V212-S214 PolarHBondContact O-N 2.82Å; V212-E319 HydrophobicContact CG2-CG 4.21Å; V212-E319 WeakPolarHBondContact CG2-OE2 3.27Å
213	Y	94.7	Very high	92.5	Very high	21 Å²	21	79.7 Å²	79.7	8%	0.082	42%	0.416	C	S	.	.			trans	-61.6	129.7	174.7	-179.7	-90.3	0	0	0	111.3	L189 V191 R218 Y257 Y258 D259 R292	L189-Y213 HydrophobicContact CB-CD2 4.21Å; L189-Y213 HydrophobicContact CB-CE2 3.83Å; L189-Y213 HydrophobicContact CD2-CD2 4.45Å; L189-Y213 HydrophobicContact CD2-CE1 4.35Å; L189-Y213 HydrophobicContact CD2-CE2 3.45Å; L189-Y213 VanDerWaalsContact CD2-CE2 3.45Å; L189-Y213 VanDerWaalsContact CD2-CZ 3.4Å; L189-Y213 WeakPolarHBondContact CD2-OH 3.5Å; L189-Y213 HydrophobicContact CG-CE2 4.28Å; V191-Y213 HydrophobicContact CG1-CD2 4.07Å; Y213-R218 HydrophobicContact CE2-CG 4.42Å; Y213-Y257 WeakPolarHBondContact CD1-O 3.41Å; Y213-Y257 WeakPolarHBondContact CE1-O 3.42Å; Y213-Y258 AromaticContact CD1-CD1 3.65Å; Y213-Y258 HydrophobicContact CD1-CD1 3.65Å; Y213-Y258 HydrophobicContact CD1-CE1 4.2Å; Y213-Y258 HydrophobicContact CD1-CG 4.47Å; Y213-Y258 HydrophobicContact CD2-CD1 4.23Å; Y213-Y258 HydrophobicContact CE1-CD1 4.11Å; Y213-Y258 AromaticContact CG-CD1 3.72Å; Y213-Y258 HydrophobicContact CG-CD1 3.72Å; Y213-Y258 AromaticContact CG-CE1 4Å; Y213-Y258 HydrophobicContact CG-CE1 4Å; Y213-D259 PolarHBondContact OH-OD1 3.39Å; Y213-D259 PolarHBondContact OH-OD2 3.38Å; Y213-D259 VanDerWaalsContact OH-OD2 3.1Å; Y213-R292 HydrophobicContact CD2-CB 4.43Å
214	S	93.4	Very high	92.6	Very high	51 Å²	51	80.8 Å²	80.8	36%	0.357	43%	0.428	S	S	.	.			trans	-152.7	157.4	168.5	66.7	0	0	0	0	108.8	V212 K216 A217 R218	V212-S214 PolarHBondContact O-N 2.82Å; S214-K216 PolarHBondContact O-N 3.38Å; S214-K216 VanDerWaalsContact O-N 3.1Å; S214-A217 CarbonylContact O-C 3.45Å; S214-A217 PolarHBondContact O-N 3.12Å; S214-A217 VanDerWaalsContact OG-CB 3.32Å; S214-A217 WeakPolarHBondContact OG-CB 3.45Å; S214-A217 PolarHBondContact OG-N 2.87Å; S214-A217 VanDerWaalsContact OG-N 3.12Å; S214-R218 PolarHBondContact O-N 2.76Å
215	T	91.6	Very high	92.5	Very high	92 Å²	92	79.8 Å²	79.8	56%	0.564	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-28.6	177.5	-45	0	0	0	0	112.4
216	K	91.8	Very high	92.1	Very high	191 Å²	191	77.8 Å²	77.8	83%	0.83	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-39.1	176.2	-65.2	-176.9	-179.4	179.6	0	112.9	S214 R218	S214-K216 PolarHBondContact O-N 3.38Å; S214-K216 VanDerWaalsContact O-N 3.1Å; K216-R218 VanDerWaalsContact C-N 3.27Å; K216-R218 PolarHBondContact O-N 3.18Å
217	A	93.1	Very high	91.6	Very high	5 Å²	5	76.4 Å²	76.4	4%	0.041	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	2.2	-179.4	0	0	0	0	0	113.4	V191 D192 Q195 P211 S214	V191-A217 CarbonylContact C-O 3.58Å; V191-A217 VanDerWaalsContact CA-O 3.22Å; V191-A217 WeakPolarHBondContact CA-O 3.45Å; D192-A217 PolarHBondContact N-O 2.98Å; Q195-A217 HydrophobicContact CB-CB 4.07Å; Q195-A217 HydrophobicContact CG-CB 4.43Å; P211-A217 HydrophobicContact CB-CB 4.47Å; P211-A217 HydrophobicContact CG-CB 3.82Å; S214-A217 CarbonylContact O-C 3.45Å; S214-A217 PolarHBondContact O-N 3.12Å; S214-A217 VanDerWaalsContact OG-CB 3.32Å; S214-A217 WeakPolarHBondContact OG-CB 3.45Å; S214-A217 PolarHBondContact OG-N 2.87Å; S214-A217 VanDerWaalsContact OG-N 3.12Å
218	R	94.3	Very high	91.5	Very high	48 Å²	48	75.9 Å²	75.9	18%	0.181	40%	0.397	C	S	.	.	B	Isolated β-bridge	trans	-65	131.8	-177.2	-175.6	175.8	69.2	175.2	14.8	111.3	Y213 S214 K216 T220 F240 D242 D259 S261	Y213-R218 HydrophobicContact CE2-CG 4.42Å; S214-R218 PolarHBondContact O-N 2.76Å; K216-R218 VanDerWaalsContact C-N 3.27Å; K216-R218 PolarHBondContact O-N 3.18Å; R218-T220 HydrophobicContact CG-CG2 4.29Å; R218-F240 HydrophobicContact CG-CE2 4.18Å; R218-D242 IonicContact NH2-OD1 2.7Å; R218-D259 IonicContact CZ-OD2 3.56Å; R218-D259 IonicContact NH1-OD2 2.75Å; R218-D259 PolarHBondContact NH1-OD2 3.02Å; R218-S261 WeakPolarHBondContact CD-OG 3.27Å; R218-S261 PolarHBondContact NH1-OG 2.86Å
219	F	94.7	Very high	91.2	Very high	41 Å²	41	71.6 Å²	71.6	18%	0.18	38%	0.38	C	S	.	.			trans	-79.8	122.3	171.6	-169.6	-106.9	0	0	0	109.6	R190 D192 K221 I223 Y263	R190-F219 HydrophobicContact CB-CB 3.96Å; R190-F219 PolarHBondContact O-N 3.16Å; D192-F219 HydrophobicContact CB-CD2 4.16Å; F219-K221 HydrophobicContact CE1-CB 4.16Å; F219-K221 VanDerWaalsContact CE1-O 3.22Å; F219-K221 WeakPolarHBondContact CE1-O 3.43Å; F219-K221 HydrophobicContact CE2-CB 4.2Å; F219-K221 HydrophobicContact CZ-CB 3.77Å; F219-I223 HydrophobicContact CE1-CG1 4.45Å; F219-Y263 HydrophobicContact CD1-CE2 4.4Å; F219-Y263 AromaticContact CD1-CZ 4Å; F219-Y263 WeakPolarHBondContact CD1-OH 2.92Å; F219-Y263 PolarHBondContact O-OH 3.31Å
220	T	93.6	Very high	90.9	Very high	73 Å²	73	75.3 Å²	75.3	45%	0.448	40%	0.402	S	S	.	.			trans	-118.5	-4.8	-174.7	56.1	0	0	0	0	114	R218 F240	R218-T220 HydrophobicContact CG-CG2 4.29Å; T220-F240 HydrophobicContact CG2-CD1 4.23Å; T220-F240 HydrophobicContact CG2-CE1 4.04Å; T220-F240 HydrophobicContact CG2-CE2 4.39Å; T220-F240 HydrophobicContact CG2-CG 4.48Å; T220-F240 HydrophobicContact CG2-CZ 4.14Å; T220-F240 WeakPolarHBondContact O-CB 3.44Å
221	K	93.6	Very high	90.4	Very high	133 Å²	133	74.7 Å²	74.7	58%	0.578	40%	0.404	S	S	*	.	S	Bend	trans	-82.2	160.7	179.9	-64.6	177.2	-177.9	173.1	0	110.8	F219 I223 Y263	F219-K221 HydrophobicContact CE1-CB 4.16Å; F219-K221 VanDerWaalsContact CE1-O 3.22Å; F219-K221 WeakPolarHBondContact CE1-O 3.43Å; F219-K221 HydrophobicContact CE2-CB 4.2Å; F219-K221 HydrophobicContact CZ-CB 3.77Å; K221-I223 PolarHBondContact O-N 3.27Å; K221-Y263 PolarHBondContact O-OH 3.27Å
222	P	93.7	Very high	90.2	Very high	83 Å²	83	79 Å²	79	54%	0.539	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-55.5	140.2	171	-25.1	35.2	0	0	0	111.9	W238	P222-W238 CarbonylContact C-O 3.58Å; P222-W238 VanDerWaalsContact CA-O 3.27Å; P222-W238 WeakPolarHBondContact CA-O 3.14Å
223	I	92.4	Very high	90	Very high	14 Å²	14	81 Å²	81	7%	0.072	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-76.5	129.1	176.4	-62.3	167.1	0	0	0	108.5	R190 F219 K221 I225 W238 Y263	R190-I223 VanDerWaalsContact CD-CD1 3.49Å; F219-I223 HydrophobicContact CE1-CG1 4.45Å; K221-I223 PolarHBondContact O-N 3.27Å; I223-I225 PolarHBondContact O-N 2.94Å; I223-W238 HydrophobicContact CB-CE3 3.92Å; I223-W238 HydrophobicContact CG2-CE3 3.71Å; I223-W238 HydrophobicContact CG2-CZ3 3.97Å; I223-W238 PolarHBondContact N-O 3.41Å; I223-Y263 HydrophobicContact CD1-CD1 3.4Å; I223-Y263 HydrophobicContact CD1-CD2 3.96Å; I223-Y263 HydrophobicContact CD1-CE1 3.64Å; I223-Y263 HydrophobicContact CD1-CE2 4.19Å; I223-Y263 HydrophobicContact CD1-CG 3.57Å; I223-Y263 HydrophobicContact CG1-CD1 3.82Å; I223-Y263 HydrophobicContact CG1-CE1 3.5Å; I223-Y263 HydrophobicContact CG1-CE2 4.37Å; I223-Y263 HydrophobicContact CG1-CG 4.37Å
224	E	89.8	Confident	89.9	Confident	166 Å²	166	80 Å²	80	78%	0.776	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-72.5	118.6	171.2	-65.8	175.7	-176.1	0	0	109.9	Q226	E224-Q226 PolarHBondContact O-N 2.84Å
225	I	89.9	Confident	89.8	Confident	55 Å²	55	83.8 Å²	83.8	28%	0.282	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-66.7	122.3	178.3	-58.1	176.1	0	0	0	108.9	I223 P231 W238	I223-I225 PolarHBondContact O-N 2.94Å; I225-P231 HydrophobicContact CD1-CB 4.29Å; I225-P231 HydrophobicContact CD1-CG 3.7Å; I225-W238 HydrophobicContact CB-CZ3 4.5Å; I225-W238 HydrophobicContact CD1-CD2 3.94Å; I225-W238 HydrophobicContact CD1-CG 4.06Å; I225-W238 HydrophobicContact CD1-CZ2 4.39Å; I225-W238 HydrophobicContact CG1-CD2 3.53Å; I225-W238 HydrophobicContact CG1-CE3 3.63Å; I225-W238 HydrophobicContact CG1-CG 4.01Å; I225-W238 HydrophobicContact CG1-CH2 4.23Å; I225-W238 HydrophobicContact CG1-CZ2 4.12Å; I225-W238 HydrophobicContact CG1-CZ3 3.99Å; I225-W238 HydrophobicContact CG2-CH2 4.33Å; I225-W238 HydrophobicContact CG2-CZ2 4.43Å
226	Q	83.9	Confident	89.8	Confident	77 Å²	77	85 Å²	85	36%	0.36	44%	0.435	S	S	.	.			trans	-98.7	98.8	178.4	-62.8	179.9	18.6	0	0	108.9	E224 G284 R285	E224-Q226 PolarHBondContact O-N 2.84Å; Q226-G284 PolarHBondContact N-O 3.01Å; Q226-G284 CarbonylContact O-C 3.51Å; Q226-G284 WeakPolarHBondContact O-CA 3.25Å; Q226-R285 HydrophobicContact CB-CB 4.16Å; Q226-R285 VanDerWaalsContact OE1-CD 3.3Å
227	G	80.8	Confident	89.9	Confident	47 Å²	47	76 Å²	76	49%	0.485	40%	0.396	S	S	.	.	S	Bend	trans	145.2	166.2	179.5	0	0	0	0	0	112.4	I229	G227-I229 PolarHBondContact O-N 3.29Å
228	N	85	Confident	89.9	Confident	182 Å²	182	76.3 Å²	76.3	97%	0.973	40%	0.396	S	S	*	.	S	Bend	trans	-83.3	63.1	176.1	-74.3	-2.9	0	0	0	110.7
229	I	85.2	Confident	90	Very high	53 Å²	53	77.6 Å²	77.6	27%	0.272	41%	0.407	S	S	.	.			trans	-129.6	133.5	-177	-64.1	167.1	0	0	0	110.8	G227 E280 Q283	G227-I229 PolarHBondContact O-N 3.29Å; I229-E280 HydrophobicContact CG2-CG 4.41Å; I229-Q283 HydrophobicContact CD1-CB 3.07Å; I229-Q283 HydrophobicContact CD1-CG 4.1Å
230	T	86	Confident	90	Very high	104 Å²	104	77.5 Å²	77.5	64%	0.638	41%	0.406	S	S	*	.			trans	-96.2	119.3	166	52.1	0	0	0	0	108.7	N232	T230-N232 PolarHBondContact O-N 3.36Å
231	P	84	Confident	90.1	Very high	35 Å²	35	75 Å²	75	23%	0.227	39%	0.392	C	S	.	.			trans	-69.2	107.1	-177.5	28.3	-34.5	0	0	0	110.1	I225 T234 K235	I225-P231 HydrophobicContact CD1-CB 4.29Å; I225-P231 HydrophobicContact CD1-CG 3.7Å; P231-T234 WeakPolarHBondContact CB-OG1 3.34Å; P231-K235 HydrophobicContact CB-CG 4.48Å; P231-K235 WeakPolarHBondContact O-CE 3.38Å; P231-K235 VanDerWaalsContact O-CG 3.3Å; P231-K235 WeakPolarHBondContact O-CG 3.49Å
232	N	89.2	Confident	90.2	Very high	109 Å²	109	72.7 Å²	72.7	58%	0.583	39%	0.386	S	S	*	.	S	Bend	trans	-88.3	-45.2	175.8	-71.8	-24.3	0	0	0	110.2	T230 E280	T230-N232 PolarHBondContact O-N 3.36Å; N232-E280 WeakPolarHBondContact CB-OE1 3.43Å; N232-E280 PolarHBondContact N-OE1 3.08Å; N232-E280 PolarHBondContact N-OE2 3.32Å
233	Y	89.3	Confident	90.1	Very high	120 Å²	120	70.6 Å²	70.6	47%	0.471	37%	0.373	S	S	.	.	S	Bend	trans	-98	-28.8	-179	-56.2	-82.7	0	0	0	112.7	A276 I277 E280	Y233-A276 HydrophobicContact CD2-CB 4.28Å; Y233-A276 HydrophobicContact CE2-CB 4.07Å; Y233-I277 HydrophobicContact CG-CG1 4.2Å; Y233-E280 WeakPolarHBondContact CD2-OE1 3.19Å; Y233-E280 PolarHBondContact N-OE1 3.07Å; Y233-E280 PolarHBondContact N-OE2 3.34Å
234	T	92.4	Very high	90	Very high	1 Å²	1	76.7 Å²	76.7	1%	0.006	41%	0.406	C	S	.	.			trans	-98	21.8	-168.3	56	0	0	0	0	115.7	P231 N236 A237 W238 Q265 I277 E280 L281	P231-T234 WeakPolarHBondContact CB-OG1 3.34Å; T234-N236 VanDerWaalsContact C-N 3.27Å; T234-N236 PolarHBondContact O-N 3.37Å; T234-N236 VanDerWaalsContact O-N 3.12Å; T234-A237 VanDerWaalsContact O-CB 3.31Å; T234-A237 WeakPolarHBondContact O-CB 3.39Å; T234-A237 PolarHBondContact O-N 3.32Å; T234-W238 PolarHBondContact O-NE1 2.98Å; T234-W238 VanDerWaalsContact O-NE1 3.1Å; T234-W238 PolarHBondContact OG1-NE1 3.49Å; T234-Q265 HydrophobicContact CG2-CG 4.48Å; T234-I277 HydrophobicContact CG2-CG2 3.97Å; T234-E280 WeakPolarHBondContact CB-OE2 3.34Å; T234-E280 HydrophobicContact CG2-CB 3.78Å; T234-E280 WeakPolarHBondContact CG2-OE2 3.43Å; T234-E280 PolarHBondContact N-OE2 2.94Å; T234-E280 PolarHBondContact OG1-OE2 3.19Å; T234-L281 HydrophobicContact CG2-CD2 3.63Å; T234-L281 HydrophobicContact CG2-CG 3.79Å
235	K	91.2	Very high	90	Very high	131 Å²	131	73.6 Å²	73.6	57%	0.57	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-38.8	-170.7	-63.8	-179	-174.3	176.2	0	114.3	P231	P231-K235 HydrophobicContact CB-CG 4.48Å; P231-K235 WeakPolarHBondContact O-CE 3.38Å; P231-K235 VanDerWaalsContact O-CG 3.3Å; P231-K235 WeakPolarHBondContact O-CG 3.49Å
236	N	91.1	Very high	90.1	Very high	118 Å²	118	71.1 Å²	71.1	63%	0.631	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-23	-178	-64.6	-17.5	0	0	0	112.9	T234 W238 N239	T234-N236 VanDerWaalsContact C-N 3.27Å; T234-N236 PolarHBondContact O-N 3.37Å; T234-N236 VanDerWaalsContact O-N 3.12Å; N236-W238 PolarHBondContact O-N 2.92Å; N236-W238 VanDerWaalsContact O-N 3.12Å; N236-N239 PolarHBondContact O-N 3.14Å; N236-N239 VanDerWaalsContact O-N 3.1Å
237	A	93.8	Very high	90.3	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-26.2	179.6	0	0	0	0	0	113.7	T234 Y263 I264 Q265 L281 W286	T234-A237 VanDerWaalsContact O-CB 3.31Å; T234-A237 WeakPolarHBondContact O-CB 3.39Å; T234-A237 PolarHBondContact O-N 3.32Å; A237-Y263 WeakPolarHBondContact O-CB 3.28Å; A237-I264 VanDerWaalsContact CA-O 3.26Å; A237-I264 WeakPolarHBondContact CA-O 3.38Å; A237-I264 PolarHBondContact N-O 3.35Å; A237-Q265 HydrophobicContact CB-CB 3.92Å; A237-Q265 HydrophobicContact CB-CG 4.41Å; A237-L281 HydrophobicContact CB-CD2 3.63Å; A237-W286 PolarHBondContact O-NE1 3.13Å
238	W	94.9	Very high	90.8	Very high	13 Å²	13	65.4 Å²	65.4	5%	0.049	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-7.6	-175.8	-49.9	98.8	0	0	0	112.6	P222 I223 I225 T234 N236 L281 W286	P222-W238 CarbonylContact C-O 3.58Å; P222-W238 VanDerWaalsContact CA-O 3.27Å; P222-W238 WeakPolarHBondContact CA-O 3.14Å; I223-W238 HydrophobicContact CB-CE3 3.92Å; I223-W238 HydrophobicContact CG2-CE3 3.71Å; I223-W238 HydrophobicContact CG2-CZ3 3.97Å; I223-W238 PolarHBondContact N-O 3.41Å; I225-W238 HydrophobicContact CB-CZ3 4.5Å; I225-W238 HydrophobicContact CD1-CD2 3.94Å; I225-W238 HydrophobicContact CD1-CG 4.06Å; I225-W238 HydrophobicContact CD1-CZ2 4.39Å; I225-W238 HydrophobicContact CG1-CD2 3.53Å; I225-W238 HydrophobicContact CG1-CE3 3.63Å; I225-W238 HydrophobicContact CG1-CG 4.01Å; I225-W238 HydrophobicContact CG1-CH2 4.23Å; I225-W238 HydrophobicContact CG1-CZ2 4.12Å; I225-W238 HydrophobicContact CG1-CZ3 3.99Å; I225-W238 HydrophobicContact CG2-CH2 4.33Å; I225-W238 HydrophobicContact CG2-CZ2 4.43Å; T234-W238 PolarHBondContact O-NE1 2.98Å; T234-W238 VanDerWaalsContact O-NE1 3.1Å; T234-W238 PolarHBondContact OG1-NE1 3.49Å; N236-W238 PolarHBondContact O-N 2.92Å; N236-W238 VanDerWaalsContact O-N 3.12Å; W238-L281 HydrophobicContact CZ2-CD2 4.27Å; W238-W286 AromaticContact CE3-CD1 3.92Å; W238-W286 HydrophobicContact CH2-CB 3.88Å; W238-W286 HydrophobicContact CH2-CG 4.42Å; W238-W286 HydrophobicContact CZ3-CB 4.1Å; W238-W286 AromaticContact CZ3-CD1 3.78Å; W238-W286 HydrophobicContact CZ3-CG 4.38Å
239	N	95.5	Very high	91.1	Very high	75 Å²	75	57.3 Å²	57.3	40%	0.401	30%	0.304	S	S	.	.	S	Bend	trans	-106.8	141	-179.9	-68.8	-35.2	0	0	0	111.5	N236 Y263	N236-N239 PolarHBondContact O-N 3.14Å; N236-N239 VanDerWaalsContact O-N 3.1Å; N239-Y263 VanDerWaalsContact C-CD1 3.45Å; N239-Y263 WeakPolarHBondContact O-CD1 3.36Å
240	F	95.5	Very high	91.5	Very high	38 Å²	38	55.8 Å²	55.8	17%	0.167	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	137.3	179	-179.8	-98.4	0	0	0	111	R218 T220 D242 S261 Y263	R218-F240 HydrophobicContact CG-CE2 4.18Å; T220-F240 HydrophobicContact CG2-CD1 4.23Å; T220-F240 HydrophobicContact CG2-CE1 4.04Å; T220-F240 HydrophobicContact CG2-CE2 4.39Å; T220-F240 HydrophobicContact CG2-CG 4.48Å; T220-F240 HydrophobicContact CG2-CZ 4.14Å; T220-F240 WeakPolarHBondContact O-CB 3.44Å; F240-D242 WeakPolarHBondContact CE1-OD1 3.43Å; F240-S261 WeakPolarHBondContact CZ-OG 3.3Å; F240-Y263 HydrophobicContact CB-CE1 3.87Å; F240-Y263 HydrophobicContact CD2-CD2 4.46Å; F240-Y263 AromaticContact CD2-CE2 3.93Å; F240-Y263 HydrophobicContact CD2-CE2 3.93Å
241	S	95.8	Very high	91.8	Very high	21 Å²	21	53.4 Å²	53.4	15%	0.147	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	132.6	175.8	-61.5	0	0	0	0	110.9	S261 G262	S241-S261 WeakPolarHBondContact O-CA 3.42Å; S241-S261 WeakPolarHBondContact O-CB 3.41Å; S241-G262 WeakPolarHBondContact CB-O 3.47Å; S241-G262 PolarHBondContact N-O 3.28Å; S241-G262 PolarHBondContact O-N 3.04Å
242	D	94.4	Very high	92.2	Very high	84 Å²	84	56 Å²	56	45%	0.449	30%	0.301	S	S	.	.			trans	-71.6	161.8	173.7	-75.1	-53.9	0	0	0	112.1	R218 F240 D244 V245 T246	R218-D242 IonicContact NH2-OD1 2.7Å; F240-D242 WeakPolarHBondContact CE1-OD1 3.43Å; D242-D244 PolarHBondContact O-N 3.36Å; D242-D244 VanDerWaalsContact O-N 3.14Å; D242-V245 PolarHBondContact O-N 3.31Å; D242-T246 WeakPolarHBondContact O-CG2 3.36Å; D242-T246 PolarHBondContact O-N 3.34Å
243	S	92.1	Very high	92.1	Very high	40 Å²	40	51.3 Å²	51.3	28%	0.28	28%	0.277	S	S	.	.	H	α-helix	trans	-57	-30.2	-176.8	52.1	0	0	0	0	114.3	V245 T246 G247	S243-V245 VanDerWaalsContact C-N 3.32Å; S243-T246 WeakPolarHBondContact CA-OG1 3.46Å; S243-T246 PolarHBondContact O-OG1 3.17Å; S243-G247 PolarHBondContact O-N 3.29Å
244	D	89.8	Confident	91.9	Very high	142 Å²	142	50.8 Å²	50.8	76%	0.759	29%	0.288	S	S	*	.	H	α-helix	trans	-71.7	-31.2	179.6	-59.7	-23.9	0	0	0	111.5	D242	D242-D244 PolarHBondContact O-N 3.36Å; D242-D244 VanDerWaalsContact O-N 3.14Å
245	V	90.7	Very high	91.6	Very high	101 Å²	101	55.2 Å²	55.2	61%	0.612	31%	0.306	S	S	*	.	H	α-helix	trans	-83.1	-42.8	178.2	-178.7	0	0	0	0	110.7	D242 S243 G247	D242-V245 PolarHBondContact O-N 3.31Å; S243-V245 VanDerWaalsContact C-N 3.32Å; V245-G247 PolarHBondContact O-N 3Å
246	T	91.1	Very high	91.5	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.012	29%	0.288	C	S	.	.	H	α-helix	trans	-67.6	-28.2	178	63.5	0	0	0	0	111.9	R185 D242 S243 A248 G260 I264	R185-T246 PolarHBondContact NH1-O 2.97Å; D242-T246 WeakPolarHBondContact O-CG2 3.36Å; D242-T246 PolarHBondContact O-N 3.34Å; S243-T246 WeakPolarHBondContact CA-OG1 3.46Å; S243-T246 PolarHBondContact O-OG1 3.17Å; T246-A248 PolarHBondContact O-N 3.14Å; T246-A248 PolarHBondContact OG1-N 3.47Å; T246-G260 WeakPolarHBondContact CB-O 3.22Å; T246-G260 PolarHBondContact OG1-O 3.31Å; T246-I264 HydrophobicContact CG2-CG2 3.66Å
247	G	88.1	Confident	91.6	Very high	2 Å²	2	50.9 Å²	50.9	2%	0.021	28%	0.284	C	S	.	.			trans	70.2	9.3	-174.4	0	0	0	0	0	113.8	S243 V245 N420 Y423	S243-G247 PolarHBondContact O-N 3.29Å; V245-G247 PolarHBondContact O-N 3Å; G247-N420 VanDerWaalsContact CA-ND2 3.28Å; G247-N420 WeakPolarHBondContact CA-ND2 3.48Å; G247-N420 PolarHBondContact O-OD1 3.49Å; G247-Y423 VanDerWaalsContact C-CE2 3.46Å; G247-Y423 WeakPolarHBondContact O-CD2 3.42Å; G247-Y423 WeakPolarHBondContact O-CE2 3.39Å
248	A	91.3	Very high	91.7	Very high	3 Å²	3	51 Å²	51	3%	0.025	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-89.9	150.1	-178.5	0	0	0	0	0	111.9	T246 G260 D422 Y423	T246-A248 PolarHBondContact O-N 3.14Å; T246-A248 PolarHBondContact OG1-N 3.47Å; A248-G260 WeakPolarHBondContact O-CA 3.41Å; A248-D422 WeakPolarHBondContact CA-OD2 3.13Å; A248-Y423 PolarHBondContact O-OH 3.32Å
249	T	92	Very high	91.7	Very high	11 Å²	11	51.4 Å²	51.4	7%	0.067	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-87.8	158.2	173.6	57.8	0	0	0	0	111.6	Y251 D422 Y423 Y426	T249-Y251 PolarHBondContact O-N 3.18Å; T249-D422 PolarHBondContact N-OD2 3.27Å; T249-D422 PolarHBondContact OG1-OD2 2.87Å; T249-D422 VanDerWaalsContact OG1-OD2 3.12Å; T249-Y423 HydrophobicContact CG2-CD1 3.34Å; T249-Y423 HydrophobicContact CG2-CD2 4.18Å; T249-Y423 HydrophobicContact CG2-CE1 3.54Å; T249-Y423 HydrophobicContact CG2-CE2 4.34Å; T249-Y423 HydrophobicContact CG2-CG 3.67Å; T249-Y426 HydrophobicContact CG2-CG 4.17Å
250	G	92.4	Very high	91.6	Very high	22 Å²	22	48 Å²	48	23%	0.227	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-66.8	130.4	167.6	0	0	0	0	0	111	Y258	G250-Y258 CarbonylContact C-O 3.47Å; G250-Y258 VanDerWaalsContact CA-O 3.27Å; G250-Y258 WeakPolarHBondContact CA-O 3.5Å
251	Y	92.3	Very high	91.6	Very high	53 Å²	53	46.1 Å²	46.1	21%	0.208	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	127.6	-176	-175.9	-99.8	0	0	0	111.2	T249 A253 Y258 F295 I314 V328	T249-Y251 PolarHBondContact O-N 3.18Å; Y251-A253 HydrophobicContact CD1-CB 3.79Å; Y251-A253 VanDerWaalsContact CE1-CA 3.43Å; Y251-A253 HydrophobicContact CE1-CB 3.57Å; Y251-A253 PolarHBondContact O-N 2.83Å; Y251-Y258 PolarHBondContact N-O 3.48Å; Y251-Y258 PolarHBondContact O-N 3.36Å; Y251-F295 AromaticContact CD1-CE1 3.87Å; Y251-F295 HydrophobicContact CD1-CE1 3.87Å; Y251-F295 HydrophobicContact CD1-CZ 4.24Å; Y251-F295 HydrophobicContact CG-CE1 4.16Å; Y251-I314 HydrophobicContact CD1-CD1 3.74Å; Y251-I314 HydrophobicContact CE1-CD1 3.21Å; Y251-I314 HydrophobicContact CE2-CD1 4.34Å; Y251-I314 HydrophobicContact CG-CD1 4.47Å; Y251-V328 HydrophobicContact CE2-CG2 3.74Å; Y251-V328 WeakPolarHBondContact OH-CG2 3.5Å
252	S	92.4	Very high	91.6	Very high	90 Å²	90	45.2 Å²	45.2	63%	0.629	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	97.4	172.3	-167.8	0	0	0	0	108.9
253	A	89	Confident	91.7	Very high	10 Å²	10	41.2 Å²	41.2	8%	0.083	23%	0.234	C	C	.	.			trans	-81.9	170.5	176	0	0	0	0	0	111.1	Y251 Y255 G256 Y258 E316	Y251-A253 HydrophobicContact CD1-CB 3.79Å; Y251-A253 VanDerWaalsContact CE1-CA 3.43Å; Y251-A253 HydrophobicContact CE1-CB 3.57Å; Y251-A253 PolarHBondContact O-N 2.83Å; A253-Y255 VanDerWaalsContact C-N 3.27Å; A253-Y255 PolarHBondContact O-N 3.34Å; A253-G256 WeakPolarHBondContact CB-O 3.48Å; A253-G256 PolarHBondContact N-O 3.17Å; A253-Y258 HydrophobicContact CB-CD2 4.17Å; A253-Y258 HydrophobicContact CB-CE2 3.79Å; A253-E316 HydrophobicContact CB-CG 4.14Å; A253-E316 VanDerWaalsContact CB-OE1 3.25Å; A253-E316 WeakPolarHBondContact CB-OE1 3.37Å; A253-E316 WeakPolarHBondContact CB-OE2 3.44Å
254	P	84.1	Confident	91.9	Very high	109 Å²	109	40.2 Å²	40.2	71%	0.708	23%	0.225	S	C	*	.	S	Bend	trans	-54.7	-37.1	178.9	-29.6	36.4	0	0	0	115	E316	P254-E316 VanDerWaalsContact CD-OE2 3.3Å; P254-E316 WeakPolarHBondContact CD-OE2 3.24Å
255	Y	86.2	Confident	92.2	Very high	95 Å²	95	34.1 Å²	34.1	37%	0.373	19%	0.192	S	C	.	.	S	Bend	trans	-94.6	-44.6	-179.2	176.7	-87.2	0	0	0	113	A253 E316 P318 E319	A253-Y255 VanDerWaalsContact C-N 3.27Å; A253-Y255 PolarHBondContact O-N 3.34Å; Y255-E316 VanDerWaalsContact CB-OE1 3.3Å; Y255-E316 WeakPolarHBondContact CB-OE1 3.22Å; Y255-E316 PolarHBondContact N-OE1 3.27Å; Y255-E316 PolarHBondContact N-OE2 3.24Å; Y255-E316 VanDerWaalsContact N-OE2 3.08Å; Y255-P318 HydrophobicContact CD1-CB 3.91Å; Y255-P318 HydrophobicContact CD2-CB 3.93Å; Y255-P318 HydrophobicContact CE1-CB 3.51Å; Y255-P318 HydrophobicContact CE2-CB 3.51Å; Y255-P318 HydrophobicContact CE2-CG 4.4Å; Y255-P318 HydrophobicContact CG-CB 4.14Å; Y255-E319 PolarHBondContact OH-OE1 3.37Å; Y255-E319 PolarHBondContact OH-OE2 2.93Å
256	G	88.8	Confident	92.4	Very high	19 Å²	19	31.6 Å²	31.6	20%	0.196	18%	0.175	C	C	.	.			trans	-142.3	165.8	-175.5	0	0	0	0	0	115.9	A253 Y258 E316	A253-G256 WeakPolarHBondContact CB-O 3.48Å; A253-G256 PolarHBondContact N-O 3.17Å; G256-Y258 WeakPolarHBondContact O-CE2 3.16Å; G256-E316 PolarHBondContact N-OE1 3.41Å
257	Y	94.6	Very high	92.6	Very high	139 Å²	139	32 Å²	32	55%	0.545	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	127.3	168.9	176.9	-94.7	0	0	0	110.2	Y213	Y213-Y257 WeakPolarHBondContact CD1-O 3.41Å; Y213-Y257 WeakPolarHBondContact CE1-O 3.42Å
258	Y	95.4	Very high	92.8	Very high	3 Å²	3	32.8 Å²	32.8	1%	0.012	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	135.9	178.5	-51.4	-81.9	0	0	0	110.2	Y213 G250 Y251 A253 G256 R292 A293 F295 E316	Y213-Y258 AromaticContact CD1-CD1 3.65Å; Y213-Y258 HydrophobicContact CD1-CD1 3.65Å; Y213-Y258 HydrophobicContact CD1-CE1 4.2Å; Y213-Y258 HydrophobicContact CD1-CG 4.47Å; Y213-Y258 HydrophobicContact CD2-CD1 4.23Å; Y213-Y258 HydrophobicContact CE1-CD1 4.11Å; Y213-Y258 AromaticContact CG-CD1 3.72Å; Y213-Y258 HydrophobicContact CG-CD1 3.72Å; Y213-Y258 AromaticContact CG-CE1 4Å; Y213-Y258 HydrophobicContact CG-CE1 4Å; G250-Y258 CarbonylContact C-O 3.47Å; G250-Y258 VanDerWaalsContact CA-O 3.27Å; G250-Y258 WeakPolarHBondContact CA-O 3.5Å; Y251-Y258 PolarHBondContact N-O 3.48Å; Y251-Y258 PolarHBondContact O-N 3.36Å; A253-Y258 HydrophobicContact CB-CD2 4.17Å; A253-Y258 HydrophobicContact CB-CE2 3.79Å; G256-Y258 WeakPolarHBondContact O-CE2 3.16Å; Y258-R292 HydrophobicContact CE1-CB 4.13Å; Y258-A293 HydrophobicContact CD1-CB 3.72Å; Y258-A293 HydrophobicContact CD2-CB 4.16Å; Y258-A293 HydrophobicContact CE1-CB 3.64Å; Y258-A293 HydrophobicContact CE2-CB 4.07Å; Y258-A293 HydrophobicContact CG-CB 3.98Å; Y258-F295 HydrophobicContact CD2-CE2 4.41Å; Y258-F295 HydrophobicContact CD2-CZ 4.01Å; Y258-F295 HydrophobicContact CG-CE2 4.3Å; Y258-F295 HydrophobicContact CG-CZ 4.26Å; Y258-E316 HydrophobicContact CE2-CG 4.12Å; Y258-E316 WeakPolarHBondContact CE2-OE1 3.36Å; Y258-E316 PolarHBondContact OH-OE1 3.15Å
259	D	94.3	Very high	92.6	Very high	20 Å²	20	37.4 Å²	37.4	11%	0.107	20%	0.199	C	C	.	.			trans	-74.9	175.1	175.6	70.3	15.5	0	0	0	111.7	R187 L189 Y213 R218 S261	R187-D259 PolarHBondContact NH1-O 3.09Å; L189-D259 VanDerWaalsContact CD2-OD1 3.32Å; L189-D259 WeakPolarHBondContact CD2-OD1 3.29Å; Y213-D259 PolarHBondContact OH-OD1 3.39Å; Y213-D259 PolarHBondContact OH-OD2 3.38Å; Y213-D259 VanDerWaalsContact OH-OD2 3.1Å; R218-D259 IonicContact CZ-OD2 3.56Å; R218-D259 IonicContact NH1-OD2 2.75Å; R218-D259 PolarHBondContact NH1-OD2 3.02Å; D259-S261 PolarHBondContact O-N 3.47Å; D259-S261 WeakPolarHBondContact OD1-CB 3.39Å; D259-S261 PolarHBondContact OD1-N 3.28Å; D259-S261 PolarHBondContact OD1-OG 2.93Å; D259-S261 PolarHBondContact OD2-OG 3.43Å
260	G	94	Very high	92.4	Very high	3 Å²	3	38.6 Å²	38.6	3%	0.031	21%	0.208	C	C	.	.	S	Bend	trans	-74.2	-5.5	177.9	0	0	0	0	0	114.4	R187 T246 A248	R187-G260 PolarHBondContact NH1-O 3.01Å; T246-G260 WeakPolarHBondContact CB-O 3.22Å; T246-G260 PolarHBondContact OG1-O 3.31Å; A248-G260 WeakPolarHBondContact O-CA 3.41Å
261	S	95	Very high	92.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.203	C	C	.	.			trans	-80.9	175.8	-176	77	0	0	0	0	112.1	R187 R218 F240 S241 D259	R187-S261 PolarHBondContact NH1-O 3.49Å; R218-S261 WeakPolarHBondContact CD-OG 3.27Å; R218-S261 PolarHBondContact NH1-OG 2.86Å; F240-S261 WeakPolarHBondContact CZ-OG 3.3Å; S241-S261 WeakPolarHBondContact O-CA 3.42Å; S241-S261 WeakPolarHBondContact O-CB 3.41Å; D259-S261 PolarHBondContact O-N 3.47Å; D259-S261 WeakPolarHBondContact OD1-CB 3.39Å; D259-S261 PolarHBondContact OD1-N 3.28Å; D259-S261 PolarHBondContact OD1-OG 2.93Å; D259-S261 PolarHBondContact OD2-OG 3.43Å
262	G	95.5	Very high	92.2	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147.4	-172	168.7	0	0	0	0	0	113.8	Q188 S241	Q188-G262 CarbonylContact O-C 3.54Å; Q188-G262 VanDerWaalsContact O-CA 3.27Å; Q188-G262 WeakPolarHBondContact O-CA 3.43Å; S241-G262 WeakPolarHBondContact CB-O 3.47Å; S241-G262 PolarHBondContact N-O 3.28Å; S241-G262 PolarHBondContact O-N 3.04Å
263	Y	97.2	Very high	92.2	Very high	1 Å²	1	42.1 Å²	42.1	0%	0.004	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	124.4	173.4	-62.6	-89.8	0	0	0	108	R187 Q188 R190 F219 K221 I223 A237 N239 F240 W286	R187-Y263 CarbonylContact C-O 3.22Å; R187-Y263 VanDerWaalsContact CA-O 3.3Å; R187-Y263 WeakPolarHBondContact CA-O 3.48Å; Q188-Y263 PolarHBondContact N-O 2.89Å; Q188-Y263 PolarHBondContact O-N 2.86Å; R190-Y263 HydrophobicContact CB-CE2 4.22Å; R190-Y263 HydrophobicContact CG-CD2 4.22Å; R190-Y263 HydrophobicContact CG-CE2 4.2Å; F219-Y263 HydrophobicContact CD1-CE2 4.4Å; F219-Y263 AromaticContact CD1-CZ 4Å; F219-Y263 WeakPolarHBondContact CD1-OH 2.92Å; F219-Y263 PolarHBondContact O-OH 3.31Å; K221-Y263 PolarHBondContact O-OH 3.27Å; I223-Y263 HydrophobicContact CD1-CD1 3.4Å; I223-Y263 HydrophobicContact CD1-CD2 3.96Å; I223-Y263 HydrophobicContact CD1-CE1 3.64Å; I223-Y263 HydrophobicContact CD1-CE2 4.19Å; I223-Y263 HydrophobicContact CD1-CG 3.57Å; I223-Y263 HydrophobicContact CG1-CD1 3.82Å; I223-Y263 HydrophobicContact CG1-CE1 3.5Å; I223-Y263 HydrophobicContact CG1-CE2 4.37Å; I223-Y263 HydrophobicContact CG1-CG 4.37Å; A237-Y263 WeakPolarHBondContact O-CB 3.28Å; N239-Y263 VanDerWaalsContact C-CD1 3.45Å; N239-Y263 WeakPolarHBondContact O-CD1 3.36Å; F240-Y263 HydrophobicContact CB-CE1 3.87Å; F240-Y263 HydrophobicContact CD2-CD2 4.46Å; F240-Y263 AromaticContact CD2-CE2 3.93Å; F240-Y263 HydrophobicContact CD2-CE2 3.93Å; Y263-W286 WeakPolarHBondContact O-CZ2 3.29Å
264	I	95.8	Very high	92.4	Very high	18 Å²	18	41.7 Å²	41.7	9%	0.092	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	138.3	-173.2	59.1	171.2	0	0	0	111.6	L186 R187 A237 T246	L186-I264 CarbonylContact O-C 3.59Å; L186-I264 VanDerWaalsContact O-CA 3.29Å; L186-I264 WeakPolarHBondContact O-CA 3.16Å; R187-I264 HydrophobicContact CB-CG2 4.07Å; R187-I264 HydrophobicContact CG-CG2 3.87Å; A237-I264 VanDerWaalsContact CA-O 3.26Å; A237-I264 WeakPolarHBondContact CA-O 3.38Å; A237-I264 PolarHBondContact N-O 3.35Å; T246-I264 HydrophobicContact CG2-CG2 3.66Å
265	Q	96	Very high	93	Very high	14 Å²	14	38.9 Å²	38.9	7%	0.065	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	119.2	167.7	-179.2	59.3	41.7	0	0	109.3	L186 T234 A237 I277 L281	L186-Q265 HydrophobicContact CB-CB 4.43Å; L186-Q265 PolarHBondContact N-O 3Å; L186-Q265 PolarHBondContact O-N 3.43Å; T234-Q265 HydrophobicContact CG2-CG 4.48Å; A237-Q265 HydrophobicContact CB-CB 3.92Å; A237-Q265 HydrophobicContact CB-CG 4.41Å; Q265-I277 HydrophobicContact CG-CG2 3.58Å; Q265-L281 HydrophobicContact CB-CD1 4.19Å; Q265-L281 HydrophobicContact CG-CD1 4.06Å
266	D	95.3	Very high	93.4	Very high	49 Å²	49	35.9 Å²	35.9	26%	0.262	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	134	169.8	-68.5	-19.2	0	0	0	109	V183 R185	V183-D266 HydrophobicContact CG2-CB 3.95Å; R185-D266 WeakPolarHBondContact CB-OD1 3.48Å; R185-D266 WeakPolarHBondContact CG-OD1 3.33Å; R185-D266 IonicContact CZ-OD1 3.96Å; R185-D266 IonicContact CZ-OD2 3.34Å; R185-D266 IonicContact NE-OD1 2.78Å; R185-D266 PolarHBondContact NE-OD1 2.73Å; R185-D266 IonicContact NE-OD2 2.67Å; R185-D266 IonicContact NH2-OD1 3.75Å; R185-D266 PolarHBondContact NH2-OD1 3.2Å; R185-D266 VanDerWaalsContact NH2-OD1 3.15Å; R185-D266 IonicContact NH2-OD2 3.61Å; R185-D266 PolarHBondContact NH2-OD2 3.02Å
267	L	94.6	Very high	93.7	Very high	10 Å²	10	35.3 Å²	35.3	5%	0.052	18%	0.179	C	C	.	.			trans	-76	-177.8	172.7	-57.1	-170	0	0	0	109.8	V183 A184 L186 T274 I277 L278	V183-L267 WeakPolarHBondContact CB-O 3.3Å; V183-L267 WeakPolarHBondContact CG1-O 3.3Å; A184-L267 HydrophobicContact CB-CD1 3.91Å; A184-L267 HydrophobicContact CB-CG 4.28Å; A184-L267 WeakPolarHBondContact O-CB 3.44Å; A184-L267 PolarHBondContact O-N 3.36Å; L186-L267 HydrophobicContact CD1-CD2 3.95Å; L186-L267 HydrophobicContact CG-CD2 4.18Å; L267-T274 HydrophobicContact CB-CG2 3.92Å; L267-T274 HydrophobicContact CD1-CG2 3.68Å; L267-T274 HydrophobicContact CD2-CG2 4.08Å; L267-T274 HydrophobicContact CG-CG2 4.09Å; L267-I277 HydrophobicContact CD2-CG2 4.06Å; L267-L278 HydrophobicContact CD2-CD2 4.34Å
268	S	92.1	Very high	93.8	Very high	19 Å²	19	28.7 Å²	28.7	13%	0.133	15%	0.153	C	C	.	.			trans	-103.6	170.2	176.2	-178.8	0	0	0	0	111.4	Y156 S270 E273 T274	Y156-S268 VanDerWaalsContact CE1-O 3.32Å; Y156-S268 WeakPolarHBondContact CE1-O 3.41Å; Y156-S268 PolarHBondContact OH-O 2.9Å; S268-S270 VanDerWaalsContact C-N 3.3Å; S268-S270 PolarHBondContact OG-N 3.32Å; S268-E273 WeakPolarHBondContact CB-OE2 3.09Å; S268-E273 PolarHBondContact OG-OE2 2.9Å; S268-T274 PolarHBondContact N-OG1 2.8Å; S268-T274 VanDerWaalsContact N-OG1 3.13Å; S268-T274 PolarHBondContact O-OG1 2.87Å
269	R	87.9	Confident	93.8	Very high	100 Å²	100	32 Å²	32	38%	0.377	17%	0.171	S	C	.	.	S	Bend	trans	-74.6	-22.8	166.1	-68.5	176	65.1	-145	-2.4	112.1	Y156 E172 V183	Y156-R269 WeakPolarHBondContact CE1-O 3.44Å; E172-R269 VanDerWaalsContact CD-NH2 3.35Å; E172-R269 IonicContact OE1-CZ 2.83Å; E172-R269 IonicContact OE1-NE 3.69Å; E172-R269 PolarHBondContact OE1-NE 3.3Å; E172-R269 IonicContact OE1-NH2 3.15Å; E172-R269 PolarHBondContact OE1-NH2 3.46Å; V183-R269 HydrophobicContact CG1-CG 3.88Å
270	S	88.2	Confident	93.8	Very high	35 Å²	35	32.2 Å²	32.2	25%	0.245	17%	0.171	C	C	.	.	S	Bend	trans	-92.4	138.4	176.5	-175.4	0	0	0	0	111.4	S268 D272 T274	S268-S270 VanDerWaalsContact C-N 3.3Å; S268-S270 PolarHBondContact OG-N 3.32Å; S270-D272 PolarHBondContact OG-N 2.84Å; S270-T274 WeakPolarHBondContact O-CB 3.39Å; S270-T274 PolarHBondContact O-N 3.25Å; S270-T274 VanDerWaalsContact O-N 3.08Å; S270-T274 PolarHBondContact O-OG1 2.97Å
271	N	88.9	Confident	93.9	Very high	26 Å²	26	32 Å²	32	14%	0.139	17%	0.17	C	C	.	.	H	α-helix	trans	-60.5	-48.1	173.3	-168.9	5.5	0	0	0	110.7	Y156 E273 T274 V275	Y156-N271 HydrophobicContact CD1-CB 4.4Å; Y156-N271 HydrophobicContact CG-CB 4.02Å; N271-E273 PolarHBondContact O-N 2.96Å; N271-T274 CarbonylContact O-C 3.57Å; N271-T274 WeakPolarHBondContact O-CA 3.37Å; N271-T274 WeakPolarHBondContact O-CB 3.41Å; N271-T274 PolarHBondContact O-N 2.61Å; N271-V275 WeakPolarHBondContact O-CG2 3.27Å; N271-V275 PolarHBondContact O-N 3.37Å
272	D	91.2	Very high	93.8	Very high	124 Å²	124	36.7 Å²	36.7	66%	0.663	19%	0.19	S	C	*	.	H	α-helix	trans	-59.2	-44.5	-177.1	-62.2	-35.4	0	0	0	112.7	S270 T274 V275 A276	S270-D272 PolarHBondContact OG-N 2.84Å; D272-T274 VanDerWaalsContact C-N 3.34Å; D272-V275 PolarHBondContact O-N 3.37Å; D272-A276 PolarHBondContact O-N 2.95Å
273	E	92.2	Very high	93.8	Very high	90 Å²	90	42 Å²	42	42%	0.421	22%	0.215	S	C	.	.	H	α-helix	trans	-67.9	-36.9	176.4	-69	-176.4	175.9	0	0	111.6	S268 N271 A276 I277	S268-E273 WeakPolarHBondContact CB-OE2 3.09Å; S268-E273 PolarHBondContact OG-OE2 2.9Å; N271-E273 PolarHBondContact O-N 2.96Å; E273-A276 WeakPolarHBondContact O-CB 3.35Å; E273-A276 PolarHBondContact O-N 3.41Å; E273-I277 VanDerWaalsContact O-CG1 3.28Å; E273-I277 WeakPolarHBondContact O-CG1 3.41Å; E273-I277 PolarHBondContact O-N 3.42Å
274	T	94.1	Very high	93.6	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-66.2	-41.6	177	-61.2	0	0	0	0	111.5	L152 Y156 L267 S268 S270 N271 D272 A276 I277 L278	L152-T274 HydrophobicContact CD2-CG2 3.54Å; Y156-T274 HydrophobicContact CE2-CG2 3.89Å; Y156-T274 PolarHBondContact OH-OG1 2.95Å; Y156-T274 VanDerWaalsContact OH-OG1 3.09Å; L267-T274 HydrophobicContact CB-CG2 3.92Å; L267-T274 HydrophobicContact CD1-CG2 3.68Å; L267-T274 HydrophobicContact CD2-CG2 4.08Å; L267-T274 HydrophobicContact CG-CG2 4.09Å; S268-T274 PolarHBondContact N-OG1 2.8Å; S268-T274 VanDerWaalsContact N-OG1 3.13Å; S268-T274 PolarHBondContact O-OG1 2.87Å; S270-T274 WeakPolarHBondContact O-CB 3.39Å; S270-T274 PolarHBondContact O-N 3.25Å; S270-T274 VanDerWaalsContact O-N 3.08Å; S270-T274 PolarHBondContact O-OG1 2.97Å; N271-T274 CarbonylContact O-C 3.57Å; N271-T274 WeakPolarHBondContact O-CA 3.37Å; N271-T274 WeakPolarHBondContact O-CB 3.41Å; N271-T274 PolarHBondContact O-N 2.61Å; D272-T274 VanDerWaalsContact C-N 3.34Å; T274-A276 VanDerWaalsContact C-N 3.31Å; T274-A276 PolarHBondContact O-N 3.07Å; T274-I277 WeakPolarHBondContact O-CB 3.35Å; T274-I277 PolarHBondContact O-N 3.17Å; T274-L278 HydrophobicContact CG2-CD1 4.03Å; T274-L278 WeakPolarHBondContact O-CB 3.49Å; T274-L278 VanDerWaalsContact O-CG 3.28Å; T274-L278 WeakPolarHBondContact O-CG 3.46Å; T274-L278 PolarHBondContact O-N 3.3Å
275	V	95.2	Very high	93.5	Very high	51 Å²	51	47.9 Å²	47.9	31%	0.309	24%	0.236	S	C	.	.	H	α-helix	trans	-61.9	-40.4	172.5	172	0	0	0	0	110.7	L152 N271 D272 L278 N279	L152-V275 HydrophobicContact CD1-CG2 3.78Å; N271-V275 WeakPolarHBondContact O-CG2 3.27Å; N271-V275 PolarHBondContact O-N 3.37Å; D272-V275 PolarHBondContact O-N 3.37Å; V275-L278 PolarHBondContact O-N 2.95Å; V275-N279 VanDerWaalsContact O-CB 3.31Å; V275-N279 WeakPolarHBondContact O-CB 3.48Å; V275-N279 VanDerWaalsContact O-CG 3.23Å; V275-N279 PolarHBondContact O-N 3.37Å; V275-N279 PolarHBondContact O-ND2 3.48Å
276	A	95.1	Very high	93.5	Very high	31 Å²	31	47.2 Å²	47.2	26%	0.256	23%	0.233	S	C	.	.	H	α-helix	trans	-63.5	-44.2	174.9	0	0	0	0	0	112.4	Y233 D272 E273 T274 N279 E280	Y233-A276 HydrophobicContact CD2-CB 4.28Å; Y233-A276 HydrophobicContact CE2-CB 4.07Å; D272-A276 PolarHBondContact O-N 2.95Å; E273-A276 WeakPolarHBondContact O-CB 3.35Å; E273-A276 PolarHBondContact O-N 3.41Å; T274-A276 VanDerWaalsContact C-N 3.31Å; T274-A276 PolarHBondContact O-N 3.07Å; A276-N279 PolarHBondContact O-N 3.17Å; A276-E280 PolarHBondContact O-N 3.28Å
277	I	95.9	Very high	93.4	Very high	8 Å²	8	45.5 Å²	45.5	4%	0.041	22%	0.224	C	C	.	.	H	α-helix	trans	-56.8	-50.8	173.8	-72.7	163	0	0	0	110.4	Y233 T234 Q265 L267 E273 T274 N279 E280 L281	Y233-I277 HydrophobicContact CG-CG1 4.2Å; T234-I277 HydrophobicContact CG2-CG2 3.97Å; Q265-I277 HydrophobicContact CG-CG2 3.58Å; L267-I277 HydrophobicContact CD2-CG2 4.06Å; E273-I277 VanDerWaalsContact O-CG1 3.28Å; E273-I277 WeakPolarHBondContact O-CG1 3.41Å; E273-I277 PolarHBondContact O-N 3.42Å; T274-I277 WeakPolarHBondContact O-CB 3.35Å; T274-I277 PolarHBondContact O-N 3.17Å; I277-N279 VanDerWaalsContact C-N 3.33Å; I277-N279 PolarHBondContact O-N 3.16Å; I277-E280 PolarHBondContact O-N 3.41Å; I277-L281 HydrophobicContact CG2-CD1 4.41Å; I277-L281 WeakPolarHBondContact O-CG 3.21Å; I277-L281 PolarHBondContact O-N 3.48Å
278	L	96	Very high	93.3	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-65.1	-37	-178.7	-69.3	168.8	0	0	0	112	W144 I147 N148 L152 L186 L267 T274 V275 L281 F282	W144-L278 HydrophobicContact CZ3-CD2 4.03Å; I147-L278 HydrophobicContact CG2-CD1 4.03Å; I147-L278 HydrophobicContact CG2-CD2 3.89Å; N148-L278 WeakPolarHBondContact OD1-CD1 2.97Å; L152-L278 HydrophobicContact CD1-CD1 3.7Å; L152-L278 HydrophobicContact CD2-CD1 3.85Å; L152-L278 HydrophobicContact CG-CD1 4.06Å; L186-L278 HydrophobicContact CD1-CD2 3.76Å; L267-L278 HydrophobicContact CD2-CD2 4.34Å; T274-L278 HydrophobicContact CG2-CD1 4.03Å; T274-L278 WeakPolarHBondContact O-CB 3.49Å; T274-L278 VanDerWaalsContact O-CG 3.28Å; T274-L278 WeakPolarHBondContact O-CG 3.46Å; T274-L278 PolarHBondContact O-N 3.3Å; V275-L278 PolarHBondContact O-N 2.95Å; L278-L281 PolarHBondContact O-N 2.68Å; L278-F282 VanDerWaalsContact O-CB 3.23Å; L278-F282 WeakPolarHBondContact O-CB 3.23Å; L278-F282 PolarHBondContact O-N 2.82Å
279	N	94.8	Very high	93.3	Very high	73 Å²	73	52 Å²	52	39%	0.39	25%	0.252	S	S	.	.	H	α-helix	trans	-64.9	-42.7	173.9	-77.6	-28.1	0	0	0	112.1	V275 A276 I277 F282 Q283	V275-N279 VanDerWaalsContact O-CB 3.31Å; V275-N279 WeakPolarHBondContact O-CB 3.48Å; V275-N279 VanDerWaalsContact O-CG 3.23Å; V275-N279 PolarHBondContact O-N 3.37Å; V275-N279 PolarHBondContact O-ND2 3.48Å; A276-N279 PolarHBondContact O-N 3.17Å; I277-N279 VanDerWaalsContact C-N 3.33Å; I277-N279 PolarHBondContact O-N 3.16Å; N279-F282 PolarHBondContact O-N 3.14Å; N279-Q283 VanDerWaalsContact O-CB 3.3Å; N279-Q283 WeakPolarHBondContact O-CB 3.37Å; N279-Q283 WeakPolarHBondContact O-CG 3.4Å; N279-Q283 PolarHBondContact O-N 3.31Å
280	E	94.9	Very high	93.6	Very high	23 Å²	23	47.5 Å²	47.5	11%	0.107	24%	0.236	C	C	.	.	H	α-helix	trans	-59.4	-46.2	173.4	-77.1	-170.5	177.4	0	0	111.4	I229 N232 Y233 T234 A276 I277 G284	I229-E280 HydrophobicContact CG2-CG 4.41Å; N232-E280 WeakPolarHBondContact CB-OE1 3.43Å; N232-E280 PolarHBondContact N-OE1 3.08Å; N232-E280 PolarHBondContact N-OE2 3.32Å; Y233-E280 WeakPolarHBondContact CD2-OE1 3.19Å; Y233-E280 PolarHBondContact N-OE1 3.07Å; Y233-E280 PolarHBondContact N-OE2 3.34Å; T234-E280 WeakPolarHBondContact CB-OE2 3.34Å; T234-E280 HydrophobicContact CG2-CB 3.78Å; T234-E280 WeakPolarHBondContact CG2-OE2 3.43Å; T234-E280 PolarHBondContact N-OE2 2.94Å; T234-E280 PolarHBondContact OG1-OE2 3.19Å; A276-E280 PolarHBondContact O-N 3.28Å; I277-E280 PolarHBondContact O-N 3.41Å; E280-G284 PolarHBondContact O-N 3.31Å
281	L	95.5	Very high	94	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.2	-43.7	178.2	-66.5	-177.9	0	0	0	112.4	W144 L186 T234 A237 W238 Q265 I277 L278 R285 W286	W144-L281 HydrophobicContact CH2-CB 4.06Å; L186-L281 HydrophobicContact CD1-CD1 3.72Å; T234-L281 HydrophobicContact CG2-CD2 3.63Å; T234-L281 HydrophobicContact CG2-CG 3.79Å; A237-L281 HydrophobicContact CB-CD2 3.63Å; W238-L281 HydrophobicContact CZ2-CD2 4.27Å; Q265-L281 HydrophobicContact CB-CD1 4.19Å; Q265-L281 HydrophobicContact CG-CD1 4.06Å; I277-L281 HydrophobicContact CG2-CD1 4.41Å; I277-L281 WeakPolarHBondContact O-CG 3.21Å; I277-L281 PolarHBondContact O-N 3.48Å; L278-L281 PolarHBondContact O-N 2.68Å; L281-R285 PolarHBondContact O-N 3.36Å; L281-W286 HydrophobicContact CB-CB 3.98Å; L281-W286 HydrophobicContact CD1-CD2 4.41Å; L281-W286 HydrophobicContact CD1-CE3 4.1Å; L281-W286 HydrophobicContact CD1-CZ3 4.43Å; L281-W286 HydrophobicContact CD2-CB 3.99Å; L281-W286 HydrophobicContact CD2-CD2 4Å; L281-W286 HydrophobicContact CD2-CG 3.75Å; L281-W286 WeakPolarHBondContact O-CB 3.33Å; L281-W286 PolarHBondContact O-N 2.82Å
282	F	94.4	Very high	94.3	Very high	98 Å²	98	45.2 Å²	45.2	43%	0.43	22%	0.22	S	C	.	.	H	α-helix	trans	-63.3	-51.4	-179.9	178.5	-96.7	0	0	0	110.9	W144 L278 N279 G284 R285	W144-F282 HydrophobicContact CB-CD2 4.39Å; W144-F282 HydrophobicContact CB-CE2 4.34Å; W144-F282 AromaticContact CD1-CD2 3.9Å; W144-F282 AromaticContact CD1-CE2 3.96Å; W144-F282 AromaticContact CD2-CD2 3.7Å; W144-F282 HydrophobicContact CD2-CD2 3.7Å; W144-F282 HydrophobicContact CD2-CE2 4.41Å; W144-F282 AromaticContact CE2-CD2 3.81Å; W144-F282 HydrophobicContact CE3-CD2 4.2Å; W144-F282 AromaticContact CG-CD2 3.77Å; W144-F282 HydrophobicContact CG-CD2 3.77Å; W144-F282 AromaticContact CG-CE2 4Å; W144-F282 HydrophobicContact CG-CE2 4Å; W144-F282 HydrophobicContact CH2-CB 4.3Å; W144-F282 HydrophobicContact CZ2-CB 4.46Å; W144-F282 HydrophobicContact CZ2-CD2 4.4Å; W144-F282 HydrophobicContact CZ3-CB 4.33Å; W144-F282 AromaticContact NE1-CD2 3.92Å; L278-F282 VanDerWaalsContact O-CB 3.23Å; L278-F282 WeakPolarHBondContact O-CB 3.23Å; L278-F282 PolarHBondContact O-N 2.82Å; N279-F282 PolarHBondContact O-N 3.14Å; F282-G284 PolarHBondContact O-N 2.83Å; F282-R285 PolarHBondContact O-N 3.19Å; F282-R285 VanDerWaalsContact O-N 3.14Å
283	Q	94	Very high	94.5	Very high	112 Å²	112	39.3 Å²	39.3	52%	0.523	19%	0.188	S	C	.	.	H	α-helix	trans	-70.1	-33.4	-177.5	-65.6	-69.2	-16.2	0	0	112.5	I229 N279 R285	I229-Q283 HydrophobicContact CD1-CB 3.07Å; I229-Q283 HydrophobicContact CD1-CG 4.1Å; N279-Q283 VanDerWaalsContact O-CB 3.3Å; N279-Q283 WeakPolarHBondContact O-CB 3.37Å; N279-Q283 WeakPolarHBondContact O-CG 3.4Å; N279-Q283 PolarHBondContact O-N 3.31Å; Q283-R285 PolarHBondContact O-N 3.26Å
284	G	93.5	Very high	94.7	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	1.2	173.3	0	0	0	0	0	114.5	Q226 E280 F282 W286	Q226-G284 PolarHBondContact N-O 3.01Å; Q226-G284 CarbonylContact O-C 3.51Å; Q226-G284 WeakPolarHBondContact O-CA 3.25Å; E280-G284 PolarHBondContact O-N 3.31Å; F282-G284 PolarHBondContact O-N 2.83Å; G284-W286 VanDerWaalsContact C-N 3.32Å; G284-W286 PolarHBondContact O-N 2.96Å
285	R	93.8	Very high	94.8	Very high	142 Å²	142	35 Å²	35	54%	0.536	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	47.3	-176.2	-158.6	-178.4	-63.4	159.5	-3.7	112.6	Q226 L281 F282 Q283 I287 D288	Q226-R285 HydrophobicContact CB-CB 4.16Å; Q226-R285 VanDerWaalsContact OE1-CD 3.3Å; L281-R285 PolarHBondContact O-N 3.36Å; F282-R285 PolarHBondContact O-N 3.19Å; F282-R285 VanDerWaalsContact O-N 3.14Å; Q283-R285 PolarHBondContact O-N 3.26Å; R285-I287 PolarHBondContact O-N 3.42Å; R285-D288 HydrophobicContact CG-CB 4.25Å
286	W	95	Very high	94.9	Very high	1 Å²	1	32.6 Å²	32.6	0%	0.004	15%	0.154	C	C	.	.			trans	-55.4	-40.4	178.3	-171.8	66.5	0	0	0	111.2	L186 Q188 R190 A237 W238 Y263 L281 G284 L294	L186-W286 HydrophobicContact CB-CH2 3.99Å; L186-W286 HydrophobicContact CB-CZ3 4.12Å; Q188-W286 HydrophobicContact CB-CE3 4.48Å; Q188-W286 HydrophobicContact CB-CH2 3.39Å; Q188-W286 HydrophobicContact CB-CZ2 3.53Å; Q188-W286 HydrophobicContact CB-CZ3 3.9Å; Q188-W286 HydrophobicContact CG-CH2 4.49Å; Q188-W286 PolarHBondContact NE2-O 2.69Å; Q188-W286 VanDerWaalsContact OE1-CE2 3.28Å; Q188-W286 PolarHBondContact OE1-O 2.98Å; R190-W286 PolarHBondContact NH1-O 3.13Å; A237-W286 PolarHBondContact O-NE1 3.13Å; W238-W286 AromaticContact CE3-CD1 3.92Å; W238-W286 HydrophobicContact CH2-CB 3.88Å; W238-W286 HydrophobicContact CH2-CG 4.42Å; W238-W286 HydrophobicContact CZ3-CB 4.1Å; W238-W286 AromaticContact CZ3-CD1 3.78Å; W238-W286 HydrophobicContact CZ3-CG 4.38Å; Y263-W286 WeakPolarHBondContact O-CZ2 3.29Å; L281-W286 HydrophobicContact CB-CB 3.98Å; L281-W286 HydrophobicContact CD1-CD2 4.41Å; L281-W286 HydrophobicContact CD1-CE3 4.1Å; L281-W286 HydrophobicContact CD1-CZ3 4.43Å; L281-W286 HydrophobicContact CD2-CB 3.99Å; L281-W286 HydrophobicContact CD2-CD2 4Å; L281-W286 HydrophobicContact CD2-CG 3.75Å; L281-W286 WeakPolarHBondContact O-CB 3.33Å; L281-W286 PolarHBondContact O-N 2.82Å; G284-W286 VanDerWaalsContact C-N 3.32Å; G284-W286 PolarHBondContact O-N 2.96Å; W286-L294 HydrophobicContact CH2-CD1 4.19Å; W286-L294 HydrophobicContact CZ3-CD1 3.68Å
287	I	94.7	Very high	94.9	Very high	13 Å²	13	31.3 Å²	31.3	7%	0.067	14%	0.143	C	C	.	.	S	Bend	trans	-94.4	120	171.4	-56.5	178.3	0	0	0	110.1	M143 W144 R285 T291 L294 M317	M143-I287 HydrophobicContact CE-CD1 3.48Å; M143-I287 VanDerWaalsContact CE-CD1 3.48Å; M143-I287 HydrophobicContact CE-CG2 4.23Å; W144-I287 HydrophobicContact CH2-CD1 4.44Å; W144-I287 HydrophobicContact CZ2-CB 4.41Å; W144-I287 HydrophobicContact CZ2-CD1 3.68Å; W144-I287 HydrophobicContact CZ2-CG1 4.02Å; R285-I287 PolarHBondContact O-N 3.42Å; I287-T291 HydrophobicContact CG2-CG2 4.25Å; I287-L294 HydrophobicContact CD1-CD1 4.35Å; I287-L294 HydrophobicContact CD1-CD2 3.75Å; I287-M317 HydrophobicContact CG2-CE 3.73Å; I287-M317 HydrophobicContact CG2-SD 4.05Å
288	D	92.6	Very high	94.8	Very high	24 Å²	24	30.9 Å²	30.9	13%	0.128	14%	0.141	C	C	.	.			trans	-138.6	-172.2	175.5	73.2	7.6	0	0	0	112.5	R190 R285 S290 T291	R190-D288 IonicContact CZ-OD1 2.63Å; R190-D288 VanDerWaalsContact CZ-OD1 3.27Å; R190-D288 IonicContact CZ-OD2 2.87Å; R190-D288 IonicContact NH1-OD1 2.66Å; R190-D288 PolarHBondContact NH1-OD1 3.39Å; R190-D288 IonicContact NH1-OD2 2.77Å; R190-D288 IonicContact NH2-OD1 3.1Å; R190-D288 PolarHBondContact NH2-OD1 3.08Å; R190-D288 IonicContact NH2-OD2 2.97Å; R190-D288 PolarHBondContact NH2-OD2 3.12Å; R285-D288 HydrophobicContact CG-CB 4.25Å; D288-S290 PolarHBondContact O-N 3.4Å; D288-S290 VanDerWaalsContact O-N 3.08Å; D288-S290 WeakPolarHBondContact OD1-CA 3.46Å; D288-S290 WeakPolarHBondContact OD1-CB 3.5Å; D288-S290 PolarHBondContact OD1-N 3.33Å; D288-S290 PolarHBondContact OD1-OG 3.29Å; D288-T291 PolarHBondContact N-OG1 3.05Å; D288-T291 VanDerWaalsContact N-OG1 3.1Å; D288-T291 WeakPolarHBondContact O-CB 3.11Å; D288-T291 PolarHBondContact O-N 2.69Å; D288-T291 PolarHBondContact O-OG1 2.78Å
289	Q	91.9	Very high	94.7	Very high	141 Å²	141	30.9 Å²	30.9	66%	0.659	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-18.1	-179.1	-64.1	175.1	-28.6	0	0	115.2	Y210 T291 R292	Y210-Q289 HydrophobicContact CD2-CB 4Å; Y210-Q289 HydrophobicContact CE2-CB 3.46Å; Y210-Q289 VanDerWaalsContact CE2-CB 3.46Å; Y210-Q289 HydrophobicContact CE2-CG 4.5Å; Q289-T291 VanDerWaalsContact C-N 3.35Å; Q289-R292 PolarHBondContact O-NH1 3.45Å
290	S	93.6	Very high	94.6	Very high	5 Å²	5	27.5 Å²	27.5	4%	0.035	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-13.3	175.7	76.9	0	0	0	0	113.1	R190 V191 Y210 D288	R190-S290 CarbonylContact C-O 3.56Å; R190-S290 VanDerWaalsContact CA-O 3.29Å; R190-S290 WeakPolarHBondContact CA-O 3.23Å; R190-S290 PolarHBondContact NE-OG 3.14Å; R190-S290 VanDerWaalsContact NE-OG 3.08Å; R190-S290 PolarHBondContact NH2-OG 2.99Å; V191-S290 WeakPolarHBondContact CG2-O 3.35Å; V191-S290 PolarHBondContact N-O 2.85Å; Y210-S290 VanDerWaalsContact CE1-CB 3.45Å; D288-S290 PolarHBondContact O-N 3.4Å; D288-S290 VanDerWaalsContact O-N 3.08Å; D288-S290 WeakPolarHBondContact OD1-CA 3.46Å; D288-S290 WeakPolarHBondContact OD1-CB 3.5Å; D288-S290 PolarHBondContact OD1-N 3.33Å; D288-S290 PolarHBondContact OD1-OG 3.29Å
291	T	95.8	Very high	94.5	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.006	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	138.7	175.7	-43.5	0	0	0	0	109.7	Q188 L189 I287 D288 Q289 M317	Q188-T291 HydrophobicContact CG-CG2 3.53Å; Q188-T291 PolarHBondContact NE2-OG1 3.5Å; L189-T291 WeakPolarHBondContact O-CA 3.47Å; I287-T291 HydrophobicContact CG2-CG2 4.25Å; D288-T291 PolarHBondContact N-OG1 3.05Å; D288-T291 VanDerWaalsContact N-OG1 3.1Å; D288-T291 WeakPolarHBondContact O-CB 3.11Å; D288-T291 PolarHBondContact O-N 2.69Å; D288-T291 PolarHBondContact O-OG1 2.78Å; Q289-T291 VanDerWaalsContact C-N 3.35Å; T291-M317 HydrophobicContact CG2-CE 4.33Å; T291-M317 HydrophobicContact CG2-SD 3.66Å
292	R	95.6	Very high	94.3	Very high	12 Å²	12	29.2 Å²	29.2	5%	0.045	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	-31.6	176	-69.3	-67.1	175.5	-105.7	17.7	113.1	L189 V191 Y210 P211 Y213 Y258 Q289 M317	L189-R292 PolarHBondContact O-N 3.37Å; V191-R292 HydrophobicContact CB-CG 4.44Å; V191-R292 HydrophobicContact CG1-CG 3.67Å; V191-R292 HydrophobicContact CG2-CG 3.96Å; Y210-R292 VanDerWaalsContact C-NH2 3.27Å; Y210-R292 PolarHBondContact O-NH2 3.28Å; P211-R292 PolarHBondContact O-NE 3.2Å; P211-R292 PolarHBondContact O-NH2 3.47Å; P211-R292 VanDerWaalsContact O-NH2 3.12Å; Y213-R292 HydrophobicContact CD2-CB 4.43Å; Y258-R292 HydrophobicContact CE1-CB 4.13Å; Q289-R292 PolarHBondContact O-NH1 3.45Å; R292-M317 WeakPolarHBondContact CD-O 3.47Å; R292-M317 PolarHBondContact O-N 3.35Å
293	A	96.5	Very high	94.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	143.3	173.8	0	0	0	0	0	111.4	Q188 L189 Y258 F295 F315	Q188-A293 WeakPolarHBondContact CA-O 3.18Å; L189-A293 HydrophobicContact CD1-CB 4.08Å; L189-A293 PolarHBondContact N-O 2.96Å; Y258-A293 HydrophobicContact CD1-CB 3.72Å; Y258-A293 HydrophobicContact CD2-CB 4.16Å; Y258-A293 HydrophobicContact CE1-CB 3.64Å; Y258-A293 HydrophobicContact CE2-CB 4.07Å; Y258-A293 HydrophobicContact CG-CB 3.98Å; A293-F295 HydrophobicContact CB-CD2 4.26Å; A293-F295 HydrophobicContact CB-CE2 3.62Å; A293-F295 HydrophobicContact CB-CZ 4.39Å; A293-F315 CarbonylContact C-O 3.5Å; A293-F315 VanDerWaalsContact CA-O 3.26Å; A293-F315 WeakPolarHBondContact CA-O 3.43Å
294	L	96.4	Very high	93.9	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	126	166.6	176	70.6	0	0	0	108.5	M143 I147 W286 I287 I296 I314 F315	M143-L294 HydrophobicContact CE-CD2 4.44Å; M143-L294 HydrophobicContact SD-CD2 3.97Å; I147-L294 HydrophobicContact CD1-CD2 3.95Å; W286-L294 HydrophobicContact CH2-CD1 4.19Å; W286-L294 HydrophobicContact CZ3-CD1 3.68Å; I287-L294 HydrophobicContact CD1-CD1 4.35Å; I287-L294 HydrophobicContact CD1-CD2 3.75Å; L294-I296 HydrophobicContact CD2-CD1 4.35Å; L294-I296 HydrophobicContact CD2-CG1 4.37Å; L294-I296 HydrophobicContact CG-CG1 4.32Å; L294-I314 CarbonylContact O-C 3.59Å; L294-I314 WeakPolarHBondContact O-CA 3.43Å; L294-F315 HydrophobicContact CB-CB 4.31Å; L294-F315 HydrophobicContact CD2-CD2 4.01Å; L294-F315 PolarHBondContact N-O 2.89Å; L294-F315 PolarHBondContact O-N 3.43Å
295	F	96.4	Very high	93.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	133.8	173.1	-66.7	-97.7	0	0	0	108.9	L186 R187 L189 Y251 Y258 A293 I313 I314	L186-F295 CarbonylContact C-O 3.52Å; L186-F295 WeakPolarHBondContact CA-O 3.46Å; R187-F295 HydrophobicContact CB-CB 4.24Å; R187-F295 PolarHBondContact N-O 3.47Å; R187-F295 VanDerWaalsContact NH2-CD2 3.33Å; R187-F295 PolarHBondContact O-N 3.44Å; L189-F295 HydrophobicContact CD1-CD2 3.71Å; L189-F295 HydrophobicContact CD1-CE2 3.41Å; L189-F295 VanDerWaalsContact CD1-CE2 3.41Å; Y251-F295 AromaticContact CD1-CE1 3.87Å; Y251-F295 HydrophobicContact CD1-CE1 3.87Å; Y251-F295 HydrophobicContact CD1-CZ 4.24Å; Y251-F295 HydrophobicContact CG-CE1 4.16Å; Y258-F295 HydrophobicContact CD2-CE2 4.41Å; Y258-F295 HydrophobicContact CD2-CZ 4.01Å; Y258-F295 HydrophobicContact CG-CE2 4.3Å; Y258-F295 HydrophobicContact CG-CZ 4.26Å; A293-F295 HydrophobicContact CB-CD2 4.26Å; A293-F295 HydrophobicContact CB-CE2 3.62Å; A293-F295 HydrophobicContact CB-CZ 4.39Å; F295-I313 CarbonylContact C-O 3.47Å; F295-I313 WeakPolarHBondContact CA-O 3.26Å; F295-I314 HydrophobicContact CD1-CB 4.48Å; F295-I314 HydrophobicContact CD1-CD1 4.17Å; F295-I314 HydrophobicContact CD1-CG1 3.67Å; F295-I314 HydrophobicContact CD1-CG2 4.25Å; F295-I314 HydrophobicContact CE1-CB 4.43Å; F295-I314 HydrophobicContact CE1-CD1 3.84Å; F295-I314 HydrophobicContact CE1-CG1 3.75Å; F295-I314 HydrophobicContact CE1-CG2 3.87Å; F295-I314 HydrophobicContact CZ-CG2 4.1Å
296	I	96.1	Very high	93.5	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	107.9	172.7	-45.2	-172.4	0	0	0	106.9	I147 L151 R185 L186 L294 K312 I313 F315	I147-I296 HydrophobicContact CD1-CD1 3.94Å; I147-I296 HydrophobicContact CG1-CD1 3.82Å; L151-I296 HydrophobicContact CD2-CD1 3.8Å; L151-I296 HydrophobicContact CD2-CG2 3.9Å; R185-I296 WeakPolarHBondContact O-CA 3.37Å; L186-I296 HydrophobicContact CD2-CB 4.14Å; L186-I296 HydrophobicContact CD2-CD1 3.82Å; L186-I296 HydrophobicContact CD2-CG1 3.56Å; L186-I296 HydrophobicContact CD2-CG2 3.93Å; L294-I296 HydrophobicContact CD2-CD1 4.35Å; L294-I296 HydrophobicContact CD2-CG1 4.37Å; L294-I296 HydrophobicContact CG-CG1 4.32Å; I296-K312 WeakPolarHBondContact O-CA 3.45Å; I296-I313 HydrophobicContact CB-CB 4.16Å; I296-I313 PolarHBondContact N-O 3.48Å; I296-I313 PolarHBondContact O-N 2.86Å; I296-F315 HydrophobicContact CD1-CE2 4.03Å
297	D	94.9	Very high	93.4	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.016	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	131.8	-170.6	-66.2	-4.4	0	0	0	110.1	A184 R185 V311 K312 Y418	A184-D297 CarbonylContact C-O 3.54Å; A184-D297 WeakPolarHBondContact CA-O 3.36Å; R185-D297 PolarHBondContact N-O 3.12Å; R185-D297 PolarHBondContact O-N 3.44Å; D297-V311 WeakPolarHBondContact CA-O 3.39Å; D297-K312 WeakPolarHBondContact OD1-CB 3.33Å; D297-K312 VanDerWaalsContact OD1-CG 3.27Å; D297-K312 WeakPolarHBondContact OD1-CG 3.43Å; D297-K312 IonicContact OD1-NZ 2.61Å; D297-K312 IonicContact OD2-NZ 3.03Å; D297-K312 PolarHBondContact OD2-NZ 3.5Å; D297-Y418 HydrophobicContact CB-CE2 4.12Å
298	F	94.5	Very high	93.3	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	158.1	173.8	57.1	-87.2	0	0	0	111	F119 L151 L155 A184 I300 V311 I313	F119-F298 HydrophobicContact CD1-CE2 4.44Å; F119-F298 AromaticContact CD1-CZ 3.72Å; F119-F298 HydrophobicContact CD1-CZ 3.72Å; F119-F298 HydrophobicContact CD2-CE2 4.35Å; F119-F298 HydrophobicContact CD2-CZ 4.1Å; F119-F298 HydrophobicContact CE1-CE1 4.43Å; F119-F298 AromaticContact CE1-CE2 3.85Å; F119-F298 HydrophobicContact CE1-CE2 3.85Å; F119-F298 AromaticContact CE1-CZ 3.49Å; F119-F298 HydrophobicContact CE1-CZ 3.49Å; F119-F298 VanDerWaalsContact CE1-CZ 3.49Å; F119-F298 AromaticContact CE2-CE2 3.76Å; F119-F298 HydrophobicContact CE2-CE2 3.76Å; F119-F298 AromaticContact CE2-CZ 3.92Å; F119-F298 HydrophobicContact CE2-CZ 3.92Å; F119-F298 HydrophobicContact CG-CZ 4.03Å; F119-F298 AromaticContact CZ-CE2 3.47Å; F119-F298 HydrophobicContact CZ-CE2 3.47Å; F119-F298 VanDerWaalsContact CZ-CE2 3.47Å; F119-F298 AromaticContact CZ-CZ 3.6Å; F119-F298 HydrophobicContact CZ-CZ 3.6Å; L151-F298 HydrophobicContact CD1-CE1 4.06Å; L151-F298 HydrophobicContact CD1-CZ 4.49Å; L155-F298 HydrophobicContact CD2-CD1 4.29Å; L155-F298 HydrophobicContact CD2-CD2 3.83Å; L155-F298 HydrophobicContact CD2-CE1 4.32Å; L155-F298 HydrophobicContact CD2-CE2 3.87Å; L155-F298 HydrophobicContact CD2-CG 4.05Å; L155-F298 HydrophobicContact CD2-CZ 4.11Å; A184-F298 HydrophobicContact CB-CB 3.78Å; A184-F298 HydrophobicContact CB-CD1 4.44Å; A184-F298 HydrophobicContact CB-CG 4.45Å; F298-I300 HydrophobicContact CD2-CD1 4.13Å; F298-I300 HydrophobicContact CD2-CG1 3.99Å; F298-I300 HydrophobicContact CE2-CD1 3.71Å; F298-I300 HydrophobicContact CE2-CG1 4.1Å; F298-V311 HydrophobicContact CD1-CB 4.34Å; F298-V311 HydrophobicContact CD2-CB 4.07Å; F298-V311 HydrophobicContact CD2-CG2 4.21Å; F298-V311 HydrophobicContact CE1-CB 3.91Å; F298-V311 HydrophobicContact CE1-CG1 3.81Å; F298-V311 HydrophobicContact CE2-CB 3.6Å; F298-V311 HydrophobicContact CE2-CG1 4.09Å; F298-V311 HydrophobicContact CE2-CG2 3.56Å; F298-V311 HydrophobicContact CG-CB 4.42Å; F298-V311 HydrophobicContact CZ-CB 3.53Å; F298-V311 HydrophobicContact CZ-CG1 3.5Å; F298-V311 VanDerWaalsContact CZ-CG1 3.5Å; F298-V311 HydrophobicContact CZ-CG2 3.87Å; F298-V311 PolarHBondContact N-O 3.48Å; F298-V311 PolarHBondContact O-N 2.98Å; F298-I313 HydrophobicContact CE1-CD1 4.12Å
299	T	93.5	Very high	93.3	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	134.3	179.9	-55.9	0	0	0	0	110.6	L181 F308 I309 I310 F421	L181-T299 HydrophobicContact CD1-CG2 4.28Å; L181-T299 PolarHBondContact N-O 2.92Å; T299-F308 HydrophobicContact CG2-CB 4.4Å; T299-F308 HydrophobicContact CG2-CD1 4.23Å; T299-I309 WeakPolarHBondContact CA-O 3.42Å; T299-I310 HydrophobicContact CG2-CG1 4.34Å; T299-F421 HydrophobicContact CG2-CD2 3.84Å; T299-F421 HydrophobicContact CG2-CE2 4.35Å
300	I	93.2	Very high	93.4	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.005	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	141	175.8	-59.2	174	0	0	0	108.4	Y111 V115 F119 I174 N178 K179 F298 F308 I309	Y111-I300 WeakPolarHBondContact OH-CG2 3.41Å; V115-I300 HydrophobicContact CG1-CD1 4.28Å; F119-I300 HydrophobicContact CE2-CD1 3.59Å; F119-I300 HydrophobicContact CZ-CD1 3.89Å; I174-I300 HydrophobicContact CD1-CD1 4.04Å; I174-I300 HydrophobicContact CD1-CG1 4.45Å; N178-I300 HydrophobicContact CB-CG2 3.5Å; K179-I300 CarbonylContact O-C 3.59Å; K179-I300 WeakPolarHBondContact O-CA 3.47Å; F298-I300 HydrophobicContact CD2-CD1 4.13Å; F298-I300 HydrophobicContact CD2-CG1 3.99Å; F298-I300 HydrophobicContact CE2-CD1 3.71Å; F298-I300 HydrophobicContact CE2-CG1 4.1Å; I300-F308 CarbonylContact O-C 3.53Å; I300-F308 VanDerWaalsContact O-CA 3.29Å; I300-F308 WeakPolarHBondContact O-CA 3.13Å; I300-I309 PolarHBondContact N-O 2.72Å; I300-I309 PolarHBondContact O-N 2.98Å
301	Y	92.2	Very high	93.4	Very high	43 Å²	43	16 Å²	16	17%	0.169	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	130.4	175.7	172.6	-112.4	0	0	0	111.2	N178 K179 L181 A303 N306 F308	N178-Y301 CarbonylContact C-O 3.6Å; K179-Y301 PolarHBondContact N-O 3.5Å; K179-Y301 PolarHBondContact O-N 2.67Å; L181-Y301 HydrophobicContact CD1-CG 4.47Å; Y301-A303 HydrophobicContact CE1-CB 3.9Å; Y301-N306 PolarHBondContact OH-OD1 2.85Å; Y301-F308 AromaticContact CD2-CD1 3.87Å; Y301-F308 HydrophobicContact CD2-CD1 3.87Å; Y301-F308 AromaticContact CD2-CD2 3.59Å; Y301-F308 HydrophobicContact CD2-CD2 3.59Å; Y301-F308 AromaticContact CD2-CE1 3.73Å; Y301-F308 HydrophobicContact CD2-CE1 3.73Å; Y301-F308 AromaticContact CD2-CE2 3.39Å; Y301-F308 HydrophobicContact CD2-CE2 3.39Å; Y301-F308 AromaticContact CD2-CG 3.81Å; Y301-F308 HydrophobicContact CD2-CG 3.81Å; Y301-F308 AromaticContact CD2-CZ 3.47Å; Y301-F308 HydrophobicContact CD2-CZ 3.47Å; Y301-F308 VanDerWaalsContact CD2-CZ 3.47Å; Y301-F308 AromaticContact CE2-CD2 3.93Å; Y301-F308 HydrophobicContact CE2-CD2 3.93Å; Y301-F308 HydrophobicContact CE2-CE1 4.39Å; Y301-F308 AromaticContact CE2-CE2 3.41Å; Y301-F308 HydrophobicContact CE2-CE2 3.41Å; Y301-F308 VanDerWaalsContact CE2-CE2 3.41Å; Y301-F308 AromaticContact CE2-CZ 3.68Å; Y301-F308 HydrophobicContact CE2-CZ 3.68Å; Y301-F308 HydrophobicContact CG-CD1 4.29Å; Y301-F308 HydrophobicContact CG-CE1 4.07Å; Y301-F308 HydrophobicContact CG-CE2 4.46Å; Y301-F308 HydrophobicContact CG-CZ 4.14Å
302	N	92.5	Very high	93.3	Very high	16 Å²	16	16.6 Å²	16.6	9%	0.086	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	117	172	-173.2	-48	0	0	0	109.9	Y111 N178 N304 I305 N306 I307	Y111-N302 HydrophobicContact CE1-CB 4.07Å; Y111-N302 HydrophobicContact CE2-CB 4.16Å; N178-N302 PolarHBondContact OD1-ND2 3.31Å; N302-N304 WeakPolarHBondContact OD1-CB 3.4Å; N302-N304 PolarHBondContact OD1-N 3.2Å; N302-I305 HydrophobicContact CB-CD1 4.2Å; N302-I305 HydrophobicContact CB-CG1 3.9Å; N302-I305 PolarHBondContact OD1-N 2.97Å; N302-N306 WeakPolarHBondContact O-CA 3.29Å; N302-N306 PolarHBondContact O-N 3.16Å; N302-I307 PolarHBondContact N-O 2.88Å; N302-I307 PolarHBondContact O-N 3.35Å
303	A	90.1	Very high	93.3	Very high	62 Å²	62	16 Å²	16	51%	0.512	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-29	-176.7	0	0	0	0	0	113.6	Y301 I305	Y301-A303 HydrophobicContact CE1-CB 3.9Å; A303-I305 VanDerWaalsContact C-N 3.27Å; A303-I305 PolarHBondContact O-N 3.3Å
304	N	90	Very high	93.2	Very high	114 Å²	114	16 Å²	16	61%	0.61	9%	0.09	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-31.7	-177.5	-63.5	-31.4	0	0	0	112	D177 N302	D177-N304 PolarHBondContact OD1-ND2 3.33Å; D177-N304 VanDerWaalsContact OD1-ND2 3.07Å; D177-N304 PolarHBondContact OD2-ND2 2.72Å; N302-N304 WeakPolarHBondContact OD1-CB 3.4Å; N302-N304 PolarHBondContact OD1-N 3.2Å
305	I	88.9	Confident	93.2	Very high	57 Å²	57	16 Å²	16	29%	0.292	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-5.1	-179.4	63.2	-179.6	0	0	0	113.2	V107 Y111 N302 A303 I307	V107-I305 HydrophobicContact CG1-CB 4.29Å; V107-I305 HydrophobicContact CG1-CD1 3.99Å; V107-I305 HydrophobicContact CG1-CG2 3.81Å; Y111-I305 HydrophobicContact CD1-CD1 3.64Å; Y111-I305 HydrophobicContact CD2-CD1 4.44Å; Y111-I305 HydrophobicContact CE1-CD1 4.22Å; Y111-I305 HydrophobicContact CG-CD1 3.77Å; N302-I305 HydrophobicContact CB-CD1 4.2Å; N302-I305 HydrophobicContact CB-CG1 3.9Å; N302-I305 PolarHBondContact OD1-N 2.97Å; A303-I305 VanDerWaalsContact C-N 3.27Å; A303-I305 PolarHBondContact O-N 3.3Å; I305-I307 HydrophobicContact CB-CG1 4.5Å; I305-I307 HydrophobicContact CD1-CB 4.13Å; I305-I307 HydrophobicContact CD1-CD1 4.03Å; I305-I307 HydrophobicContact CD1-CG1 4.29Å; I305-I307 HydrophobicContact CG1-CB 4.03Å; I305-I307 HydrophobicContact CG1-CD1 4.25Å; I305-I307 HydrophobicContact CG1-CG1 4.08Å; I305-I307 PolarHBondContact O-N 3.44Å
306	N	89.7	Confident	93.1	Very high	7 Å²	7	16 Å²	16	4%	0.037	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	51.3	-177.1	-176	11.8	0	0	0	112.5	Y301 N302 F335 Q338	Y301-N306 PolarHBondContact OH-OD1 2.85Å; N302-N306 WeakPolarHBondContact O-CA 3.29Å; N302-N306 PolarHBondContact O-N 3.16Å; N306-F335 PolarHBondContact ND2-O 3.3Å; N306-F335 WeakPolarHBondContact OD1-CD2 3.29Å; N306-Q338 PolarHBondContact ND2-OE1 3.45Å
307	I	91.8	Very high	93	Very high	12 Å²	12	16.4 Å²	16.4	6%	0.062	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	136.4	177.7	-62.6	178.8	0	0	0	109.2	Y111 N302 I305 P331	Y111-I307 HydrophobicContact CD1-CB 4.06Å; Y111-I307 HydrophobicContact CD1-CG2 3.77Å; Y111-I307 HydrophobicContact CE1-CB 4.08Å; Y111-I307 HydrophobicContact CE1-CG2 3.88Å; N302-I307 PolarHBondContact N-O 2.88Å; N302-I307 PolarHBondContact O-N 3.35Å; I305-I307 HydrophobicContact CB-CG1 4.5Å; I305-I307 HydrophobicContact CD1-CB 4.13Å; I305-I307 HydrophobicContact CD1-CD1 4.03Å; I305-I307 HydrophobicContact CD1-CG1 4.29Å; I305-I307 HydrophobicContact CG1-CB 4.03Å; I305-I307 HydrophobicContact CG1-CD1 4.25Å; I305-I307 HydrophobicContact CG1-CG1 4.08Å; I305-I307 PolarHBondContact O-N 3.44Å; I307-P331 HydrophobicContact CG2-CB 4.02Å
308	F	92.3	Very high	92.9	Very high	2 Å²	2	16.4 Å²	16.4	1%	0.009	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	140.6	171.4	-62.5	-109.6	0	0	0	108.3	L181 T299 I300 Y301 P331 V332 L334 F335 M408	L181-F308 HydrophobicContact CD1-CD1 3.53Å; L181-F308 HydrophobicContact CD1-CE1 3.33Å; T299-F308 HydrophobicContact CG2-CB 4.4Å; T299-F308 HydrophobicContact CG2-CD1 4.23Å; I300-F308 CarbonylContact O-C 3.53Å; I300-F308 VanDerWaalsContact O-CA 3.29Å; I300-F308 WeakPolarHBondContact O-CA 3.13Å; Y301-F308 AromaticContact CD2-CD1 3.87Å; Y301-F308 HydrophobicContact CD2-CD1 3.87Å; Y301-F308 AromaticContact CD2-CD2 3.59Å; Y301-F308 HydrophobicContact CD2-CD2 3.59Å; Y301-F308 AromaticContact CD2-CE1 3.73Å; Y301-F308 HydrophobicContact CD2-CE1 3.73Å; Y301-F308 AromaticContact CD2-CE2 3.39Å; Y301-F308 HydrophobicContact CD2-CE2 3.39Å; Y301-F308 AromaticContact CD2-CG 3.81Å; Y301-F308 HydrophobicContact CD2-CG 3.81Å; Y301-F308 AromaticContact CD2-CZ 3.47Å; Y301-F308 HydrophobicContact CD2-CZ 3.47Å; Y301-F308 VanDerWaalsContact CD2-CZ 3.47Å; Y301-F308 AromaticContact CE2-CD2 3.93Å; Y301-F308 HydrophobicContact CE2-CD2 3.93Å; Y301-F308 HydrophobicContact CE2-CE1 4.39Å; Y301-F308 AromaticContact CE2-CE2 3.41Å; Y301-F308 HydrophobicContact CE2-CE2 3.41Å; Y301-F308 VanDerWaalsContact CE2-CE2 3.41Å; Y301-F308 AromaticContact CE2-CZ 3.68Å; Y301-F308 HydrophobicContact CE2-CZ 3.68Å; Y301-F308 HydrophobicContact CG-CD1 4.29Å; Y301-F308 HydrophobicContact CG-CE1 4.07Å; Y301-F308 HydrophobicContact CG-CE2 4.46Å; Y301-F308 HydrophobicContact CG-CZ 4.14Å; F308-P331 CarbonylContact O-C 3.58Å; F308-P331 VanDerWaalsContact O-CA 3.29Å; F308-P331 WeakPolarHBondContact O-CA 3.32Å; F308-V332 WeakPolarHBondContact CB-O 3.5Å; F308-V332 PolarHBondContact N-O 3.4Å; F308-V332 PolarHBondContact O-N 2.96Å; F308-L334 HydrophobicContact CB-CD1 4.27Å; F308-L334 HydrophobicContact CB-CG 4.31Å; F308-L334 HydrophobicContact CD1-CD1 3.69Å; F308-L334 HydrophobicContact CD1-CG 4.41Å; F308-L334 HydrophobicContact CD2-CB 3.78Å; F308-L334 HydrophobicContact CD2-CD1 3.74Å; F308-L334 HydrophobicContact CD2-CG 3.56Å; F308-L334 HydrophobicContact CE1-CD1 3.85Å; F308-L334 HydrophobicContact CE2-CB 3.7Å; F308-L334 HydrophobicContact CE2-CD1 3.95Å; F308-L334 HydrophobicContact CE2-CG 3.94Å; F308-L334 HydrophobicContact CG-CD1 3.64Å; F308-L334 HydrophobicContact CG-CG 3.85Å; F308-L334 HydrophobicContact CZ-CB 4.34Å; F308-L334 HydrophobicContact CZ-CD1 4Å; F308-L334 HydrophobicContact CZ-CG 4.48Å; F308-F335 AromaticContact CE2-CD2 3.85Å; F308-F335 HydrophobicContact CE2-CD2 3.85Å; F308-F335 AromaticContact CE2-CE2 3.98Å; F308-F335 HydrophobicContact CE2-CE2 3.98Å; F308-F335 HydrophobicContact CZ-CD2 4.01Å; F308-F335 AromaticContact CZ-CE2 3.63Å; F308-F335 HydrophobicContact CZ-CE2 3.63Å; F308-F335 HydrophobicContact CZ-CZ 4.39Å; F308-M408 HydrophobicContact CE1-SD 4.24Å; F308-M408 HydrophobicContact CZ-SD 4.35Å
309	I	93.5	Very high	92.7	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	119.8	168.2	-77.6	179.1	0	0	0	107.9	Y111 V115 T299 I300 V311 V329 P331	Y111-I309 HydrophobicContact CD1-CD1 3.21Å; Y111-I309 HydrophobicContact CD1-CG1 3.68Å; Y111-I309 HydrophobicContact CD2-CD1 3.81Å; Y111-I309 HydrophobicContact CE1-CB 4.21Å; Y111-I309 HydrophobicContact CE1-CD1 3.24Å; Y111-I309 HydrophobicContact CE1-CG1 3.37Å; Y111-I309 HydrophobicContact CE2-CD1 3.8Å; Y111-I309 HydrophobicContact CG-CD1 3.52Å; Y111-I309 HydrophobicContact CG-CG1 4.46Å; V115-I309 HydrophobicContact CB-CD1 4.12Å; V115-I309 HydrophobicContact CG1-CG2 4.06Å; V115-I309 HydrophobicContact CG2-CD1 3.67Å; T299-I309 WeakPolarHBondContact CA-O 3.42Å; I300-I309 PolarHBondContact N-O 2.72Å; I300-I309 PolarHBondContact O-N 2.98Å; I309-V311 HydrophobicContact CG2-CG2 3.67Å; I309-V329 HydrophobicContact CG2-CG1 3.44Å; I309-V329 VanDerWaalsContact CG2-CG1 3.44Å; I309-P331 HydrophobicContact CD1-CB 4.47Å; I309-P331 HydrophobicContact CG1-CB 3.87Å
310	I	93.8	Very high	92.5	Very high	4 Å²	4	25 Å²	25	2%	0.021	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	118.7	168.7	-56.7	84.2	0	0	0	106.9	T299 Q330 V332 F421 A425	T299-I310 HydrophobicContact CG2-CG1 4.34Å; I310-Q330 PolarHBondContact N-O 2.94Å; I310-Q330 PolarHBondContact O-N 3.37Å; I310-V332 HydrophobicContact CD1-CB 4.12Å; I310-V332 HydrophobicContact CD1-CG2 3.5Å; I310-F421 HydrophobicContact CG1-CB 4.01Å; I310-A425 HydrophobicContact CB-CB 4.19Å; I310-A425 HydrophobicContact CD1-CB 3.74Å; I310-A425 HydrophobicContact CG1-CB 3.91Å; I310-A425 HydrophobicContact CG2-CB 4.49Å
311	V	94.3	Very high	92.3	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	132	175.7	-174.4	0	0	0	0	108.8	V115 D297 F298 I309 I313 V328 V329	V115-V311 HydrophobicContact CG1-CG2 3.78Å; D297-V311 WeakPolarHBondContact CA-O 3.39Å; F298-V311 HydrophobicContact CD1-CB 4.34Å; F298-V311 HydrophobicContact CD2-CB 4.07Å; F298-V311 HydrophobicContact CD2-CG2 4.21Å; F298-V311 HydrophobicContact CE1-CB 3.91Å; F298-V311 HydrophobicContact CE1-CG1 3.81Å; F298-V311 HydrophobicContact CE2-CB 3.6Å; F298-V311 HydrophobicContact CE2-CG1 4.09Å; F298-V311 HydrophobicContact CE2-CG2 3.56Å; F298-V311 HydrophobicContact CG-CB 4.42Å; F298-V311 HydrophobicContact CZ-CB 3.53Å; F298-V311 HydrophobicContact CZ-CG1 3.5Å; F298-V311 VanDerWaalsContact CZ-CG1 3.5Å; F298-V311 HydrophobicContact CZ-CG2 3.87Å; F298-V311 PolarHBondContact N-O 3.48Å; F298-V311 PolarHBondContact O-N 2.98Å; I309-V311 HydrophobicContact CG2-CG2 3.67Å; V311-I313 HydrophobicContact CG1-CG1 4.03Å; V311-V328 WeakPolarHBondContact CA-O 3.39Å; V311-V329 HydrophobicContact CG1-CG2 4.43Å; V311-V329 HydrophobicContact CG2-CG1 4.43Å
312	K	94	Very high	92.2	Very high	13 Å²	13	26.8 Å²	26.8	6%	0.057	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	121.6	167.2	-56.2	-174.9	167	-96.6	0	109.5	I296 D297 I314 T327 V328 D422	I296-K312 WeakPolarHBondContact O-CA 3.45Å; D297-K312 WeakPolarHBondContact OD1-CB 3.33Å; D297-K312 VanDerWaalsContact OD1-CG 3.27Å; D297-K312 WeakPolarHBondContact OD1-CG 3.43Å; D297-K312 IonicContact OD1-NZ 2.61Å; D297-K312 IonicContact OD2-NZ 3.03Å; D297-K312 PolarHBondContact OD2-NZ 3.5Å; K312-I314 HydrophobicContact CB-CG1 4.41Å; K312-T327 CarbonylContact O-C 3.53Å; K312-T327 WeakPolarHBondContact O-CA 3.34Å; K312-V328 HydrophobicContact CB-CB 4.22Å; K312-V328 PolarHBondContact N-O 3.25Å; K312-V328 PolarHBondContact O-N 2.86Å; K312-D422 VanDerWaalsContact CE-CG 3.41Å; K312-D422 WeakPolarHBondContact CE-OD1 3.46Å; K312-D422 IonicContact NZ-OD1 3.8Å; K312-D422 PolarHBondContact NZ-OD1 2.87Å; K312-D422 IonicContact NZ-OD2 3.3Å; K312-D422 PolarHBondContact NZ-OD2 2.92Å
313	I	94.8	Very high	92.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	127.2	172.4	-51.3	177.2	0	0	0	107.1	I120 F134 Y146 L151 F295 I296 F298 V311 F315 T327	I120-I313 HydrophobicContact CD1-CD1 4.31Å; I120-I313 HydrophobicContact CD1-CG1 4.39Å; F134-I313 HydrophobicContact CE2-CG2 3.42Å; F134-I313 VanDerWaalsContact CE2-CG2 3.42Å; F134-I313 HydrophobicContact CZ-CG2 3.6Å; Y146-I313 HydrophobicContact CE1-CD1 4.36Å; Y146-I313 HydrophobicContact CE1-CG2 4.32Å; Y146-I313 WeakPolarHBondContact OH-CD1 3.42Å; L151-I313 HydrophobicContact CD1-CD1 3.84Å; F295-I313 CarbonylContact C-O 3.47Å; F295-I313 WeakPolarHBondContact CA-O 3.26Å; I296-I313 HydrophobicContact CB-CB 4.16Å; I296-I313 PolarHBondContact N-O 3.48Å; I296-I313 PolarHBondContact O-N 2.86Å; F298-I313 HydrophobicContact CE1-CD1 4.12Å; V311-I313 HydrophobicContact CG1-CG1 4.03Å; I313-F315 HydrophobicContact CG2-CE2 3.9Å; I313-F315 HydrophobicContact CG2-CZ 4.09Å; I313-T327 HydrophobicContact CG2-CG2 4.35Å
314	I	94.9	Very high	92.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.3	-167	-53	165.9	0	0	0	108.2	Y251 L294 F295 K312 E316 G325 S326 V328	Y251-I314 HydrophobicContact CD1-CD1 3.74Å; Y251-I314 HydrophobicContact CE1-CD1 3.21Å; Y251-I314 HydrophobicContact CE2-CD1 4.34Å; Y251-I314 HydrophobicContact CG-CD1 4.47Å; L294-I314 CarbonylContact O-C 3.59Å; L294-I314 WeakPolarHBondContact O-CA 3.43Å; F295-I314 HydrophobicContact CD1-CB 4.48Å; F295-I314 HydrophobicContact CD1-CD1 4.17Å; F295-I314 HydrophobicContact CD1-CG1 3.67Å; F295-I314 HydrophobicContact CD1-CG2 4.25Å; F295-I314 HydrophobicContact CE1-CB 4.43Å; F295-I314 HydrophobicContact CE1-CD1 3.84Å; F295-I314 HydrophobicContact CE1-CG1 3.75Å; F295-I314 HydrophobicContact CE1-CG2 3.87Å; F295-I314 HydrophobicContact CZ-CG2 4.1Å; K312-I314 HydrophobicContact CB-CG1 4.41Å; I314-E316 HydrophobicContact CG2-CG 4.22Å; I314-G325 CarbonylContact O-C 3.54Å; I314-G325 WeakPolarHBondContact O-CA 3.28Å; I314-S326 PolarHBondContact N-O 3.33Å; I314-S326 PolarHBondContact O-N 3.45Å; I314-S326 VanDerWaalsContact O-O 3.13Å; I314-V328 HydrophobicContact CD1-CG2 4.22Å
315	F	95.4	Very high	92.2	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	115.2	171.1	-62.3	-78.5	0	0	0	109.3	F134 I137 M143 Y146 A293 L294 I296 I313 L323 F324	F134-F315 HydrophobicContact CD2-CE1 4.46Å; F134-F315 HydrophobicContact CD2-CZ 4.45Å; F134-F315 AromaticContact CE2-CE1 3.62Å; F134-F315 HydrophobicContact CE2-CE1 3.62Å; F134-F315 HydrophobicContact CE2-CE2 4.49Å; F134-F315 AromaticContact CE2-CZ 3.56Å; F134-F315 HydrophobicContact CE2-CZ 3.56Å; F134-F315 AromaticContact CZ-CE1 3.98Å; F134-F315 HydrophobicContact CZ-CE1 3.98Å; F134-F315 HydrophobicContact CZ-CZ 4.21Å; I137-F315 HydrophobicContact CB-CE1 4.47Å; I137-F315 HydrophobicContact CD1-CE1 3.91Å; I137-F315 HydrophobicContact CD1-CZ 4.28Å; I137-F315 HydrophobicContact CG2-CE1 4.14Å; M143-F315 HydrophobicContact CG-CD1 4.01Å; M143-F315 HydrophobicContact CG-CD2 3.92Å; M143-F315 HydrophobicContact CG-CE1 3.99Å; M143-F315 HydrophobicContact CG-CE2 3.9Å; M143-F315 HydrophobicContact CG-CG 3.96Å; M143-F315 HydrophobicContact CG-CZ 3.92Å; M143-F315 HydrophobicContact SD-CB 3.97Å; M143-F315 HydrophobicContact SD-CD1 4.31Å; M143-F315 HydrophobicContact SD-CD2 3.96Å; M143-F315 HydrophobicContact SD-CG 3.82Å; Y146-F315 HydrophobicContact CD1-CE2 4.38Å; Y146-F315 AromaticContact CD1-CZ 3.72Å; Y146-F315 HydrophobicContact CD1-CZ 3.72Å; Y146-F315 AromaticContact CE1-CZ 3.99Å; Y146-F315 HydrophobicContact CE1-CZ 3.99Å; A293-F315 CarbonylContact C-O 3.5Å; A293-F315 VanDerWaalsContact CA-O 3.26Å; A293-F315 WeakPolarHBondContact CA-O 3.43Å; L294-F315 HydrophobicContact CB-CB 4.31Å; L294-F315 HydrophobicContact CD2-CD2 4.01Å; L294-F315 PolarHBondContact N-O 2.89Å; L294-F315 PolarHBondContact O-N 3.43Å; I296-F315 HydrophobicContact CD1-CE2 4.03Å; I313-F315 HydrophobicContact CG2-CE2 3.9Å; I313-F315 HydrophobicContact CG2-CZ 4.09Å; F315-L323 HydrophobicContact CB-CD1 3.96Å; F315-L323 HydrophobicContact CB-CG 4.36Å; F315-L323 HydrophobicContact CD1-CD2 3.71Å; F315-L323 HydrophobicContact CD1-CG 4.21Å; F315-L323 HydrophobicContact CE1-CD2 4.32Å; F315-L323 HydrophobicContact CG-CD2 4.44Å; F315-F324 WeakPolarHBondContact CA-O 2.94Å
316	E	94.6	Very high	92.3	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.009	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	132.8	175.6	-59.5	-170.1	86.2	0	0	110.5	A253 P254 Y255 G256 Y258 I314 P318 L323 F324	A253-E316 HydrophobicContact CB-CG 4.14Å; A253-E316 VanDerWaalsContact CB-OE1 3.25Å; A253-E316 WeakPolarHBondContact CB-OE1 3.37Å; A253-E316 WeakPolarHBondContact CB-OE2 3.44Å; P254-E316 VanDerWaalsContact CD-OE2 3.3Å; P254-E316 WeakPolarHBondContact CD-OE2 3.24Å; Y255-E316 VanDerWaalsContact CB-OE1 3.3Å; Y255-E316 WeakPolarHBondContact CB-OE1 3.22Å; Y255-E316 PolarHBondContact N-OE1 3.27Å; Y255-E316 PolarHBondContact N-OE2 3.24Å; Y255-E316 VanDerWaalsContact N-OE2 3.08Å; G256-E316 PolarHBondContact N-OE1 3.41Å; Y258-E316 HydrophobicContact CE2-CG 4.12Å; Y258-E316 WeakPolarHBondContact CE2-OE1 3.36Å; Y258-E316 PolarHBondContact OH-OE1 3.15Å; I314-E316 HydrophobicContact CG2-CG 4.22Å; E316-P318 WeakPolarHBondContact O-CD 3.35Å; E316-L323 WeakPolarHBondContact O-CA 3.27Å; E316-F324 HydrophobicContact CB-CB 4.41Å; E316-F324 PolarHBondContact N-O 2.9Å; E316-F324 PolarHBondContact O-N 2.9Å
317	M	94.8	Very high	92.4	Very high	7 Å²	7	24.1 Å²	24.1	3%	0.034	16%	0.157	C	C	.	.			trans	-120.5	84.5	-180	-64.5	165.7	-165.5	0	0	108.1	M143 I287 T291 R292 L323	M143-M317 HydrophobicContact CE-CE 3.9Å; M143-M317 HydrophobicContact SD-CE 3.61Å; I287-M317 HydrophobicContact CG2-CE 3.73Å; I287-M317 HydrophobicContact CG2-SD 4.05Å; T291-M317 HydrophobicContact CG2-CE 4.33Å; T291-M317 HydrophobicContact CG2-SD 3.66Å; R292-M317 WeakPolarHBondContact CD-O 3.47Å; R292-M317 PolarHBondContact O-N 3.35Å; M317-L323 HydrophobicContact CE-CD1 3.49Å; M317-L323 VanDerWaalsContact CE-CD1 3.49Å; M317-L323 HydrophobicContact CG-CD1 3.38Å; M317-L323 HydrophobicContact SD-CD1 4.26Å
318	P	91.9	Very high	92.4	Very high	3 Å²	3	25.4 Å²	25.4	2%	0.019	17%	0.166	C	C	.	.			trans	-66.5	162.7	-177.3	27.7	-33.7	0	0	0	112	Y255 E316 S320 G321 F324	Y255-P318 HydrophobicContact CD1-CB 3.91Å; Y255-P318 HydrophobicContact CD2-CB 3.93Å; Y255-P318 HydrophobicContact CE1-CB 3.51Å; Y255-P318 HydrophobicContact CE2-CB 3.51Å; Y255-P318 HydrophobicContact CE2-CG 4.4Å; Y255-P318 HydrophobicContact CG-CB 4.14Å; E316-P318 WeakPolarHBondContact O-CD 3.35Å; P318-S320 PolarHBondContact O-N 3.38Å; P318-G321 WeakPolarHBondContact CG-O 3.3Å; P318-G321 WeakPolarHBondContact O-CA 3.37Å; P318-G321 PolarHBondContact O-N 3.45Å; P318-F324 HydrophobicContact CG-CD2 3.81Å; P318-F324 HydrophobicContact CG-CE2 3.57Å
319	E	91	Very high	92.4	Very high	85 Å²	85	26.3 Å²	26.3	40%	0.397	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-21.9	177.9	72.6	-65.3	152.4	0	0	113.6	V212 Y255 G321	V212-E319 HydrophobicContact CG2-CG 4.21Å; V212-E319 WeakPolarHBondContact CG2-OE2 3.27Å; Y255-E319 PolarHBondContact OH-OE1 3.37Å; Y255-E319 PolarHBondContact OH-OE2 2.93Å; E319-G321 PolarHBondContact O-N 2.97Å
320	S	89.3	Confident	92.3	Very high	97 Å²	97	28.1 Å²	28.1	68%	0.678	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65	-12.1	169.1	58.6	0	0	0	0	113.1	P318	P318-S320 PolarHBondContact O-N 3.38Å
321	G	89	Confident	92.3	Very high	39 Å²	39	28.6 Å²	28.6	40%	0.402	18%	0.183	S	C	.	.			trans	82.4	-177.9	-169.2	0	0	0	0	0	112.5	P318 E319	P318-G321 WeakPolarHBondContact CG-O 3.3Å; P318-G321 WeakPolarHBondContact O-CA 3.37Å; P318-G321 PolarHBondContact O-N 3.45Å; E319-G321 PolarHBondContact O-N 2.97Å
322	G	89.7	Confident	92.1	Very high	42 Å²	42	28.6 Å²	28.6	43%	0.433	18%	0.183	S	C	.	.			trans	79.9	178.6	-171.2	0	0	0	0	0	112.8
323	L	91.6	Very high	91.8	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.01	19%	0.192	C	C	.	.			trans	-133.8	136.6	-179.1	-165.7	81.2	0	0	0	109.9	I137 H138 M143 F315 E316 M317	I137-L323 HydrophobicContact CB-CD2 4.42Å; I137-L323 HydrophobicContact CG2-CD2 3.49Å; I137-L323 VanDerWaalsContact CG2-CD2 3.49Å; H138-L323 VanDerWaalsContact O-CB 3.27Å; H138-L323 WeakPolarHBondContact O-CB 3.39Å; H138-L323 PolarHBondContact O-N 2.74Å; H138-L323 VanDerWaalsContact O-N 3.12Å; M143-L323 HydrophobicContact CB-CD2 3.72Å; M143-L323 HydrophobicContact CG-CD2 4.16Å; M143-L323 HydrophobicContact SD-CD1 4.15Å; M143-L323 HydrophobicContact SD-CD2 4.21Å; F315-L323 HydrophobicContact CB-CD1 3.96Å; F315-L323 HydrophobicContact CB-CG 4.36Å; F315-L323 HydrophobicContact CD1-CD2 3.71Å; F315-L323 HydrophobicContact CD1-CG 4.21Å; F315-L323 HydrophobicContact CE1-CD2 4.32Å; F315-L323 HydrophobicContact CG-CD2 4.44Å; E316-L323 WeakPolarHBondContact O-CA 3.27Å; M317-L323 HydrophobicContact CE-CD1 3.49Å; M317-L323 VanDerWaalsContact CE-CD1 3.49Å; M317-L323 HydrophobicContact CG-CD1 3.38Å; M317-L323 HydrophobicContact SD-CD1 4.26Å
324	F	90	Very high	91.3	Very high	111 Å²	111	31.5 Å²	31.5	49%	0.487	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	117.5	175.1	-62.1	-87.6	0	0	0	109.8	F315 E316 P318	F315-F324 WeakPolarHBondContact CA-O 2.94Å; E316-F324 HydrophobicContact CB-CB 4.41Å; E316-F324 PolarHBondContact N-O 2.9Å; E316-F324 PolarHBondContact O-N 2.9Å; P318-F324 HydrophobicContact CG-CD2 3.81Å; P318-F324 HydrophobicContact CG-CE2 3.57Å
325	G	91.1	Very high	90.9	Very high	31 Å²	31	35.1 Å²	35.1	32%	0.32	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	133.2	175.2	0	0	0	0	0	111.9	F134 I314	F134-G325 VanDerWaalsContact CE1-C 3.43Å; I314-G325 CarbonylContact O-C 3.54Å; I314-G325 WeakPolarHBondContact O-CA 3.28Å
326	S	91.2	Very high	90.2	Very high	19 Å²	19	36.5 Å²	36.5	13%	0.133	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	159.2	167.5	65.9	0	0	0	0	111	I314	I314-S326 PolarHBondContact N-O 3.33Å; I314-S326 PolarHBondContact O-N 3.45Å; I314-S326 VanDerWaalsContact O-O 3.13Å
327	T	91.6	Very high	89.7	Confident	36 Å²	36	39.9 Å²	39.9	22%	0.221	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	146.1	-173.5	56.5	0	0	0	0	111.1	I120 F134 K312 I313	I120-T327 HydrophobicContact CD1-CG2 3.24Å; I120-T327 HydrophobicContact CG1-CG2 3.74Å; I120-T327 HydrophobicContact CG2-CG2 4.37Å; F134-T327 HydrophobicContact CD1-CG2 4.12Å; F134-T327 HydrophobicContact CE1-CG2 3.51Å; F134-T327 HydrophobicContact CE2-CG2 4.36Å; F134-T327 HydrophobicContact CZ-CG2 3.66Å; K312-T327 CarbonylContact O-C 3.53Å; K312-T327 WeakPolarHBondContact O-CA 3.34Å; I313-T327 HydrophobicContact CG2-CG2 4.35Å
328	V	91.5	Very high	89	Confident	40 Å²	40	45.5 Å²	45.5	24%	0.242	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	120.4	172.7	-176.5	0	0	0	0	107.7	Y251 V311 K312 I314	Y251-V328 HydrophobicContact CE2-CG2 3.74Å; Y251-V328 WeakPolarHBondContact OH-CG2 3.5Å; V311-V328 WeakPolarHBondContact CA-O 3.39Å; K312-V328 HydrophobicContact CB-CB 4.22Å; K312-V328 PolarHBondContact N-O 3.25Å; K312-V328 PolarHBondContact O-N 2.86Å; I314-V328 HydrophobicContact CD1-CG2 4.22Å
329	V	92.5	Very high	88.7	Confident	21 Å²	21	48.1 Å²	48.1	13%	0.127	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	106.9	174.7	-172.8	0	0	0	0	106.9	N112 V115 Y116 I309 V311 P331	N112-V329 WeakPolarHBondContact OD1-CB 3.36Å; N112-V329 WeakPolarHBondContact OD1-CG1 3.36Å; V115-V329 HydrophobicContact CB-CG1 4.45Å; V115-V329 HydrophobicContact CG1-CG1 4.15Å; Y116-V329 HydrophobicContact CD2-CG2 4.15Å; I309-V329 HydrophobicContact CG2-CG1 3.44Å; I309-V329 VanDerWaalsContact CG2-CG1 3.44Å; V311-V329 HydrophobicContact CG1-CG2 4.43Å; V311-V329 HydrophobicContact CG2-CG1 4.43Å; V329-P331 WeakPolarHBondContact O-CD 3.22Å
330	Q	92.3	Very high	88.5	Confident	38 Å²	38	50.2 Å²	50.2	18%	0.178	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	103.9	-174.5	-177.8	60	69.8	0	0	109.9	I310 V332 A425	I310-Q330 PolarHBondContact N-O 2.94Å; I310-Q330 PolarHBondContact O-N 3.37Å; Q330-V332 HydrophobicContact CG-CG2 3.89Å; Q330-A425 HydrophobicContact CG-CB 4.18Å
331	P	92.8	Very high	88.3	Confident	13 Å²	13	50 Å²	50	8%	0.084	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	139.5	169.6	30.3	-33.2	0	0	0	110.6	T108 N112 I307 F308 I309 V329 Y428	T108-P331 HydrophobicContact CG2-CB 3.53Å; T108-P331 HydrophobicContact CG2-CG 3.31Å; N112-P331 HydrophobicContact CB-CG 4.37Å; I307-P331 HydrophobicContact CG2-CB 4.02Å; F308-P331 CarbonylContact O-C 3.58Å; F308-P331 VanDerWaalsContact O-CA 3.29Å; F308-P331 WeakPolarHBondContact O-CA 3.32Å; I309-P331 HydrophobicContact CD1-CB 4.47Å; I309-P331 HydrophobicContact CG1-CB 3.87Å; V329-P331 WeakPolarHBondContact O-CD 3.22Å; P331-Y428 WeakPolarHBondContact O-CE1 3.46Å
332	V	90.4	Very high	88.1	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.012	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	130.3	-177.9	-169.5	0	0	0	0	109.7	F308 I310 Q330 L334 A425 Y428	F308-V332 WeakPolarHBondContact CB-O 3.5Å; F308-V332 PolarHBondContact N-O 3.4Å; F308-V332 PolarHBondContact O-N 2.96Å; I310-V332 HydrophobicContact CD1-CB 4.12Å; I310-V332 HydrophobicContact CD1-CG2 3.5Å; Q330-V332 HydrophobicContact CG-CG2 3.89Å; V332-L334 HydrophobicContact CB-CD2 4.18Å; V332-L334 HydrophobicContact CG1-CD2 3.41Å; V332-L334 VanDerWaalsContact CG1-CD2 3.41Å; V332-L334 HydrophobicContact CG1-CG 4.27Å; V332-A425 HydrophobicContact CG2-CB 4.41Å; V332-Y428 HydrophobicContact CB-CD1 4.12Å; V332-Y428 HydrophobicContact CB-CE1 4.17Å; V332-Y428 HydrophobicContact CB-CG 4.43Å; V332-Y428 HydrophobicContact CG1-CD1 3.76Å; V332-Y428 HydrophobicContact CG1-CD2 3.69Å; V332-Y428 HydrophobicContact CG1-CE1 3.95Å; V332-Y428 HydrophobicContact CG1-CE2 3.94Å; V332-Y428 HydrophobicContact CG1-CG 3.6Å; V332-Y428 HydrophobicContact CG2-CD1 3.67Å; V332-Y428 HydrophobicContact CG2-CE1 4.08Å; V332-Y428 HydrophobicContact CG2-CG 4.16Å
333	R	88.1	Confident	88.1	Confident	65 Å²	65	52.9 Å²	52.9	25%	0.245	27%	0.271	C	S	.	.			trans	-93.8	94.7	170.4	-172.3	170.7	-175	-158.3	-4.5	109.7	D342	R333-D342 IonicContact CZ-OD1 3.06Å; R333-D342 IonicContact CZ-OD2 3.27Å; R333-D342 IonicContact NH1-OD1 3.79Å; R333-D342 PolarHBondContact NH1-OD1 3.4Å; R333-D342 IonicContact NH2-OD1 2.72Å; R333-D342 PolarHBondContact NH2-OD1 2.94Å; R333-D342 IonicContact NH2-OD2 3.17Å; R333-D342 PolarHBondContact NH2-OD2 3.02Å
334	L	84.5	Confident	88	Confident	8 Å²	8	58.6 Å²	58.6	4%	0.042	30%	0.296	C	S	.	.			trans	-74.3	-45.1	-177.2	-60.1	-173.3	0	0	0	112.4	F308 V332 R336 V404 F421 L424	F308-L334 HydrophobicContact CB-CD1 4.27Å; F308-L334 HydrophobicContact CB-CG 4.31Å; F308-L334 HydrophobicContact CD1-CD1 3.69Å; F308-L334 HydrophobicContact CD1-CG 4.41Å; F308-L334 HydrophobicContact CD2-CB 3.78Å; F308-L334 HydrophobicContact CD2-CD1 3.74Å; F308-L334 HydrophobicContact CD2-CG 3.56Å; F308-L334 HydrophobicContact CE1-CD1 3.85Å; F308-L334 HydrophobicContact CE2-CB 3.7Å; F308-L334 HydrophobicContact CE2-CD1 3.95Å; F308-L334 HydrophobicContact CE2-CG 3.94Å; F308-L334 HydrophobicContact CG-CD1 3.64Å; F308-L334 HydrophobicContact CG-CG 3.85Å; F308-L334 HydrophobicContact CZ-CB 4.34Å; F308-L334 HydrophobicContact CZ-CD1 4Å; F308-L334 HydrophobicContact CZ-CG 4.48Å; V332-L334 HydrophobicContact CB-CD2 4.18Å; V332-L334 HydrophobicContact CG1-CD2 3.41Å; V332-L334 VanDerWaalsContact CG1-CD2 3.41Å; V332-L334 HydrophobicContact CG1-CG 4.27Å; L334-R336 PolarHBondContact O-N 2.96Å; L334-V404 HydrophobicContact CB-CG1 4.14Å; L334-V404 HydrophobicContact CB-CG2 3.96Å; L334-V404 HydrophobicContact CD2-CG2 3.97Å; L334-V404 HydrophobicContact CG-CG2 4.4Å; L334-F421 HydrophobicContact CD1-CD1 4Å; L334-F421 HydrophobicContact CD1-CE1 3.84Å; L334-F421 HydrophobicContact CD1-CG 4.5Å; L334-F421 HydrophobicContact CD1-CZ 4.19Å; L334-L424 HydrophobicContact CD1-CD2 4.07Å; L334-L424 HydrophobicContact CD2-CD2 3.28Å; L334-L424 HydrophobicContact CD2-CG 3.84Å; L334-L424 HydrophobicContact CG-CD2 4.31Å
335	F	85.1	Confident	88	Confident	77 Å²	77	53.9 Å²	53.9	34%	0.338	28%	0.276	S	S	.	.			trans	-87.9	92.9	176	-60.2	-52.9	0	0	0	110.1	N306 F308 V404 M408	N306-F335 PolarHBondContact ND2-O 3.3Å; N306-F335 WeakPolarHBondContact OD1-CD2 3.29Å; F308-F335 AromaticContact CE2-CD2 3.85Å; F308-F335 HydrophobicContact CE2-CD2 3.85Å; F308-F335 AromaticContact CE2-CE2 3.98Å; F308-F335 HydrophobicContact CE2-CE2 3.98Å; F308-F335 HydrophobicContact CZ-CD2 4.01Å; F308-F335 AromaticContact CZ-CE2 3.63Å; F308-F335 HydrophobicContact CZ-CE2 3.63Å; F308-F335 HydrophobicContact CZ-CZ 4.39Å; F335-V404 HydrophobicContact CD1-CG1 4.17Å; F335-V404 HydrophobicContact CE1-CG1 3.89Å; F335-M408 HydrophobicContact CE1-CG 4.13Å; F335-M408 HydrophobicContact CE2-CE 4.43Å; F335-M408 HydrophobicContact CZ-CE 3.94Å; F335-M408 HydrophobicContact CZ-CG 3.81Å; F335-M408 HydrophobicContact CZ-SD 4.1Å
336	R	82.1	Confident	87.9	Confident	28 Å²	28	54.9 Å²	54.9	11%	0.106	27%	0.274	C	S	.	.			trans	-76	-35.6	-175.2	-74.2	178.6	153.5	-129.3	4.4	114.2	L334 D342 E349 H431	L334-R336 PolarHBondContact O-N 2.96Å; R336-D342 WeakPolarHBondContact O-CB 3.35Å; R336-E349 IonicContact NH1-OE1 3.28Å; R336-E349 PolarHBondContact NH1-OE1 2.8Å; R336-H431 PolarHBondContact NH2-NE2 3.2Å
337	Y	82.9	Confident	88	Confident	74 Å²	74	58 Å²	58	29%	0.29	29%	0.292	S	S	.	.			trans	-113.4	93.3	-168.8	-47.1	-65.9	0	0	0	111.5	L346 E349	Y337-L346 HydrophobicContact CD1-CB 3.89Å; Y337-L346 HydrophobicContact CD1-CD1 4.4Å; Y337-L346 HydrophobicContact CD1-CG 4.5Å; Y337-L346 HydrophobicContact CE1-CB 3.67Å; Y337-L346 HydrophobicContact CE1-CD1 3.72Å; Y337-L346 HydrophobicContact CE1-CG 4.18Å; Y337-L346 HydrophobicContact CE2-CD1 4.31Å; Y337-E349 PolarHBondContact OH-OE2 3.18Å
338	Q	80.8	Confident	88	Confident	124 Å²	124	56.7 Å²	56.7	58%	0.579	28%	0.284	S	S	*	.			trans	-134.8	-44.4	179.4	-169.1	175.9	22.5	0	0	112.6	N306 D342	N306-Q338 PolarHBondContact ND2-OE1 3.45Å; Q338-D342 PolarHBondContact N-OD2 3.42Å; Q338-D342 VanDerWaalsContact N-OD2 3.14Å
339	T	84.4	Confident	88	Confident	58 Å²	58	55.2 Å²	55.2	36%	0.356	28%	0.275	S	S	.	.	S	Bend	trans	-91.6	162.1	-178.2	65.2	0	0	0	0	111.4	T341 D342 Y343	T339-T341 PolarHBondContact O-N 3.37Å; T339-T341 PolarHBondContact OG1-OG1 3.01Å; T339-D342 WeakPolarHBondContact CB-OD2 3.48Å; T339-D342 PolarHBondContact N-OD2 2.88Å; T339-D342 WeakPolarHBondContact O-CB 3.47Å; T339-D342 PolarHBondContact O-N 2.9Å; T339-D342 PolarHBondContact OG1-N 3.45Å; T339-D342 PolarHBondContact OG1-OD1 3.12Å; T339-D342 PolarHBondContact OG1-OD2 3.45Å; T339-Y343 VanDerWaalsContact O-CD2 3.29Å; T339-Y343 WeakPolarHBondContact O-CD2 3.25Å; T339-Y343 PolarHBondContact O-N 3.26Å
340	V	86.7	Confident	88	Confident	130 Å²	130	58.8 Å²	58.8	79%	0.788	29%	0.292	S	S	*	.	H	α-helix	trans	-57.3	-36.9	175.8	-178.2	0	0	0	0	111.4	D342 Y343 F344	V340-D342 VanDerWaalsContact C-N 3.31Å; V340-D342 PolarHBondContact O-N 2.96Å; V340-Y343 PolarHBondContact O-N 3.39Å; V340-F344 PolarHBondContact O-N 2.94Å
341	T	85.4	Confident	88.1	Confident	93 Å²	93	59.9 Å²	59.9	57%	0.571	30%	0.301	S	S	*	.	H	α-helix	trans	-65	-34.3	174.9	44.2	0	0	0	0	112.4	T339 F344 V345	T339-T341 PolarHBondContact O-N 3.37Å; T339-T341 PolarHBondContact OG1-OG1 3.01Å; T341-F344 WeakPolarHBondContact O-CB 3.26Å; T341-F344 PolarHBondContact O-N 3.46Å; T341-V345 WeakPolarHBondContact O-CG2 3.39Å; T341-V345 PolarHBondContact O-N 2.88Å; T341-V345 VanDerWaalsContact O-N 3.1Å
342	D	85.5	Confident	88.1	Confident	6 Å²	6	60.3 Å²	60.3	3%	0.032	30%	0.301	C	S	.	.	H	α-helix	trans	-70.6	-35.9	177.4	-56.6	-38	0	0	0	112.1	R333 R336 Q338 T339 V340 F344 V345 L346	R333-D342 IonicContact CZ-OD1 3.06Å; R333-D342 IonicContact CZ-OD2 3.27Å; R333-D342 IonicContact NH1-OD1 3.79Å; R333-D342 PolarHBondContact NH1-OD1 3.4Å; R333-D342 IonicContact NH2-OD1 2.72Å; R333-D342 PolarHBondContact NH2-OD1 2.94Å; R333-D342 IonicContact NH2-OD2 3.17Å; R333-D342 PolarHBondContact NH2-OD2 3.02Å; R336-D342 WeakPolarHBondContact O-CB 3.35Å; Q338-D342 PolarHBondContact N-OD2 3.42Å; Q338-D342 VanDerWaalsContact N-OD2 3.14Å; T339-D342 WeakPolarHBondContact CB-OD2 3.48Å; T339-D342 PolarHBondContact N-OD2 2.88Å; T339-D342 WeakPolarHBondContact O-CB 3.47Å; T339-D342 PolarHBondContact O-N 2.9Å; T339-D342 PolarHBondContact OG1-N 3.45Å; T339-D342 PolarHBondContact OG1-OD1 3.12Å; T339-D342 PolarHBondContact OG1-OD2 3.45Å; V340-D342 VanDerWaalsContact C-N 3.31Å; V340-D342 PolarHBondContact O-N 2.96Å; D342-F344 VanDerWaalsContact C-N 3.29Å; D342-F344 PolarHBondContact O-N 3.22Å; D342-V345 WeakPolarHBondContact O-CB 3.48Å; D342-V345 PolarHBondContact O-N 3.28Å; D342-L346 PolarHBondContact O-N 3.49Å
343	Y	89	Confident	88.2	Confident	134 Å²	134	63.9 Å²	63.9	53%	0.525	32%	0.32	S	S	.	.	H	α-helix	trans	-66.4	-32.7	173.3	-74.7	-72.9	0	0	0	112.2	T339 V340 L346 V347	T339-Y343 VanDerWaalsContact O-CD2 3.29Å; T339-Y343 WeakPolarHBondContact O-CD2 3.25Å; T339-Y343 PolarHBondContact O-N 3.26Å; V340-Y343 PolarHBondContact O-N 3.39Å; Y343-L346 HydrophobicContact CD1-CD2 4.34Å; Y343-L346 WeakPolarHBondContact O-CB 3.46Å; Y343-L346 PolarHBondContact O-N 3.19Å; Y343-V347 PolarHBondContact O-N 3.2Å; Y343-V347 VanDerWaalsContact O-N 3.16Å
344	F	90.8	Very high	88.5	Confident	123 Å²	123	65.4 Å²	65.4	54%	0.539	34%	0.336	S	S	.	.	H	α-helix	trans	-62.7	-43.4	170	172.8	-98.5	0	0	0	111.6	I98 V340 T341 D342 L346 V347 C348	I98-F344 HydrophobicContact CG2-CE1 4.15Å; V340-F344 PolarHBondContact O-N 2.94Å; T341-F344 WeakPolarHBondContact O-CB 3.26Å; T341-F344 PolarHBondContact O-N 3.46Å; D342-F344 VanDerWaalsContact C-N 3.29Å; D342-F344 PolarHBondContact O-N 3.22Å; F344-L346 VanDerWaalsContact C-N 3.31Å; F344-L346 PolarHBondContact O-N 3.2Å; F344-V347 PolarHBondContact O-N 3.43Å; F344-V347 VanDerWaalsContact O-N 3.17Å; F344-C348 PolarHBondContact O-N 2.9Å
345	V	88.8	Confident	88.9	Confident	12 Å²	12	66.5 Å²	66.5	7%	0.073	34%	0.341	C	S	.	.	H	α-helix	trans	-60.4	-40.9	174.4	177	0	0	0	0	111.3	T102 T341 D342 V347 C348 E349	T102-V345 HydrophobicContact CG2-CG2 3.31Å; T341-V345 WeakPolarHBondContact O-CG2 3.39Å; T341-V345 PolarHBondContact O-N 2.88Å; T341-V345 VanDerWaalsContact O-N 3.1Å; D342-V345 WeakPolarHBondContact O-CB 3.48Å; D342-V345 PolarHBondContact O-N 3.28Å; V345-V347 VanDerWaalsContact C-N 3.3Å; V345-V347 PolarHBondContact O-N 3.29Å; V345-C348 CarbonylContact O-C 3.33Å; V345-C348 WeakPolarHBondContact O-CA 3.1Å; V345-C348 WeakPolarHBondContact O-CB 3.25Å; V345-C348 PolarHBondContact O-N 3.22Å; V345-C348 VanDerWaalsContact O-N 3.08Å; V345-E349 HydrophobicContact CG1-CG 4.19Å; V345-E349 WeakPolarHBondContact O-CG 3.25Å; V345-E349 PolarHBondContact O-N 2.99Å
346	L	89.4	Confident	89.3	Confident	52 Å²	52	63.5 Å²	63.5	27%	0.272	33%	0.328	S	S	.	.	H	α-helix	trans	-57.3	-43.3	175.5	178.6	64.2	0	0	0	111.8	Y337 D342 Y343 F344 E349 I350	Y337-L346 HydrophobicContact CD1-CB 3.89Å; Y337-L346 HydrophobicContact CD1-CD1 4.4Å; Y337-L346 HydrophobicContact CD1-CG 4.5Å; Y337-L346 HydrophobicContact CE1-CB 3.67Å; Y337-L346 HydrophobicContact CE1-CD1 3.72Å; Y337-L346 HydrophobicContact CE1-CG 4.18Å; Y337-L346 HydrophobicContact CE2-CD1 4.31Å; D342-L346 PolarHBondContact O-N 3.49Å; Y343-L346 HydrophobicContact CD1-CD2 4.34Å; Y343-L346 WeakPolarHBondContact O-CB 3.46Å; Y343-L346 PolarHBondContact O-N 3.19Å; F344-L346 VanDerWaalsContact C-N 3.31Å; F344-L346 PolarHBondContact O-N 3.2Å; L346-E349 PolarHBondContact O-N 3.06Å; L346-I350 HydrophobicContact CD1-CD1 4.43Å; L346-I350 HydrophobicContact CG-CD1 4.22Å; L346-I350 WeakPolarHBondContact O-CG1 3.48Å; L346-I350 PolarHBondContact O-N 3.07Å
347	V	92.4	Very high	89.8	Confident	85 Å²	85	64.6 Å²	64.6	52%	0.515	34%	0.343	S	S	.	.	H	α-helix	trans	-62.4	-44.1	175.3	175.8	0	0	0	0	110.5	Y343 F344 V345 E349 I350 V351	Y343-V347 PolarHBondContact O-N 3.2Å; Y343-V347 VanDerWaalsContact O-N 3.16Å; F344-V347 PolarHBondContact O-N 3.43Å; F344-V347 VanDerWaalsContact O-N 3.17Å; V345-V347 VanDerWaalsContact C-N 3.3Å; V345-V347 PolarHBondContact O-N 3.29Å; V347-E349 VanDerWaalsContact C-N 3.34Å; V347-E349 PolarHBondContact O-N 3.35Å; V347-I350 PolarHBondContact O-N 3.4Å; V347-V351 WeakPolarHBondContact O-CG2 3.46Å; V347-V351 PolarHBondContact O-N 3.08Å
348	C	92.7	Very high	90.3	Very high	8 Å²	8	63 Å²	63	5%	0.054	34%	0.337	C	S	.	.	H	α-helix	trans	-60.4	-40.8	174.7	-68.1	0	0	0	0	112.5	L95 I99 F344 V345 V351 Y352	L95-C348 HydrophobicContact CD2-CB 4.09Å; I99-C348 HydrophobicContact CD1-CB 4.45Å; I99-C348 HydrophobicContact CG1-CB 4.15Å; F344-C348 PolarHBondContact O-N 2.9Å; V345-C348 CarbonylContact O-C 3.33Å; V345-C348 WeakPolarHBondContact O-CA 3.1Å; V345-C348 WeakPolarHBondContact O-CB 3.25Å; V345-C348 PolarHBondContact O-N 3.22Å; V345-C348 VanDerWaalsContact O-N 3.08Å; C348-V351 PolarHBondContact O-N 3.42Å; C348-Y352 VanDerWaalsContact O-CB 3.28Å; C348-Y352 WeakPolarHBondContact O-CB 3.16Å; C348-Y352 PolarHBondContact O-N 3.25Å
349	E	91.5	Very high	90.8	Very high	9 Å²	9	57.9 Å²	57.9	4%	0.042	31%	0.312	C	S	.	.	H	α-helix	trans	-62.9	-43.5	176.2	-73.4	177	159.3	0	0	111.2	I99 R336 Y337 V345 L346 V347 Y352 L353	I99-E349 HydrophobicContact CD1-CG 4.22Å; I99-E349 HydrophobicContact CG1-CG 4.33Å; I99-E349 HydrophobicContact CG2-CG 4.44Å; R336-E349 IonicContact NH1-OE1 3.28Å; R336-E349 PolarHBondContact NH1-OE1 2.8Å; Y337-E349 PolarHBondContact OH-OE2 3.18Å; V345-E349 HydrophobicContact CG1-CG 4.19Å; V345-E349 WeakPolarHBondContact O-CG 3.25Å; V345-E349 PolarHBondContact O-N 2.99Å; L346-E349 PolarHBondContact O-N 3.06Å; V347-E349 VanDerWaalsContact C-N 3.34Å; V347-E349 PolarHBondContact O-N 3.35Å; E349-Y352 WeakPolarHBondContact O-CB 3.09Å; E349-Y352 PolarHBondContact O-N 3.37Å; E349-L353 WeakPolarHBondContact O-CG 3.25Å; E349-L353 PolarHBondContact O-N 3.49Å
350	I	92.5	Very high	91.1	Very high	96 Å²	96	57 Å²	57	49%	0.492	31%	0.307	S	S	.	.	H	α-helix	trans	-62.4	-46.6	176.2	-67.3	166.6	0	0	0	110.8	L346 V347 Y352 L353 V354	L346-I350 HydrophobicContact CD1-CD1 4.43Å; L346-I350 HydrophobicContact CG-CD1 4.22Å; L346-I350 WeakPolarHBondContact O-CG1 3.48Å; L346-I350 PolarHBondContact O-N 3.07Å; V347-I350 PolarHBondContact O-N 3.4Å; I350-Y352 VanDerWaalsContact C-N 3.28Å; I350-Y352 PolarHBondContact O-N 3.21Å; I350-L353 PolarHBondContact O-N 2.84Å; I350-V354 PolarHBondContact O-N 3.49Å
351	V	94.2	Very high	91.4	Very high	61 Å²	61	54.6 Å²	54.6	37%	0.37	29%	0.289	S	S	.	.	H	α-helix	trans	-62.3	-39.5	176.9	176.9	0	0	0	0	110.6	L95 V347 C348 L353 V354 F355	L95-V351 HydrophobicContact CD1-CB 4.4Å; L95-V351 HydrophobicContact CD1-CG1 3.6Å; V347-V351 WeakPolarHBondContact O-CG2 3.46Å; V347-V351 PolarHBondContact O-N 3.08Å; C348-V351 PolarHBondContact O-N 3.42Å; V351-L353 PolarHBondContact O-N 3.4Å; V351-V354 WeakPolarHBondContact O-CB 3.38Å; V351-V354 PolarHBondContact O-N 2.79Å; V351-F355 HydrophobicContact CG1-CD2 3.99Å; V351-F355 HydrophobicContact CG1-CE2 3.87Å; V351-F355 WeakPolarHBondContact O-CD2 3.14Å; V351-F355 PolarHBondContact O-N 3.04Å; V351-F355 VanDerWaalsContact O-N 3.07Å
352	Y	93.1	Very high	91.5	Very high	22 Å²	22	51.1 Å²	51.1	9%	0.086	27%	0.266	C	S	.	.	H	α-helix	trans	-62.6	-40	175.5	-178.6	-92.3	0	0	0	112.4	F92 L96 I99 C348 E349 I350 V354 F355 L356 S390	F92-Y352 HydrophobicContact CD2-CD2 4.24Å; F92-Y352 HydrophobicContact CD2-CE2 4.07Å; F92-Y352 AromaticContact CE2-CD2 3.83Å; F92-Y352 HydrophobicContact CE2-CD2 3.83Å; F92-Y352 AromaticContact CE2-CE2 3.26Å; F92-Y352 HydrophobicContact CE2-CE2 3.26Å; F92-Y352 AromaticContact CE2-CZ 3.97Å; F92-Y352 AromaticContact CZ-CE2 3.74Å; F92-Y352 HydrophobicContact CZ-CE2 3.74Å; L96-Y352 HydrophobicContact CB-CE2 4.15Å; L96-Y352 HydrophobicContact CD1-CE2 3.84Å; I99-Y352 HydrophobicContact CD1-CD2 4.19Å; I99-Y352 HydrophobicContact CD1-CG 3.89Å; C348-Y352 VanDerWaalsContact O-CB 3.28Å; C348-Y352 WeakPolarHBondContact O-CB 3.16Å; C348-Y352 PolarHBondContact O-N 3.25Å; E349-Y352 WeakPolarHBondContact O-CB 3.09Å; E349-Y352 PolarHBondContact O-N 3.37Å; I350-Y352 VanDerWaalsContact C-N 3.28Å; I350-Y352 PolarHBondContact O-N 3.21Å; Y352-V354 VanDerWaalsContact C-N 3.28Å; Y352-V354 PolarHBondContact O-N 3.21Å; Y352-F355 CarbonylContact O-C 3.41Å; Y352-F355 WeakPolarHBondContact O-CB 3.14Å; Y352-F355 PolarHBondContact O-N 3.1Å; Y352-L356 WeakPolarHBondContact O-CB 3.47Å; Y352-L356 PolarHBondContact O-N 3.31Å; Y352-S390 VanDerWaalsContact OH-CB 3.25Å; Y352-S390 WeakPolarHBondContact OH-CB 3.02Å
353	L	92.9	Very high	91.7	Very high	76 Å²	76	51.4 Å²	51.4	40%	0.398	27%	0.267	S	S	.	.	H	α-helix	trans	-62.9	-34.4	174.6	-69.9	175.8	0	0	0	112.5	E349 I350 V351 L356 A357 A394	E349-L353 WeakPolarHBondContact O-CG 3.25Å; E349-L353 PolarHBondContact O-N 3.49Å; I350-L353 PolarHBondContact O-N 2.84Å; V351-L353 PolarHBondContact O-N 3.4Å; L353-L356 HydrophobicContact CD2-CD2 4.31Å; L353-L356 PolarHBondContact O-N 3Å; L353-A357 PolarHBondContact O-N 3.45Å; L353-A394 HydrophobicContact CD2-CB 3.73Å
354	V	94.2	Very high	91.7	Very high	98 Å²	98	50 Å²	50	59%	0.594	27%	0.268	S	S	*	.	H	α-helix	trans	-65.6	-44.2	172.8	176.4	0	0	0	0	110.8	I350 V351 Y352 L356 A357 Y358	I350-V354 PolarHBondContact O-N 3.49Å; V351-V354 WeakPolarHBondContact O-CB 3.38Å; V351-V354 PolarHBondContact O-N 2.79Å; Y352-V354 VanDerWaalsContact C-N 3.28Å; Y352-V354 PolarHBondContact O-N 3.21Å; V354-L356 VanDerWaalsContact C-N 3.33Å; V354-L356 PolarHBondContact O-N 3.08Å; V354-A357 PolarHBondContact O-N 3.17Å; V354-Y358 PolarHBondContact O-N 3.04Å
355	F	93.3	Very high	91.6	Very high	30 Å²	30	45.6 Å²	45.6	13%	0.132	25%	0.25	C	C	.	.	H	α-helix	trans	-62.3	-39.4	173.2	-85.5	-72.6	0	0	0	112.5	L88 V91 F92 L95 V351 Y352 Y358 Y359	L88-F355 HydrophobicContact CD1-CE1 3.75Å; L88-F355 HydrophobicContact CD1-CZ 4.28Å; L88-F355 HydrophobicContact CG-CE1 3.96Å; V91-F355 HydrophobicContact CG1-CE2 4.25Å; V91-F355 HydrophobicContact CG1-CZ 4.03Å; F92-F355 HydrophobicContact CB-CD1 4.28Å; F92-F355 HydrophobicContact CB-CE1 4.47Å; F92-F355 HydrophobicContact CD2-CB 3.75Å; F92-F355 HydrophobicContact CD2-CD1 4.41Å; F92-F355 HydrophobicContact CD2-CG 4.08Å; F92-F355 HydrophobicContact CE2-CB 4.25Å; L95-F355 HydrophobicContact CD1-CD2 3.78Å; L95-F355 HydrophobicContact CD1-CE2 3.6Å; V351-F355 HydrophobicContact CG1-CD2 3.99Å; V351-F355 HydrophobicContact CG1-CE2 3.87Å; V351-F355 WeakPolarHBondContact O-CD2 3.14Å; V351-F355 PolarHBondContact O-N 3.04Å; V351-F355 VanDerWaalsContact O-N 3.07Å; Y352-F355 CarbonylContact O-C 3.41Å; Y352-F355 WeakPolarHBondContact O-CB 3.14Å; Y352-F355 PolarHBondContact O-N 3.1Å; F355-Y358 WeakPolarHBondContact O-CB 3.28Å; F355-Y358 PolarHBondContact O-N 3.41Å; F355-Y359 HydrophobicContact CB-CE2 4.42Å; F355-Y359 HydrophobicContact CD1-CE2 4.28Å; F355-Y359 WeakPolarHBondContact O-CD2 3.47Å; F355-Y359 PolarHBondContact O-N 3.34Å
356	L	92.4	Very high	91.5	Very high	14 Å²	14	45.4 Å²	45.4	7%	0.073	25%	0.248	C	C	.	.	H	α-helix	trans	-60.9	-47.4	176.2	178.2	57.8	0	0	0	110.9	Y352 L353 V354 Y358 Y359 V360 S390 I391 A394	Y352-L356 WeakPolarHBondContact O-CB 3.47Å; Y352-L356 PolarHBondContact O-N 3.31Å; L353-L356 HydrophobicContact CD2-CD2 4.31Å; L353-L356 PolarHBondContact O-N 3Å; V354-L356 VanDerWaalsContact C-N 3.33Å; V354-L356 PolarHBondContact O-N 3.08Å; L356-Y358 VanDerWaalsContact C-N 3.28Å; L356-Y358 PolarHBondContact O-N 2.97Å; L356-Y359 PolarHBondContact O-N 3.47Å; L356-V360 HydrophobicContact CD1-CG2 4.12Å; L356-V360 HydrophobicContact CG-CG2 4.41Å; L356-V360 WeakPolarHBondContact O-CB 3.45Å; L356-V360 VanDerWaalsContact O-CG2 3.23Å; L356-V360 WeakPolarHBondContact O-CG2 3.44Å; L356-V360 PolarHBondContact O-N 2.93Å; L356-S390 WeakPolarHBondContact CD1-OG 3.28Å; L356-I391 HydrophobicContact CD1-CG1 4.41Å; L356-I391 HydrophobicContact CD2-CG1 4.43Å; L356-A394 HydrophobicContact CD2-CB 4.12Å
357	A	93.7	Very high	91.4	Very high	51 Å²	51	46.3 Å²	46.3	42%	0.421	25%	0.252	S	S	.	.	H	α-helix	trans	-59.6	-40.6	175.2	0	0	0	0	0	111.8	L353 V354 I361	L353-A357 PolarHBondContact O-N 3.45Å; V354-A357 PolarHBondContact O-N 3.17Å; A357-I361 WeakPolarHBondContact O-CD1 3.34Å; A357-I361 VanDerWaalsContact O-CG1 3.26Å; A357-I361 WeakPolarHBondContact O-CG1 3.38Å; A357-I361 PolarHBondContact O-N 2.99Å; A357-I361 VanDerWaalsContact O-N 3.12Å
358	Y	92.1	Very high	91	Very high	42 Å²	42	45.5 Å²	45.5	17%	0.165	25%	0.251	C	S	.	.	H	α-helix	trans	-58.4	-52.9	173.7	168.5	-91.2	0	0	0	111.7	I63 W64 L88 V354 F355 L356 V360 I361 E362	I63-Y358 HydrophobicContact CG2-CE2 4.22Å; W64-Y358 HydrophobicContact CD2-CE2 4.32Å; W64-Y358 HydrophobicContact CE3-CD2 4.36Å; W64-Y358 AromaticContact CE3-CE2 3.94Å; W64-Y358 HydrophobicContact CE3-CE2 3.94Å; W64-Y358 AromaticContact CH2-CD2 3.56Å; W64-Y358 HydrophobicContact CH2-CD2 3.56Å; W64-Y358 AromaticContact CH2-CE2 3.99Å; W64-Y358 HydrophobicContact CH2-CE2 3.99Å; W64-Y358 HydrophobicContact CH2-CG 4.3Å; W64-Y358 HydrophobicContact CZ2-CD2 4.06Å; W64-Y358 HydrophobicContact CZ2-CE2 4.39Å; W64-Y358 AromaticContact CZ3-CD2 3.73Å; W64-Y358 HydrophobicContact CZ3-CD2 3.73Å; W64-Y358 AromaticContact CZ3-CE2 3.75Å; W64-Y358 HydrophobicContact CZ3-CE2 3.75Å; W64-Y358 HydrophobicContact CZ3-CG 4.41Å; W64-Y358 VanDerWaalsContact CZ3-O 3.25Å; W64-Y358 WeakPolarHBondContact CZ3-O 3.43Å; L88-Y358 HydrophobicContact CD2-CE1 3.87Å; V354-Y358 PolarHBondContact O-N 3.04Å; F355-Y358 WeakPolarHBondContact O-CB 3.28Å; F355-Y358 PolarHBondContact O-N 3.41Å; L356-Y358 VanDerWaalsContact C-N 3.28Å; L356-Y358 PolarHBondContact O-N 2.97Å; Y358-V360 PolarHBondContact O-N 3.26Å; Y358-I361 PolarHBondContact O-N 3.17Å; Y358-E362 WeakPolarHBondContact CE1-OE2 3.47Å; Y358-E362 VanDerWaalsContact CZ-OE2 3.3Å; Y358-E362 PolarHBondContact O-N 3.37Å; Y358-E362 PolarHBondContact OH-OE2 2.99Å
359	Y	91.1	Very high	90.5	Very high	16 Å²	16	47.9 Å²	47.9	6%	0.063	27%	0.265	C	S	.	.	H	α-helix	trans	-66.6	-36.2	-179.7	-72.2	-61.5	0	0	0	113.1	F92 F355 L356 I361 E362 E363	F92-Y359 HydrophobicContact CB-CE2 4.2Å; F92-Y359 HydrophobicContact CD1-CE2 4.01Å; F92-Y359 HydrophobicContact CD2-CD2 4.27Å; F92-Y359 AromaticContact CD2-CE2 3.58Å; F92-Y359 HydrophobicContact CD2-CE2 3.58Å; F92-Y359 HydrophobicContact CE1-CE2 4.27Å; F92-Y359 HydrophobicContact CE2-CD2 4.11Å; F92-Y359 AromaticContact CE2-CE2 3.83Å; F92-Y359 HydrophobicContact CE2-CE2 3.83Å; F92-Y359 AromaticContact CG-CE2 3.64Å; F92-Y359 HydrophobicContact CG-CE2 3.64Å; F92-Y359 HydrophobicContact CZ-CD2 4.43Å; F92-Y359 HydrophobicContact CZ-CE2 4.18Å; F355-Y359 HydrophobicContact CB-CE2 4.42Å; F355-Y359 HydrophobicContact CD1-CE2 4.28Å; F355-Y359 WeakPolarHBondContact O-CD2 3.47Å; F355-Y359 PolarHBondContact O-N 3.34Å; L356-Y359 PolarHBondContact O-N 3.47Å; Y359-I361 VanDerWaalsContact C-N 3.32Å; Y359-I361 PolarHBondContact O-N 3.46Å; Y359-E362 WeakPolarHBondContact O-CB 3.32Å; Y359-E362 PolarHBondContact O-N 3.45Å; Y359-E363 WeakPolarHBondContact O-CG 3.43Å; Y359-E363 PolarHBondContact O-N 2.83Å
360	V	92.4	Very high	90	Very high	39 Å²	39	49.3 Å²	49.3	24%	0.236	27%	0.271	C	S	.	.	H	α-helix	trans	-58.7	-46.1	174.7	168.2	0	0	0	0	110.8	L356 Y358 E363 I364 V387 I391	L356-V360 HydrophobicContact CD1-CG2 4.12Å; L356-V360 HydrophobicContact CG-CG2 4.41Å; L356-V360 WeakPolarHBondContact O-CB 3.45Å; L356-V360 VanDerWaalsContact O-CG2 3.23Å; L356-V360 WeakPolarHBondContact O-CG2 3.44Å; L356-V360 PolarHBondContact O-N 2.93Å; Y358-V360 PolarHBondContact O-N 3.26Å; V360-E363 PolarHBondContact O-N 3.02Å; V360-I364 HydrophobicContact CG1-CD1 3.72Å; V360-I364 WeakPolarHBondContact O-CB 3.36Å; V360-I364 WeakPolarHBondContact O-CD1 3.41Å; V360-I364 WeakPolarHBondContact O-CG1 3.46Å; V360-I364 PolarHBondContact O-N 3Å; V360-V387 HydrophobicContact CG2-CG1 3.6Å; V360-I391 HydrophobicContact CG2-CD1 4.23Å
361	I	91.8	Very high	89.7	Confident	80 Å²	80	53.7 Å²	53.7	41%	0.41	28%	0.281	S	S	.	.	H	α-helix	trans	-66.5	-40.9	177.8	-64.9	164.3	0	0	0	110.5	W64 A357 Y358 Y359 E363 I364 L365	W64-I361 HydrophobicContact CE3-CG2 4.26Å; W64-I361 HydrophobicContact CH2-CB 3.49Å; W64-I361 VanDerWaalsContact CH2-CB 3.49Å; W64-I361 HydrophobicContact CH2-CD1 4.09Å; W64-I361 HydrophobicContact CH2-CG1 4.4Å; W64-I361 HydrophobicContact CH2-CG2 3.36Å; W64-I361 HydrophobicContact CZ2-CB 4.44Å; W64-I361 HydrophobicContact CZ2-CG2 3.96Å; W64-I361 HydrophobicContact CZ3-CB 3.71Å; W64-I361 HydrophobicContact CZ3-CG2 3.53Å; A357-I361 WeakPolarHBondContact O-CD1 3.34Å; A357-I361 VanDerWaalsContact O-CG1 3.26Å; A357-I361 WeakPolarHBondContact O-CG1 3.38Å; A357-I361 PolarHBondContact O-N 2.99Å; A357-I361 VanDerWaalsContact O-N 3.12Å; Y358-I361 PolarHBondContact O-N 3.17Å; Y359-I361 VanDerWaalsContact C-N 3.32Å; Y359-I361 PolarHBondContact O-N 3.46Å; I361-E363 VanDerWaalsContact C-N 3.34Å; I361-E363 PolarHBondContact O-N 3.16Å; I361-I364 PolarHBondContact O-N 2.78Å; I361-L365 HydrophobicContact CG2-CD1 3.97Å; I361-L365 HydrophobicContact CG2-CG 4.31Å; I361-L365 WeakPolarHBondContact O-CB 3.42Å; I361-L365 VanDerWaalsContact O-CG 3.25Å; I361-L365 WeakPolarHBondContact O-CG 3.46Å; I361-L365 PolarHBondContact O-N 2.94Å
362	E	88.5	Confident	89.2	Confident	19 Å²	19	61.5 Å²	61.5	9%	0.089	30%	0.304	C	S	.	.	H	α-helix	trans	-56.4	-48.9	176.7	-172.5	178.2	153	0	0	110.7	W64 T66 Y358 Y359 L365 E366	W64-E362 HydrophobicContact CE3-CB 4.3Å; W64-E362 HydrophobicContact CZ3-CB 4.02Å; T66-E362 HydrophobicContact CG2-CG 3.9Å; T66-E362 WeakPolarHBondContact CG2-OE1 3.38Å; Y358-E362 WeakPolarHBondContact CE1-OE2 3.47Å; Y358-E362 VanDerWaalsContact CZ-OE2 3.3Å; Y358-E362 PolarHBondContact O-N 3.37Å; Y358-E362 PolarHBondContact OH-OE2 2.99Å; Y359-E362 WeakPolarHBondContact O-CB 3.32Å; Y359-E362 PolarHBondContact O-N 3.45Å; E362-L365 PolarHBondContact O-N 3.44Å; E362-E366 PolarHBondContact O-N 3.06Å
363	E	89.7	Confident	88.7	Confident	13 Å²	13	69.5 Å²	69.5	6%	0.061	33%	0.334	C	S	.	.	H	α-helix	trans	-68.8	-38.4	-179.4	-65.6	-46.7	147.1	0	0	113.2	Y359 V360 I361 L365 E366 L367 Y374 D383 V387	Y359-E363 WeakPolarHBondContact O-CG 3.43Å; Y359-E363 PolarHBondContact O-N 2.83Å; V360-E363 PolarHBondContact O-N 3.02Å; I361-E363 VanDerWaalsContact C-N 3.34Å; I361-E363 PolarHBondContact O-N 3.16Å; E363-L365 VanDerWaalsContact C-N 3.31Å; E363-L365 PolarHBondContact O-N 3.4Å; E363-E366 PolarHBondContact O-N 3.09Å; E363-L367 WeakPolarHBondContact O-CB 3.45Å; E363-L367 PolarHBondContact O-N 3.33Å; E363-Y374 WeakPolarHBondContact OE2-CE2 3.45Å; E363-Y374 PolarHBondContact OE2-OH 3.28Å; E363-D383 VanDerWaalsContact OE1-CB 3.28Å; E363-D383 WeakPolarHBondContact OE1-CB 3.41Å; E363-V387 HydrophobicContact CG-CG2 4.13Å
364	I	89.2	Confident	88.1	Confident	105 Å²	105	66 Å²	66	54%	0.538	32%	0.316	S	S	.	.	H	α-helix	trans	-62.1	-41.9	174.7	-70.2	166.9	0	0	0	110.5	V360 I361 S368	V360-I364 HydrophobicContact CG1-CD1 3.72Å; V360-I364 WeakPolarHBondContact O-CB 3.36Å; V360-I364 WeakPolarHBondContact O-CD1 3.41Å; V360-I364 WeakPolarHBondContact O-CG1 3.46Å; V360-I364 PolarHBondContact O-N 3Å; I361-I364 PolarHBondContact O-N 2.78Å; I364-S368 WeakPolarHBondContact O-CB 3.31Å; I364-S368 PolarHBondContact O-N 3.11Å
365	L	87.9	Confident	87.5	Confident	30 Å²	30	66.6 Å²	66.6	16%	0.157	31%	0.311	C	S	.	.	H	α-helix	trans	-64.8	-47.3	176.5	-69.8	174.3	0	0	0	111.1	V52 I54 W64 I361 E362 E363 L367 S368 V369	V52-L365 HydrophobicContact CG1-CD2 4.12Å; I54-L365 HydrophobicContact CD1-CD2 4.28Å; W64-L365 HydrophobicContact CD2-CD1 4.42Å; W64-L365 HydrophobicContact CE3-CD1 4.14Å; I361-L365 HydrophobicContact CG2-CD1 3.97Å; I361-L365 HydrophobicContact CG2-CG 4.31Å; I361-L365 WeakPolarHBondContact O-CB 3.42Å; I361-L365 VanDerWaalsContact O-CG 3.25Å; I361-L365 WeakPolarHBondContact O-CG 3.46Å; I361-L365 PolarHBondContact O-N 2.94Å; E362-L365 PolarHBondContact O-N 3.44Å; E363-L365 VanDerWaalsContact C-N 3.31Å; E363-L365 PolarHBondContact O-N 3.4Å; L365-L367 PolarHBondContact O-N 2.69Å; L365-S368 PolarHBondContact O-N 3.24Å; L365-S368 PolarHBondContact O-OG 3.38Å; L365-V369 WeakPolarHBondContact O-CG2 3.32Å; L365-V369 PolarHBondContact O-N 3.12Å
366	E	85.7	Confident	86.9	Confident	7 Å²	7	71.8 Å²	71.8	3%	0.033	34%	0.338	C	S	.	.	H	α-helix	trans	-61.4	-42.2	177.3	-73.5	-146	168.1	0	0	112.5	T66 N68 E362 E363 V369 K370 Y374 N380	T66-E366 PolarHBondContact OG1-OE1 3.25Å; N68-E366 PolarHBondContact ND2-OE1 3.05Å; N68-E366 PolarHBondContact ND2-OE2 2.82Å; E362-E366 PolarHBondContact O-N 3.06Å; E363-E366 PolarHBondContact O-N 3.09Å; E366-V369 PolarHBondContact O-N 2.98Å; E366-K370 WeakPolarHBondContact O-CB 2.98Å; E366-K370 PolarHBondContact O-N 3.23Å; E366-K370 IonicContact OE1-NZ 3.86Å; E366-K370 IonicContact OE2-NZ 3.68Å; E366-K370 PolarHBondContact OE2-NZ 3.05Å; E366-Y374 HydrophobicContact CB-CD2 4Å; E366-Y374 HydrophobicContact CB-CE2 3.68Å; E366-N380 PolarHBondContact OE2-ND2 3.19Å
367	L	87.5	Confident	86.5	Confident	71 Å²	71	73.3 Å²	73.3	37%	0.372	35%	0.346	S	S	.	.	H	α-helix	trans	-63.3	-42.4	177.8	-175.5	64.6	0	0	0	111.3	E363 L365 V369 R371 Y374 F375	E363-L367 WeakPolarHBondContact O-CB 3.45Å; E363-L367 PolarHBondContact O-N 3.33Å; L365-L367 PolarHBondContact O-N 2.69Å; L367-V369 VanDerWaalsContact C-N 3.26Å; L367-V369 PolarHBondContact O-N 3.26Å; L367-R371 WeakPolarHBondContact O-CA 3.29Å; L367-R371 PolarHBondContact O-N 2.94Å; L367-Y374 HydrophobicContact CD1-CD1 4.13Å; L367-Y374 HydrophobicContact CD1-CG 4.06Å; L367-F375 HydrophobicContact CD1-CE2 4.05Å; L367-F375 HydrophobicContact CD1-CZ 4.12Å
368	S	84.1	Confident	86.1	Confident	68 Å²	68	76.4 Å²	76.4	48%	0.476	36%	0.355	S	S	.	.	H	α-helix	trans	-62.4	-33.7	178.7	76.5	0	0	0	0	112.8	I364 L365	I364-S368 WeakPolarHBondContact O-CB 3.31Å; I364-S368 PolarHBondContact O-N 3.11Å; L365-S368 PolarHBondContact O-N 3.24Å; L365-S368 PolarHBondContact O-OG 3.38Å
369	V	83.8	Confident	85.9	Confident	59 Å²	59	76.4 Å²	76.4	36%	0.358	36%	0.355	S	S	.	.	H	α-helix	trans	-84.6	-48.1	-178.4	176.3	0	0	0	0	111.9	V52 L365 E366 L367	V52-V369 HydrophobicContact CG2-CG2 3.28Å; L365-V369 WeakPolarHBondContact O-CG2 3.32Å; L365-V369 PolarHBondContact O-N 3.12Å; E366-V369 PolarHBondContact O-N 2.98Å; L367-V369 VanDerWaalsContact C-N 3.26Å; L367-V369 PolarHBondContact O-N 3.26Å
370	K	80	Confident	85.7	Confident	39 Å²	39	75.7 Å²	75.7	17%	0.17	35%	0.352	C	S	.	.	H	α-helix	trans	-87.2	-20.9	-172.4	-68.3	175.1	179.6	166.3	0	113.6	N68 E366 W372 R373 Y374 N380	N68-K370 VanDerWaalsContact CB-NZ 3.34Å; N68-K370 PolarHBondContact ND2-NZ 3.01Å; E366-K370 WeakPolarHBondContact O-CB 2.98Å; E366-K370 PolarHBondContact O-N 3.23Å; E366-K370 IonicContact OE1-NZ 3.86Å; E366-K370 IonicContact OE2-NZ 3.68Å; E366-K370 PolarHBondContact OE2-NZ 3.05Å; K370-W372 PolarHBondContact O-N 3.45Å; K370-R373 PolarHBondContact O-N 3.13Å; K370-R373 VanDerWaalsContact O-N 3.12Å; K370-Y374 HydrophobicContact CB-CD2 4.47Å; K370-Y374 HydrophobicContact CD-CD2 4.21Å; K370-N380 PolarHBondContact NZ-ND2 3.25Å; K370-N380 VanDerWaalsContact NZ-ND2 3.16Å
371	R	85.8	Confident	85.6	Confident	187 Å²	187	78 Å²	78	71%	0.706	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	49.1	-120.3	-177.1	-59.4	-179.3	177.2	156	-2.7	111.2	L367 R373 Y374	L367-R371 WeakPolarHBondContact O-CA 3.29Å; L367-R371 PolarHBondContact O-N 2.94Å; R371-R373 PolarHBondContact O-N 3.24Å; R371-Y374 WeakPolarHBondContact O-CB 3.16Å; R371-Y374 PolarHBondContact O-N 2.92Å
372	W	84	Confident	85.5	Confident	225 Å²	225	75.6 Å²	75.6	85%	0.852	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-69.7	-29.4	-177.7	-71.5	79	0	0	0	114.1	K370 Y374 F375	K370-W372 PolarHBondContact O-N 3.45Å; W372-Y374 PolarHBondContact O-N 3.12Å; W372-Y374 VanDerWaalsContact O-N 3.13Å; W372-F375 PolarHBondContact O-N 3.26Å
373	R	82.1	Confident	85.6	Confident	191 Å²	191	74.9 Å²	74.9	72%	0.721	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-66.3	-14.5	176	-69.3	-173.9	-69.4	158.1	-2.9	112.5	K370 R371	K370-R373 PolarHBondContact O-N 3.13Å; K370-R373 VanDerWaalsContact O-N 3.12Å; R371-R373 PolarHBondContact O-N 3.24Å
374	Y	79.8	Confident	85.7	Confident	2 Å²	2	76.5 Å²	76.5	1%	0.008	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-61.8	-46.6	174.5	-177.2	-82.5	0	0	0	111.5	E363 E366 L367 K370 R371 W372 I376 N377 N380 I384	E363-Y374 WeakPolarHBondContact OE2-CE2 3.45Å; E363-Y374 PolarHBondContact OE2-OH 3.28Å; E366-Y374 HydrophobicContact CB-CD2 4Å; E366-Y374 HydrophobicContact CB-CE2 3.68Å; L367-Y374 HydrophobicContact CD1-CD1 4.13Å; L367-Y374 HydrophobicContact CD1-CG 4.06Å; K370-Y374 HydrophobicContact CB-CD2 4.47Å; K370-Y374 HydrophobicContact CD-CD2 4.21Å; R371-Y374 WeakPolarHBondContact O-CB 3.16Å; R371-Y374 PolarHBondContact O-N 2.92Å; W372-Y374 PolarHBondContact O-N 3.12Å; W372-Y374 VanDerWaalsContact O-N 3.13Å; Y374-I376 VanDerWaalsContact C-N 3.25Å; Y374-I376 PolarHBondContact O-N 3.43Å; Y374-N377 PolarHBondContact O-N 3.23Å; Y374-N380 HydrophobicContact CD1-CB 4.13Å; Y374-N380 HydrophobicContact CD2-CB 4.31Å; Y374-N380 WeakPolarHBondContact CD2-ND2 3.13Å; Y374-N380 HydrophobicContact CE1-CB 3.63Å; Y374-N380 HydrophobicContact CE2-CB 3.89Å; Y374-N380 WeakPolarHBondContact CE2-ND2 3.28Å; Y374-N380 HydrophobicContact CG-CB 4.41Å; Y374-N380 PolarHBondContact OH-O 3.04Å; Y374-I384 HydrophobicContact CD1-CD1 4.15Å; Y374-I384 HydrophobicContact CE1-CD1 3.29Å; Y374-I384 HydrophobicContact CE1-CG1 3.8Å; Y374-I384 WeakPolarHBondContact OH-CG1 3.05Å
375	F	83	Confident	85.9	Confident	110 Å²	110	73.5 Å²	73.5	48%	0.482	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-12.8	-174	-66.6	-72.3	0	0	0	114.4	L367 W372 N377 I384	L367-F375 HydrophobicContact CD1-CE2 4.05Å; L367-F375 HydrophobicContact CD1-CZ 4.12Å; W372-F375 PolarHBondContact O-N 3.26Å; F375-N377 VanDerWaalsContact C-N 3.28Å; F375-I384 HydrophobicContact CE1-CD1 3.82Å; F375-I384 HydrophobicContact CZ-CD1 4.45Å
376	I	81.3	Confident	86	Confident	139 Å²	139	72.8 Å²	72.8	71%	0.713	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-26.9	176.2	-61	175.5	0	0	0	110.6	Y374 I378	Y374-I376 VanDerWaalsContact C-N 3.25Å; Y374-I376 PolarHBondContact O-N 3.43Å; I376-I378 PolarHBondContact O-N 3.03Å
377	N	83.6	Confident	86.4	Confident	46 Å²	46	73.3 Å²	73.3	25%	0.246	35%	0.346	C	S	.	.			trans	-85.6	116.3	-179.3	-173.3	14.3	0	0	0	111.3	Y374 F375 W379 N380 L381	Y374-N377 PolarHBondContact O-N 3.23Å; F375-N377 VanDerWaalsContact C-N 3.28Å; N377-W379 PolarHBondContact O-N 3.34Å; N377-W379 VanDerWaalsContact OD1-CD1 3.31Å; N377-W379 PolarHBondContact OD1-N 3.49Å; N377-N380 HydrophobicContact CB-CB 4.09Å; N377-N380 PolarHBondContact ND2-OD1 3.15Å; N377-N380 WeakPolarHBondContact O-CB 3.37Å; N377-N380 PolarHBondContact O-N 3.04Å; N377-L381 PolarHBondContact O-N 2.46Å; N377-L381 VanDerWaalsContact O-N 3.15Å
378	I	85.2	Confident	86.6	Confident	117 Å²	117	73.6 Å²	73.6	60%	0.6	35%	0.35	S	S	*	.	H	α-helix	trans	-55.4	-36.4	179.4	-167.3	66.2	0	0	0	112.8	I376 N380 L381 M382	I376-I378 PolarHBondContact O-N 3.03Å; I378-N380 VanDerWaalsContact C-N 3.35Å; I378-N380 PolarHBondContact O-N 3.27Å; I378-L381 PolarHBondContact O-N 2.94Å; I378-M382 PolarHBondContact O-N 3.48Å
379	W	87	Confident	87	Confident	42 Å²	42	70.9 Å²	70.9	16%	0.159	33%	0.332	C	S	.	.	H	α-helix	trans	-66.2	-38.6	179.5	-59.8	109.6	0	0	0	112.2	N377 M382 D383 F447 K448 T460	N377-W379 PolarHBondContact O-N 3.34Å; N377-W379 VanDerWaalsContact OD1-CD1 3.31Å; N377-W379 PolarHBondContact OD1-N 3.49Å; W379-M382 PolarHBondContact O-N 3.4Å; W379-D383 PolarHBondContact O-N 2.94Å; W379-D383 VanDerWaalsContact O-OD2 3.1Å; W379-F447 HydrophobicContact CH2-CB 3.78Å; W379-F447 HydrophobicContact CZ3-CB 4.4Å; W379-K448 HydrophobicContact CB-CD 4.12Å; W379-K448 HydrophobicContact CB-CG 4.44Å; W379-K448 HydrophobicContact CD2-CB 3.96Å; W379-K448 HydrophobicContact CD2-CD 4.34Å; W379-K448 HydrophobicContact CD2-CG 3.86Å; W379-K448 HydrophobicContact CE3-CB 3.66Å; W379-K448 HydrophobicContact CE3-CD 4.32Å; W379-K448 HydrophobicContact CE3-CG 4Å; W379-K448 HydrophobicContact CG-CD 4.27Å; W379-K448 HydrophobicContact CG-CG 4.06Å; W379-K448 HydrophobicContact CH2-CB 4.27Å; W379-K448 HydrophobicContact CZ3-CB 3.84Å; W379-T460 HydrophobicContact CZ2-CG2 4.23Å
380	N	87.9	Confident	87.4	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-71	-36.8	178.8	-78.4	42.8	0	0	0	110.7	N68 E366 K370 Y374 N377 I378 M382 D383 I384	N68-N380 PolarHBondContact ND2-OD1 2.89Å; E366-N380 PolarHBondContact OE2-ND2 3.19Å; K370-N380 PolarHBondContact NZ-ND2 3.25Å; K370-N380 VanDerWaalsContact NZ-ND2 3.16Å; Y374-N380 HydrophobicContact CD1-CB 4.13Å; Y374-N380 HydrophobicContact CD2-CB 4.31Å; Y374-N380 WeakPolarHBondContact CD2-ND2 3.13Å; Y374-N380 HydrophobicContact CE1-CB 3.63Å; Y374-N380 HydrophobicContact CE2-CB 3.89Å; Y374-N380 WeakPolarHBondContact CE2-ND2 3.28Å; Y374-N380 HydrophobicContact CG-CB 4.41Å; Y374-N380 PolarHBondContact OH-O 3.04Å; N377-N380 HydrophobicContact CB-CB 4.09Å; N377-N380 PolarHBondContact ND2-OD1 3.15Å; N377-N380 WeakPolarHBondContact O-CB 3.37Å; N377-N380 PolarHBondContact O-N 3.04Å; I378-N380 VanDerWaalsContact C-N 3.35Å; I378-N380 PolarHBondContact O-N 3.27Å; N380-M382 VanDerWaalsContact C-N 3.33Å; N380-M382 PolarHBondContact O-N 3.21Å; N380-D383 PolarHBondContact O-N 3.25Å; N380-I384 PolarHBondContact O-N 2.82Å
381	L	89.5	Confident	88	Confident	87 Å²	87	70.4 Å²	70.4	46%	0.455	33%	0.329	S	S	.	.	H	α-helix	trans	-62.2	-41.4	172.4	-177.3	62.1	0	0	0	111.9	N377 I378 I384 A385	N377-L381 PolarHBondContact O-N 2.46Å; N377-L381 VanDerWaalsContact O-N 3.15Å; I378-L381 PolarHBondContact O-N 2.94Å; L381-I384 PolarHBondContact O-N 3.31Å; L381-A385 PolarHBondContact O-N 2.77Å
382	M	89.8	Confident	88.2	Confident	31 Å²	31	65.8 Å²	65.8	15%	0.153	32%	0.317	C	S	.	.	H	α-helix	trans	-64	-40.8	174.1	178.3	172.4	-94.6	0	0	111.9	I378 W379 N380 I384 A385 M386 L441 I444 K445	I378-M382 PolarHBondContact O-N 3.48Å; W379-M382 PolarHBondContact O-N 3.4Å; N380-M382 VanDerWaalsContact C-N 3.33Å; N380-M382 PolarHBondContact O-N 3.21Å; M382-I384 PolarHBondContact O-N 3.36Å; M382-A385 PolarHBondContact O-N 2.92Å; M382-M386 HydrophobicContact CG-SD 4.25Å; M382-M386 WeakPolarHBondContact O-CG 3.37Å; M382-M386 PolarHBondContact O-N 2.98Å; M382-L441 HydrophobicContact CE-CB 4.43Å; M382-L441 HydrophobicContact CE-CD2 3.57Å; M382-L441 HydrophobicContact CG-CB 4.44Å; M382-L441 HydrophobicContact CG-CD2 4.47Å; M382-I444 HydrophobicContact CE-CB 3.84Å; M382-I444 HydrophobicContact CE-CG2 3.52Å; M382-I444 HydrophobicContact SD-CB 4.46Å; M382-I444 HydrophobicContact SD-CG2 4.17Å; M382-K445 HydrophobicContact SD-CB 4Å
383	D	91	Very high	88.5	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-60	-44.3	176.6	-68.9	-32.6	0	0	0	111.2	E363 W379 N380 M386 V387 K445 K448	E363-D383 VanDerWaalsContact OE1-CB 3.28Å; E363-D383 WeakPolarHBondContact OE1-CB 3.41Å; W379-D383 PolarHBondContact O-N 2.94Å; W379-D383 VanDerWaalsContact O-OD2 3.1Å; N380-D383 PolarHBondContact O-N 3.25Å; D383-M386 PolarHBondContact O-N 2.93Å; D383-V387 WeakPolarHBondContact O-CG2 3.47Å; D383-V387 PolarHBondContact O-N 3.27Å; D383-K445 VanDerWaalsContact OD1-CD 3.24Å; D383-K445 WeakPolarHBondContact OD1-CD 3.36Å; D383-K445 WeakPolarHBondContact OD1-CE 3.36Å; D383-K445 IonicContact OD1-NZ 2.82Å; D383-K445 PolarHBondContact OD1-NZ 3.43Å; D383-K448 IonicContact OD2-NZ 2.74Å; D383-K448 PolarHBondContact OD2-NZ 3.23Å
384	I	91.9	Very high	88.9	Confident	47 Å²	47	47.2 Å²	47.2	24%	0.241	25%	0.252	C	S	.	.	H	α-helix	trans	-60.3	-48.4	172.1	-68.5	-175.8	0	0	0	111.6	Y374 F375 N380 L381 M382 M386 V387 V388	Y374-I384 HydrophobicContact CD1-CD1 4.15Å; Y374-I384 HydrophobicContact CE1-CD1 3.29Å; Y374-I384 HydrophobicContact CE1-CG1 3.8Å; Y374-I384 WeakPolarHBondContact OH-CG1 3.05Å; F375-I384 HydrophobicContact CE1-CD1 3.82Å; F375-I384 HydrophobicContact CZ-CD1 4.45Å; N380-I384 PolarHBondContact O-N 2.82Å; L381-I384 PolarHBondContact O-N 3.31Å; M382-I384 PolarHBondContact O-N 3.36Å; I384-M386 VanDerWaalsContact C-N 3.26Å; I384-M386 PolarHBondContact O-N 2.99Å; I384-V387 PolarHBondContact O-N 2.84Å; I384-V387 VanDerWaalsContact O-N 3.14Å; I384-V388 HydrophobicContact CG2-CG2 4.08Å; I384-V388 WeakPolarHBondContact O-CG2 3.26Å; I384-V388 PolarHBondContact O-N 3.3Å
385	A	92.4	Very high	89.4	Confident	42 Å²	42	49.1 Å²	49.1	35%	0.347	27%	0.271	S	S	.	.	H	α-helix	trans	-59.1	-40.6	-178.2	0	0	0	0	0	111.6	L381 M382 A389 L441	L381-A385 PolarHBondContact O-N 2.77Å; M382-A385 PolarHBondContact O-N 2.92Å; A385-A389 VanDerWaalsContact O-CB 3.3Å; A385-A389 WeakPolarHBondContact O-CB 3.4Å; A385-A389 PolarHBondContact O-N 3.31Å; A385-L441 HydrophobicContact CB-CD1 3.99Å
386	M	91.6	Very high	89.6	Confident	14 Å²	14	44.4 Å²	44.4	7%	0.069	25%	0.251	C	S	.	.	H	α-helix	trans	-64.7	-44	174.3	-71.6	177.9	66.3	0	0	112.4	F92 M382 D383 I384 S390 L441 K445	F92-M386 HydrophobicContact CE1-CE 4.12Å; M382-M386 HydrophobicContact CG-SD 4.25Å; M382-M386 WeakPolarHBondContact O-CG 3.37Å; M382-M386 PolarHBondContact O-N 2.98Å; D383-M386 PolarHBondContact O-N 2.93Å; I384-M386 VanDerWaalsContact C-N 3.26Å; I384-M386 PolarHBondContact O-N 2.99Å; M386-S390 VanDerWaalsContact O-CB 3.29Å; M386-S390 WeakPolarHBondContact O-CB 3.31Å; M386-S390 PolarHBondContact O-N 3Å; M386-S390 PolarHBondContact O-OG 3.34Å; M386-L441 HydrophobicContact CG-CB 3.64Å; M386-L441 HydrophobicContact CG-CD1 4.1Å; M386-L441 HydrophobicContact SD-CB 4.14Å; M386-K445 HydrophobicContact CE-CD 4.2Å; M386-K445 HydrophobicContact SD-CB 4.24Å; M386-K445 HydrophobicContact SD-CD 3.67Å
387	V	92.6	Very high	89.8	Confident	19 Å²	19	39.2 Å²	39.2	12%	0.115	23%	0.225	C	C	.	.	H	α-helix	trans	-63.3	-44.3	177.3	169.5	0	0	0	0	111.1	V360 E363 D383 I384 S390 I391	V360-V387 HydrophobicContact CG2-CG1 3.6Å; E363-V387 HydrophobicContact CG-CG2 4.13Å; D383-V387 WeakPolarHBondContact O-CG2 3.47Å; D383-V387 PolarHBondContact O-N 3.27Å; I384-V387 PolarHBondContact O-N 2.84Å; I384-V387 VanDerWaalsContact O-N 3.14Å; V387-S390 WeakPolarHBondContact CA-OG 3.17Å; V387-S390 PolarHBondContact O-N 3.44Å; V387-S390 PolarHBondContact O-OG 3.37Å; V387-I391 HydrophobicContact CG1-CD1 3.76Å; V387-I391 HydrophobicContact CG1-CG1 4.43Å; V387-I391 VanDerWaalsContact O-CG1 3.23Å; V387-I391 WeakPolarHBondContact O-CG1 3.38Å; V387-I391 PolarHBondContact O-N 3.45Å
388	V	92.5	Very high	89.9	Confident	76 Å²	76	42.1 Å²	42.1	46%	0.461	24%	0.239	S	C	.	.	H	α-helix	trans	-63.5	-48.9	178.2	172.2	0	0	0	0	111.1	I384 S390 I391 I392	I384-V388 HydrophobicContact CG2-CG2 4.08Å; I384-V388 WeakPolarHBondContact O-CG2 3.26Å; I384-V388 PolarHBondContact O-N 3.3Å; V388-S390 VanDerWaalsContact C-N 3.3Å; V388-S390 PolarHBondContact O-N 2.93Å; V388-I391 PolarHBondContact O-N 2.85Å; V388-I392 HydrophobicContact CG1-CD1 4.05Å; V388-I392 WeakPolarHBondContact O-CG1 3.34Å; V388-I392 PolarHBondContact O-N 2.93Å
389	A	92.6	Very high	90.1	Very high	11 Å²	11	40.3 Å²	40.3	9%	0.091	23%	0.225	C	C	.	.	H	α-helix	trans	-64.4	-34.4	-179.9	0	0	0	0	0	112.3	A385 I392 C393 S434 C438	A385-A389 VanDerWaalsContact O-CB 3.3Å; A385-A389 WeakPolarHBondContact O-CB 3.4Å; A385-A389 PolarHBondContact O-N 3.31Å; A389-I392 PolarHBondContact O-N 3.48Å; A389-C393 PolarHBondContact O-N 3.12Å; A389-C393 PolarHBondContact O-SG 3.38Å; A389-S434 PolarHBondContact O-OG 3Å; A389-C438 VanDerWaalsContact C-SG 3.51Å; A389-C438 WeakPolarHBondContact CB-SG 3.24Å
390	S	92.2	Very high	90	Very high	4 Å²	4	38.5 Å²	38.5	3%	0.028	22%	0.219	C	C	.	.	H	α-helix	trans	-73.8	-34.2	175.3	54.2	0	0	0	0	113.7	Y352 L356 M386 V387 V388 C393 A394	Y352-S390 VanDerWaalsContact OH-CB 3.25Å; Y352-S390 WeakPolarHBondContact OH-CB 3.02Å; L356-S390 WeakPolarHBondContact CD1-OG 3.28Å; M386-S390 VanDerWaalsContact O-CB 3.29Å; M386-S390 WeakPolarHBondContact O-CB 3.31Å; M386-S390 PolarHBondContact O-N 3Å; M386-S390 PolarHBondContact O-OG 3.34Å; V387-S390 WeakPolarHBondContact CA-OG 3.17Å; V387-S390 PolarHBondContact O-N 3.44Å; V387-S390 PolarHBondContact O-OG 3.37Å; V388-S390 VanDerWaalsContact C-N 3.3Å; V388-S390 PolarHBondContact O-N 2.93Å; S390-C393 PolarHBondContact O-N 3Å; S390-A394 WeakPolarHBondContact O-CB 3.41Å; S390-A394 PolarHBondContact O-N 3.3Å
391	I	92.2	Very high	89.9	Confident	84 Å²	84	42.2 Å²	42.2	43%	0.431	24%	0.242	S	C	.	.	H	α-helix	trans	-62.5	-44.6	170.1	-70.6	165.9	0	0	0	110.5	L356 V360 V387 V388 C393 A394 G395	L356-I391 HydrophobicContact CD1-CG1 4.41Å; L356-I391 HydrophobicContact CD2-CG1 4.43Å; V360-I391 HydrophobicContact CG2-CD1 4.23Å; V387-I391 HydrophobicContact CG1-CD1 3.76Å; V387-I391 HydrophobicContact CG1-CG1 4.43Å; V387-I391 VanDerWaalsContact O-CG1 3.23Å; V387-I391 WeakPolarHBondContact O-CG1 3.38Å; V387-I391 PolarHBondContact O-N 3.45Å; V388-I391 PolarHBondContact O-N 2.85Å; I391-C393 VanDerWaalsContact C-N 3.3Å; I391-C393 PolarHBondContact O-N 2.94Å; I391-A394 PolarHBondContact O-N 3.28Å; I391-G395 PolarHBondContact O-N 3.18Å
392	I	90.6	Very high	89.6	Confident	90 Å²	90	42.9 Å²	42.9	46%	0.462	24%	0.244	S	C	.	.	H	α-helix	trans	-59	-44.4	175.4	-67.1	166.7	0	0	0	110.2	V388 A389 G395 F396	V388-I392 HydrophobicContact CG1-CD1 4.05Å; V388-I392 WeakPolarHBondContact O-CG1 3.34Å; V388-I392 PolarHBondContact O-N 2.93Å; A389-I392 PolarHBondContact O-N 3.48Å; I392-G395 PolarHBondContact O-N 3.15Å; I392-F396 PolarHBondContact O-N 3.48Å
393	C	90.6	Very high	89.4	Confident	13 Å²	13	42.9 Å²	42.9	9%	0.088	25%	0.245	C	C	.	.	H	α-helix	trans	-60.3	-48.6	176.2	-71.7	0	0	0	0	112.3	A389 S390 I391 F396 L397 H431 S434 M435	A389-C393 PolarHBondContact O-N 3.12Å; A389-C393 PolarHBondContact O-SG 3.38Å; S390-C393 PolarHBondContact O-N 3Å; I391-C393 VanDerWaalsContact C-N 3.3Å; I391-C393 PolarHBondContact O-N 2.94Å; C393-F396 PolarHBondContact O-N 3.28Å; C393-L397 WeakPolarHBondContact O-CG 3.38Å; C393-L397 PolarHBondContact O-N 3.44Å; C393-L397 VanDerWaalsContact O-N 3.12Å; C393-H431 PolarHBondContact O-ND1 3.41Å; C393-S434 PolarHBondContact SG-OG 2.72Å; C393-M435 PolarHBondContact SG-N 2.9Å
394	A	89.6	Confident	89.2	Confident	14 Å²	14	43.1 Å²	43.1	12%	0.116	25%	0.246	C	C	.	.	H	α-helix	trans	-63.3	-42.1	179.7	0	0	0	0	0	112.5	L353 L356 S390 I391 F396 L397 I398	L353-A394 HydrophobicContact CD2-CB 3.73Å; L356-A394 HydrophobicContact CD2-CB 4.12Å; S390-A394 WeakPolarHBondContact O-CB 3.41Å; S390-A394 PolarHBondContact O-N 3.3Å; I391-A394 PolarHBondContact O-N 3.28Å; A394-F396 VanDerWaalsContact C-N 3.3Å; A394-F396 PolarHBondContact O-N 2.85Å; A394-L397 WeakPolarHBondContact O-CB 3.49Å; A394-L397 PolarHBondContact O-N 3.35Å; A394-I398 PolarHBondContact O-N 3.09Å
395	G	89.8	Confident	88.8	Confident	41 Å²	41	44.6 Å²	44.6	42%	0.423	26%	0.261	S	S	.	.	H	α-helix	trans	-59.9	-40.8	175.6	0	0	0	0	0	112.1	I391 I392 I398 Y399	I391-G395 PolarHBondContact O-N 3.18Å; I392-G395 PolarHBondContact O-N 3.15Å; G395-I398 PolarHBondContact O-N 2.96Å; G395-Y399 WeakPolarHBondContact O-CB 3.43Å; G395-Y399 PolarHBondContact O-N 2.85Å
396	F	88.8	Confident	88.5	Confident	12 Å²	12	47 Å²	47	5%	0.053	27%	0.268	C	S	.	.	H	α-helix	trans	-64.9	-39.8	175.2	177.2	-96.8	0	0	0	113	I392 C393 A394 I398 Y399 S400 W427 Y428 H431	I392-F396 PolarHBondContact O-N 3.48Å; C393-F396 PolarHBondContact O-N 3.28Å; A394-F396 VanDerWaalsContact C-N 3.3Å; A394-F396 PolarHBondContact O-N 2.85Å; F396-I398 VanDerWaalsContact C-N 3.3Å; F396-I398 PolarHBondContact O-N 2.88Å; F396-Y399 HydrophobicContact CD2-CD1 4.32Å; F396-Y399 HydrophobicContact CE2-CD1 4.39Å; F396-Y399 PolarHBondContact O-N 3.5Å; F396-S400 VanDerWaalsContact O-CB 3.28Å; F396-S400 WeakPolarHBondContact O-CB 3.37Å; F396-S400 PolarHBondContact O-N 3Å; F396-W427 HydrophobicContact CD2-CB 3.64Å; F396-W427 HydrophobicContact CE2-CB 3.43Å; F396-W427 VanDerWaalsContact CE2-CB 3.43Å; F396-Y428 AromaticContact CE1-CD2 3.76Å; F396-Y428 HydrophobicContact CE1-CD2 3.76Å; F396-Y428 HydrophobicContact CE1-CG 4.5Å; F396-Y428 VanDerWaalsContact CE2-N 3.3Å; F396-Y428 AromaticContact CZ-CD2 3.81Å; F396-Y428 HydrophobicContact CZ-CD2 3.81Å; F396-Y428 HydrophobicContact CZ-CG 4.21Å; F396-H431 HydrophobicContact CB-CB 4.08Å; F396-H431 HydrophobicContact CD1-CB 3.29Å; F396-H431 AromaticContact CD1-CD2 3.64Å; F396-H431 AromaticContact CD1-CE1 3.93Å; F396-H431 AromaticContact CD1-CG 3.15Å; F396-H431 AromaticContact CD1-ND1 3.37Å; F396-H431 WeakPolarHBondContact CD1-ND1 3.19Å; F396-H431 HydrophobicContact CD2-CB 4.23Å; F396-H431 HydrophobicContact CE1-CB 3.74Å; F396-H431 AromaticContact CE1-CD2 3.87Å; F396-H431 AromaticContact CE1-CG 3.74Å; F396-H431 HydrophobicContact CG-CB 3.56Å; F396-H431 AromaticContact CG-CG 3.81Å; F396-H431 AromaticContact CG-ND1 3.89Å; F396-H431 HydrophobicContact CZ-CB 4.39Å
397	L	84.4	Confident	88.2	Confident	30 Å²	30	48.5 Å²	48.5	16%	0.157	28%	0.276	C	S	.	.	H	α-helix	trans	-56	-48	177.5	-65.8	-176.5	0	0	0	111.1	C393 A394 S400 T401	C393-L397 WeakPolarHBondContact O-CG 3.38Å; C393-L397 PolarHBondContact O-N 3.44Å; C393-L397 VanDerWaalsContact O-N 3.12Å; A394-L397 WeakPolarHBondContact O-CB 3.49Å; A394-L397 PolarHBondContact O-N 3.35Å; L397-S400 PolarHBondContact O-N 3.36Å; L397-T401 PolarHBondContact O-N 3.2Å; L397-T401 PolarHBondContact O-OG1 3.37Å
398	I	86.6	Confident	87.8	Confident	107 Å²	107	49 Å²	49	55%	0.549	28%	0.277	S	S	.	.	H	α-helix	trans	-65.3	-47.2	179.8	-62.3	165.7	0	0	0	110.6	A394 G395 F396 S400 T401 I402	A394-I398 PolarHBondContact O-N 3.09Å; G395-I398 PolarHBondContact O-N 2.96Å; F396-I398 VanDerWaalsContact C-N 3.3Å; F396-I398 PolarHBondContact O-N 2.88Å; I398-S400 VanDerWaalsContact C-N 3.35Å; I398-S400 PolarHBondContact O-N 2.64Å; I398-T401 PolarHBondContact O-N 2.96Å; I398-I402 HydrophobicContact CG2-CD1 3.98Å; I398-I402 WeakPolarHBondContact O-CG1 3.41Å; I398-I402 PolarHBondContact O-N 3.34Å
399	Y	88	Confident	87.5	Confident	79 Å²	79	48 Å²	48	31%	0.31	27%	0.274	S	S	.	.	H	α-helix	trans	-58	-45.6	178	175.4	-96	0	0	0	112.2	G395 F396 T401 I402 I403 W427	G395-Y399 WeakPolarHBondContact O-CB 3.43Å; G395-Y399 PolarHBondContact O-N 2.85Å; F396-Y399 HydrophobicContact CD2-CD1 4.32Å; F396-Y399 HydrophobicContact CE2-CD1 4.39Å; F396-Y399 PolarHBondContact O-N 3.5Å; Y399-T401 PolarHBondContact O-N 3.2Å; Y399-I402 PolarHBondContact O-N 3.17Å; Y399-I403 HydrophobicContact CD1-CD1 3.95Å; Y399-I403 HydrophobicContact CD2-CD1 3.59Å; Y399-I403 HydrophobicContact CE1-CD1 3.44Å; Y399-I403 VanDerWaalsContact CE1-CD1 3.44Å; Y399-I403 HydrophobicContact CE2-CD1 3.04Å; Y399-I403 HydrophobicContact CE2-CG1 4.39Å; Y399-I403 HydrophobicContact CG-CD1 4.02Å; Y399-I403 PolarHBondContact O-N 3.2Å; Y399-I403 VanDerWaalsContact O-N 3.08Å; Y399-I403 WeakPolarHBondContact OH-CD1 3.44Å; Y399-W427 HydrophobicContact CE1-CB 4.36Å; Y399-W427 AromaticContact CE1-CD1 3.7Å; Y399-W427 HydrophobicContact CE1-CG 4.16Å; Y399-W427 AromaticContact CZ-CD1 3.9Å
400	S	86.1	Confident	87.1	Confident	3 Å²	3	50 Å²	50	2%	0.021	29%	0.291	C	S	.	.	H	α-helix	trans	-60.6	-44.7	179.7	-174	0	0	0	0	111.4	F396 L397 I398 I402 V404	F396-S400 VanDerWaalsContact O-CB 3.28Å; F396-S400 WeakPolarHBondContact O-CB 3.37Å; F396-S400 PolarHBondContact O-N 3Å; L397-S400 PolarHBondContact O-N 3.36Å; I398-S400 VanDerWaalsContact C-N 3.35Å; I398-S400 PolarHBondContact O-N 2.64Å; S400-I402 PolarHBondContact O-N 3.04Å; S400-V404 VanDerWaalsContact O-CB 3.31Å; S400-V404 WeakPolarHBondContact O-CB 3.09Å; S400-V404 WeakPolarHBondContact O-CG2 3.29Å; S400-V404 PolarHBondContact O-N 2.93Å
401	T	84.5	Confident	86.8	Confident	79 Å²	79	50.5 Å²	50.5	49%	0.485	29%	0.293	S	S	.	.	H	α-helix	trans	-63.3	-40.7	-179.9	-57.9	0	0	0	0	112.2	L397 I398 Y399	L397-T401 PolarHBondContact O-N 3.2Å; L397-T401 PolarHBondContact O-OG1 3.37Å; I398-T401 PolarHBondContact O-N 2.96Å; Y399-T401 PolarHBondContact O-N 3.2Å
402	I	85	Confident	86.4	Confident	100 Å²	100	52.1 Å²	52.1	51%	0.513	30%	0.301	S	S	.	.	H	α-helix	trans	-67.6	-48.4	-179.3	-64.6	167.1	0	0	0	110.9	I398 Y399 S400 S405 N406	I398-I402 HydrophobicContact CG2-CD1 3.98Å; I398-I402 WeakPolarHBondContact O-CG1 3.41Å; I398-I402 PolarHBondContact O-N 3.34Å; Y399-I402 PolarHBondContact O-N 3.17Å; S400-I402 PolarHBondContact O-N 3.04Å; I402-S405 PolarHBondContact O-N 3.43Å; I402-N406 PolarHBondContact O-N 2.83Å
403	I	84.9	Confident	86.3	Confident	32 Å²	32	54.5 Å²	54.5	16%	0.164	32%	0.315	C	S	.	.	H	α-helix	trans	-75.3	-36	-173.2	-75.3	169.3	0	0	0	112.9	Y399 S405 N406 N407	Y399-I403 HydrophobicContact CD1-CD1 3.95Å; Y399-I403 HydrophobicContact CD2-CD1 3.59Å; Y399-I403 HydrophobicContact CE1-CD1 3.44Å; Y399-I403 VanDerWaalsContact CE1-CD1 3.44Å; Y399-I403 HydrophobicContact CE2-CD1 3.04Å; Y399-I403 HydrophobicContact CE2-CG1 4.39Å; Y399-I403 HydrophobicContact CG-CD1 4.02Å; Y399-I403 PolarHBondContact O-N 3.2Å; Y399-I403 VanDerWaalsContact O-N 3.08Å; Y399-I403 WeakPolarHBondContact OH-CD1 3.44Å; I403-S405 VanDerWaalsContact C-N 3.26Å; I403-S405 PolarHBondContact O-N 3.47Å; I403-N406 PolarHBondContact O-N 3.32Å; I403-N407 WeakPolarHBondContact O-CB 3.06Å; I403-N407 PolarHBondContact O-N 2.73Å
404	V	85.5	Confident	86.1	Confident	8 Å²	8	57.5 Å²	57.5	5%	0.048	33%	0.33	C	S	.	.	H	α-helix	trans	-57.3	-44.1	174.5	170.2	0	0	0	0	110.4	L334 F335 S400 N406 M408 L424	L334-V404 HydrophobicContact CB-CG1 4.14Å; L334-V404 HydrophobicContact CB-CG2 3.96Å; L334-V404 HydrophobicContact CD2-CG2 3.97Å; L334-V404 HydrophobicContact CG-CG2 4.4Å; F335-V404 HydrophobicContact CD1-CG1 4.17Å; F335-V404 HydrophobicContact CE1-CG1 3.89Å; S400-V404 VanDerWaalsContact O-CB 3.31Å; S400-V404 WeakPolarHBondContact O-CB 3.09Å; S400-V404 WeakPolarHBondContact O-CG2 3.29Å; S400-V404 PolarHBondContact O-N 2.93Å; V404-N406 VanDerWaalsContact C-N 3.34Å; V404-N406 PolarHBondContact O-N 3.22Å; V404-M408 HydrophobicContact CG1-CG 4.04Å; V404-M408 WeakPolarHBondContact O-CB 3.49Å; V404-M408 WeakPolarHBondContact O-CG 3.39Å; V404-M408 PolarHBondContact O-N 3.46Å; V404-L424 HydrophobicContact CG2-CD1 4.33Å; V404-L424 HydrophobicContact CG2-CD2 3.71Å
405	S	84.8	Confident	85.8	Confident	78 Å²	78	60.9 Å²	60.9	55%	0.545	35%	0.345	S	S	.	.	H	α-helix	trans	-60.7	-43	178.3	-170	0	0	0	0	112.2	I402 I403 S409	I402-S405 PolarHBondContact O-N 3.43Å; I403-S405 VanDerWaalsContact C-N 3.26Å; I403-S405 PolarHBondContact O-N 3.47Å; S405-S409 WeakPolarHBondContact O-CB 3.32Å; S405-S409 PolarHBondContact O-N 2.84Å; S405-S409 VanDerWaalsContact O-N 3.17Å; S405-S409 PolarHBondContact O-OG 3.31Å
406	N	85.9	Confident	85.5	Confident	94 Å²	94	62.5 Å²	62.5	50%	0.503	35%	0.35	S	S	.	.	H	α-helix	trans	-71.4	-47.1	-178.3	-68.8	-4.4	0	0	0	112	I402 I403 V404 S409 A410	I402-N406 PolarHBondContact O-N 2.83Å; I403-N406 PolarHBondContact O-N 3.32Å; V404-N406 VanDerWaalsContact C-N 3.34Å; V404-N406 PolarHBondContact O-N 3.22Å; N406-S409 PolarHBondContact O-N 2.88Å; N406-S409 PolarHBondContact O-OG 2.91Å; N406-A410 PolarHBondContact O-N 2.66Å; N406-A410 VanDerWaalsContact O-N 3.09Å
407	N	84.9	Confident	85.5	Confident	44 Å²	44	63.7 Å²	63.7	24%	0.235	36%	0.36	C	S	.	.	H	α-helix	trans	-71.4	-35.3	-177.8	-68.9	2	0	0	0	112	I403 A410 L411 N420 F421	I403-N407 WeakPolarHBondContact O-CB 3.06Å; I403-N407 PolarHBondContact O-N 2.73Å; N407-A410 PolarHBondContact O-N 2.86Å; N407-L411 WeakPolarHBondContact O-CB 3.49Å; N407-L411 PolarHBondContact O-N 3.42Å; N407-N420 PolarHBondContact ND2-O 3.34Å; N407-F421 HydrophobicContact CB-CE1 3.92Å
408	M	84.8	Confident	85.7	Confident	29 Å²	29	63 Å²	63	14%	0.143	36%	0.355	C	S	.	.	H	α-helix	trans	-68.2	-40.4	175.4	-73.3	-58.6	-51.2	0	0	112.2	F308 F335 V404 A410 L411 I412 F421	F308-M408 HydrophobicContact CE1-SD 4.24Å; F308-M408 HydrophobicContact CZ-SD 4.35Å; F335-M408 HydrophobicContact CE1-CG 4.13Å; F335-M408 HydrophobicContact CE2-CE 4.43Å; F335-M408 HydrophobicContact CZ-CE 3.94Å; F335-M408 HydrophobicContact CZ-CG 3.81Å; F335-M408 HydrophobicContact CZ-SD 4.1Å; V404-M408 HydrophobicContact CG1-CG 4.04Å; V404-M408 WeakPolarHBondContact O-CB 3.49Å; V404-M408 WeakPolarHBondContact O-CG 3.39Å; V404-M408 PolarHBondContact O-N 3.46Å; M408-A410 VanDerWaalsContact C-N 3.34Å; M408-L411 PolarHBondContact O-N 2.89Å; M408-I412 VanDerWaalsContact O-CG1 3.25Å; M408-I412 WeakPolarHBondContact O-CG1 3.43Å; M408-I412 PolarHBondContact O-N 3.35Å; M408-F421 HydrophobicContact SD-CE1 4.37Å; M408-F421 HydrophobicContact SD-CZ 3.69Å
409	S	85.3	Confident	85.7	Confident	56 Å²	56	58.1 Å²	58.1	39%	0.392	33%	0.331	S	S	.	.	H	α-helix	trans	-65.9	-38.2	176.3	53.2	0	0	0	0	111.9	S405 N406 I412 N413	S405-S409 WeakPolarHBondContact O-CB 3.32Å; S405-S409 PolarHBondContact O-N 2.84Å; S405-S409 VanDerWaalsContact O-N 3.17Å; S405-S409 PolarHBondContact O-OG 3.31Å; N406-S409 PolarHBondContact O-N 2.88Å; N406-S409 PolarHBondContact O-OG 2.91Å; S409-I412 PolarHBondContact O-N 2.88Å; S409-N413 VanDerWaalsContact O-CG 3.23Å; S409-N413 PolarHBondContact O-N 2.98Å; S409-N413 VanDerWaalsContact O-N 3.16Å; S409-N413 PolarHBondContact O-ND2 2.67Å
410	A	85.6	Confident	85.6	Confident	53 Å²	53	57 Å²	57	44%	0.438	33%	0.33	S	S	.	.	H	α-helix	trans	-61.5	-45.6	172.2	0	0	0	0	0	112.4	N406 N407 M408 I412 N413 D414	N406-A410 PolarHBondContact O-N 2.66Å; N406-A410 VanDerWaalsContact O-N 3.09Å; N407-A410 PolarHBondContact O-N 2.86Å; M408-A410 VanDerWaalsContact C-N 3.34Å; A410-I412 PolarHBondContact O-N 3.34Å; A410-N413 PolarHBondContact O-N 3.47Å; A410-D414 PolarHBondContact O-N 3.48Å
411	L	85.2	Confident	85.7	Confident	15 Å²	15	57 Å²	57	8%	0.079	33%	0.33	C	S	.	.	H	α-helix	trans	-66.7	-35.2	179.7	-175.5	65.6	0	0	0	113	L181 N407 M408 N413 D414 I415 P419 F421	L181-L411 HydrophobicContact CB-CD2 4.18Å; L181-L411 HydrophobicContact CD1-CD2 4.37Å; N407-L411 WeakPolarHBondContact O-CB 3.49Å; N407-L411 PolarHBondContact O-N 3.42Å; M408-L411 PolarHBondContact O-N 2.89Å; L411-N413 VanDerWaalsContact C-N 3.31Å; L411-D414 CarbonylContact O-C 3.45Å; L411-D414 VanDerWaalsContact O-C 3.22Å; L411-I415 WeakPolarHBondContact O-CA 3.25Å; L411-I415 PolarHBondContact O-N 3.44Å; L411-P419 HydrophobicContact CD1-CB 4.1Å; L411-P419 HydrophobicContact CD2-CB 4.22Å; L411-F421 HydrophobicContact CD2-CE2 4.41Å
412	I	84.5	Confident	86	Confident	118 Å²	118	53.5 Å²	53.5	61%	0.605	31%	0.308	S	S	*	.	H	α-helix	trans	-66.6	-37.1	175.2	-70.3	165.5	0	0	0	110.6	M408 S409 A410	M408-I412 VanDerWaalsContact O-CG1 3.25Å; M408-I412 WeakPolarHBondContact O-CG1 3.43Å; M408-I412 PolarHBondContact O-N 3.35Å; S409-I412 PolarHBondContact O-N 2.88Å; A410-I412 PolarHBondContact O-N 3.34Å
413	N	87	Confident	86.1	Confident	140 Å²	140	52.2 Å²	52.2	75%	0.749	30%	0.297	S	S	*	.	H	α-helix	trans	-72.3	-37.3	177.9	-68.6	-24.4	0	0	0	112.5	S409 A410 L411	S409-N413 VanDerWaalsContact O-CG 3.23Å; S409-N413 PolarHBondContact O-N 2.98Å; S409-N413 VanDerWaalsContact O-N 3.16Å; S409-N413 PolarHBondContact O-ND2 2.67Å; A410-N413 PolarHBondContact O-N 3.47Å; L411-N413 VanDerWaalsContact C-N 3.31Å
414	D	86.2	Confident	86.3	Confident	76 Å²	76	50.8 Å²	50.8	41%	0.406	29%	0.29	S	S	.	.			trans	-130.6	88.3	177.1	-174.7	1.1	0	0	0	111.4	A410 L411 S416 S417	A410-D414 PolarHBondContact O-N 3.48Å; L411-D414 CarbonylContact O-C 3.45Å; L411-D414 VanDerWaalsContact O-C 3.22Å; D414-S416 PolarHBondContact O-N 2.99Å; D414-S416 PolarHBondContact OD1-N 2.92Å; D414-S416 VanDerWaalsContact OD1-N 3.13Å; D414-S416 PolarHBondContact OD1-OG 2.84Å; D414-S417 PolarHBondContact O-N 3.02Å; D414-S417 PolarHBondContact O-OG 2.86Å; D414-S417 PolarHBondContact OD1-N 3.45Å
415	I	83.5	Confident	86.6	Confident	85 Å²	85	50.8 Å²	50.8	44%	0.436	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-18.9	-178.5	-56.8	165.7	0	0	0	111.6	G182 L411 S417	G182-I415 WeakPolarHBondContact CA-O 3.49Å; L411-I415 WeakPolarHBondContact O-CA 3.25Å; L411-I415 PolarHBondContact O-N 3.44Å; I415-S417 VanDerWaalsContact C-N 3.34Å
416	S	84.5	Confident	86.8	Confident	75 Å²	75	51.6 Å²	51.6	52%	0.524	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-7.6	176.9	34.1	0	0	0	0	114	V183 D414	V183-S416 WeakPolarHBondContact CG2-O 3.44Å; D414-S416 PolarHBondContact O-N 2.99Å; D414-S416 PolarHBondContact OD1-N 2.92Å; D414-S416 VanDerWaalsContact OD1-N 3.13Å; D414-S416 PolarHBondContact OD1-OG 2.84Å
417	S	88.4	Confident	86.9	Confident	36 Å²	36	52.6 Å²	52.6	25%	0.252	28%	0.279	S	S	.	.	S	Bend	trans	-81.3	152.5	179.5	68.7	0	0	0	0	112.8	G182 D414 I415	G182-S417 VanDerWaalsContact CA-O 3.26Å; G182-S417 WeakPolarHBondContact CA-O 3.35Å; D414-S417 PolarHBondContact O-N 3.02Å; D414-S417 PolarHBondContact O-OG 2.86Å; D414-S417 PolarHBondContact OD1-N 3.45Å; I415-S417 VanDerWaalsContact C-N 3.34Å
418	Y	88.4	Confident	87.2	Confident	16 Å²	16	51.3 Å²	51.3	6%	0.063	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-66.1	128.1	169.2	167.6	-96.9	0	0	0	110.5	V183 R185 D297 N420	V183-Y418 WeakPolarHBondContact O-CD2 3.25Å; R185-Y418 HydrophobicContact CB-CD2 3.37Å; R185-Y418 HydrophobicContact CB-CE2 3.57Å; R185-Y418 HydrophobicContact CB-CG 3.95Å; R185-Y418 HydrophobicContact CG-CD2 4.43Å; R185-Y418 VanDerWaalsContact NH1-CD1 3.33Å; D297-Y418 HydrophobicContact CB-CE2 4.12Å; Y418-N420 PolarHBondContact O-N 2.92Å
419	P	86.1	Confident	87.4	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.032	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-78.2	116.8	178.2	32.5	-34.6	0	0	0	111	L181 L411 F421	L181-P419 HydrophobicContact CB-CG 4.39Å; L181-P419 WeakPolarHBondContact O-CD 3.48Å; L181-P419 VanDerWaalsContact O-CG 3.29Å; L181-P419 WeakPolarHBondContact O-CG 3.48Å; L411-P419 HydrophobicContact CD1-CB 4.1Å; L411-P419 HydrophobicContact CD2-CB 4.22Å; P419-F421 VanDerWaalsContact C-N 3.34Å; P419-F421 HydrophobicContact CB-CD2 3.66Å; P419-F421 HydrophobicContact CB-CE2 3.53Å; P419-F421 HydrophobicContact CB-CZ 4.4Å; P419-F421 HydrophobicContact CG-CD2 4.25Å; P419-F421 HydrophobicContact CG-CE2 4.36Å; P419-F421 PolarHBondContact O-N 3.25Å
420	N	86.2	Confident	87.7	Confident	56 Å²	56	51.3 Å²	51.3	30%	0.299	27%	0.267	S	S	.	.			trans	-77.5	79.8	176.6	-173.6	1.6	0	0	0	111.9	G247 N407 Y418	G247-N420 VanDerWaalsContact CA-ND2 3.28Å; G247-N420 WeakPolarHBondContact CA-ND2 3.48Å; G247-N420 PolarHBondContact O-OD1 3.49Å; N407-N420 PolarHBondContact ND2-O 3.34Å; Y418-N420 PolarHBondContact O-N 2.92Å
421	F	89.4	Confident	87.9	Confident	3 Å²	3	49.1 Å²	49.1	1%	0.013	25%	0.248	C	C	.	.			trans	-104.9	6.2	173.5	-65.6	-54.4	0	0	0	113.9	L181 T299 I310 L334 N407 M408 L411 P419 L424 A425	L181-F421 HydrophobicContact CD1-CE2 4.31Å; T299-F421 HydrophobicContact CG2-CD2 3.84Å; T299-F421 HydrophobicContact CG2-CE2 4.35Å; I310-F421 HydrophobicContact CG1-CB 4.01Å; L334-F421 HydrophobicContact CD1-CD1 4Å; L334-F421 HydrophobicContact CD1-CE1 3.84Å; L334-F421 HydrophobicContact CD1-CG 4.5Å; L334-F421 HydrophobicContact CD1-CZ 4.19Å; N407-F421 HydrophobicContact CB-CE1 3.92Å; M408-F421 HydrophobicContact SD-CE1 4.37Å; M408-F421 HydrophobicContact SD-CZ 3.69Å; L411-F421 HydrophobicContact CD2-CE2 4.41Å; P419-F421 VanDerWaalsContact C-N 3.34Å; P419-F421 HydrophobicContact CB-CD2 3.66Å; P419-F421 HydrophobicContact CB-CE2 3.53Å; P419-F421 HydrophobicContact CB-CZ 4.4Å; P419-F421 HydrophobicContact CG-CD2 4.25Å; P419-F421 HydrophobicContact CG-CE2 4.36Å; P419-F421 PolarHBondContact O-N 3.25Å; F421-L424 HydrophobicContact CD1-CD2 3.77Å; F421-L424 HydrophobicContact CE1-CD2 4.39Å; F421-L424 WeakPolarHBondContact O-CB 3.4Å; F421-L424 PolarHBondContact O-N 2.95Å; F421-A425 WeakPolarHBondContact O-CB 3.41Å; F421-A425 PolarHBondContact O-N 3.25Å
422	D	89.1	Confident	88.1	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-65.4	-52.5	-174.6	-172.6	28.3	0	0	0	112.7	A248 T249 K312 L424 A425 Y426	A248-D422 WeakPolarHBondContact CA-OD2 3.13Å; T249-D422 PolarHBondContact N-OD2 3.27Å; T249-D422 PolarHBondContact OG1-OD2 2.87Å; T249-D422 VanDerWaalsContact OG1-OD2 3.12Å; K312-D422 VanDerWaalsContact CE-CG 3.41Å; K312-D422 WeakPolarHBondContact CE-OD1 3.46Å; K312-D422 IonicContact NZ-OD1 3.8Å; K312-D422 PolarHBondContact NZ-OD1 2.87Å; K312-D422 IonicContact NZ-OD2 3.3Å; K312-D422 PolarHBondContact NZ-OD2 2.92Å; D422-L424 PolarHBondContact O-N 3.24Å; D422-A425 PolarHBondContact O-N 2.73Å; D422-A425 VanDerWaalsContact O-N 3.13Å; D422-Y426 WeakPolarHBondContact O-CB 3.37Å; D422-Y426 PolarHBondContact O-N 2.86Å
423	Y	89	Confident	88.5	Confident	74 Å²	74	50.1 Å²	50.1	29%	0.29	25%	0.246	S	C	.	.	H	α-helix	trans	-53.5	-41.1	174.4	-82.7	-80	0	0	0	112	G247 A248 T249 Y426 W427	G247-Y423 VanDerWaalsContact C-CE2 3.46Å; G247-Y423 WeakPolarHBondContact O-CD2 3.42Å; G247-Y423 WeakPolarHBondContact O-CE2 3.39Å; A248-Y423 PolarHBondContact O-OH 3.32Å; T249-Y423 HydrophobicContact CG2-CD1 3.34Å; T249-Y423 HydrophobicContact CG2-CD2 4.18Å; T249-Y423 HydrophobicContact CG2-CE1 3.54Å; T249-Y423 HydrophobicContact CG2-CE2 4.34Å; T249-Y423 HydrophobicContact CG2-CG 3.67Å; Y423-Y426 PolarHBondContact O-N 3.49Å; Y423-W427 WeakPolarHBondContact O-CB 3.45Å; Y423-W427 PolarHBondContact O-N 3.47Å
424	L	89.1	Confident	88.7	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-66.8	-43.8	-179	-172.6	61.4	0	0	0	111.6	L334 V404 F421 D422 Y428	L334-L424 HydrophobicContact CD1-CD2 4.07Å; L334-L424 HydrophobicContact CD2-CD2 3.28Å; L334-L424 HydrophobicContact CD2-CG 3.84Å; L334-L424 HydrophobicContact CG-CD2 4.31Å; V404-L424 HydrophobicContact CG2-CD1 4.33Å; V404-L424 HydrophobicContact CG2-CD2 3.71Å; F421-L424 HydrophobicContact CD1-CD2 3.77Å; F421-L424 HydrophobicContact CE1-CD2 4.39Å; F421-L424 WeakPolarHBondContact O-CB 3.4Å; F421-L424 PolarHBondContact O-N 2.95Å; D422-L424 PolarHBondContact O-N 3.24Å; L424-Y428 WeakPolarHBondContact O-CB 3.35Å; L424-Y428 PolarHBondContact O-N 2.86Å
425	A	90	Very high	89	Confident	7 Å²	7	41 Å²	41	6%	0.058	20%	0.198	C	C	.	.	H	α-helix	trans	-63.7	-43.5	175.5	0	0	0	0	0	112.1	I310 Q330 V332 F421 D422 Y428 S429	I310-A425 HydrophobicContact CB-CB 4.19Å; I310-A425 HydrophobicContact CD1-CB 3.74Å; I310-A425 HydrophobicContact CG1-CB 3.91Å; I310-A425 HydrophobicContact CG2-CB 4.49Å; Q330-A425 HydrophobicContact CG-CB 4.18Å; V332-A425 HydrophobicContact CG2-CB 4.41Å; F421-A425 WeakPolarHBondContact O-CB 3.41Å; F421-A425 PolarHBondContact O-N 3.25Å; D422-A425 PolarHBondContact O-N 2.73Å; D422-A425 VanDerWaalsContact O-N 3.13Å; A425-Y428 PolarHBondContact O-N 3.45Å; A425-S429 PolarHBondContact O-N 2.87Å
426	Y	89.8	Confident	89.4	Confident	95 Å²	95	39.8 Å²	39.8	37%	0.373	20%	0.2	S	C	.	.	H	α-helix	trans	-58	-53	176.5	177	-93.7	0	0	0	111.7	T249 D422 Y423 Y428 S429 H430	T249-Y426 HydrophobicContact CG2-CG 4.17Å; D422-Y426 WeakPolarHBondContact O-CB 3.37Å; D422-Y426 PolarHBondContact O-N 2.86Å; Y423-Y426 PolarHBondContact O-N 3.49Å; Y426-Y428 VanDerWaalsContact C-N 3.34Å; Y426-Y428 PolarHBondContact O-N 3.28Å; Y426-S429 PolarHBondContact O-N 3.03Å; Y426-H430 AromaticContact CD1-CD2 3.84Å; Y426-H430 AromaticContact CE1-CD2 3.42Å; Y426-H430 VanDerWaalsContact CE1-CD2 3.42Å; Y426-H430 WeakPolarHBondContact CE1-CD2 3.48Å; Y426-H430 AromaticContact CE1-NE2 3.48Å; Y426-H430 WeakPolarHBondContact CE1-NE2 3.46Å; Y426-H430 AromaticContact CE2-NE2 3.56Å; Y426-H430 AromaticContact CZ-CD2 3.56Å; Y426-H430 AromaticContact CZ-NE2 3.09Å; Y426-H430 PolarHBondContact O-CD2 2.78Å; Y426-H430 VanDerWaalsContact O-CD2 3.29Å; Y426-H430 PolarHBondContact O-N 3.42Å; Y426-H430 PolarHBondContact OH-NE2 3.05Å
427	W	89.1	Confident	89.8	Confident	116 Å²	116	40.7 Å²	40.7	44%	0.439	20%	0.198	S	C	.	.	H	α-helix	trans	-67.5	-34.7	179.8	-75.4	117.3	0	0	0	112.3	F396 Y399 Y423 H430 H431	F396-W427 HydrophobicContact CD2-CB 3.64Å; F396-W427 HydrophobicContact CE2-CB 3.43Å; F396-W427 VanDerWaalsContact CE2-CB 3.43Å; Y399-W427 HydrophobicContact CE1-CB 4.36Å; Y399-W427 AromaticContact CE1-CD1 3.7Å; Y399-W427 HydrophobicContact CE1-CG 4.16Å; Y399-W427 AromaticContact CZ-CD1 3.9Å; Y423-W427 WeakPolarHBondContact O-CB 3.45Å; Y423-W427 PolarHBondContact O-N 3.47Å; W427-H430 PolarHBondContact O-N 3.16Å; W427-H431 WeakPolarHBondContact O-CB 3.1Å; W427-H431 PolarHBondContact O-N 3.3Å
428	Y	89.9	Confident	90	Very high	16 Å²	16	39 Å²	39	6%	0.063	19%	0.187	C	C	.	.	H	α-helix	trans	-63.1	-42.5	174.8	-177.9	-100.6	0	0	0	112.5	P331 V332 F396 L424 A425 Y426 H430 H431 I432	P331-Y428 WeakPolarHBondContact O-CE1 3.46Å; V332-Y428 HydrophobicContact CB-CD1 4.12Å; V332-Y428 HydrophobicContact CB-CE1 4.17Å; V332-Y428 HydrophobicContact CB-CG 4.43Å; V332-Y428 HydrophobicContact CG1-CD1 3.76Å; V332-Y428 HydrophobicContact CG1-CD2 3.69Å; V332-Y428 HydrophobicContact CG1-CE1 3.95Å; V332-Y428 HydrophobicContact CG1-CE2 3.94Å; V332-Y428 HydrophobicContact CG1-CG 3.6Å; V332-Y428 HydrophobicContact CG2-CD1 3.67Å; V332-Y428 HydrophobicContact CG2-CE1 4.08Å; V332-Y428 HydrophobicContact CG2-CG 4.16Å; F396-Y428 AromaticContact CE1-CD2 3.76Å; F396-Y428 HydrophobicContact CE1-CD2 3.76Å; F396-Y428 HydrophobicContact CE1-CG 4.5Å; F396-Y428 VanDerWaalsContact CE2-N 3.3Å; F396-Y428 AromaticContact CZ-CD2 3.81Å; F396-Y428 HydrophobicContact CZ-CD2 3.81Å; F396-Y428 HydrophobicContact CZ-CG 4.21Å; L424-Y428 WeakPolarHBondContact O-CB 3.35Å; L424-Y428 PolarHBondContact O-N 2.86Å; A425-Y428 PolarHBondContact O-N 3.45Å; Y426-Y428 VanDerWaalsContact C-N 3.34Å; Y426-Y428 PolarHBondContact O-N 3.28Å; Y428-H430 VanDerWaalsContact C-N 3.3Å; Y428-H430 PolarHBondContact O-N 3.05Å; Y428-H431 WeakPolarHBondContact O-CB 3.44Å; Y428-H431 PolarHBondContact O-N 2.94Å; Y428-I432 HydrophobicContact CD1-CD1 3.78Å; Y428-I432 HydrophobicContact CD1-CG1 4.48Å; Y428-I432 HydrophobicContact CE1-CD1 3.19Å; Y428-I432 HydrophobicContact CE1-CG1 4.13Å; Y428-I432 HydrophobicContact CE2-CD1 4.44Å; Y428-I432 PolarHBondContact O-N 3.19Å
429	S	89.9	Confident	90.3	Very high	28 Å²	28	39.4 Å²	39.4	20%	0.196	19%	0.19	C	C	.	.	H	α-helix	trans	-59.8	-41.2	174.8	177.2	0	0	0	0	111.8	A425 Y426 R433	A425-S429 PolarHBondContact O-N 2.87Å; Y426-S429 PolarHBondContact O-N 3.03Å; S429-R433 WeakPolarHBondContact O-CG 3.32Å; S429-R433 PolarHBondContact O-N 3.37Å; S429-R433 VanDerWaalsContact O-N 3.17Å; S429-R433 PolarHBondContact O-NE 3.4Å; S429-R433 VanDerWaalsContact O-NE 3.08Å; S429-R433 PolarHBondContact OG-NE 3.27Å; S429-R433 PolarHBondContact OG-NH2 3.19Å
430	H	90	Very high	90.7	Very high	57 Å²	57	45.3 Å²	45.3	26%	0.264	22%	0.216	S	C	.	.	H	α-helix	trans	-68.7	-36.6	174.7	-77.5	-66.8	0	0	0	112.7	Y426 W427 Y428 R433 S434	Y426-H430 AromaticContact CD1-CD2 3.84Å; Y426-H430 AromaticContact CE1-CD2 3.42Å; Y426-H430 VanDerWaalsContact CE1-CD2 3.42Å; Y426-H430 WeakPolarHBondContact CE1-CD2 3.48Å; Y426-H430 AromaticContact CE1-NE2 3.48Å; Y426-H430 WeakPolarHBondContact CE1-NE2 3.46Å; Y426-H430 AromaticContact CE2-NE2 3.56Å; Y426-H430 AromaticContact CZ-CD2 3.56Å; Y426-H430 AromaticContact CZ-NE2 3.09Å; Y426-H430 PolarHBondContact O-CD2 2.78Å; Y426-H430 VanDerWaalsContact O-CD2 3.29Å; Y426-H430 PolarHBondContact O-N 3.42Å; Y426-H430 PolarHBondContact OH-NE2 3.05Å; W427-H430 PolarHBondContact O-N 3.16Å; Y428-H430 VanDerWaalsContact C-N 3.3Å; Y428-H430 PolarHBondContact O-N 3.05Å; H430-R433 PolarHBondContact CE1-NH1 3.27Å; H430-R433 PolarHBondContact CE1-NH2 3.43Å; H430-R433 VanDerWaalsContact CE1-NH2 3.31Å; H430-R433 VanDerWaalsContact ND1-CZ 3.28Å; H430-R433 PolarHBondContact ND1-NH1 2.63Å; H430-R433 PolarHBondContact ND1-NH2 2.87Å; H430-R433 VanDerWaalsContact ND1-NH2 3.17Å; H430-R433 PolarHBondContact O-N 3.4Å; H430-S434 WeakPolarHBondContact O-CB 3.33Å; H430-S434 PolarHBondContact O-N 3.36Å
431	H	90.2	Very high	91.1	Very high	8 Å²	8	44 Å²	44	4%	0.037	21%	0.209	C	C	.	.	H	α-helix	trans	-60.4	-47.9	174.6	171.8	77.8	0	0	0	112.1	R336 C393 F396 W427 Y428 R433 S434 M435	R336-H431 PolarHBondContact NH2-NE2 3.2Å; C393-H431 PolarHBondContact O-ND1 3.41Å; F396-H431 HydrophobicContact CB-CB 4.08Å; F396-H431 HydrophobicContact CD1-CB 3.29Å; F396-H431 AromaticContact CD1-CD2 3.64Å; F396-H431 AromaticContact CD1-CE1 3.93Å; F396-H431 AromaticContact CD1-CG 3.15Å; F396-H431 AromaticContact CD1-ND1 3.37Å; F396-H431 WeakPolarHBondContact CD1-ND1 3.19Å; F396-H431 HydrophobicContact CD2-CB 4.23Å; F396-H431 HydrophobicContact CE1-CB 3.74Å; F396-H431 AromaticContact CE1-CD2 3.87Å; F396-H431 AromaticContact CE1-CG 3.74Å; F396-H431 HydrophobicContact CG-CB 3.56Å; F396-H431 AromaticContact CG-CG 3.81Å; F396-H431 AromaticContact CG-ND1 3.89Å; F396-H431 HydrophobicContact CZ-CB 4.39Å; W427-H431 WeakPolarHBondContact O-CB 3.1Å; W427-H431 PolarHBondContact O-N 3.3Å; Y428-H431 WeakPolarHBondContact O-CB 3.44Å; Y428-H431 PolarHBondContact O-N 2.94Å; H431-R433 VanDerWaalsContact C-N 3.33Å; H431-R433 PolarHBondContact O-N 3.39Å; H431-S434 PolarHBondContact O-N 2.91Å; H431-M435 WeakPolarHBondContact O-CB 3.38Å; H431-M435 PolarHBondContact O-N 2.63Å
432	I	90.8	Very high	91.2	Very high	36 Å²	36	43.9 Å²	43.9	19%	0.185	21%	0.208	C	C	.	.	H	α-helix	trans	-60.5	-44.7	176.5	-69.2	172.8	0	0	0	110.7	L104 Y428 S434 M435 A436	L104-I432 HydrophobicContact CD1-CG2 4.45Å; L104-I432 HydrophobicContact CD2-CD1 3.94Å; L104-I432 HydrophobicContact CD2-CG1 4.34Å; L104-I432 HydrophobicContact CD2-CG2 4.25Å; Y428-I432 HydrophobicContact CD1-CD1 3.78Å; Y428-I432 HydrophobicContact CD1-CG1 4.48Å; Y428-I432 HydrophobicContact CE1-CD1 3.19Å; Y428-I432 HydrophobicContact CE1-CG1 4.13Å; Y428-I432 HydrophobicContact CE2-CD1 4.44Å; Y428-I432 PolarHBondContact O-N 3.19Å; I432-S434 PolarHBondContact O-N 2.96Å; I432-M435 PolarHBondContact O-N 2.94Å; I432-A436 WeakPolarHBondContact O-CB 3.25Å; I432-A436 PolarHBondContact O-N 3.11Å
433	R	91.5	Very high	91.4	Very high	118 Å²	118	47.7 Å²	47.7	45%	0.445	23%	0.227	S	C	.	.	H	α-helix	trans	-61.8	-43.1	177.5	-76	178.8	-81.7	159.4	-6	112.2	S429 H430 H431 A436 I437	S429-R433 WeakPolarHBondContact O-CG 3.32Å; S429-R433 PolarHBondContact O-N 3.37Å; S429-R433 VanDerWaalsContact O-N 3.17Å; S429-R433 PolarHBondContact O-NE 3.4Å; S429-R433 VanDerWaalsContact O-NE 3.08Å; S429-R433 PolarHBondContact OG-NE 3.27Å; S429-R433 PolarHBondContact OG-NH2 3.19Å; H430-R433 PolarHBondContact CE1-NH1 3.27Å; H430-R433 PolarHBondContact CE1-NH2 3.43Å; H430-R433 VanDerWaalsContact CE1-NH2 3.31Å; H430-R433 VanDerWaalsContact ND1-CZ 3.28Å; H430-R433 PolarHBondContact ND1-NH1 2.63Å; H430-R433 PolarHBondContact ND1-NH2 2.87Å; H430-R433 VanDerWaalsContact ND1-NH2 3.17Å; H430-R433 PolarHBondContact O-N 3.4Å; H431-R433 VanDerWaalsContact C-N 3.33Å; H431-R433 PolarHBondContact O-N 3.39Å; R433-A436 PolarHBondContact O-N 3.02Å; R433-I437 WeakPolarHBondContact O-CG1 3.44Å; R433-I437 PolarHBondContact O-N 3.16Å
434	S	91.2	Very high	91.5	Very high	13 Å²	13	46.7 Å²	46.7	9%	0.091	23%	0.227	C	C	.	.	H	α-helix	trans	-63.3	-44.1	176	-170.4	0	0	0	0	111.5	A389 C393 H430 H431 I432 A436 I437 C438	A389-S434 PolarHBondContact O-OG 3Å; C393-S434 PolarHBondContact SG-OG 2.72Å; H430-S434 WeakPolarHBondContact O-CB 3.33Å; H430-S434 PolarHBondContact O-N 3.36Å; H431-S434 PolarHBondContact O-N 2.91Å; I432-S434 PolarHBondContact O-N 2.96Å; S434-A436 VanDerWaalsContact C-N 3.34Å; S434-A436 PolarHBondContact O-N 3.46Å; S434-I437 PolarHBondContact O-N 2.8Å; S434-C438 PolarHBondContact O-N 2.94Å; S434-C438 PolarHBondContact O-SG 3.27Å; S434-C438 VanDerWaalsContact O-SG 3.37Å
435	M	92.1	Very high	91.5	Very high	12 Å²	12	47 Å²	47	6%	0.059	23%	0.228	C	C	.	.	H	α-helix	trans	-62	-40.4	176.1	-176.1	175.5	70	0	0	112	A100 T103 L104 C393 H431 I432 C438 V439	A100-M435 HydrophobicContact CB-CE 4.32Å; A100-M435 HydrophobicContact CB-CG 4.1Å; A100-M435 HydrophobicContact CB-SD 4.04Å; T103-M435 WeakPolarHBondContact OG1-CE 3.47Å; L104-M435 HydrophobicContact CD1-CE 4.28Å; L104-M435 HydrophobicContact CG-CE 4.39Å; C393-M435 PolarHBondContact SG-N 2.9Å; H431-M435 WeakPolarHBondContact O-CB 3.38Å; H431-M435 PolarHBondContact O-N 2.63Å; I432-M435 PolarHBondContact O-N 2.94Å; M435-C438 WeakPolarHBondContact O-CB 3.04Å; M435-C438 PolarHBondContact O-N 2.86Å; M435-V439 WeakPolarHBondContact O-CG2 3.41Å; M435-V439 PolarHBondContact O-N 3.48Å
436	A	93.7	Very high	91.4	Very high	59 Å²	59	49.1 Å²	49.1	49%	0.488	24%	0.238	S	C	.	.	H	α-helix	trans	-62	-43.8	174.8	0	0	0	0	0	112	I432 R433 S434 V439 F440	I432-A436 WeakPolarHBondContact O-CB 3.25Å; I432-A436 PolarHBondContact O-N 3.11Å; R433-A436 PolarHBondContact O-N 3.02Å; S434-A436 VanDerWaalsContact C-N 3.34Å; S434-A436 PolarHBondContact O-N 3.46Å; A436-V439 PolarHBondContact O-N 3.36Å; A436-F440 WeakPolarHBondContact O-CB 3.4Å; A436-F440 PolarHBondContact O-N 3.04Å
437	I	92.4	Very high	91.3	Very high	93 Å²	93	49.5 Å²	49.5	48%	0.477	24%	0.241	S	C	.	.	H	α-helix	trans	-62.4	-44	175.1	-66.1	165.3	0	0	0	110.6	R433 S434 V439 F440 L441	R433-I437 WeakPolarHBondContact O-CG1 3.44Å; R433-I437 PolarHBondContact O-N 3.16Å; S434-I437 PolarHBondContact O-N 2.8Å; I437-V439 PolarHBondContact O-N 2.8Å; I437-F440 PolarHBondContact O-N 3.47Å; I437-L441 HydrophobicContact CG2-CD1 3.84Å; I437-L441 HydrophobicContact CG2-CG 4.2Å; I437-L441 WeakPolarHBondContact O-CB 3.43Å; I437-L441 VanDerWaalsContact O-CG 3.31Å; I437-L441 WeakPolarHBondContact O-CG 3.39Å; I437-L441 PolarHBondContact O-N 3.36Å
438	C	92.9	Very high	91.1	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.014	22%	0.222	C	C	.	.	H	α-helix	trans	-56.4	-47.4	175.5	-75.4	0	0	0	0	112.4	L96 A389 S434 M435 G442	L96-C438 HydrophobicContact CD1-CB 4.5Å; A389-C438 VanDerWaalsContact C-SG 3.51Å; A389-C438 WeakPolarHBondContact CB-SG 3.24Å; S434-C438 PolarHBondContact O-N 2.94Å; S434-C438 PolarHBondContact O-SG 3.27Å; S434-C438 VanDerWaalsContact O-SG 3.37Å; M435-C438 WeakPolarHBondContact O-CB 3.04Å; M435-C438 PolarHBondContact O-N 2.86Å; C438-G442 PolarHBondContact O-N 3.11Å
439	V	93.6	Very high	90.8	Very high	24 Å²	24	44.1 Å²	44.1	15%	0.145	22%	0.221	C	C	.	.	H	α-helix	trans	-63.8	-45.7	179.2	172.1	0	0	0	0	110.6	L96 L97 A100 M435 A436 I437 G442 I443	L96-V439 HydrophobicContact CD1-CG2 4.37Å; L96-V439 HydrophobicContact CD2-CG2 4.19Å; L96-V439 HydrophobicContact CG-CG2 3.95Å; L97-V439 HydrophobicContact CD2-CG1 3.92Å; A100-V439 HydrophobicContact CB-CG2 3.68Å; M435-V439 WeakPolarHBondContact O-CG2 3.41Å; M435-V439 PolarHBondContact O-N 3.48Å; A436-V439 PolarHBondContact O-N 3.36Å; I437-V439 PolarHBondContact O-N 2.8Å; V439-G442 PolarHBondContact O-N 3.4Å; V439-I443 HydrophobicContact CG1-CD1 4.04Å; V439-I443 WeakPolarHBondContact O-CG1 3.48Å; V439-I443 PolarHBondContact O-N 2.81Å
440	F	94.7	Very high	90.5	Very high	129 Å²	129	45.9 Å²	45.9	57%	0.566	23%	0.228	S	C	*	.	H	α-helix	trans	-58.8	-51.3	178.4	175.5	-102.1	0	0	0	112.1	A436 I437 G442 I443 I444	A436-F440 WeakPolarHBondContact O-CB 3.4Å; A436-F440 PolarHBondContact O-N 3.04Å; I437-F440 PolarHBondContact O-N 3.47Å; F440-G442 VanDerWaalsContact C-N 3.28Å; F440-G442 PolarHBondContact O-N 3.48Å; F440-I443 PolarHBondContact O-N 3.28Å; F440-I444 HydrophobicContact CD1-CD1 3.95Å; F440-I444 HydrophobicContact CD2-CD1 4.43Å; F440-I444 HydrophobicContact CE1-CD1 3.37Å; F440-I444 HydrophobicContact CE2-CD1 3.92Å; F440-I444 HydrophobicContact CG-CD1 4.46Å; F440-I444 HydrophobicContact CZ-CD1 3.36Å; F440-I444 PolarHBondContact O-N 3.26Å; F440-I444 VanDerWaalsContact O-N 3.11Å
441	L	93.9	Very high	89.9	Confident	28 Å²	28	44.5 Å²	44.5	15%	0.147	22%	0.224	C	C	.	.	H	α-helix	trans	-63	-37.8	176.2	-64.5	177.5	0	0	0	111.4	M382 A385 M386 I437 I443 I444 K445	M382-L441 HydrophobicContact CE-CB 4.43Å; M382-L441 HydrophobicContact CE-CD2 3.57Å; M382-L441 HydrophobicContact CG-CB 4.44Å; M382-L441 HydrophobicContact CG-CD2 4.47Å; A385-L441 HydrophobicContact CB-CD1 3.99Å; M386-L441 HydrophobicContact CG-CB 3.64Å; M386-L441 HydrophobicContact CG-CD1 4.1Å; M386-L441 HydrophobicContact SD-CB 4.14Å; I437-L441 HydrophobicContact CG2-CD1 3.84Å; I437-L441 HydrophobicContact CG2-CG 4.2Å; I437-L441 WeakPolarHBondContact O-CB 3.43Å; I437-L441 VanDerWaalsContact O-CG 3.31Å; I437-L441 WeakPolarHBondContact O-CG 3.39Å; I437-L441 PolarHBondContact O-N 3.36Å; L441-I443 VanDerWaalsContact C-N 3.34Å; L441-I443 PolarHBondContact O-N 3.04Å; L441-I444 PolarHBondContact O-N 3.49Å; L441-K445 WeakPolarHBondContact O-CB 3.38Å; L441-K445 PolarHBondContact O-N 2.81Å
442	G	92	Very high	89.3	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.8	-39.7	177.2	0	0	0	0	0	113.3	Y89 C438 V439 F440	Y89-G442 VanDerWaalsContact OH-C 3.31Å; Y89-G442 VanDerWaalsContact OH-CA 3.23Å; Y89-G442 WeakPolarHBondContact OH-CA 3.23Å; Y89-G442 PolarHBondContact OH-O 3.1Å; C438-G442 PolarHBondContact O-N 3.11Å; V439-G442 PolarHBondContact O-N 3.4Å; F440-G442 VanDerWaalsContact C-N 3.28Å; F440-G442 PolarHBondContact O-N 3.48Å
443	I	93	Very high	88.7	Confident	84 Å²	84	47.2 Å²	47.2	43%	0.431	24%	0.239	S	C	.	.	H	α-helix	trans	-69.7	-44.6	175.1	-66.8	169.5	0	0	0	110.5	V439 F440 L441 K445 I446	V439-I443 HydrophobicContact CG1-CD1 4.04Å; V439-I443 WeakPolarHBondContact O-CG1 3.48Å; V439-I443 PolarHBondContact O-N 2.81Å; F440-I443 PolarHBondContact O-N 3.28Å; L441-I443 VanDerWaalsContact C-N 3.34Å; L441-I443 PolarHBondContact O-N 3.04Å; I443-K445 VanDerWaalsContact C-N 3.29Å; I443-K445 PolarHBondContact O-N 2.87Å; I443-I446 VanDerWaalsContact O-CB 3.26Å; I443-I446 WeakPolarHBondContact O-CB 3.4Å; I443-I446 VanDerWaalsContact O-CG1 3.29Å; I443-I446 WeakPolarHBondContact O-CG1 3.48Å; I443-I446 PolarHBondContact O-N 3.46Å; I443-I446 VanDerWaalsContact O-N 3.12Å
444	I	91.5	Very high	88	Confident	53 Å²	53	46.9 Å²	46.9	27%	0.272	24%	0.237	S	C	.	.	H	α-helix	trans	-62.8	-37.3	178.5	-66.4	174.3	0	0	0	111.5	M382 F440 L441 I446 F447	M382-I444 HydrophobicContact CE-CB 3.84Å; M382-I444 HydrophobicContact CE-CG2 3.52Å; M382-I444 HydrophobicContact SD-CB 4.46Å; M382-I444 HydrophobicContact SD-CG2 4.17Å; F440-I444 HydrophobicContact CD1-CD1 3.95Å; F440-I444 HydrophobicContact CD2-CD1 4.43Å; F440-I444 HydrophobicContact CE1-CD1 3.37Å; F440-I444 HydrophobicContact CE2-CD1 3.92Å; F440-I444 HydrophobicContact CG-CD1 4.46Å; F440-I444 HydrophobicContact CZ-CD1 3.36Å; F440-I444 PolarHBondContact O-N 3.26Å; F440-I444 VanDerWaalsContact O-N 3.11Å; L441-I444 PolarHBondContact O-N 3.49Å; I444-I446 PolarHBondContact O-N 3.33Å; I444-F447 HydrophobicContact CG2-CD2 4.3Å; I444-F447 WeakPolarHBondContact O-CB 3.42Å; I444-F447 VanDerWaalsContact O-CD2 3.28Å; I444-F447 WeakPolarHBondContact O-CD2 3.33Å; I444-F447 PolarHBondContact O-N 3.28Å
445	K	89.6	Confident	87.5	Confident	8 Å²	8	49.5 Å²	49.5	4%	0.035	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-19.2	177.6	174.5	172.2	171.1	175.5	0	113.2	Y89 M382 D383 M386 L441 I443 F447 K448 Y449	Y89-K445 HydrophobicContact CD2-CD 4.48Å; Y89-K445 HydrophobicContact CE1-CG 4.24Å; Y89-K445 HydrophobicContact CE2-CD 3.58Å; Y89-K445 VanDerWaalsContact CE2-CE 3.44Å; Y89-K445 HydrophobicContact CE2-CG 4.11Å; Y89-K445 WeakPolarHBondContact OH-CB 3.23Å; Y89-K445 WeakPolarHBondContact OH-CD 3.18Å; M382-K445 HydrophobicContact SD-CB 4Å; D383-K445 VanDerWaalsContact OD1-CD 3.24Å; D383-K445 WeakPolarHBondContact OD1-CD 3.36Å; D383-K445 WeakPolarHBondContact OD1-CE 3.36Å; D383-K445 IonicContact OD1-NZ 2.82Å; D383-K445 PolarHBondContact OD1-NZ 3.43Å; M386-K445 HydrophobicContact CE-CD 4.2Å; M386-K445 HydrophobicContact SD-CB 4.24Å; M386-K445 HydrophobicContact SD-CD 3.67Å; L441-K445 WeakPolarHBondContact O-CB 3.38Å; L441-K445 PolarHBondContact O-N 2.81Å; I443-K445 VanDerWaalsContact C-N 3.29Å; I443-K445 PolarHBondContact O-N 2.87Å; K445-F447 PolarHBondContact O-N 3.16Å; K445-K448 WeakPolarHBondContact O-CB 3.5Å; K445-K448 PolarHBondContact O-N 2.69Å; K445-Y449 HydrophobicContact CG-CE2 4.31Å
446	I	88.7	Confident	87.1	Confident	53 Å²	53	51.4 Å²	51.4	27%	0.272	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-35.6	171.3	-60.5	175	0	0	0	111.4	Y89 L93 I443 I444 K448 Y449 L450	Y89-I446 HydrophobicContact CE1-CG1 4.11Å; L93-I446 HydrophobicContact CD2-CD1 3.55Å; L93-I446 HydrophobicContact CD2-CG1 3.99Å; I443-I446 VanDerWaalsContact O-CB 3.26Å; I443-I446 WeakPolarHBondContact O-CB 3.4Å; I443-I446 VanDerWaalsContact O-CG1 3.29Å; I443-I446 WeakPolarHBondContact O-CG1 3.48Å; I443-I446 PolarHBondContact O-N 3.46Å; I443-I446 VanDerWaalsContact O-N 3.12Å; I444-I446 PolarHBondContact O-N 3.33Å; I446-K448 PolarHBondContact O-N 3.05Å; I446-K448 VanDerWaalsContact O-N 3.11Å; I446-Y449 PolarHBondContact O-N 2.93Å; I446-L450 HydrophobicContact CG2-CD1 4Å; I446-L450 HydrophobicContact CG2-CG 4.05Å; I446-L450 PolarHBondContact O-N 3.37Å
447	F	86.8	Confident	86.5	Confident	102 Å²	102	51 Å²	51	45%	0.447	26%	0.256	S	S	.	.	H	α-helix	trans	-57	-29.2	177.4	-73.9	-68.5	0	0	0	112.9	W379 I444 K445 Y449 L450 T451	W379-F447 HydrophobicContact CH2-CB 3.78Å; W379-F447 HydrophobicContact CZ3-CB 4.4Å; I444-F447 HydrophobicContact CG2-CD2 4.3Å; I444-F447 WeakPolarHBondContact O-CB 3.42Å; I444-F447 VanDerWaalsContact O-CD2 3.28Å; I444-F447 WeakPolarHBondContact O-CD2 3.33Å; I444-F447 PolarHBondContact O-N 3.28Å; K445-F447 PolarHBondContact O-N 3.16Å; F447-Y449 PolarHBondContact O-N 3.24Å; F447-L450 HydrophobicContact CD1-CD1 3.93Å; F447-L450 HydrophobicContact CE1-CD1 4.27Å; F447-L450 PolarHBondContact O-N 3.09Å; F447-T451 WeakPolarHBondContact O-CG2 3.33Å; F447-T451 PolarHBondContact O-N 2.92Å
448	K	84.9	Confident	86.1	Confident	7 Å²	7	48.2 Å²	48.2	3%	0.03	24%	0.241	C	C	.	.	H	α-helix	trans	-55.4	-35.5	174	-168.3	-178.5	-179.2	176.7	0	112.2	R67 W379 D383 K445 I446 T451	R67-K448 VanDerWaalsContact CZ-CG 3.5Å; R67-K448 PolarHBondContact NH1-O 3.01Å; W379-K448 HydrophobicContact CB-CD 4.12Å; W379-K448 HydrophobicContact CB-CG 4.44Å; W379-K448 HydrophobicContact CD2-CB 3.96Å; W379-K448 HydrophobicContact CD2-CD 4.34Å; W379-K448 HydrophobicContact CD2-CG 3.86Å; W379-K448 HydrophobicContact CE3-CB 3.66Å; W379-K448 HydrophobicContact CE3-CD 4.32Å; W379-K448 HydrophobicContact CE3-CG 4Å; W379-K448 HydrophobicContact CG-CD 4.27Å; W379-K448 HydrophobicContact CG-CG 4.06Å; W379-K448 HydrophobicContact CH2-CB 4.27Å; W379-K448 HydrophobicContact CZ3-CB 3.84Å; D383-K448 IonicContact OD2-NZ 2.74Å; D383-K448 PolarHBondContact OD2-NZ 3.23Å; K445-K448 WeakPolarHBondContact O-CB 3.5Å; K445-K448 PolarHBondContact O-N 2.69Å; I446-K448 PolarHBondContact O-N 3.05Å; I446-K448 VanDerWaalsContact O-N 3.11Å; K448-T451 PolarHBondContact O-OG1 3.46Å
449	Y	83.7	Confident	85.7	Confident	13 Å²	13	53 Å²	53	5%	0.051	27%	0.266	C	S	.	.	H	α-helix	trans	-94	-24	-177.5	-54.5	-76.6	0	0	0	112.5	E85 L86 Y89 K445 I446 F447 T451 I452	E85-Y449 HydrophobicContact CB-CE1 3.83Å; L86-Y449 HydrophobicContact CB-CD1 4.13Å; L86-Y449 HydrophobicContact CB-CG 4.27Å; L86-Y449 HydrophobicContact CD1-CD2 4.03Å; L86-Y449 HydrophobicContact CD1-CG 3.84Å; Y89-Y449 HydrophobicContact CD1-CD2 4.07Å; Y89-Y449 AromaticContact CD1-CE2 3.43Å; Y89-Y449 HydrophobicContact CD1-CE2 3.43Å; Y89-Y449 VanDerWaalsContact CD1-CE2 3.43Å; Y89-Y449 HydrophobicContact CD2-CE2 4.26Å; Y89-Y449 AromaticContact CE1-CE2 3.95Å; Y89-Y449 HydrophobicContact CE1-CE2 3.95Å; Y89-Y449 AromaticContact CG-CE2 3.62Å; Y89-Y449 HydrophobicContact CG-CE2 3.62Å; Y89-Y449 AromaticContact CG-CZ 3.93Å; K445-Y449 HydrophobicContact CG-CE2 4.31Å; I446-Y449 PolarHBondContact O-N 2.93Å; F447-Y449 PolarHBondContact O-N 3.24Å; Y449-T451 PolarHBondContact O-N 2.88Å; Y449-I452 WeakPolarHBondContact O-CD1 3.5Å; Y449-I452 VanDerWaalsContact O-CG1 3.24Å; Y449-I452 WeakPolarHBondContact O-CG1 3.35Å; Y449-I452 PolarHBondContact O-N 2.93Å
450	L	82.6	Confident	85.2	Confident	64 Å²	64	53.8 Å²	53.8	34%	0.335	27%	0.27	S	S	.	.	H	α-helix	trans	-70.5	-16.1	177	-69.2	177.3	0	0	0	113.4	I446 F447 I452 D453 L456	I446-L450 HydrophobicContact CG2-CD1 4Å; I446-L450 HydrophobicContact CG2-CG 4.05Å; I446-L450 PolarHBondContact O-N 3.37Å; F447-L450 HydrophobicContact CD1-CD1 3.93Å; F447-L450 HydrophobicContact CE1-CD1 4.27Å; F447-L450 PolarHBondContact O-N 3.09Å; L450-I452 PolarHBondContact O-N 3.09Å; L450-D453 PolarHBondContact O-N 2.87Å; L450-L456 HydrophobicContact CB-CB 4.35Å; L450-L456 HydrophobicContact CB-CD1 3.72Å; L450-L456 HydrophobicContact CD1-CD1 4.13Å; L450-L456 HydrophobicContact CD2-CD1 4.01Å; L450-L456 HydrophobicContact CG-CD1 4.15Å
451	T	78.9	Confident	84.8	Confident	29 Å²	29	50.8 Å²	50.8	18%	0.178	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-4.6	173.2	67.7	0	0	0	0	114.1	F447 K448 Y449 D453 T460	F447-T451 WeakPolarHBondContact O-CG2 3.33Å; F447-T451 PolarHBondContact O-N 2.92Å; K448-T451 PolarHBondContact O-OG1 3.46Å; Y449-T451 PolarHBondContact O-N 2.88Å; T451-D453 VanDerWaalsContact C-N 3.25Å; T451-T460 HydrophobicContact CG2-CG2 4.22Å
452	I	76	Confident	84.5	Confident	36 Å²	36	50 Å²	50	19%	0.185	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-32.5	169.1	-61.3	168.9	0	0	0	110.4	T82 Y449 L450 L573	T82-I452 WeakPolarHBondContact OG1-CD1 3.48Å; Y449-I452 WeakPolarHBondContact O-CD1 3.5Å; Y449-I452 VanDerWaalsContact O-CG1 3.24Å; Y449-I452 WeakPolarHBondContact O-CG1 3.35Å; Y449-I452 PolarHBondContact O-N 2.93Å; L450-I452 PolarHBondContact O-N 3.09Å; I452-L573 HydrophobicContact CG2-CB 4.3Å; I452-L573 HydrophobicContact CG2-CD1 3.57Å; I452-L573 HydrophobicContact CG2-CD2 3.9Å; I452-L573 HydrophobicContact CG2-CG 4.11Å
453	D	79.1	Confident	84.2	Confident	64 Å²	64	55.9 Å²	55.9	34%	0.342	28%	0.281	S	S	.	.	S	Bend	trans	-79.2	137	174.7	179.8	67.6	0	0	0	111.3	L450 T451 S455 L456 N457	L450-D453 PolarHBondContact O-N 2.87Å; T451-D453 VanDerWaalsContact C-N 3.25Å; D453-S455 PolarHBondContact O-N 3.37Å; D453-S455 WeakPolarHBondContact OD2-CA 3.11Å; D453-S455 WeakPolarHBondContact OD2-CB 2.9Å; D453-S455 PolarHBondContact OD2-N 3.2Å; D453-S455 PolarHBondContact OD2-OG 3.14Å; D453-L456 HydrophobicContact CB-CB 4.27Å; D453-L456 HydrophobicContact CB-CD1 4.18Å; D453-L456 HydrophobicContact CB-CG 4.29Å; D453-L456 PolarHBondContact O-N 2.97Å; D453-L456 PolarHBondContact OD2-N 3.35Å; D453-L456 VanDerWaalsContact OD2-N 3.1Å; D453-N457 WeakPolarHBondContact O-CB 3.43Å; D453-N457 PolarHBondContact O-N 3.31Å
454	R	77.4	Confident	83.9	Confident	111 Å²	111	55.6 Å²	55.6	42%	0.419	29%	0.286	S	S	.	.	H	α-helix	trans	-63	-40.9	-176.5	-173.5	179.5	-177.1	-177.9	3.9	111.9	Q458 L564	R454-Q458 PolarHBondContact O-N 3.06Å; R454-Q458 VanDerWaalsContact O-N 3.08Å; R454-L564 PolarHBondContact NH2-O 3.44Å
455	S	80.2	Confident	83.6	Confident	69 Å²	69	55.6 Å²	55.6	48%	0.483	29%	0.286	S	S	.	.	H	α-helix	trans	-71.7	-41	-177.2	75.2	0	0	0	0	111.8	D453 Q458 L459	D453-S455 PolarHBondContact O-N 3.37Å; D453-S455 WeakPolarHBondContact OD2-CA 3.11Å; D453-S455 WeakPolarHBondContact OD2-CB 2.9Å; D453-S455 PolarHBondContact OD2-N 3.2Å; D453-S455 PolarHBondContact OD2-OG 3.14Å; S455-Q458 VanDerWaalsContact O-CB 3.31Å; S455-Q458 WeakPolarHBondContact O-CB 3.42Å; S455-Q458 PolarHBondContact O-N 3.13Å; S455-L459 PolarHBondContact O-N 2.97Å
456	L	83	Confident	83.7	Confident	52 Å²	52	55.2 Å²	55.2	27%	0.272	29%	0.285	S	S	.	.	H	α-helix	trans	-73.5	-32.4	177.7	-61.3	176.4	0	0	0	112.1	L450 D453 Q458 L459 T460	L450-L456 HydrophobicContact CB-CB 4.35Å; L450-L456 HydrophobicContact CB-CD1 3.72Å; L450-L456 HydrophobicContact CD1-CD1 4.13Å; L450-L456 HydrophobicContact CD2-CD1 4.01Å; L450-L456 HydrophobicContact CG-CD1 4.15Å; D453-L456 HydrophobicContact CB-CB 4.27Å; D453-L456 HydrophobicContact CB-CD1 4.18Å; D453-L456 HydrophobicContact CB-CG 4.29Å; D453-L456 PolarHBondContact O-N 2.97Å; D453-L456 PolarHBondContact OD2-N 3.35Å; D453-L456 VanDerWaalsContact OD2-N 3.1Å; L456-Q458 VanDerWaalsContact C-N 3.31Å; L456-L459 HydrophobicContact CD2-CD1 4.17Å; L456-L459 PolarHBondContact O-N 3.25Å; L456-T460 PolarHBondContact O-N 3.11Å; L456-T460 VanDerWaalsContact O-N 3.14Å; L456-T460 PolarHBondContact O-OG1 3Å; L456-T460 VanDerWaalsContact O-OG1 3.07Å
457	N	81.9	Confident	83.8	Confident	50 Å²	50	55 Å²	55	27%	0.267	29%	0.291	S	S	.	.	H	α-helix	trans	-63.8	-37.6	170.9	-168.8	42.1	0	0	0	111.6	D453 L459 T460 R461	D453-N457 WeakPolarHBondContact O-CB 3.43Å; D453-N457 PolarHBondContact O-N 3.31Å; N457-L459 PolarHBondContact O-N 3.25Å; N457-T460 PolarHBondContact O-N 3.2Å; N457-R461 WeakPolarHBondContact O-CB 3.13Å; N457-R461 PolarHBondContact O-N 3.43Å
458	Q	82.8	Confident	83.9	Confident	35 Å²	35	58.5 Å²	58.5	16%	0.164	30%	0.302	C	S	.	.	H	α-helix	trans	-56.8	-50.1	173.5	-175.2	169.5	-2.1	0	0	111.9	R454 S455 L456 T460 R461 T462 L564	R454-Q458 PolarHBondContact O-N 3.06Å; R454-Q458 VanDerWaalsContact O-N 3.08Å; S455-Q458 VanDerWaalsContact O-CB 3.31Å; S455-Q458 WeakPolarHBondContact O-CB 3.42Å; S455-Q458 PolarHBondContact O-N 3.13Å; L456-Q458 VanDerWaalsContact C-N 3.31Å; Q458-T460 VanDerWaalsContact C-N 3.34Å; Q458-T460 PolarHBondContact O-N 3.28Å; Q458-R461 PolarHBondContact O-N 3.22Å; Q458-T462 PolarHBondContact O-N 3.44Å; Q458-T462 PolarHBondContact O-OG1 3.2Å; Q458-L564 HydrophobicContact CB-CD1 3.28Å; Q458-L564 HydrophobicContact CG-CD1 3.39Å
459	L	84.5	Confident	84.2	Confident	103 Å²	103	62.6 Å²	62.6	54%	0.539	32%	0.324	S	S	.	.	H	α-helix	trans	-58.3	-46.6	178.6	-66.1	173.5	0	0	0	111.9	S455 L456 N457 R461 T462 M463	S455-L459 PolarHBondContact O-N 2.97Å; L456-L459 HydrophobicContact CD2-CD1 4.17Å; L456-L459 PolarHBondContact O-N 3.25Å; N457-L459 PolarHBondContact O-N 3.25Å; L459-R461 PolarHBondContact O-N 3.15Å; L459-T462 PolarHBondContact O-N 3Å; L459-M463 WeakPolarHBondContact O-CG 3.33Å; L459-M463 PolarHBondContact O-N 3.4Å; L459-M463 VanDerWaalsContact O-N 3.15Å
460	T	84.7	Confident	84.6	Confident	40 Å²	40	63.5 Å²	63.5	25%	0.245	33%	0.33	C	S	.	.	H	α-helix	trans	-64.3	-41.4	-179.5	-53.9	0	0	0	0	111.5	W379 T451 L456 N457 Q458 M463 S464	W379-T460 HydrophobicContact CZ2-CG2 4.23Å; T451-T460 HydrophobicContact CG2-CG2 4.22Å; L456-T460 PolarHBondContact O-N 3.11Å; L456-T460 VanDerWaalsContact O-N 3.14Å; L456-T460 PolarHBondContact O-OG1 3Å; L456-T460 VanDerWaalsContact O-OG1 3.07Å; N457-T460 PolarHBondContact O-N 3.2Å; Q458-T460 VanDerWaalsContact C-N 3.34Å; Q458-T460 PolarHBondContact O-N 3.28Å; T460-M463 PolarHBondContact O-N 3.3Å; T460-S464 PolarHBondContact O-N 3.06Å; T460-S464 VanDerWaalsContact O-N 3.1Å
461	R	84.5	Confident	85.1	Confident	66 Å²	66	65.3 Å²	65.3	25%	0.249	34%	0.339	C	S	.	.	H	α-helix	trans	-67	-41	177.7	-169.8	176.7	178.1	164.8	3.5	111.5	N457 Q458 L459 M463 S464 I465 T560 E563	N457-R461 WeakPolarHBondContact O-CB 3.13Å; N457-R461 PolarHBondContact O-N 3.43Å; Q458-R461 PolarHBondContact O-N 3.22Å; L459-R461 PolarHBondContact O-N 3.15Å; R461-M463 VanDerWaalsContact C-N 3.31Å; R461-M463 PolarHBondContact O-N 2.96Å; R461-S464 WeakPolarHBondContact O-CB 3.44Å; R461-S464 PolarHBondContact O-N 3.5Å; R461-S464 VanDerWaalsContact O-N 3.08Å; R461-I465 HydrophobicContact CG-CD1 4.33Å; R461-I465 WeakPolarHBondContact O-CG1 3.31Å; R461-I465 PolarHBondContact O-N 3.47Å; R461-T560 HydrophobicContact CB-CG2 4.23Å; R461-T560 HydrophobicContact CG-CG2 3.9Å; R461-E563 IonicContact CZ-OE2 2.88Å; R461-E563 IonicContact NE-OE2 2.62Å; R461-E563 PolarHBondContact NE-OE2 3.05Å; R461-E563 IonicContact NH1-OE2 3.59Å; R461-E563 IonicContact NH2-OE1 2.77Å; R461-E563 PolarHBondContact NH2-OE1 3.27Å; R461-E563 IonicContact NH2-OE2 3.3Å; R461-E563 PolarHBondContact NH2-OE2 3.38Å
462	T	87.9	Confident	85.6	Confident	10 Å²	10	65.8 Å²	65.8	6%	0.061	35%	0.35	C	S	.	.	H	α-helix	trans	-58.2	-46.9	177.6	-59.6	0	0	0	0	110.5	Q458 L459 S464 I465 A466 S556 T560	Q458-T462 PolarHBondContact O-N 3.44Å; Q458-T462 PolarHBondContact O-OG1 3.2Å; L459-T462 PolarHBondContact O-N 3Å; T462-S464 VanDerWaalsContact C-N 3.31Å; T462-S464 PolarHBondContact O-N 3.34Å; T462-I465 PolarHBondContact O-N 2.88Å; T462-A466 VanDerWaalsContact O-CB 3.28Å; T462-A466 WeakPolarHBondContact O-CB 3.18Å; T462-A466 PolarHBondContact O-N 3.23Å; T462-S556 VanDerWaalsContact CG2-OG 3.29Å; T462-S556 WeakPolarHBondContact CG2-OG 3.43Å; T462-T560 PolarHBondContact OG1-OG1 3.04Å
463	M	87.2	Confident	86.4	Confident	125 Å²	125	64.9 Å²	64.9	62%	0.616	34%	0.344	S	S	*	.	H	α-helix	trans	-60.5	-40.3	175.6	-67.3	-65.2	-177.9	0	0	112.3	L459 T460 R461 A467	L459-M463 WeakPolarHBondContact O-CG 3.33Å; L459-M463 PolarHBondContact O-N 3.4Å; L459-M463 VanDerWaalsContact O-N 3.15Å; T460-M463 PolarHBondContact O-N 3.3Å; R461-M463 VanDerWaalsContact C-N 3.31Å; R461-M463 PolarHBondContact O-N 2.96Å; M463-A467 VanDerWaalsContact O-CB 3.31Å; M463-A467 WeakPolarHBondContact O-CB 3.48Å; M463-A467 PolarHBondContact O-N 3.46Å
464	S	85.1	Confident	87	Confident	78 Å²	78	65.8 Å²	65.8	55%	0.545	35%	0.349	S	S	.	.	H	α-helix	trans	-67.8	-34.9	179.6	-173.7	0	0	0	0	113.6	T460 R461 T462	T460-S464 PolarHBondContact O-N 3.06Å; T460-S464 VanDerWaalsContact O-N 3.1Å; R461-S464 WeakPolarHBondContact O-CB 3.44Å; R461-S464 PolarHBondContact O-N 3.5Å; R461-S464 VanDerWaalsContact O-N 3.08Å; T462-S464 VanDerWaalsContact C-N 3.31Å; T462-S464 PolarHBondContact O-N 3.34Å
465	I	87.1	Confident	87.7	Confident	52 Å²	52	65.6 Å²	65.6	27%	0.267	36%	0.355	S	S	.	.	H	α-helix	trans	-74.9	-48.6	176.7	-64.1	-175.3	0	0	0	109.4	R461 T462 A467 T560 E563	R461-I465 HydrophobicContact CG-CD1 4.33Å; R461-I465 WeakPolarHBondContact O-CG1 3.31Å; R461-I465 PolarHBondContact O-N 3.47Å; T462-I465 PolarHBondContact O-N 2.88Å; I465-A467 PolarHBondContact O-N 2.83Å; I465-T560 HydrophobicContact CD1-CG2 3.52Å; I465-T560 HydrophobicContact CG1-CG2 4.27Å; I465-E563 WeakPolarHBondContact CD1-OE2 3.45Å
466	A	91.2	Very high	88.2	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.008	36%	0.356	C	S	.	.	H	α-helix	trans	-60.7	-29	179.3	0	0	0	0	0	113.1	T462 Y468 D469 L470	T462-A466 VanDerWaalsContact O-CB 3.28Å; T462-A466 WeakPolarHBondContact O-CB 3.18Å; T462-A466 PolarHBondContact O-N 3.23Å; A466-Y468 VanDerWaalsContact C-N 3.27Å; A466-Y468 PolarHBondContact O-N 3.12Å; A466-Y468 VanDerWaalsContact O-N 3.17Å; A466-D469 PolarHBondContact O-N 3.47Å; A466-L470 HydrophobicContact CB-CD1 4.03Å; A466-L470 HydrophobicContact CB-CG 4.29Å; A466-L470 VanDerWaalsContact O-CB 3.27Å; A466-L470 WeakPolarHBondContact O-CB 3.49Å; A466-L470 VanDerWaalsContact O-CG 3.22Å; A466-L470 WeakPolarHBondContact O-CG 3.38Å; A466-L470 PolarHBondContact O-N 3.28Å
467	A	89.7	Confident	88.6	Confident	48 Å²	48	66.2 Å²	66.2	40%	0.397	35%	0.35	S	S	.	.	H	α-helix	trans	-53.8	-38.6	-174	0	0	0	0	0	114	M463 I465 L471	M463-A467 VanDerWaalsContact O-CB 3.31Å; M463-A467 WeakPolarHBondContact O-CB 3.48Å; M463-A467 PolarHBondContact O-N 3.46Å; I465-A467 PolarHBondContact O-N 2.83Å; A467-L471 VanDerWaalsContact O-CB 3.25Å; A467-L471 WeakPolarHBondContact O-CB 3.4Å; A467-L471 PolarHBondContact O-N 3.44Å
468	Y	89.5	Confident	89.1	Confident	176 Å²	176	65.6 Å²	65.6	69%	0.69	35%	0.349	S	S	*	.	H	α-helix	trans	-72.3	-43.5	-179.6	-68.6	-74.5	0	0	0	112.2	A466 L471 G472	A466-Y468 VanDerWaalsContact C-N 3.27Å; A466-Y468 PolarHBondContact O-N 3.12Å; A466-Y468 VanDerWaalsContact O-N 3.17Å; Y468-L471 PolarHBondContact O-N 2.57Å; Y468-G472 PolarHBondContact O-N 3.24Å; Y468-G472 VanDerWaalsContact O-N 3.09Å
469	D	92.2	Very high	89.6	Confident	93 Å²	93	69.5 Å²	69.5	50%	0.497	37%	0.37	S	S	.	.	H	α-helix	trans	-68.4	-40.2	177.8	-62.4	-28.5	0	0	0	111.1	A466 L471 G472 F473 I552	A466-D469 PolarHBondContact O-N 3.47Å; D469-L471 VanDerWaalsContact C-N 3.34Å; D469-L471 PolarHBondContact O-N 3.34Å; D469-G472 PolarHBondContact O-N 3.26Å; D469-F473 PolarHBondContact O-N 3.35Å; D469-I552 HydrophobicContact CB-CG2 3.73Å
470	L	92.2	Very high	89.9	Confident	32 Å²	32	66.7 Å²	66.7	17%	0.168	36%	0.357	C	S	.	.	H	α-helix	trans	-63.1	-38.4	173.5	-72	-179	0	0	0	112.2	A466 F473 L474 F549 I552	A466-L470 HydrophobicContact CB-CD1 4.03Å; A466-L470 HydrophobicContact CB-CG 4.29Å; A466-L470 VanDerWaalsContact O-CB 3.27Å; A466-L470 WeakPolarHBondContact O-CB 3.49Å; A466-L470 VanDerWaalsContact O-CG 3.22Å; A466-L470 WeakPolarHBondContact O-CG 3.38Å; A466-L470 PolarHBondContact O-N 3.28Å; L470-F473 PolarHBondContact O-N 3.32Å; L470-L474 VanDerWaalsContact O-CB 3.24Å; L470-L474 WeakPolarHBondContact O-CB 3.36Å; L470-L474 PolarHBondContact O-N 2.84Å; L470-F549 HydrophobicContact CD1-CE2 4Å; L470-F549 HydrophobicContact CD1-CZ 4.33Å; L470-F549 HydrophobicContact CD2-CD2 3.42Å; L470-F549 VanDerWaalsContact CD2-CD2 3.42Å; L470-F549 HydrophobicContact CD2-CE2 3.36Å; L470-F549 HydrophobicContact CD2-CG 4.35Å; L470-F549 HydrophobicContact CD2-CZ 4.26Å; L470-F549 HydrophobicContact CG-CE2 4.25Å; L470-I552 HydrophobicContact CD2-CB 4.18Å; L470-I552 HydrophobicContact CD2-CD1 4.3Å; L470-I552 HydrophobicContact CD2-CG2 3.85Å; L470-I552 HydrophobicContact CG-CG2 4.13Å
471	L	91.1	Very high	90.3	Very high	102 Å²	102	65.6 Å²	65.6	53%	0.534	35%	0.348	S	S	.	.	H	α-helix	trans	-65.1	-41.5	175.6	-177.5	64.2	0	0	0	111.3	A467 Y468 D469 L474 I475	A467-L471 VanDerWaalsContact O-CB 3.25Å; A467-L471 WeakPolarHBondContact O-CB 3.4Å; A467-L471 PolarHBondContact O-N 3.44Å; Y468-L471 PolarHBondContact O-N 2.57Å; D469-L471 VanDerWaalsContact C-N 3.34Å; D469-L471 PolarHBondContact O-N 3.34Å; L471-L474 HydrophobicContact CD1-CD2 4.42Å; L471-L474 PolarHBondContact O-N 3.41Å; L471-I475 PolarHBondContact O-N 3.28Å
472	G	90.8	Very high	90.9	Very high	38 Å²	38	66.7 Å²	66.7	39%	0.392	36%	0.355	S	S	.	.	H	α-helix	trans	-61	-46	173.6	0	0	0	0	0	112.3	Y468 D469 I475	Y468-G472 PolarHBondContact O-N 3.24Å; Y468-G472 VanDerWaalsContact O-N 3.09Å; D469-G472 PolarHBondContact O-N 3.26Å; G472-I475 PolarHBondContact O-N 3.11Å
473	F	91.5	Very high	91.2	Very high	17 Å²	17	69.1 Å²	69.1	8%	0.075	38%	0.376	C	S	.	.	H	α-helix	trans	-64	-38.8	175.1	174.9	-112.5	0	0	0	112.9	D469 L470 I475 M476 F477 L545 M548 F549 I552	D469-F473 PolarHBondContact O-N 3.35Å; L470-F473 PolarHBondContact O-N 3.32Å; F473-I475 PolarHBondContact O-N 3.41Å; F473-M476 HydrophobicContact CD2-CE 4.02Å; F473-M476 WeakPolarHBondContact O-CB 3.45Å; F473-M476 PolarHBondContact O-N 3.33Å; F473-F477 PolarHBondContact O-N 3.21Å; F473-L545 HydrophobicContact CE2-CD2 3.99Å; F473-L545 HydrophobicContact CZ-CB 4.22Å; F473-L545 HydrophobicContact CZ-CD2 3.76Å; F473-L545 WeakPolarHBondContact CZ-O 3.48Å; F473-M548 HydrophobicContact CB-CE 4.4Å; F473-M548 HydrophobicContact CD2-CE 3.38Å; F473-M548 HydrophobicContact CD2-CG 3.93Å; F473-M548 HydrophobicContact CD2-SD 3.34Å; F473-M548 WeakPolarHBondContact CD2-SD 3.44Å; F473-M548 HydrophobicContact CE2-CB 3.94Å; F473-M548 HydrophobicContact CE2-CE 3.97Å; F473-M548 HydrophobicContact CE2-CG 3.7Å; F473-M548 HydrophobicContact CE2-SD 3.22Å; F473-M548 WeakPolarHBondContact CE2-SD 3.37Å; F473-M548 HydrophobicContact CG-CE 4.17Å; F473-M548 HydrophobicContact CG-SD 4.44Å; F473-M548 HydrophobicContact CZ-CB 4.08Å; F473-M548 HydrophobicContact CZ-CG 4.23Å; F473-M548 HydrophobicContact CZ-SD 4.27Å; F473-F549 HydrophobicContact CD1-CD2 4.37Å; F473-F549 HydrophobicContact CE1-CB 4.07Å; F473-F549 HydrophobicContact CE1-CD2 4.35Å; F473-I552 HydrophobicContact CB-CD1 3.78Å; F473-I552 HydrophobicContact CD1-CD1 4.41Å; F473-I552 HydrophobicContact CG-CD1 4.01Å
474	L	91.5	Very high	91.6	Very high	84 Å²	84	64.7 Å²	64.7	44%	0.44	35%	0.353	S	S	.	.	H	α-helix	trans	-58.2	-36.5	179.3	-178.7	65.3	0	0	0	111.8	L470 L471 F477 C478	L470-L474 VanDerWaalsContact O-CB 3.24Å; L470-L474 WeakPolarHBondContact O-CB 3.36Å; L470-L474 PolarHBondContact O-N 2.84Å; L471-L474 HydrophobicContact CD1-CD2 4.42Å; L471-L474 PolarHBondContact O-N 3.41Å; L474-F477 HydrophobicContact CD1-CD1 3.96Å; L474-F477 WeakPolarHBondContact O-CB 3.49Å; L474-F477 PolarHBondContact O-N 2.66Å; L474-C478 WeakPolarHBondContact O-CB 3.44Å; L474-C478 PolarHBondContact O-N 2.75Å; L474-C478 PolarHBondContact O-SG 3.3Å
475	I	93.1	Very high	92.1	Very high	106 Å²	106	61 Å²	61	54%	0.544	33%	0.327	S	S	.	.	H	α-helix	trans	-62.3	-47.2	175.9	-64.2	166.2	0	0	0	110.4	L471 G472 F473 F477 C478 I479	L471-I475 PolarHBondContact O-N 3.28Å; G472-I475 PolarHBondContact O-N 3.11Å; F473-I475 PolarHBondContact O-N 3.41Å; I475-F477 VanDerWaalsContact C-N 3.34Å; I475-F477 PolarHBondContact O-N 3.42Å; I475-C478 PolarHBondContact O-N 3.1Å; I475-I479 HydrophobicContact CG2-CD1 4.46Å; I475-I479 WeakPolarHBondContact O-CG1 3.5Å; I475-I479 PolarHBondContact O-N 2.83Å
476	M	90.5	Very high	92.5	Very high	102 Å²	102	62.3 Å²	62.3	50%	0.502	33%	0.332	S	S	.	.	H	α-helix	trans	-63.3	-41.9	177.1	-61.3	-166.2	-67.5	0	0	111.7	F473 I479 V480 M548	F473-M476 HydrophobicContact CD2-CE 4.02Å; F473-M476 WeakPolarHBondContact O-CB 3.45Å; F473-M476 PolarHBondContact O-N 3.33Å; M476-I479 PolarHBondContact O-N 3.11Å; M476-V480 PolarHBondContact O-N 3.22Å; M476-M548 HydrophobicContact CE-CE 3.81Å
477	F	91.1	Very high	92.7	Very high	32 Å²	32	66.1 Å²	66.1	14%	0.14	35%	0.352	C	S	.	.	H	α-helix	trans	-57.1	-50.8	173.9	167.9	-93.9	0	0	0	111.5	F473 L474 I475 I479 V480 Y481 M513 L545	F473-F477 PolarHBondContact O-N 3.21Å; L474-F477 HydrophobicContact CD1-CD1 3.96Å; L474-F477 WeakPolarHBondContact O-CB 3.49Å; L474-F477 PolarHBondContact O-N 2.66Å; I475-F477 VanDerWaalsContact C-N 3.34Å; I475-F477 PolarHBondContact O-N 3.42Å; F477-I479 VanDerWaalsContact C-N 3.28Å; F477-I479 PolarHBondContact O-N 3.02Å; F477-V480 PolarHBondContact O-N 2.96Å; F477-Y481 HydrophobicContact CE1-CD1 4.26Å; F477-Y481 HydrophobicContact CE1-CD2 4.25Å; F477-Y481 AromaticContact CE1-CG 3.9Å; F477-Y481 HydrophobicContact CE1-CG 3.9Å; F477-Y481 HydrophobicContact CE2-CD2 4.35Å; F477-Y481 HydrophobicContact CZ-CD1 4.49Å; F477-Y481 AromaticContact CZ-CD2 3.68Å; F477-Y481 HydrophobicContact CZ-CD2 3.68Å; F477-Y481 HydrophobicContact CZ-CE2 4.33Å; F477-Y481 AromaticContact CZ-CG 3.77Å; F477-Y481 HydrophobicContact CZ-CG 3.77Å; F477-Y481 WeakPolarHBondContact O-CB 3.42Å; F477-Y481 PolarHBondContact O-N 3.36Å; F477-M513 HydrophobicContact CE2-CE 3.57Å; F477-M513 HydrophobicContact CE2-SD 4.11Å; F477-M513 HydrophobicContact CZ-CE 3.68Å; F477-M513 HydrophobicContact CZ-SD 3.79Å; F477-L545 HydrophobicContact CD2-CB 4.49Å; F477-L545 HydrophobicContact CD2-CD1 3.49Å; F477-L545 VanDerWaalsContact CD2-CD1 3.49Å; F477-L545 HydrophobicContact CD2-CD2 4.2Å; F477-L545 HydrophobicContact CD2-CG 4.27Å; F477-L545 HydrophobicContact CE2-CD1 3.74Å
478	C	93.1	Very high	92.9	Very high	38 Å²	38	63.9 Å²	63.9	26%	0.257	33%	0.334	S	S	.	.	H	α-helix	trans	-60.3	-36.5	-177.8	-77.4	0	0	0	0	112.5	L474 I475 F482	L474-C478 WeakPolarHBondContact O-CB 3.44Å; L474-C478 PolarHBondContact O-N 2.75Å; L474-C478 PolarHBondContact O-SG 3.3Å; I475-C478 PolarHBondContact O-N 3.1Å; C478-F482 HydrophobicContact CB-CD2 4.04Å; C478-F482 HydrophobicContact CB-CE2 3.98Å; C478-F482 WeakPolarHBondContact O-CB 3.41Å; C478-F482 WeakPolarHBondContact O-CD2 3.4Å; C478-F482 WeakPolarHBondContact O-CG 3.42Å; C478-F482 PolarHBondContact O-N 3.05Å
479	I	92.7	Very high	93.1	Very high	117 Å²	117	59 Å²	59	60%	0.6	32%	0.315	S	S	*	.	H	α-helix	trans	-59.4	-51.1	177.5	-68	165.3	0	0	0	110.4	I475 M476 F477 A483	I475-I479 HydrophobicContact CG2-CD1 4.46Å; I475-I479 WeakPolarHBondContact O-CG1 3.5Å; I475-I479 PolarHBondContact O-N 2.83Å; M476-I479 PolarHBondContact O-N 3.11Å; F477-I479 VanDerWaalsContact C-N 3.28Å; F477-I479 PolarHBondContact O-N 3.02Å; I479-A483 WeakPolarHBondContact O-CB 3.33Å; I479-A483 PolarHBondContact O-N 2.88Å; I479-A483 VanDerWaalsContact O-N 3.11Å
480	V	91.9	Very high	93.3	Very high	44 Å²	44	60.2 Å²	60.2	27%	0.267	32%	0.32	S	S	.	.	H	α-helix	trans	-73.7	-40.7	-177.8	-175.4	0	0	0	0	111.2	M476 F477 F482 A483 F484 F540	M476-V480 PolarHBondContact O-N 3.22Å; F477-V480 PolarHBondContact O-N 2.96Å; V480-F482 PolarHBondContact O-N 3.12Å; V480-A483 WeakPolarHBondContact O-CB 3.32Å; V480-A483 PolarHBondContact O-N 3.17Å; V480-F484 HydrophobicContact CG1-CD2 3.74Å; V480-F484 HydrophobicContact CG1-CE2 3.63Å; V480-F484 WeakPolarHBondContact O-CD2 3.48Å; V480-F484 PolarHBondContact O-N 3.13Å; V480-F540 HydrophobicContact CB-CD1 4.39Å; V480-F540 HydrophobicContact CB-CE1 3.53Å; V480-F540 HydrophobicContact CB-CZ 3.87Å; V480-F540 HydrophobicContact CG1-CD1 3.57Å; V480-F540 HydrophobicContact CG1-CE1 3.13Å; V480-F540 HydrophobicContact CG1-CE2 4.22Å; V480-F540 HydrophobicContact CG1-CG 4.3Å; V480-F540 HydrophobicContact CG1-CZ 3.52Å; V480-F540 HydrophobicContact CG2-CE1 3.94Å; V480-F540 HydrophobicContact CG2-CZ 3.73Å
481	Y	93.3	Very high	93.3	Very high	16 Å²	16	60.5 Å²	60.5	6%	0.063	33%	0.327	C	S	.	.	H	α-helix	trans	-59.7	-46.6	178.3	177.3	-102.4	0	0	0	112.2	F477 A483 F484 A485 T506 L509 M513 F537	F477-Y481 HydrophobicContact CE1-CD1 4.26Å; F477-Y481 HydrophobicContact CE1-CD2 4.25Å; F477-Y481 AromaticContact CE1-CG 3.9Å; F477-Y481 HydrophobicContact CE1-CG 3.9Å; F477-Y481 HydrophobicContact CE2-CD2 4.35Å; F477-Y481 HydrophobicContact CZ-CD1 4.49Å; F477-Y481 AromaticContact CZ-CD2 3.68Å; F477-Y481 HydrophobicContact CZ-CD2 3.68Å; F477-Y481 HydrophobicContact CZ-CE2 4.33Å; F477-Y481 AromaticContact CZ-CG 3.77Å; F477-Y481 HydrophobicContact CZ-CG 3.77Å; F477-Y481 WeakPolarHBondContact O-CB 3.42Å; F477-Y481 PolarHBondContact O-N 3.36Å; Y481-A483 VanDerWaalsContact C-N 3.34Å; Y481-F484 PolarHBondContact O-N 2.92Å; Y481-A485 PolarHBondContact O-N 3.01Å; Y481-T506 HydrophobicContact CE1-CG2 3.76Å; Y481-T506 VanDerWaalsContact OH-CG2 3.25Å; Y481-T506 WeakPolarHBondContact OH-CG2 3.23Å; Y481-T506 PolarHBondContact OH-O 2.9Å; Y481-L509 HydrophobicContact CE2-CB 3.78Å; Y481-M513 HydrophobicContact CD2-SD 4.27Å; Y481-M513 HydrophobicContact CE2-SD 4Å; Y481-F537 HydrophobicContact CD2-CE2 4.41Å
482	F	95.3	Very high	93.4	Very high	90 Å²	90	55.8 Å²	55.8	40%	0.395	30%	0.302	S	S	.	.	H	α-helix	trans	-72.4	-26.4	176.7	-70.1	-52.6	0	0	0	113.2	C478 V480 A485 Q486 F502 T506	C478-F482 HydrophobicContact CB-CD2 4.04Å; C478-F482 HydrophobicContact CB-CE2 3.98Å; C478-F482 WeakPolarHBondContact O-CB 3.41Å; C478-F482 WeakPolarHBondContact O-CD2 3.4Å; C478-F482 WeakPolarHBondContact O-CG 3.42Å; C478-F482 PolarHBondContact O-N 3.05Å; V480-F482 PolarHBondContact O-N 3.12Å; F482-A485 HydrophobicContact CD1-CB 4.39Å; F482-A485 PolarHBondContact O-N 3.49Å; F482-Q486 WeakPolarHBondContact O-CB 3.42Å; F482-Q486 PolarHBondContact O-N 3.38Å; F482-F502 HydrophobicContact CD1-CE1 4.26Å; F482-F502 AromaticContact CD1-CZ 3.61Å; F482-F502 HydrophobicContact CD1-CZ 3.61Å; F482-F502 HydrophobicContact CE1-CE1 4.29Å; F482-F502 HydrophobicContact CE1-CZ 4.09Å; F482-F502 HydrophobicContact CG-CZ 4.44Å; F482-T506 HydrophobicContact CE1-CG2 4.5Å
483	A	95.4	Very high	93.4	Very high	61 Å²	61	55.7 Å²	55.7	50%	0.504	30%	0.296	S	S	.	.	H	α-helix	trans	-62.7	-44.3	169.2	0	0	0	0	0	111.3	I479 V480 Y481 Q486 L487	I479-A483 WeakPolarHBondContact O-CB 3.33Å; I479-A483 PolarHBondContact O-N 2.88Å; I479-A483 VanDerWaalsContact O-N 3.11Å; V480-A483 WeakPolarHBondContact O-CB 3.32Å; V480-A483 PolarHBondContact O-N 3.17Å; Y481-A483 VanDerWaalsContact C-N 3.34Å; A483-Q486 PolarHBondContact O-N 3.5Å; A483-L487 WeakPolarHBondContact O-CB 3.16Å; A483-L487 PolarHBondContact O-N 3.4Å
484	F	95	Very high	93.3	Very high	31 Å²	31	59.4 Å²	59.4	14%	0.136	33%	0.33	C	S	.	.	H	α-helix	trans	-67	-37.5	172.7	-82	-75.4	0	0	0	112.7	V480 Y481 L487 G488 L509 F533 F537 F540	V480-F484 HydrophobicContact CG1-CD2 3.74Å; V480-F484 HydrophobicContact CG1-CE2 3.63Å; V480-F484 WeakPolarHBondContact O-CD2 3.48Å; V480-F484 PolarHBondContact O-N 3.13Å; Y481-F484 PolarHBondContact O-N 2.92Å; F484-L487 HydrophobicContact CD1-CD2 4.48Å; F484-L487 PolarHBondContact O-N 3.36Å; F484-G488 PolarHBondContact O-N 2.84Å; F484-L509 HydrophobicContact CB-CD1 4.39Å; F484-F533 HydrophobicContact CB-CE2 4.48Å; F484-F533 HydrophobicContact CD1-CD2 4.21Å; F484-F533 AromaticContact CD1-CE2 3.86Å; F484-F533 HydrophobicContact CD1-CE2 3.86Å; F484-F537 HydrophobicContact CB-CD2 3.89Å; F484-F537 HydrophobicContact CB-CE2 4.23Å; F484-F537 HydrophobicContact CD1-CB 4.16Å; F484-F537 HydrophobicContact CD1-CD2 4.02Å; F484-F537 HydrophobicContact CD2-CD2 4.01Å; F484-F537 HydrophobicContact CE1-CB 4.15Å; F484-F537 AromaticContact CG-CD2 3.73Å; F484-F537 HydrophobicContact CG-CD2 3.73Å; F484-F537 HydrophobicContact CG-CE2 4.44Å; F484-F540 HydrophobicContact CE2-CB 4.35Å; F484-F540 HydrophobicContact CE2-CD1 4.3Å; F484-F540 HydrophobicContact CE2-CG 4.31Å
485	A	95.7	Very high	93.1	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-61.8	-44.3	175.4	0	0	0	0	0	111.6	Y481 F482 G488 Y489 F502 T505 L509	Y481-A485 PolarHBondContact O-N 3.01Å; F482-A485 HydrophobicContact CD1-CB 4.39Å; F482-A485 PolarHBondContact O-N 3.49Å; A485-G488 PolarHBondContact O-N 3.35Å; A485-Y489 VanDerWaalsContact O-CB 3.29Å; A485-Y489 WeakPolarHBondContact O-CB 3.14Å; A485-Y489 PolarHBondContact O-N 3.07Å; A485-F502 HydrophobicContact CB-CE2 3.92Å; A485-F502 HydrophobicContact CB-CZ 4.4Å; A485-T505 HydrophobicContact CB-CG2 4.41Å; A485-T505 WeakPolarHBondContact O-CG2 3.39Å; A485-L509 VanDerWaalsContact CA-CD1 3.43Å; A485-L509 HydrophobicContact CB-CD1 3.78Å
486	Q	95.9	Very high	92.9	Very high	80 Å²	80	60.7 Å²	60.7	37%	0.374	32%	0.323	S	S	.	.	H	α-helix	trans	-64.3	-44	175.7	-171.7	62.9	33.3	0	0	111.5	F482 A483 Y489 L490	F482-Q486 WeakPolarHBondContact O-CB 3.42Å; F482-Q486 PolarHBondContact O-N 3.38Å; A483-Q486 PolarHBondContact O-N 3.5Å; Q486-Y489 PolarHBondContact O-N 3.43Å; Q486-L490 HydrophobicContact CG-CD1 4.07Å; Q486-L490 HydrophobicContact CG-CG 4.49Å; Q486-L490 WeakPolarHBondContact O-CB 3.41Å; Q486-L490 WeakPolarHBondContact O-CG 3.48Å; Q486-L490 PolarHBondContact O-N 2.97Å
487	L	94.6	Very high	92.8	Very high	82 Å²	82	63 Å²	63	43%	0.429	34%	0.337	S	S	.	.	H	α-helix	trans	-59.4	-49	176.2	178.5	62	0	0	0	111.4	A483 F484 L490 A491 F533	A483-L487 WeakPolarHBondContact O-CB 3.16Å; A483-L487 PolarHBondContact O-N 3.4Å; F484-L487 HydrophobicContact CD1-CD2 4.48Å; F484-L487 PolarHBondContact O-N 3.36Å; L487-L490 PolarHBondContact O-N 2.95Å; L487-A491 WeakPolarHBondContact O-CB 3.25Å; L487-A491 PolarHBondContact O-N 2.76Å; L487-F533 HydrophobicContact CB-CE2 4.41Å; L487-F533 HydrophobicContact CD2-CD2 3.79Å; L487-F533 HydrophobicContact CD2-CE2 4.2Å; L487-F533 HydrophobicContact CG-CD2 4.06Å; L487-F533 HydrophobicContact CG-CE2 4.24Å
488	G	93.6	Very high	92.7	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-64.7	-40.4	-179.8	0	0	0	0	0	112.9	F484 A485 F492	F484-G488 PolarHBondContact O-N 2.84Å; A485-G488 PolarHBondContact O-N 3.35Å; G488-F492 WeakPolarHBondContact O-CB 3.37Å; G488-F492 WeakPolarHBondContact O-CD2 3.38Å; G488-F492 PolarHBondContact O-N 3.04Å
489	Y	95.5	Very high	92.7	Very high	75 Å²	75	61.3 Å²	61.3	29%	0.294	33%	0.331	S	S	.	.	H	α-helix	trans	-62.1	-51.5	175.6	173.7	-112.6	0	0	0	111.2	A485 Q486 A491 S493 Y499 S500	A485-Y489 VanDerWaalsContact O-CB 3.29Å; A485-Y489 WeakPolarHBondContact O-CB 3.14Å; A485-Y489 PolarHBondContact O-N 3.07Å; Q486-Y489 PolarHBondContact O-N 3.43Å; Y489-A491 VanDerWaalsContact C-N 3.34Å; Y489-A491 PolarHBondContact O-N 2.91Å; Y489-S493 WeakPolarHBondContact O-CB 3.4Å; Y489-S493 PolarHBondContact O-N 3.33Å; Y489-S493 PolarHBondContact O-OG 3.4Å; Y489-Y499 VanDerWaalsContact CD2-O 3.31Å; Y489-Y499 WeakPolarHBondContact CD2-O 3.46Å; Y489-S500 WeakPolarHBondContact CE2-O 3.41Å
490	L	94.7	Very high	92.6	Very high	118 Å²	118	58.1 Å²	58.1	62%	0.618	32%	0.318	S	S	*	.	H	α-helix	trans	-67.6	-34.8	-179	-66.7	178.1	0	0	0	112.6	Q486 L487	Q486-L490 HydrophobicContact CG-CD1 4.07Å; Q486-L490 HydrophobicContact CG-CG 4.49Å; Q486-L490 WeakPolarHBondContact O-CB 3.41Å; Q486-L490 WeakPolarHBondContact O-CG 3.48Å; Q486-L490 PolarHBondContact O-N 2.97Å; L487-L490 PolarHBondContact O-N 2.95Å
491	A	92.6	Very high	92.6	Very high	38 Å²	38	58.1 Å²	58.1	31%	0.314	32%	0.321	S	S	.	.	H	α-helix	trans	-77	-35.7	-178.1	0	0	0	0	0	113.4	L487 Y489 L529	L487-A491 WeakPolarHBondContact O-CB 3.25Å; L487-A491 PolarHBondContact O-N 2.76Å; Y489-A491 VanDerWaalsContact C-N 3.34Å; Y489-A491 PolarHBondContact O-N 2.91Å; A491-L529 HydrophobicContact CB-CD2 3.93Å
492	F	93.1	Very high	92.6	Very high	2 Å²	2	61.1 Å²	61.1	1%	0.009	33%	0.334	C	S	.	.	H	α-helix	trans	-124.3	-7.4	-166.2	-48.7	-59.4	0	0	0	115.7	G488 A494 R495 T496 Y499 I522 A525 H526 L529 F533	G488-F492 WeakPolarHBondContact O-CB 3.37Å; G488-F492 WeakPolarHBondContact O-CD2 3.38Å; G488-F492 PolarHBondContact O-N 3.04Å; F492-A494 VanDerWaalsContact C-N 3.34Å; F492-A494 PolarHBondContact O-N 2.93Å; F492-A494 VanDerWaalsContact O-N 3.16Å; F492-R495 PolarHBondContact O-N 2.84Å; F492-T496 WeakPolarHBondContact CB-OG1 3.24Å; F492-T496 PolarHBondContact O-N 3.48Å; F492-T496 VanDerWaalsContact O-N 3.09Å; F492-T496 PolarHBondContact O-OG1 3.46Å; F492-Y499 HydrophobicContact CB-CD1 4.45Å; F492-Y499 HydrophobicContact CB-CD2 4.25Å; F492-Y499 HydrophobicContact CB-CG 3.96Å; F492-Y499 HydrophobicContact CD2-CD1 4.23Å; F492-Y499 HydrophobicContact CD2-CE1 4.34Å; F492-Y499 HydrophobicContact CD2-CG 4.5Å; F492-I522 HydrophobicContact CZ-CG2 4.44Å; F492-A525 HydrophobicContact CD1-CB 3.68Å; F492-A525 HydrophobicContact CE1-CB 4.39Å; F492-A525 HydrophobicContact CG-CB 4.42Å; F492-H526 HydrophobicContact CE1-CB 4.24Å; F492-L529 HydrophobicContact CZ-CG 4.34Å; F492-F533 HydrophobicContact CE2-CB 4.15Å; F492-F533 AromaticContact CE2-CD1 3.64Å; F492-F533 HydrophobicContact CE2-CD1 3.64Å; F492-F533 HydrophobicContact CE2-CD2 4.34Å; F492-F533 HydrophobicContact CE2-CE1 4.07Å; F492-F533 AromaticContact CE2-CG 3.78Å; F492-F533 HydrophobicContact CE2-CG 3.78Å; F492-F533 HydrophobicContact CZ-CB 4.11Å; F492-F533 HydrophobicContact CZ-CD1 4.33Å; F492-F533 HydrophobicContact CZ-CG 4.26Å
493	S	91.1	Very high	92.5	Very high	37 Å²	37	60.6 Å²	60.6	26%	0.259	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-40.4	-172.4	50.7	0	0	0	0	116.3	Y489 R495 Y499	Y489-S493 WeakPolarHBondContact O-CB 3.4Å; Y489-S493 PolarHBondContact O-N 3.33Å; Y489-S493 PolarHBondContact O-OG 3.4Å; S493-R495 VanDerWaalsContact C-N 3.29Å; S493-R495 PolarHBondContact O-N 3.21Å; S493-Y499 WeakPolarHBondContact CA-O 3.05Å; S493-Y499 WeakPolarHBondContact CB-O 3.28Å
494	A	88.6	Confident	92.3	Very high	94 Å²	94	61.9 Å²	61.9	78%	0.777	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-13.1	-178.2	0	0	0	0	0	114.1	F492	F492-A494 VanDerWaalsContact C-N 3.34Å; F492-A494 PolarHBondContact O-N 2.93Å; F492-A494 VanDerWaalsContact O-N 3.16Å
495	R	88.6	Confident	92.3	Very high	204 Å²	204	60.4 Å²	60.4	77%	0.77	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.8	-24.1	-172	-61.4	-62.2	-172.3	177.9	0.3	113.4	F492 S493 A525	F492-R495 PolarHBondContact O-N 2.84Å; S493-R495 VanDerWaalsContact C-N 3.29Å; S493-R495 PolarHBondContact O-N 3.21Å; R495-A525 HydrophobicContact CB-CB 4.13Å
496	T	88.9	Confident	92.3	Very high	14 Å²	14	61.7 Å²	61.7	9%	0.086	34%	0.335	C	S	.	.			trans	-132.4	126.2	-175.2	49.7	0	0	0	0	111.5	F492 A498 Y499 S500 S521 A525	F492-T496 WeakPolarHBondContact CB-OG1 3.24Å; F492-T496 PolarHBondContact O-N 3.48Å; F492-T496 VanDerWaalsContact O-N 3.09Å; F492-T496 PolarHBondContact O-OG1 3.46Å; T496-A498 PolarHBondContact O-N 3.43Å; T496-Y499 CarbonylContact O-C 3.58Å; T496-Y499 PolarHBondContact O-N 3.42Å; T496-Y499 WeakPolarHBondContact OG1-CD2 3.35Å; T496-S500 PolarHBondContact O-N 3.26Å; T496-S521 WeakPolarHBondContact CG2-O 3.25Å; T496-A525 HydrophobicContact CG2-CB 3.92Å
497	L	87.3	Confident	92.2	Very high	149 Å²	149	64.4 Å²	64.4	78%	0.78	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-59.4	-36.3	-179	-176.5	63.9	0	0	0	112.4	Y499 S500	L497-Y499 PolarHBondContact O-N 3.5Å; L497-Y499 VanDerWaalsContact O-N 3.12Å; L497-S500 VanDerWaalsContact O-CB 3.28Å; L497-S500 WeakPolarHBondContact O-CB 3.29Å; L497-S500 PolarHBondContact O-N 3.01Å; L497-S500 VanDerWaalsContact O-N 3.11Å; L497-S500 PolarHBondContact O-OG 3.39Å
498	A	90.1	Very high	92.1	Very high	30 Å²	30	61.1 Å²	61.1	25%	0.248	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-57.3	-24.3	175.5	0	0	0	0	0	113.5	T496 Q504 T505 S508	T496-A498 PolarHBondContact O-N 3.43Å; A498-Q504 CarbonylContact O-C 3.56Å; A498-Q504 VanDerWaalsContact O-O 3.09Å; A498-T505 WeakPolarHBondContact O-CA 3.5Å; A498-T505 PolarHBondContact O-N 3.27Å; A498-S508 WeakPolarHBondContact CB-OG 3.41Å; A498-S508 PolarHBondContact O-OG 3.32Å
499	Y	92.7	Very high	92.1	Very high	6 Å²	6	61.1 Å²	61.1	2%	0.024	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-114.4	10.1	-178.9	-60.4	-96.8	0	0	0	112.8	Y489 F492 S493 T496 L497 S501 T505 I522 F533	Y489-Y499 VanDerWaalsContact CD2-O 3.31Å; Y489-Y499 WeakPolarHBondContact CD2-O 3.46Å; F492-Y499 HydrophobicContact CB-CD1 4.45Å; F492-Y499 HydrophobicContact CB-CD2 4.25Å; F492-Y499 HydrophobicContact CB-CG 3.96Å; F492-Y499 HydrophobicContact CD2-CD1 4.23Å; F492-Y499 HydrophobicContact CD2-CE1 4.34Å; F492-Y499 HydrophobicContact CD2-CG 4.5Å; S493-Y499 WeakPolarHBondContact CA-O 3.05Å; S493-Y499 WeakPolarHBondContact CB-O 3.28Å; T496-Y499 CarbonylContact O-C 3.58Å; T496-Y499 PolarHBondContact O-N 3.42Å; T496-Y499 WeakPolarHBondContact OG1-CD2 3.35Å; L497-Y499 PolarHBondContact O-N 3.5Å; L497-Y499 VanDerWaalsContact O-N 3.12Å; Y499-S501 VanDerWaalsContact C-N 3.31Å; Y499-S501 PolarHBondContact O-N 2.95Å; Y499-T505 WeakPolarHBondContact CA-OG1 3.27Å; Y499-T505 HydrophobicContact CD1-CG2 3.62Å; Y499-T505 HydrophobicContact CE1-CG2 4.08Å; Y499-T505 PolarHBondContact O-OG1 3Å; Y499-I522 HydrophobicContact CE2-CG1 4.1Å; Y499-I522 WeakPolarHBondContact OH-CD1 3.28Å; Y499-F533 HydrophobicContact CE1-CE1 4.2Å; Y499-F533 HydrophobicContact CE1-CZ 4.44Å
500	S	90.2	Very high	92	Very high	49 Å²	49	63.3 Å²	63.3	34%	0.343	34%	0.338	S	S	.	.	S	Bend	trans	-65.1	-28	-173	58	0	0	0	0	114.9	Y489 T496 L497	Y489-S500 WeakPolarHBondContact CE2-O 3.41Å; T496-S500 PolarHBondContact O-N 3.26Å; L497-S500 VanDerWaalsContact O-CB 3.28Å; L497-S500 WeakPolarHBondContact O-CB 3.29Å; L497-S500 PolarHBondContact O-N 3.01Å; L497-S500 VanDerWaalsContact O-N 3.11Å; L497-S500 PolarHBondContact O-OG 3.39Å
501	S	91.7	Very high	91.9	Very high	45 Å²	45	63.6 Å²	63.6	32%	0.315	33%	0.331	S	S	.	.	S	Bend	trans	-136.3	153	174.7	65.6	0	0	0	0	109.8	Y499 T503 Q504 T505	Y499-S501 VanDerWaalsContact C-N 3.31Å; Y499-S501 PolarHBondContact O-N 2.95Å; S501-T503 PolarHBondContact O-N 2.7Å; S501-Q504 PolarHBondContact O-N 3.1Å; S501-Q504 WeakPolarHBondContact OG-CB 3.25Å; S501-Q504 VanDerWaalsContact OG-CG 3.26Å; S501-Q504 WeakPolarHBondContact OG-CG 3.26Å; S501-Q504 PolarHBondContact OG-N 3.45Å; S501-T505 PolarHBondContact O-N 2.89Å; S501-T505 PolarHBondContact O-OG1 3.46Å; S501-T505 VanDerWaalsContact O-OG1 3.06Å
502	F	94.3	Very high	91.8	Very high	79 Å²	79	62 Å²	62	35%	0.346	32%	0.317	S	S	.	.	H	α-helix	trans	-53.6	-39.6	178.5	-178.6	-100.5	0	0	0	112.8	F482 A485 T505 T506	F482-F502 HydrophobicContact CD1-CE1 4.26Å; F482-F502 AromaticContact CD1-CZ 3.61Å; F482-F502 HydrophobicContact CD1-CZ 3.61Å; F482-F502 HydrophobicContact CE1-CE1 4.29Å; F482-F502 HydrophobicContact CE1-CZ 4.09Å; F482-F502 HydrophobicContact CG-CZ 4.44Å; A485-F502 HydrophobicContact CB-CE2 3.92Å; A485-F502 HydrophobicContact CB-CZ 4.4Å; F502-T505 PolarHBondContact O-N 3.44Å; F502-T506 WeakPolarHBondContact O-CB 3.47Å; F502-T506 PolarHBondContact O-N 2.9Å; F502-T506 PolarHBondContact O-OG1 2.87Å
503	T	92.7	Very high	91.6	Very high	78 Å²	78	63.4 Å²	63.4	48%	0.479	32%	0.324	S	S	.	.	H	α-helix	trans	-66.3	-44.7	176.7	-47.8	0	0	0	0	111.9	S501 T505 T506 Y507	S501-T503 PolarHBondContact O-N 2.7Å; T503-T505 VanDerWaalsContact C-N 3.35Å; T503-T506 WeakPolarHBondContact O-CB 3.5Å; T503-T506 PolarHBondContact O-N 2.94Å; T503-Y507 HydrophobicContact CG2-CD2 4.24Å; T503-Y507 HydrophobicContact CG2-CE2 3.62Å; T503-Y507 WeakPolarHBondContact O-CD2 3.19Å; T503-Y507 PolarHBondContact O-N 3.35Å
504	Q	92	Very high	91.5	Very high	89 Å²	89	66.9 Å²	66.9	42%	0.416	34%	0.344	S	S	.	.	H	α-helix	trans	-65.8	-37.9	175.9	-72.3	-65.1	-13.5	0	0	112	A498 S501 T506 Y507 S508	A498-Q504 CarbonylContact O-C 3.56Å; A498-Q504 VanDerWaalsContact O-O 3.09Å; S501-Q504 PolarHBondContact O-N 3.1Å; S501-Q504 WeakPolarHBondContact OG-CB 3.25Å; S501-Q504 VanDerWaalsContact OG-CG 3.26Å; S501-Q504 WeakPolarHBondContact OG-CG 3.26Å; S501-Q504 PolarHBondContact OG-N 3.45Å; Q504-T506 VanDerWaalsContact C-N 3.31Å; Q504-T506 PolarHBondContact O-N 3.41Å; Q504-Y507 PolarHBondContact O-N 2.99Å; Q504-S508 WeakPolarHBondContact O-CB 3.38Å; Q504-S508 PolarHBondContact O-N 2.88Å; Q504-S508 PolarHBondContact O-OG 3.46Å
505	T	94.7	Very high	91.4	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-59.9	-44	173	-57.5	0	0	0	0	110.9	A485 A498 Y499 S501 F502 T503 S508 L509	A485-T505 HydrophobicContact CB-CG2 4.41Å; A485-T505 WeakPolarHBondContact O-CG2 3.39Å; A498-T505 WeakPolarHBondContact O-CA 3.5Å; A498-T505 PolarHBondContact O-N 3.27Å; Y499-T505 WeakPolarHBondContact CA-OG1 3.27Å; Y499-T505 HydrophobicContact CD1-CG2 3.62Å; Y499-T505 HydrophobicContact CE1-CG2 4.08Å; Y499-T505 PolarHBondContact O-OG1 3Å; S501-T505 PolarHBondContact O-N 2.89Å; S501-T505 PolarHBondContact O-OG1 3.46Å; S501-T505 VanDerWaalsContact O-OG1 3.06Å; F502-T505 PolarHBondContact O-N 3.44Å; T503-T505 VanDerWaalsContact C-N 3.35Å; T505-S508 PolarHBondContact O-N 3.44Å; T505-L509 HydrophobicContact CG2-CD1 4.18Å; T505-L509 HydrophobicContact CG2-CG 4.43Å; T505-L509 WeakPolarHBondContact O-CG 3.33Å; T505-L509 PolarHBondContact O-N 3.23Å
506	T	94.7	Very high	91.5	Very high	27 Å²	27	58.7 Å²	58.7	17%	0.166	31%	0.313	C	S	.	.	H	α-helix	trans	-59.2	-50.7	176.7	-59.3	0	0	0	0	110.6	Y481 F482 F502 T503 Q504 S508 L509 F510	Y481-T506 HydrophobicContact CE1-CG2 3.76Å; Y481-T506 VanDerWaalsContact OH-CG2 3.25Å; Y481-T506 WeakPolarHBondContact OH-CG2 3.23Å; Y481-T506 PolarHBondContact OH-O 2.9Å; F482-T506 HydrophobicContact CE1-CG2 4.5Å; F502-T506 WeakPolarHBondContact O-CB 3.47Å; F502-T506 PolarHBondContact O-N 2.9Å; F502-T506 PolarHBondContact O-OG1 2.87Å; T503-T506 WeakPolarHBondContact O-CB 3.5Å; T503-T506 PolarHBondContact O-N 2.94Å; Q504-T506 VanDerWaalsContact C-N 3.31Å; Q504-T506 PolarHBondContact O-N 3.41Å; T506-S508 VanDerWaalsContact C-N 3.3Å; T506-S508 PolarHBondContact O-N 3.34Å; T506-L509 PolarHBondContact O-N 2.97Å; T506-F510 PolarHBondContact O-N 3.36Å
507	Y	94.5	Very high	91.4	Very high	137 Å²	137	61.2 Å²	61.2	54%	0.537	33%	0.325	S	S	.	.	H	α-helix	trans	-59.5	-40.4	175.6	-66.1	-42.1	0	0	0	113	T503 Q504 F510 R511	T503-Y507 HydrophobicContact CG2-CD2 4.24Å; T503-Y507 HydrophobicContact CG2-CE2 3.62Å; T503-Y507 WeakPolarHBondContact O-CD2 3.19Å; T503-Y507 PolarHBondContact O-N 3.35Å; Q504-Y507 PolarHBondContact O-N 2.99Å; Y507-F510 PolarHBondContact O-N 2.72Å; Y507-R511 WeakPolarHBondContact O-CG 3.48Å; Y507-R511 PolarHBondContact O-N 3.49Å
508	S	92.9	Very high	91.4	Very high	12 Å²	12	57.8 Å²	57.8	8%	0.084	31%	0.307	C	S	.	.	H	α-helix	trans	-65.6	-39.9	178.4	-60.1	0	0	0	0	112.1	A498 Q504 T505 T506 R511 I512	A498-S508 WeakPolarHBondContact CB-OG 3.41Å; A498-S508 PolarHBondContact O-OG 3.32Å; Q504-S508 WeakPolarHBondContact O-CB 3.38Å; Q504-S508 PolarHBondContact O-N 2.88Å; Q504-S508 PolarHBondContact O-OG 3.46Å; T505-S508 PolarHBondContact O-N 3.44Å; T506-S508 VanDerWaalsContact C-N 3.3Å; T506-S508 PolarHBondContact O-N 3.34Å; S508-R511 WeakPolarHBondContact O-CB 3.37Å; S508-R511 PolarHBondContact O-N 2.96Å; S508-I512 WeakPolarHBondContact O-CG1 3.39Å; S508-I512 PolarHBondContact O-N 2.88Å; S508-I512 VanDerWaalsContact O-N 3.11Å
509	L	93.5	Very high	91.3	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-66.9	-37.6	173.9	-70.1	175.5	0	0	0	112.1	Y481 F484 A485 T505 T506 I512 M513 F533 F537	Y481-L509 HydrophobicContact CE2-CB 3.78Å; F484-L509 HydrophobicContact CB-CD1 4.39Å; A485-L509 VanDerWaalsContact CA-CD1 3.43Å; A485-L509 HydrophobicContact CB-CD1 3.78Å; T505-L509 HydrophobicContact CG2-CD1 4.18Å; T505-L509 HydrophobicContact CG2-CG 4.43Å; T505-L509 WeakPolarHBondContact O-CG 3.33Å; T505-L509 PolarHBondContact O-N 3.23Å; T506-L509 PolarHBondContact O-N 2.97Å; L509-I512 HydrophobicContact CD2-CD1 4.3Å; L509-I512 PolarHBondContact O-N 3.36Å; L509-M513 WeakPolarHBondContact O-CG 3.35Å; L509-M513 PolarHBondContact O-N 3.32Å; L509-M513 VanDerWaalsContact O-N 3.1Å; L509-F533 HydrophobicContact CD2-CE1 4.21Å; L509-F533 HydrophobicContact CD2-CZ 3.82Å; L509-F537 HydrophobicContact CB-CE1 4.44Å; L509-F537 HydrophobicContact CB-CE2 4.4Å; L509-F537 HydrophobicContact CB-CZ 3.86Å; L509-F537 HydrophobicContact CD1-CE2 4.47Å; L509-F537 HydrophobicContact CD2-CD1 4.13Å; L509-F537 HydrophobicContact CD2-CD2 4.17Å; L509-F537 HydrophobicContact CD2-CE1 3.87Å; L509-F537 HydrophobicContact CD2-CE2 3.92Å; L509-F537 HydrophobicContact CD2-CG 4.27Å; L509-F537 HydrophobicContact CD2-CZ 3.75Å; L509-F537 HydrophobicContact CG-CE2 4.5Å; L509-F537 HydrophobicContact CG-CZ 4.29Å
510	F	92.7	Very high	91.2	Very high	121 Å²	121	63 Å²	63	53%	0.531	33%	0.332	S	S	.	.	H	α-helix	trans	-64.3	-40.2	174.1	-170.6	-98.4	0	0	0	111.9	T506 Y507 I512 M513 V514	T506-F510 PolarHBondContact O-N 3.36Å; Y507-F510 PolarHBondContact O-N 2.72Å; F510-I512 VanDerWaalsContact C-N 3.31Å; F510-I512 PolarHBondContact O-N 2.88Å; F510-M513 HydrophobicContact CD2-SD 4.4Å; F510-M513 WeakPolarHBondContact O-CB 3.36Å; F510-M513 PolarHBondContact O-N 3.33Å; F510-M513 VanDerWaalsContact O-N 3.1Å; F510-V514 HydrophobicContact CD1-CG2 4.43Å; F510-V514 HydrophobicContact CE1-CG2 4.06Å; F510-V514 HydrophobicContact CZ-CG2 4.45Å; F510-V514 PolarHBondContact O-N 2.97Å
511	R	92.5	Very high	91.1	Very high	124 Å²	124	62.4 Å²	62.4	47%	0.468	33%	0.328	S	S	.	.	H	α-helix	trans	-57.8	-42.9	172.9	-75.1	176.8	68.9	-160.9	-0.9	111.8	Y507 S508 M513 V514 G515 D516	Y507-R511 WeakPolarHBondContact O-CG 3.48Å; Y507-R511 PolarHBondContact O-N 3.49Å; S508-R511 WeakPolarHBondContact O-CB 3.37Å; S508-R511 PolarHBondContact O-N 2.96Å; R511-M513 VanDerWaalsContact C-N 3.31Å; R511-M513 PolarHBondContact O-N 3.4Å; R511-V514 PolarHBondContact O-N 2.93Å; R511-V514 VanDerWaalsContact O-N 3.15Å; R511-G515 PolarHBondContact O-N 2.79Å; R511-G515 VanDerWaalsContact O-N 3.16Å; R511-D516 CarbonylContact C-O 3.58Å; R511-D516 HydrophobicContact CB-CB 4.22Å; R511-D516 IonicContact CZ-OD2 3.57Å; R511-D516 IonicContact NE-OD2 2.71Å; R511-D516 PolarHBondContact NE-OD2 3.1Å; R511-D516 VanDerWaalsContact NH2-CG 3.3Å; R511-D516 IonicContact NH2-OD1 3.18Å; R511-D516 PolarHBondContact NH2-OD1 3.4Å; R511-D516 IonicContact NH2-OD2 3.22Å; R511-D516 PolarHBondContact NH2-OD2 3.03Å; R511-D516 PolarHBondContact O-N 3Å
512	I	91.6	Very high	91	Very high	5 Å²	5	60.4 Å²	60.4	3%	0.026	31%	0.314	C	S	.	.	H	α-helix	trans	-61.7	-38.7	175.5	-65.7	166.4	0	0	0	111.4	S508 L509 F510 V514 G515 D516 I517 F534 F537 V538	S508-I512 WeakPolarHBondContact O-CG1 3.39Å; S508-I512 PolarHBondContact O-N 2.88Å; S508-I512 VanDerWaalsContact O-N 3.11Å; L509-I512 HydrophobicContact CD2-CD1 4.3Å; L509-I512 PolarHBondContact O-N 3.36Å; F510-I512 VanDerWaalsContact C-N 3.31Å; F510-I512 PolarHBondContact O-N 2.88Å; I512-V514 VanDerWaalsContact C-N 3.27Å; I512-V514 PolarHBondContact O-N 3.41Å; I512-G515 PolarHBondContact O-N 2.94Å; I512-D516 PolarHBondContact N-O 3.24Å; I512-I517 HydrophobicContact CG1-CG1 4.48Å; I512-I517 HydrophobicContact CG2-CG1 4.25Å; I512-F534 HydrophobicContact CG2-CE2 4.32Å; I512-F537 HydrophobicContact CB-CD1 4.44Å; I512-F537 HydrophobicContact CB-CE1 3.9Å; I512-F537 HydrophobicContact CG2-CD1 3.74Å; I512-F537 HydrophobicContact CG2-CE1 3.58Å; I512-V538 HydrophobicContact CG2-CG2 4.16Å
513	M	87.8	Confident	90.9	Very high	32 Å²	32	60.2 Å²	60.2	16%	0.158	32%	0.316	C	S	.	.	H	α-helix	trans	-62.7	-33.1	176.6	-63.2	179.6	64	0	0	112.9	F477 Y481 L509 F510 R511 G515 F537 V541	F477-M513 HydrophobicContact CE2-CE 3.57Å; F477-M513 HydrophobicContact CE2-SD 4.11Å; F477-M513 HydrophobicContact CZ-CE 3.68Å; F477-M513 HydrophobicContact CZ-SD 3.79Å; Y481-M513 HydrophobicContact CD2-SD 4.27Å; Y481-M513 HydrophobicContact CE2-SD 4Å; L509-M513 WeakPolarHBondContact O-CG 3.35Å; L509-M513 PolarHBondContact O-N 3.32Å; L509-M513 VanDerWaalsContact O-N 3.1Å; F510-M513 HydrophobicContact CD2-SD 4.4Å; F510-M513 WeakPolarHBondContact O-CB 3.36Å; F510-M513 PolarHBondContact O-N 3.33Å; F510-M513 VanDerWaalsContact O-N 3.1Å; R511-M513 VanDerWaalsContact C-N 3.31Å; R511-M513 PolarHBondContact O-N 3.4Å; M513-G515 VanDerWaalsContact C-N 3.27Å; M513-F537 HydrophobicContact CG-CE1 4.39Å; M513-F537 HydrophobicContact CG-CZ 4.07Å; M513-V541 HydrophobicContact CB-CG1 4.14Å; M513-V541 HydrophobicContact CE-CG1 4.11Å; M513-V541 HydrophobicContact CG-CG1 3.72Å; M513-V541 HydrophobicContact CG-CG2 4.12Å
514	V	89.4	Confident	90.8	Very high	110 Å²	110	65.3 Å²	65.3	67%	0.667	33%	0.332	S	S	*	.	H	α-helix	trans	-80.2	-10.6	176	-179.2	0	0	0	0	111.9	F510 R511 I512	F510-V514 HydrophobicContact CD1-CG2 4.43Å; F510-V514 HydrophobicContact CE1-CG2 4.06Å; F510-V514 HydrophobicContact CZ-CG2 4.45Å; F510-V514 PolarHBondContact O-N 2.97Å; R511-V514 PolarHBondContact O-N 2.93Å; R511-V514 VanDerWaalsContact O-N 3.15Å; I512-V514 VanDerWaalsContact C-N 3.27Å; I512-V514 PolarHBondContact O-N 3.41Å
515	G	87.6	Confident	90.7	Very high	45 Å²	45	62.2 Å²	62.2	46%	0.464	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.7	5.9	178.6	0	0	0	0	0	115	R511 I512 M513 I517	R511-G515 PolarHBondContact O-N 2.79Å; R511-G515 VanDerWaalsContact O-N 3.16Å; I512-G515 PolarHBondContact O-N 2.94Å; M513-G515 VanDerWaalsContact C-N 3.27Å; G515-I517 PolarHBondContact O-N 3.37Å
516	D	89.5	Confident	90.5	Very high	80 Å²	80	66.1 Å²	66.1	43%	0.428	34%	0.339	S	S	.	.			trans	-89.8	101.8	175.6	179.8	11.2	0	0	0	110.3	R511 I512	R511-D516 CarbonylContact C-O 3.58Å; R511-D516 HydrophobicContact CB-CB 4.22Å; R511-D516 IonicContact CZ-OD2 3.57Å; R511-D516 IonicContact NE-OD2 2.71Å; R511-D516 PolarHBondContact NE-OD2 3.1Å; R511-D516 VanDerWaalsContact NH2-CG 3.3Å; R511-D516 IonicContact NH2-OD1 3.18Å; R511-D516 PolarHBondContact NH2-OD1 3.4Å; R511-D516 IonicContact NH2-OD2 3.22Å; R511-D516 PolarHBondContact NH2-OD2 3.03Å; R511-D516 PolarHBondContact O-N 3Å; I512-D516 PolarHBondContact N-O 3.24Å
517	I	86.1	Confident	90.3	Very high	68 Å²	68	69.3 Å²	69.3	35%	0.349	36%	0.36	S	S	.	.			trans	-121.1	113	-164.6	-57.6	173.8	0	0	0	110.9	I512 G515 F519 F534	I512-I517 HydrophobicContact CG1-CG1 4.48Å; I512-I517 HydrophobicContact CG2-CG1 4.25Å; G515-I517 PolarHBondContact O-N 3.37Å; I517-F519 HydrophobicContact CG2-CB 4.02Å; I517-F519 PolarHBondContact O-N 3.48Å; I517-F534 HydrophobicContact CB-CE2 4.35Å; I517-F534 HydrophobicContact CD1-CE2 3.96Å; I517-F534 HydrophobicContact CD1-CZ 3.81Å; I517-F534 HydrophobicContact CG1-CE2 4.23Å; I517-F534 HydrophobicContact CG1-CZ 4.49Å; I517-F534 HydrophobicContact CG2-CD2 4.19Å; I517-F534 HydrophobicContact CG2-CE2 3.25Å; I517-F534 HydrophobicContact CG2-CZ 3.54Å
518	D	87.6	Confident	90.2	Very high	77 Å²	77	67.1 Å²	67.1	41%	0.412	36%	0.361	S	S	.	.			trans	-94.3	67.3	168.7	-174.4	13.6	0	0	0	111.3	P520 S521	D518-P520 VanDerWaalsContact C-CD 3.44Å; D518-P520 WeakPolarHBondContact OD1-CD 3.23Å; D518-S521 PolarHBondContact O-N 3.43Å; D518-S521 PolarHBondContact OD1-N 3.2Å; D518-S521 PolarHBondContact OD1-OG 3.32Å; D518-S521 WeakPolarHBondContact OD2-CB 3.34Å; D518-S521 PolarHBondContact OD2-OG 3.28Å
519	F	89.2	Confident	90.2	Very high	68 Å²	68	69.9 Å²	69.9	30%	0.298	38%	0.375	S	S	.	.	H	α-helix	trans	-60.2	-38.9	177.8	-174.9	-107.8	0	0	0	113.9	I517 S521 I522 L523 P531 F534	I517-F519 HydrophobicContact CG2-CB 4.02Å; I517-F519 PolarHBondContact O-N 3.48Å; F519-S521 VanDerWaalsContact C-N 3.28Å; F519-S521 PolarHBondContact O-N 3.09Å; F519-I522 PolarHBondContact O-N 3.48Å; F519-I522 VanDerWaalsContact O-N 3.12Å; F519-L523 HydrophobicContact CE1-CB 4.38Å; F519-L523 HydrophobicContact CE1-CD2 4.33Å; F519-L523 PolarHBondContact O-N 2.94Å; F519-P531 HydrophobicContact CE2-CB 4.32Å; F519-P531 HydrophobicContact CE2-CG 4.33Å; F519-P531 HydrophobicContact CZ-CB 4.16Å; F519-P531 HydrophobicContact CZ-CG 3.95Å; F519-F534 HydrophobicContact CD2-CB 4.23Å; F519-F534 AromaticContact CD2-CD1 3.57Å; F519-F534 HydrophobicContact CD2-CD1 3.57Å; F519-F534 HydrophobicContact CD2-CD2 4.33Å; F519-F534 AromaticContact CD2-CE1 3.97Å; F519-F534 HydrophobicContact CD2-CE1 3.97Å; F519-F534 AromaticContact CD2-CG 3.76Å; F519-F534 HydrophobicContact CD2-CG 3.76Å; F519-F534 HydrophobicContact CE2-CB 4.15Å; F519-F534 AromaticContact CE2-CD1 3.63Å; F519-F534 HydrophobicContact CE2-CD1 3.63Å; F519-F534 HydrophobicContact CE2-CE1 4.3Å; F519-F534 AromaticContact CE2-CG 4Å; F519-F534 HydrophobicContact CE2-CG 4Å
520	P	90.6	Very high	90.2	Very high	76 Å²	76	69.9 Å²	69.9	49%	0.494	38%	0.375	S	S	.	.	H	α-helix	trans	-56.7	-39	178.8	-27.6	36.4	0	0	0	113.7	D518 L523 K524	D518-P520 VanDerWaalsContact C-CD 3.44Å; D518-P520 WeakPolarHBondContact OD1-CD 3.23Å; P520-L523 PolarHBondContact O-N 2.83Å; P520-K524 WeakPolarHBondContact O-CB 3.31Å; P520-K524 WeakPolarHBondContact O-CG 3.32Å; P520-K524 PolarHBondContact O-N 3.16Å
521	S	88.4	Confident	90.2	Very high	37 Å²	37	65.6 Å²	65.6	26%	0.259	36%	0.359	S	S	.	.	H	α-helix	trans	-65.8	-38.7	177.5	-68.6	0	0	0	0	112.6	T496 D518 F519 A525	T496-S521 WeakPolarHBondContact CG2-O 3.25Å; D518-S521 PolarHBondContact O-N 3.43Å; D518-S521 PolarHBondContact OD1-N 3.2Å; D518-S521 PolarHBondContact OD1-OG 3.32Å; D518-S521 WeakPolarHBondContact OD2-CB 3.34Å; D518-S521 PolarHBondContact OD2-OG 3.28Å; F519-S521 VanDerWaalsContact C-N 3.28Å; F519-S521 PolarHBondContact O-N 3.09Å; S521-A525 PolarHBondContact O-N 3.15Å; S521-A525 VanDerWaalsContact O-N 3.15Å
522	I	89.2	Confident	90.3	Very high	3 Å²	3	64.2 Å²	64.2	2%	0.015	36%	0.36	C	S	.	.	H	α-helix	trans	-67.8	-42.5	177.2	-61.7	168.9	0	0	0	110.6	F492 Y499 F519 A525 H526 G530 F534	F492-I522 HydrophobicContact CZ-CG2 4.44Å; Y499-I522 HydrophobicContact CE2-CG1 4.1Å; Y499-I522 WeakPolarHBondContact OH-CD1 3.28Å; F519-I522 PolarHBondContact O-N 3.48Å; F519-I522 VanDerWaalsContact O-N 3.12Å; I522-A525 WeakPolarHBondContact O-CB 3.35Å; I522-A525 PolarHBondContact O-N 2.94Å; I522-H526 PolarHBondContact O-N 3.2Å; I522-G530 WeakPolarHBondContact CG2-O 3.36Å; I522-F534 HydrophobicContact CD1-CD2 4.34Å
523	L	91.5	Very high	90.5	Very high	76 Å²	76	64.1 Å²	64.1	40%	0.398	36%	0.359	S	S	.	.	H	α-helix	trans	-64.6	-41.3	178.4	-175.2	67.8	0	0	0	112	F519 P520 A525 H526 P531	F519-L523 HydrophobicContact CE1-CB 4.38Å; F519-L523 HydrophobicContact CE1-CD2 4.33Å; F519-L523 PolarHBondContact O-N 2.94Å; P520-L523 PolarHBondContact O-N 2.83Å; L523-A525 VanDerWaalsContact C-N 3.27Å; L523-A525 PolarHBondContact O-N 3.17Å; L523-H526 CarbonylContact O-C 3.54Å; L523-P531 HydrophobicContact CD1-CG 3.62Å
524	K	90.1	Very high	90.7	Very high	185 Å²	185	64.1 Å²	64.1	80%	0.804	36%	0.359	S	S	*	.	H	α-helix	trans	-64.3	-31.4	174.9	-75.3	178.8	-176.1	178.8	0	112.6	P520	P520-K524 WeakPolarHBondContact O-CB 3.31Å; P520-K524 WeakPolarHBondContact O-CG 3.32Å; P520-K524 PolarHBondContact O-N 3.16Å
525	A	89.8	Confident	90.8	Very high	23 Å²	23	63.2 Å²	63.2	19%	0.19	35%	0.353	C	S	.	.	H	α-helix	trans	-69.2	-47.2	179.1	0	0	0	0	0	111.9	F492 R495 T496 S521 I522 L523	F492-A525 HydrophobicContact CD1-CB 3.68Å; F492-A525 HydrophobicContact CE1-CB 4.39Å; F492-A525 HydrophobicContact CG-CB 4.42Å; R495-A525 HydrophobicContact CB-CB 4.13Å; T496-A525 HydrophobicContact CG2-CB 3.92Å; S521-A525 PolarHBondContact O-N 3.15Å; S521-A525 VanDerWaalsContact O-N 3.15Å; I522-A525 WeakPolarHBondContact O-CB 3.35Å; I522-A525 PolarHBondContact O-N 2.94Å; L523-A525 VanDerWaalsContact C-N 3.27Å; L523-A525 PolarHBondContact O-N 3.17Å
526	H	91.2	Very high	91.1	Very high	82 Å²	82	64 Å²	64	38%	0.38	35%	0.349	S	S	.	.			trans	-154.6	123.7	173	-168.7	-66.7	0	0	0	111.6	F492 I522 L523 V528 L529 G530	F492-H526 HydrophobicContact CE1-CB 4.24Å; I522-H526 PolarHBondContact O-N 3.2Å; L523-H526 CarbonylContact O-C 3.54Å; H526-V528 VanDerWaalsContact C-N 3.34Å; H526-V528 PolarHBondContact ND1-N 2.97Å; H526-V528 VanDerWaalsContact ND1-N 3.13Å; H526-V528 PolarHBondContact O-N 2.96Å; H526-L529 HydrophobicContact CB-CB 4.15Å; H526-L529 WeakPolarHBondContact ND1-CB 3.29Å; H526-L529 PolarHBondContact ND1-N 3.31Å; H526-G530 WeakPolarHBondContact O-CA 3.28Å; H526-G530 PolarHBondContact O-N 3.1Å
527	P	90.2	Very high	91.2	Very high	94 Å²	94	60.2 Å²	60.2	61%	0.61	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-29	-170.6	24.8	-34.6	0	0	0	114.6	P531	P527-P531 VanDerWaalsContact O-CD 3.28Å; P527-P531 WeakPolarHBondContact O-CD 3.31Å; P527-P531 VanDerWaalsContact O-CG 3.31Å; P527-P531 WeakPolarHBondContact O-CG 3.46Å
528	V	92.9	Very high	91.5	Very high	91 Å²	91	58.4 Å²	58.4	55%	0.552	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-58.9	179.5	-177.7	0	0	0	0	112.7	H526 G530 P531 I532	H526-V528 VanDerWaalsContact C-N 3.34Å; H526-V528 PolarHBondContact ND1-N 2.97Å; H526-V528 VanDerWaalsContact ND1-N 3.13Å; H526-V528 PolarHBondContact O-N 2.96Å; V528-G530 VanDerWaalsContact C-N 3.28Å; V528-G530 PolarHBondContact O-N 3.08Å; V528-P531 WeakPolarHBondContact O-CD 3.46Å; V528-I532 HydrophobicContact CG1-CD1 3.72Å; V528-I532 WeakPolarHBondContact O-CG1 3.44Å; V528-I532 PolarHBondContact O-N 3.07Å
529	L	92.9	Very high	91.6	Very high	71 Å²	71	60.6 Å²	60.6	37%	0.372	33%	0.327	S	S	.	.	H	α-helix	trans	-58.5	-36.6	179.8	-174.6	64.7	0	0	0	113.2	A491 F492 H526 I532 F533	A491-L529 HydrophobicContact CB-CD2 3.93Å; F492-L529 HydrophobicContact CZ-CG 4.34Å; H526-L529 HydrophobicContact CB-CB 4.15Å; H526-L529 WeakPolarHBondContact ND1-CB 3.29Å; H526-L529 PolarHBondContact ND1-N 3.31Å; L529-I532 PolarHBondContact O-N 3.26Å; L529-F533 VanDerWaalsContact O-CB 3.25Å; L529-F533 WeakPolarHBondContact O-CB 3.43Å; L529-F533 PolarHBondContact O-N 3.39Å
530	G	93	Very high	91.6	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-59.1	-58.9	179.2	0	0	0	0	0	112.8	I522 H526 V528 I532 F533 F534	I522-G530 WeakPolarHBondContact CG2-O 3.36Å; H526-G530 WeakPolarHBondContact O-CA 3.28Å; H526-G530 PolarHBondContact O-N 3.1Å; V528-G530 VanDerWaalsContact C-N 3.28Å; V528-G530 PolarHBondContact O-N 3.08Å; G530-I532 VanDerWaalsContact C-N 3.34Å; G530-I532 PolarHBondContact O-N 3.45Å; G530-F533 PolarHBondContact O-N 3.21Å; G530-F534 WeakPolarHBondContact O-CB 3.34Å; G530-F534 PolarHBondContact O-N 2.87Å
531	P	93.8	Very high	91.4	Very high	30 Å²	30	56.4 Å²	56.4	20%	0.195	30%	0.301	C	S	.	.	H	α-helix	trans	-58.3	-40.1	175.2	-29.5	37.2	0	0	0	114.3	F519 L523 P527 V528 F534 V535	F519-P531 HydrophobicContact CE2-CB 4.32Å; F519-P531 HydrophobicContact CE2-CG 4.33Å; F519-P531 HydrophobicContact CZ-CB 4.16Å; F519-P531 HydrophobicContact CZ-CG 3.95Å; L523-P531 HydrophobicContact CD1-CG 3.62Å; P527-P531 VanDerWaalsContact O-CD 3.28Å; P527-P531 WeakPolarHBondContact O-CD 3.31Å; P527-P531 VanDerWaalsContact O-CG 3.31Å; P527-P531 WeakPolarHBondContact O-CG 3.46Å; V528-P531 WeakPolarHBondContact O-CD 3.46Å; P531-F534 PolarHBondContact O-N 3.31Å; P531-V535 WeakPolarHBondContact O-CB 3.48Å; P531-V535 VanDerWaalsContact O-CG2 3.29Å; P531-V535 WeakPolarHBondContact O-CG2 3.38Å; P531-V535 PolarHBondContact O-N 3.18Å
532	I	94.6	Very high	91.2	Very high	95 Å²	95	58 Å²	58	49%	0.487	30%	0.303	S	S	.	.	H	α-helix	trans	-62.4	-48.3	177.7	-67.1	170.7	0	0	0	110.5	V528 L529 G530 F534 V535 T536	V528-I532 HydrophobicContact CG1-CD1 3.72Å; V528-I532 WeakPolarHBondContact O-CG1 3.44Å; V528-I532 PolarHBondContact O-N 3.07Å; L529-I532 PolarHBondContact O-N 3.26Å; G530-I532 VanDerWaalsContact C-N 3.34Å; G530-I532 PolarHBondContact O-N 3.45Å; I532-F534 VanDerWaalsContact C-N 3.32Å; I532-F534 PolarHBondContact O-N 3.35Å; I532-V535 PolarHBondContact O-N 3.44Å; I532-T536 HydrophobicContact CG2-CG2 4.32Å; I532-T536 WeakPolarHBondContact O-CB 3.27Å; I532-T536 VanDerWaalsContact O-CG2 3.24Å; I532-T536 WeakPolarHBondContact O-CG2 3.49Å; I532-T536 PolarHBondContact O-N 3.22Å; I532-T536 PolarHBondContact O-OG1 3.16Å
533	F	94.1	Very high	91	Very high	4 Å²	4	64.1 Å²	64.1	2%	0.018	33%	0.33	C	S	.	.	H	α-helix	trans	-56.6	-47.9	175.7	169.6	-98.7	0	0	0	111.5	F484 L487 F492 Y499 L509 L529 G530 T536 F537	F484-F533 HydrophobicContact CB-CE2 4.48Å; F484-F533 HydrophobicContact CD1-CD2 4.21Å; F484-F533 AromaticContact CD1-CE2 3.86Å; F484-F533 HydrophobicContact CD1-CE2 3.86Å; L487-F533 HydrophobicContact CB-CE2 4.41Å; L487-F533 HydrophobicContact CD2-CD2 3.79Å; L487-F533 HydrophobicContact CD2-CE2 4.2Å; L487-F533 HydrophobicContact CG-CD2 4.06Å; L487-F533 HydrophobicContact CG-CE2 4.24Å; F492-F533 HydrophobicContact CE2-CB 4.15Å; F492-F533 AromaticContact CE2-CD1 3.64Å; F492-F533 HydrophobicContact CE2-CD1 3.64Å; F492-F533 HydrophobicContact CE2-CD2 4.34Å; F492-F533 HydrophobicContact CE2-CE1 4.07Å; F492-F533 AromaticContact CE2-CG 3.78Å; F492-F533 HydrophobicContact CE2-CG 3.78Å; F492-F533 HydrophobicContact CZ-CB 4.11Å; F492-F533 HydrophobicContact CZ-CD1 4.33Å; F492-F533 HydrophobicContact CZ-CG 4.26Å; Y499-F533 HydrophobicContact CE1-CE1 4.2Å; Y499-F533 HydrophobicContact CE1-CZ 4.44Å; L509-F533 HydrophobicContact CD2-CE1 4.21Å; L509-F533 HydrophobicContact CD2-CZ 3.82Å; L529-F533 VanDerWaalsContact O-CB 3.25Å; L529-F533 WeakPolarHBondContact O-CB 3.43Å; L529-F533 PolarHBondContact O-N 3.39Å; G530-F533 PolarHBondContact O-N 3.21Å; F533-T536 PolarHBondContact O-OG1 2.99Å; F533-F537 VanDerWaalsContact O-CB 3.28Å; F533-F537 WeakPolarHBondContact O-CB 3.49Å; F533-F537 PolarHBondContact O-N 3.13Å
534	F	92.3	Very high	90.5	Very high	32 Å²	32	63.7 Å²	63.7	14%	0.14	33%	0.33	C	S	.	.	H	α-helix	trans	-62.9	-50.6	-179.1	173.9	-104.1	0	0	0	112.4	I512 I517 F519 I522 G530 P531 I532 T536 F537 V538	I512-F534 HydrophobicContact CG2-CE2 4.32Å; I517-F534 HydrophobicContact CB-CE2 4.35Å; I517-F534 HydrophobicContact CD1-CE2 3.96Å; I517-F534 HydrophobicContact CD1-CZ 3.81Å; I517-F534 HydrophobicContact CG1-CE2 4.23Å; I517-F534 HydrophobicContact CG1-CZ 4.49Å; I517-F534 HydrophobicContact CG2-CD2 4.19Å; I517-F534 HydrophobicContact CG2-CE2 3.25Å; I517-F534 HydrophobicContact CG2-CZ 3.54Å; F519-F534 HydrophobicContact CD2-CB 4.23Å; F519-F534 AromaticContact CD2-CD1 3.57Å; F519-F534 HydrophobicContact CD2-CD1 3.57Å; F519-F534 HydrophobicContact CD2-CD2 4.33Å; F519-F534 AromaticContact CD2-CE1 3.97Å; F519-F534 HydrophobicContact CD2-CE1 3.97Å; F519-F534 AromaticContact CD2-CG 3.76Å; F519-F534 HydrophobicContact CD2-CG 3.76Å; F519-F534 HydrophobicContact CE2-CB 4.15Å; F519-F534 AromaticContact CE2-CD1 3.63Å; F519-F534 HydrophobicContact CE2-CD1 3.63Å; F519-F534 HydrophobicContact CE2-CE1 4.3Å; F519-F534 AromaticContact CE2-CG 4Å; F519-F534 HydrophobicContact CE2-CG 4Å; I522-F534 HydrophobicContact CD1-CD2 4.34Å; G530-F534 WeakPolarHBondContact O-CB 3.34Å; G530-F534 PolarHBondContact O-N 2.87Å; P531-F534 PolarHBondContact O-N 3.31Å; I532-F534 VanDerWaalsContact C-N 3.32Å; I532-F534 PolarHBondContact O-N 3.35Å; F534-T536 PolarHBondContact O-N 3.49Å; F534-F537 PolarHBondContact O-N 3.39Å; F534-V538 HydrophobicContact CD2-CG2 4.01Å; F534-V538 HydrophobicContact CE1-CG2 4.2Å; F534-V538 HydrophobicContact CE2-CG2 3.52Å; F534-V538 HydrophobicContact CZ-CG2 3.65Å; F534-V538 WeakPolarHBondContact O-CB 3.4Å; F534-V538 VanDerWaalsContact O-CG2 3.31Å; F534-V538 WeakPolarHBondContact O-CG2 3.22Å; F534-V538 PolarHBondContact O-N 3.12Å
535	V	92.3	Very high	90.2	Very high	90 Å²	90	55.4 Å²	55.4	55%	0.545	30%	0.295	S	S	.	.	H	α-helix	trans	-62.8	-43.7	-179.2	171.3	0	0	0	0	111.1	P531 I532 F539	P531-V535 WeakPolarHBondContact O-CB 3.48Å; P531-V535 VanDerWaalsContact O-CG2 3.29Å; P531-V535 WeakPolarHBondContact O-CG2 3.38Å; P531-V535 PolarHBondContact O-N 3.18Å; I532-V535 PolarHBondContact O-N 3.44Å; V535-F539 VanDerWaalsContact O-CB 3.26Å; V535-F539 WeakPolarHBondContact O-CB 3.24Å; V535-F539 PolarHBondContact O-N 2.92Å
536	T	93.3	Very high	90	Very high	61 Å²	61	57.3 Å²	57.3	37%	0.374	30%	0.301	S	S	.	.	H	α-helix	trans	-65.4	-41.2	179	52.6	0	0	0	0	112.1	I532 F533 F534 F540	I532-T536 HydrophobicContact CG2-CG2 4.32Å; I532-T536 WeakPolarHBondContact O-CB 3.27Å; I532-T536 VanDerWaalsContact O-CG2 3.24Å; I532-T536 WeakPolarHBondContact O-CG2 3.49Å; I532-T536 PolarHBondContact O-N 3.22Å; I532-T536 PolarHBondContact O-OG1 3.16Å; F533-T536 PolarHBondContact O-OG1 2.99Å; F534-T536 PolarHBondContact O-N 3.49Å; T536-F540 WeakPolarHBondContact O-CB 3.31Å; T536-F540 PolarHBondContact O-N 3.11Å
537	F	93.1	Very high	89.8	Confident	1 Å²	1	57.5 Å²	57.5	0%	0.004	31%	0.305	C	S	.	.	H	α-helix	trans	-64.9	-49.6	176.3	179.5	-104.6	0	0	0	112.1	Y481 F484 L509 I512 M513 F533 F534 F539 F540 V541	Y481-F537 HydrophobicContact CD2-CE2 4.41Å; F484-F537 HydrophobicContact CB-CD2 3.89Å; F484-F537 HydrophobicContact CB-CE2 4.23Å; F484-F537 HydrophobicContact CD1-CB 4.16Å; F484-F537 HydrophobicContact CD1-CD2 4.02Å; F484-F537 HydrophobicContact CD2-CD2 4.01Å; F484-F537 HydrophobicContact CE1-CB 4.15Å; F484-F537 AromaticContact CG-CD2 3.73Å; F484-F537 HydrophobicContact CG-CD2 3.73Å; F484-F537 HydrophobicContact CG-CE2 4.44Å; L509-F537 HydrophobicContact CB-CE1 4.44Å; L509-F537 HydrophobicContact CB-CE2 4.4Å; L509-F537 HydrophobicContact CB-CZ 3.86Å; L509-F537 HydrophobicContact CD1-CE2 4.47Å; L509-F537 HydrophobicContact CD2-CD1 4.13Å; L509-F537 HydrophobicContact CD2-CD2 4.17Å; L509-F537 HydrophobicContact CD2-CE1 3.87Å; L509-F537 HydrophobicContact CD2-CE2 3.92Å; L509-F537 HydrophobicContact CD2-CG 4.27Å; L509-F537 HydrophobicContact CD2-CZ 3.75Å; L509-F537 HydrophobicContact CG-CE2 4.5Å; L509-F537 HydrophobicContact CG-CZ 4.29Å; I512-F537 HydrophobicContact CB-CD1 4.44Å; I512-F537 HydrophobicContact CB-CE1 3.9Å; I512-F537 HydrophobicContact CG2-CD1 3.74Å; I512-F537 HydrophobicContact CG2-CE1 3.58Å; M513-F537 HydrophobicContact CG-CE1 4.39Å; M513-F537 HydrophobicContact CG-CZ 4.07Å; F533-F537 VanDerWaalsContact O-CB 3.28Å; F533-F537 WeakPolarHBondContact O-CB 3.49Å; F533-F537 PolarHBondContact O-N 3.13Å; F534-F537 PolarHBondContact O-N 3.39Å; F537-F539 VanDerWaalsContact C-N 3.31Å; F537-F539 PolarHBondContact O-N 3.01Å; F537-F540 PolarHBondContact O-N 3.44Å; F537-V541 HydrophobicContact CD1-CG2 4.27Å; F537-V541 HydrophobicContact CD2-CG2 4.06Å; F537-V541 HydrophobicContact CE1-CG2 3.86Å; F537-V541 HydrophobicContact CE2-CG2 3.64Å; F537-V541 HydrophobicContact CG-CG2 4.37Å; F537-V541 HydrophobicContact CZ-CG2 3.53Å; F537-V541 WeakPolarHBondContact O-CB 3.42Å; F537-V541 WeakPolarHBondContact O-CG2 3.43Å; F537-V541 PolarHBondContact O-N 2.73Å
538	V	90.8	Very high	89.7	Confident	31 Å²	31	56.9 Å²	56.9	19%	0.188	30%	0.295	C	S	.	.	H	α-helix	trans	-59.5	-43.9	177.9	168.5	0	0	0	0	110.6	I512 F534 F540 V541 F542	I512-V538 HydrophobicContact CG2-CG2 4.16Å; F534-V538 HydrophobicContact CD2-CG2 4.01Å; F534-V538 HydrophobicContact CE1-CG2 4.2Å; F534-V538 HydrophobicContact CE2-CG2 3.52Å; F534-V538 HydrophobicContact CZ-CG2 3.65Å; F534-V538 WeakPolarHBondContact O-CB 3.4Å; F534-V538 VanDerWaalsContact O-CG2 3.31Å; F534-V538 WeakPolarHBondContact O-CG2 3.22Å; F534-V538 PolarHBondContact O-N 3.12Å; V538-F540 PolarHBondContact O-N 3.03Å; V538-V541 PolarHBondContact O-N 3.42Å; V538-F542 HydrophobicContact CB-CD2 4.43Å; V538-F542 HydrophobicContact CG1-CD2 3.72Å; V538-F542 HydrophobicContact CG1-CE2 4.19Å; V538-F542 WeakPolarHBondContact O-CB 3.49Å; V538-F542 WeakPolarHBondContact O-CD2 3.33Å; V538-F542 PolarHBondContact O-N 2.88Å
539	F	90.4	Very high	89.6	Confident	123 Å²	123	56.5 Å²	56.5	54%	0.539	29%	0.286	S	S	.	.	I	π-helix	trans	-59.1	-48.9	177.5	-179.5	-96.2	0	0	0	111.5	V535 F537 F543 V544	V535-F539 VanDerWaalsContact O-CB 3.26Å; V535-F539 WeakPolarHBondContact O-CB 3.24Å; V535-F539 PolarHBondContact O-N 2.92Å; F537-F539 VanDerWaalsContact C-N 3.31Å; F537-F539 PolarHBondContact O-N 3.01Å; F539-F543 HydrophobicContact CD2-CB 4.44Å; F539-F543 AromaticContact CD2-CD2 3.64Å; F539-F543 HydrophobicContact CD2-CD2 3.64Å; F539-F543 HydrophobicContact CD2-CE2 4.22Å; F539-F543 HydrophobicContact CD2-CG 4.26Å; F539-F543 HydrophobicContact CE2-CB 4.32Å; F539-F543 HydrophobicContact CE2-CD2 4.09Å; F539-F543 HydrophobicContact CE2-CG 4.29Å; F539-F543 HydrophobicContact CG-CD2 4.32Å; F539-F543 WeakPolarHBondContact O-CB 3.34Å; F539-F543 PolarHBondContact O-N 3.08Å; F539-V544 HydrophobicContact CE1-CG2 4.48Å
540	F	89.3	Confident	89.4	Confident	54 Å²	54	58.2 Å²	58.2	24%	0.237	30%	0.295	C	S	.	.	I	π-helix	trans	-64.9	-44.5	-179	-167.3	-97.2	0	0	0	112.5	V480 F484 T536 F537 V538 V544 L545	V480-F540 HydrophobicContact CB-CD1 4.39Å; V480-F540 HydrophobicContact CB-CE1 3.53Å; V480-F540 HydrophobicContact CB-CZ 3.87Å; V480-F540 HydrophobicContact CG1-CD1 3.57Å; V480-F540 HydrophobicContact CG1-CE1 3.13Å; V480-F540 HydrophobicContact CG1-CE2 4.22Å; V480-F540 HydrophobicContact CG1-CG 4.3Å; V480-F540 HydrophobicContact CG1-CZ 3.52Å; V480-F540 HydrophobicContact CG2-CE1 3.94Å; V480-F540 HydrophobicContact CG2-CZ 3.73Å; F484-F540 HydrophobicContact CE2-CB 4.35Å; F484-F540 HydrophobicContact CE2-CD1 4.3Å; F484-F540 HydrophobicContact CE2-CG 4.31Å; T536-F540 WeakPolarHBondContact O-CB 3.31Å; T536-F540 PolarHBondContact O-N 3.11Å; F537-F540 PolarHBondContact O-N 3.44Å; V538-F540 PolarHBondContact O-N 3.03Å; F540-V544 HydrophobicContact CD2-CB 4.38Å; F540-V544 HydrophobicContact CD2-CG2 4.27Å; F540-V544 HydrophobicContact CE2-CB 4.45Å; F540-V544 HydrophobicContact CE2-CG1 4.27Å; F540-V544 VanDerWaalsContact O-CB 3.26Å; F540-V544 WeakPolarHBondContact O-CB 3.46Å; F540-V544 PolarHBondContact O-N 3.38Å; F540-L545 HydrophobicContact CD1-CD1 3.44Å; F540-L545 VanDerWaalsContact CD1-CD1 3.44Å; F540-L545 HydrophobicContact CD1-CD2 4.5Å; F540-L545 HydrophobicContact CD1-CG 3.81Å; F540-L545 HydrophobicContact CE1-CD1 3.32Å; F540-L545 HydrophobicContact CE1-CD2 3.67Å; F540-L545 HydrophobicContact CE1-CG 3.47Å; F540-L545 VanDerWaalsContact CE1-CG 3.47Å; F540-L545 HydrophobicContact CZ-CD1 4.46Å; F540-L545 HydrophobicContact CZ-CD2 4.08Å; F540-L545 HydrophobicContact CZ-CG 4.2Å; F540-L545 PolarHBondContact O-N 3.16Å
541	V	86.9	Confident	89.4	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.006	32%	0.317	C	S	.	.	I	π-helix	trans	-65.9	-55.7	-180	167.4	0	0	0	0	111.7	M513 F537 V538 L545 L546	M513-V541 HydrophobicContact CB-CG1 4.14Å; M513-V541 HydrophobicContact CE-CG1 4.11Å; M513-V541 HydrophobicContact CG-CG1 3.72Å; M513-V541 HydrophobicContact CG-CG2 4.12Å; F537-V541 HydrophobicContact CD1-CG2 4.27Å; F537-V541 HydrophobicContact CD2-CG2 4.06Å; F537-V541 HydrophobicContact CE1-CG2 3.86Å; F537-V541 HydrophobicContact CE2-CG2 3.64Å; F537-V541 HydrophobicContact CG-CG2 4.37Å; F537-V541 HydrophobicContact CZ-CG2 3.53Å; F537-V541 WeakPolarHBondContact O-CB 3.42Å; F537-V541 WeakPolarHBondContact O-CG2 3.43Å; F537-V541 PolarHBondContact O-N 2.73Å; V538-V541 PolarHBondContact O-N 3.42Å; V541-L545 HydrophobicContact CG2-CD1 4.4Å; V541-L545 PolarHBondContact O-N 3.32Å; V541-L546 HydrophobicContact CG1-CD1 4.41Å; V541-L546 HydrophobicContact CG1-CG 4.47Å; V541-L546 PolarHBondContact O-N 2.89Å
542	F	83.9	Confident	89.3	Confident	71 Å²	71	60.4 Å²	60.4	31%	0.311	31%	0.313	S	S	.	.	I	π-helix	trans	-77.8	-43	-170	-75.9	-78	0	0	0	112.6	V538 L546	V538-F542 HydrophobicContact CB-CD2 4.43Å; V538-F542 HydrophobicContact CG1-CD2 3.72Å; V538-F542 HydrophobicContact CG1-CE2 4.19Å; V538-F542 WeakPolarHBondContact O-CB 3.49Å; V538-F542 WeakPolarHBondContact O-CD2 3.33Å; V538-F542 PolarHBondContact O-N 2.88Å; F542-L546 HydrophobicContact CD1-CD1 3.6Å; F542-L546 HydrophobicContact CE1-CD1 3.9Å; F542-L546 HydrophobicContact CG-CD1 4.39Å
543	F	83.9	Confident	89.1	Confident	131 Å²	131	58.3 Å²	58.3	58%	0.575	30%	0.302	S	S	*	.	I	π-helix	trans	-88.4	-31	-174.2	-66.3	-80.1	0	0	0	113.5	F539 N547	F539-F543 HydrophobicContact CD2-CB 4.44Å; F539-F543 AromaticContact CD2-CD2 3.64Å; F539-F543 HydrophobicContact CD2-CD2 3.64Å; F539-F543 HydrophobicContact CD2-CE2 4.22Å; F539-F543 HydrophobicContact CD2-CG 4.26Å; F539-F543 HydrophobicContact CE2-CB 4.32Å; F539-F543 HydrophobicContact CE2-CD2 4.09Å; F539-F543 HydrophobicContact CE2-CG 4.29Å; F539-F543 HydrophobicContact CG-CD2 4.32Å; F539-F543 WeakPolarHBondContact O-CB 3.34Å; F539-F543 PolarHBondContact O-N 3.08Å; F543-N547 PolarHBondContact O-ND2 3.27Å
544	V	81.6	Confident	89	Confident	67 Å²	67	61.8 Å²	61.8	41%	0.406	32%	0.321	S	S	.	.	I	π-helix	trans	-98	-59.1	-177.4	-171.9	0	0	0	0	110.5	F539 F540 M548	F539-V544 HydrophobicContact CE1-CG2 4.48Å; F540-V544 HydrophobicContact CD2-CB 4.38Å; F540-V544 HydrophobicContact CD2-CG2 4.27Å; F540-V544 HydrophobicContact CE2-CB 4.45Å; F540-V544 HydrophobicContact CE2-CG1 4.27Å; F540-V544 VanDerWaalsContact O-CB 3.26Å; F540-V544 WeakPolarHBondContact O-CB 3.46Å; F540-V544 PolarHBondContact O-N 3.38Å; V544-M548 PolarHBondContact O-N 3Å
545	L	83.1	Confident	89	Confident	12 Å²	12	66.5 Å²	66.5	6%	0.063	34%	0.343	C	S	.	.	I	π-helix	trans	-76.8	-49.3	-167.3	-66	170.9	0	0	0	113.9	F473 F477 F540 V541 N547 M548 F549	F473-L545 HydrophobicContact CE2-CD2 3.99Å; F473-L545 HydrophobicContact CZ-CB 4.22Å; F473-L545 HydrophobicContact CZ-CD2 3.76Å; F473-L545 WeakPolarHBondContact CZ-O 3.48Å; F477-L545 HydrophobicContact CD2-CB 4.49Å; F477-L545 HydrophobicContact CD2-CD1 3.49Å; F477-L545 VanDerWaalsContact CD2-CD1 3.49Å; F477-L545 HydrophobicContact CD2-CD2 4.2Å; F477-L545 HydrophobicContact CD2-CG 4.27Å; F477-L545 HydrophobicContact CE2-CD1 3.74Å; F540-L545 HydrophobicContact CD1-CD1 3.44Å; F540-L545 VanDerWaalsContact CD1-CD1 3.44Å; F540-L545 HydrophobicContact CD1-CD2 4.5Å; F540-L545 HydrophobicContact CD1-CG 3.81Å; F540-L545 HydrophobicContact CE1-CD1 3.32Å; F540-L545 HydrophobicContact CE1-CD2 3.67Å; F540-L545 HydrophobicContact CE1-CG 3.47Å; F540-L545 VanDerWaalsContact CE1-CG 3.47Å; F540-L545 HydrophobicContact CZ-CD1 4.46Å; F540-L545 HydrophobicContact CZ-CD2 4.08Å; F540-L545 HydrophobicContact CZ-CG 4.2Å; F540-L545 PolarHBondContact O-N 3.16Å; V541-L545 HydrophobicContact CG2-CD1 4.4Å; V541-L545 PolarHBondContact O-N 3.32Å; L545-N547 VanDerWaalsContact C-N 3.32Å; L545-N547 PolarHBondContact O-N 2.88Å; L545-M548 PolarHBondContact O-N 3.42Å; L545-F549 PolarHBondContact O-N 3.5Å
546	L	85.8	Confident	88.9	Confident	62 Å²	62	62.4 Å²	62.4	33%	0.325	32%	0.319	S	S	.	.	H	α-helix	trans	-64.6	-37.9	-177.9	-73.6	179.8	0	0	0	112.1	V541 F542 M548 F549 L550	V541-L546 HydrophobicContact CG1-CD1 4.41Å; V541-L546 HydrophobicContact CG1-CG 4.47Å; V541-L546 PolarHBondContact O-N 2.89Å; F542-L546 HydrophobicContact CD1-CD1 3.6Å; F542-L546 HydrophobicContact CE1-CD1 3.9Å; F542-L546 HydrophobicContact CG-CD1 4.39Å; L546-M548 PolarHBondContact O-N 2.9Å; L546-F549 WeakPolarHBondContact O-CB 3.38Å; L546-F549 PolarHBondContact O-N 3.42Å; L546-L550 WeakPolarHBondContact O-CG 3.46Å; L546-L550 PolarHBondContact O-N 3.28Å
547	N	88.2	Confident	88.8	Confident	87 Å²	87	64 Å²	64	47%	0.465	32%	0.318	S	S	.	.	H	α-helix	trans	-64.3	-39.2	176.4	-72.5	-27.1	0	0	0	112.3	F543 L545 L550 A551	F543-N547 PolarHBondContact O-ND2 3.27Å; L545-N547 VanDerWaalsContact C-N 3.32Å; L545-N547 PolarHBondContact O-N 2.88Å; N547-L550 PolarHBondContact O-N 3.4Å; N547-A551 WeakPolarHBondContact O-CB 3.36Å; N547-A551 PolarHBondContact O-N 2.87Å
548	M	88.5	Confident	88.7	Confident	80 Å²	80	69.7 Å²	69.7	39%	0.394	34%	0.343	S	S	.	.	H	α-helix	trans	-65.8	-41.3	174.6	-177	172.1	171.9	0	0	111.8	F473 M476 V544 L545 L546 L550 A551 I552	F473-M548 HydrophobicContact CB-CE 4.4Å; F473-M548 HydrophobicContact CD2-CE 3.38Å; F473-M548 HydrophobicContact CD2-CG 3.93Å; F473-M548 HydrophobicContact CD2-SD 3.34Å; F473-M548 WeakPolarHBondContact CD2-SD 3.44Å; F473-M548 HydrophobicContact CE2-CB 3.94Å; F473-M548 HydrophobicContact CE2-CE 3.97Å; F473-M548 HydrophobicContact CE2-CG 3.7Å; F473-M548 HydrophobicContact CE2-SD 3.22Å; F473-M548 WeakPolarHBondContact CE2-SD 3.37Å; F473-M548 HydrophobicContact CG-CE 4.17Å; F473-M548 HydrophobicContact CG-SD 4.44Å; F473-M548 HydrophobicContact CZ-CB 4.08Å; F473-M548 HydrophobicContact CZ-CG 4.23Å; F473-M548 HydrophobicContact CZ-SD 4.27Å; M476-M548 HydrophobicContact CE-CE 3.81Å; V544-M548 PolarHBondContact O-N 3Å; L545-M548 PolarHBondContact O-N 3.42Å; L546-M548 PolarHBondContact O-N 2.9Å; M548-L550 VanDerWaalsContact C-N 3.34Å; M548-L550 PolarHBondContact O-N 3.4Å; M548-A551 PolarHBondContact O-N 3.19Å; M548-I552 HydrophobicContact CE-CD1 4.12Å; M548-I552 HydrophobicContact CG-CD1 4.27Å; M548-I552 WeakPolarHBondContact O-CG1 3.48Å; M548-I552 PolarHBondContact O-N 2.87Å; M548-I552 VanDerWaalsContact O-N 3.1Å
549	F	89.2	Confident	88.6	Confident	83 Å²	83	71.1 Å²	71.1	36%	0.364	35%	0.352	S	S	.	.	H	α-helix	trans	-59.5	-44.5	175.8	-175.6	-97.3	0	0	0	112	L470 F473 L545 L546 I552 I553	L470-F549 HydrophobicContact CD1-CE2 4Å; L470-F549 HydrophobicContact CD1-CZ 4.33Å; L470-F549 HydrophobicContact CD2-CD2 3.42Å; L470-F549 VanDerWaalsContact CD2-CD2 3.42Å; L470-F549 HydrophobicContact CD2-CE2 3.36Å; L470-F549 HydrophobicContact CD2-CG 4.35Å; L470-F549 HydrophobicContact CD2-CZ 4.26Å; L470-F549 HydrophobicContact CG-CE2 4.25Å; F473-F549 HydrophobicContact CD1-CD2 4.37Å; F473-F549 HydrophobicContact CE1-CB 4.07Å; F473-F549 HydrophobicContact CE1-CD2 4.35Å; L545-F549 PolarHBondContact O-N 3.5Å; L546-F549 WeakPolarHBondContact O-CB 3.38Å; L546-F549 PolarHBondContact O-N 3.42Å; F549-I552 PolarHBondContact O-N 3.04Å; F549-I553 HydrophobicContact CD1-CD1 3.74Å; F549-I553 HydrophobicContact CE1-CD1 3.24Å; F549-I553 HydrophobicContact CE1-CG1 4.41Å; F549-I553 HydrophobicContact CZ-CD1 3.68Å; F549-I553 WeakPolarHBondContact O-CG1 3.29Å; F549-I553 PolarHBondContact O-N 3.42Å
550	L	90.2	Very high	88.4	Confident	107 Å²	107	65.3 Å²	65.3	56%	0.56	33%	0.327	S	S	*	.	H	α-helix	trans	-64.3	-39.2	176.4	-69.4	174.6	0	0	0	112.3	L546 N547 M548 I553 D554	L546-L550 WeakPolarHBondContact O-CG 3.46Å; L546-L550 PolarHBondContact O-N 3.28Å; N547-L550 PolarHBondContact O-N 3.4Å; M548-L550 VanDerWaalsContact C-N 3.34Å; M548-L550 PolarHBondContact O-N 3.4Å; L550-I553 PolarHBondContact O-N 2.82Å; L550-D554 WeakPolarHBondContact O-CB 3.43Å; L550-D554 PolarHBondContact O-N 3.04Å
551	A	92.1	Very high	88.3	Confident	56 Å²	56	67.5 Å²	67.5	46%	0.463	34%	0.336	S	S	.	.	H	α-helix	trans	-62.2	-43.5	177.6	0	0	0	0	0	112.3	N547 M548 I553 D554 E555	N547-A551 WeakPolarHBondContact O-CB 3.36Å; N547-A551 PolarHBondContact O-N 2.87Å; M548-A551 PolarHBondContact O-N 3.19Å; A551-I553 VanDerWaalsContact C-N 3.34Å; A551-I553 PolarHBondContact O-N 3.23Å; A551-D554 PolarHBondContact O-N 3.21Å; A551-E555 PolarHBondContact O-N 3.35Å
552	I	91.6	Very high	88.3	Confident	20 Å²	20	69.8 Å²	69.8	10%	0.103	36%	0.355	C	S	.	.	H	α-helix	trans	-62.1	-42.7	177.2	-64.8	165.9	0	0	0	110.8	D469 L470 F473 M548 F549 E555 S556	D469-I552 HydrophobicContact CB-CG2 3.73Å; L470-I552 HydrophobicContact CD2-CB 4.18Å; L470-I552 HydrophobicContact CD2-CD1 4.3Å; L470-I552 HydrophobicContact CD2-CG2 3.85Å; L470-I552 HydrophobicContact CG-CG2 4.13Å; F473-I552 HydrophobicContact CB-CD1 3.78Å; F473-I552 HydrophobicContact CD1-CD1 4.41Å; F473-I552 HydrophobicContact CG-CD1 4.01Å; M548-I552 HydrophobicContact CE-CD1 4.12Å; M548-I552 HydrophobicContact CG-CD1 4.27Å; M548-I552 WeakPolarHBondContact O-CG1 3.48Å; M548-I552 PolarHBondContact O-N 2.87Å; M548-I552 VanDerWaalsContact O-N 3.1Å; F549-I552 PolarHBondContact O-N 3.04Å; I552-E555 PolarHBondContact O-N 3.2Å; I552-S556 WeakPolarHBondContact O-CB 3.29Å; I552-S556 PolarHBondContact O-N 3.4Å; I552-S556 PolarHBondContact O-OG 3.4Å
553	I	90.2	Very high	88.3	Confident	51 Å²	51	69.3 Å²	69.3	26%	0.262	35%	0.354	S	S	.	.	H	α-helix	trans	-65.4	-44.5	178.3	-67.7	175.5	0	0	0	110.9	F549 L550 A551 E555 S556 Y557	F549-I553 HydrophobicContact CD1-CD1 3.74Å; F549-I553 HydrophobicContact CE1-CD1 3.24Å; F549-I553 HydrophobicContact CE1-CG1 4.41Å; F549-I553 HydrophobicContact CZ-CD1 3.68Å; F549-I553 WeakPolarHBondContact O-CG1 3.29Å; F549-I553 PolarHBondContact O-N 3.42Å; L550-I553 PolarHBondContact O-N 2.82Å; A551-I553 VanDerWaalsContact C-N 3.34Å; A551-I553 PolarHBondContact O-N 3.23Å; I553-E555 VanDerWaalsContact C-N 3.34Å; I553-E555 PolarHBondContact O-N 3.43Å; I553-S556 PolarHBondContact O-N 3.14Å; I553-S556 PolarHBondContact O-OG 3.42Å; I553-Y557 WeakPolarHBondContact O-CB 3.37Å; I553-Y557 PolarHBondContact O-N 2.61Å
554	D	91.8	Very high	88	Confident	78 Å²	78	63.4 Å²	63.4	42%	0.417	33%	0.328	S	S	.	.	H	α-helix	trans	-60.3	-43.1	178.1	-178	52.1	0	0	0	111.9	L550 A551 Y557 K558	L550-D554 WeakPolarHBondContact O-CB 3.43Å; L550-D554 PolarHBondContact O-N 3.04Å; A551-D554 PolarHBondContact O-N 3.21Å; D554-Y557 PolarHBondContact O-N 3.2Å; D554-K558 WeakPolarHBondContact O-CG 3.29Å; D554-K558 PolarHBondContact O-N 2.94Å; D554-K558 WeakPolarHBondContact OD1-CE 3.48Å; D554-K558 IonicContact OD1-NZ 2.8Å; D554-K558 WeakPolarHBondContact OD2-CE 3.41Å; D554-K558 IonicContact OD2-NZ 3.32Å; D554-K558 PolarHBondContact OD2-NZ 3.06Å
555	E	93.6	Very high	87.7	Confident	130 Å²	130	65.8 Å²	65.8	61%	0.607	34%	0.337	S	S	*	.	H	α-helix	trans	-62.8	-45.3	175.8	-175.9	169.6	-167.8	0	0	112.3	A551 I552 I553 Y557 K558 T559	A551-E555 PolarHBondContact O-N 3.35Å; I552-E555 PolarHBondContact O-N 3.2Å; I553-E555 VanDerWaalsContact C-N 3.34Å; I553-E555 PolarHBondContact O-N 3.43Å; E555-Y557 VanDerWaalsContact C-N 3.3Å; E555-Y557 PolarHBondContact O-N 3.35Å; E555-K558 PolarHBondContact O-N 3.06Å; E555-T559 PolarHBondContact O-N 3.46Å; E555-T559 PolarHBondContact O-OG1 2.98Å
556	S	90.4	Very high	87.3	Confident	4 Å²	4	73 Å²	73	3%	0.028	37%	0.371	C	S	.	.	H	α-helix	trans	-63	-36.4	177	73.3	0	0	0	0	112.4	T462 I552 I553 T559 T560	T462-S556 VanDerWaalsContact CG2-OG 3.29Å; T462-S556 WeakPolarHBondContact CG2-OG 3.43Å; I552-S556 WeakPolarHBondContact O-CB 3.29Å; I552-S556 PolarHBondContact O-N 3.4Å; I552-S556 PolarHBondContact O-OG 3.4Å; I553-S556 PolarHBondContact O-N 3.14Å; I553-S556 PolarHBondContact O-OG 3.42Å; S556-T559 PolarHBondContact O-N 2.92Å; S556-T560 PolarHBondContact O-N 3.35Å; S556-T560 PolarHBondContact O-OG1 3.47Å
557	Y	89.7	Confident	86.4	Confident	94 Å²	94	73.7 Å²	73.7	37%	0.369	37%	0.373	S	S	.	.	H	α-helix	trans	-68.1	-41.2	177.9	176.3	-94.4	0	0	0	111.9	I553 D554 E555 T559 T560 K561	I553-Y557 WeakPolarHBondContact O-CB 3.37Å; I553-Y557 PolarHBondContact O-N 2.61Å; D554-Y557 PolarHBondContact O-N 3.2Å; E555-Y557 VanDerWaalsContact C-N 3.3Å; E555-Y557 PolarHBondContact O-N 3.35Å; Y557-T559 VanDerWaalsContact C-N 3.33Å; Y557-T560 PolarHBondContact O-N 3.36Å; Y557-T560 PolarHBondContact O-OG1 2.91Å; Y557-T560 VanDerWaalsContact O-OG1 3.05Å; Y557-K561 HydrophobicContact CE1-CD 4.2Å; Y557-K561 VanDerWaalsContact O-CB 3.3Å; Y557-K561 WeakPolarHBondContact O-CB 3.38Å; Y557-K561 PolarHBondContact O-N 3.26Å
558	K	90.6	Very high	84.7	Confident	121 Å²	121	78.3 Å²	78.3	53%	0.526	39%	0.388	S	S	.	.	H	α-helix	trans	-61.6	-44.7	174.5	-71.8	171.3	-171.1	164.1	0	111	D554 E555 K561 A562	D554-K558 WeakPolarHBondContact O-CG 3.29Å; D554-K558 PolarHBondContact O-N 2.94Å; D554-K558 WeakPolarHBondContact OD1-CE 3.48Å; D554-K558 IonicContact OD1-NZ 2.8Å; D554-K558 WeakPolarHBondContact OD2-CE 3.41Å; D554-K558 IonicContact OD2-NZ 3.32Å; D554-K558 PolarHBondContact OD2-NZ 3.06Å; E555-K558 PolarHBondContact O-N 3.06Å; K558-K561 PolarHBondContact O-N 3.04Å; K558-A562 PolarHBondContact O-N 3.47Å
559	T	89.2	Confident	83	Confident	62 Å²	62	81.7 Å²	81.7	38%	0.38	41%	0.408	S	S	.	.	H	α-helix	trans	-60.4	-49.6	177.9	-59.2	0	0	0	0	111.5	E555 S556 Y557 K561 A562 E563	E555-T559 PolarHBondContact O-N 3.46Å; E555-T559 PolarHBondContact O-OG1 2.98Å; S556-T559 PolarHBondContact O-N 2.92Å; Y557-T559 VanDerWaalsContact C-N 3.33Å; T559-K561 PolarHBondContact O-N 3.47Å; T559-A562 PolarHBondContact O-N 3.25Å; T559-E563 WeakPolarHBondContact O-CG 3.43Å; T559-E563 PolarHBondContact O-N 3.45Å
560	T	87	Confident	81.4	Confident	0 Å²	0	79.8 Å²	79.8	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-67.1	-37.1	179.4	53.9	0	0	0	0	113.7	R461 T462 I465 S556 Y557 A562 E563 L564	R461-T560 HydrophobicContact CB-CG2 4.23Å; R461-T560 HydrophobicContact CG-CG2 3.9Å; T462-T560 PolarHBondContact OG1-OG1 3.04Å; I465-T560 HydrophobicContact CD1-CG2 3.52Å; I465-T560 HydrophobicContact CG1-CG2 4.27Å; S556-T560 PolarHBondContact O-N 3.35Å; S556-T560 PolarHBondContact O-OG1 3.47Å; Y557-T560 PolarHBondContact O-N 3.36Å; Y557-T560 PolarHBondContact O-OG1 2.91Å; Y557-T560 VanDerWaalsContact O-OG1 3.05Å; T560-A562 VanDerWaalsContact C-N 3.32Å; T560-A562 PolarHBondContact O-N 3.05Å; T560-E563 PolarHBondContact O-N 2.96Å; T560-L564 WeakPolarHBondContact O-CB 3.5Å; T560-L564 WeakPolarHBondContact O-CG 3.46Å; T560-L564 PolarHBondContact O-N 3.34Å
561	K	86.2	Confident	79.7	Confident	100 Å²	100	78.8 Å²	78.8	44%	0.435	40%	0.4	S	S	.	.	H	α-helix	trans	-60.5	-44.5	175.5	-171.7	176.9	178.4	-178.4	0	110.5	Y557 K558 T559 L564 I565	Y557-K561 HydrophobicContact CE1-CD 4.2Å; Y557-K561 VanDerWaalsContact O-CB 3.3Å; Y557-K561 WeakPolarHBondContact O-CB 3.38Å; Y557-K561 PolarHBondContact O-N 3.26Å; K558-K561 PolarHBondContact O-N 3.04Å; T559-K561 PolarHBondContact O-N 3.47Å; K561-L564 PolarHBondContact O-N 3.46Å; K561-I565 HydrophobicContact CG-CD1 4.03Å; K561-I565 WeakPolarHBondContact O-CD1 3.46Å; K561-I565 VanDerWaalsContact O-CG1 3.26Å; K561-I565 WeakPolarHBondContact O-CG1 3.42Å; K561-I565 PolarHBondContact O-N 3.22Å
562	A	86.6	Confident	78.1	Confident	49 Å²	49	80.9 Å²	80.9	41%	0.405	41%	0.407	S	S	.	.	H	α-helix	trans	-61.2	-46.2	175.7	0	0	0	0	0	112	K558 T559 T560 L564 I565 Q566	K558-A562 PolarHBondContact O-N 3.47Å; T559-A562 PolarHBondContact O-N 3.25Å; T560-A562 VanDerWaalsContact C-N 3.32Å; T560-A562 PolarHBondContact O-N 3.05Å; A562-L564 VanDerWaalsContact C-N 3.34Å; A562-L564 PolarHBondContact O-N 3.01Å; A562-I565 PolarHBondContact O-N 2.96Å; A562-Q566 WeakPolarHBondContact O-CG 3.16Å; A562-Q566 PolarHBondContact O-N 3.28Å
563	E	84.1	Confident	76.6	Confident	62 Å²	62	82.3 Å²	82.3	29%	0.29	42%	0.415	S	S	.	.	H	α-helix	trans	-62.7	-36.7	177.9	-69.7	-176.8	136.6	0	0	113.2	R461 I465 T559 T560 Q567	R461-E563 IonicContact CZ-OE2 2.88Å; R461-E563 IonicContact NE-OE2 2.62Å; R461-E563 PolarHBondContact NE-OE2 3.05Å; R461-E563 IonicContact NH1-OE2 3.59Å; R461-E563 IonicContact NH2-OE1 2.77Å; R461-E563 PolarHBondContact NH2-OE1 3.27Å; R461-E563 IonicContact NH2-OE2 3.3Å; R461-E563 PolarHBondContact NH2-OE2 3.38Å; I465-E563 WeakPolarHBondContact CD1-OE2 3.45Å; T559-E563 WeakPolarHBondContact O-CG 3.43Å; T559-E563 PolarHBondContact O-N 3.45Å; T560-E563 PolarHBondContact O-N 2.96Å; E563-Q567 PolarHBondContact O-N 3.42Å
564	L	77.8	Confident	75.2	Confident	6 Å²	6	82.1 Å²	82.1	3%	0.031	43%	0.425	C	S	.	.	H	α-helix	trans	-77.3	-28.1	179.6	-75.2	171.5	0	0	0	113.6	R454 Q458 T560 K561 A562 Q566 Q567	R454-L564 PolarHBondContact NH2-O 3.44Å; Q458-L564 HydrophobicContact CB-CD1 3.28Å; Q458-L564 HydrophobicContact CG-CD1 3.39Å; T560-L564 WeakPolarHBondContact O-CB 3.5Å; T560-L564 WeakPolarHBondContact O-CG 3.46Å; T560-L564 PolarHBondContact O-N 3.34Å; K561-L564 PolarHBondContact O-N 3.46Å; A562-L564 VanDerWaalsContact C-N 3.34Å; A562-L564 PolarHBondContact O-N 3.01Å; L564-Q566 VanDerWaalsContact C-N 3.31Å; L564-Q567 PolarHBondContact O-N 3.25Å
565	I	76.4	Confident	73.9	Confident	117 Å²	117	83.6 Å²	83.6	60%	0.6	43%	0.429	S	S	*	.	H	α-helix	trans	-68.4	-36.9	172.3	-69.7	165.2	0	0	0	109.8	K561 A562 Q567	K561-I565 HydrophobicContact CG-CD1 4.03Å; K561-I565 WeakPolarHBondContact O-CD1 3.46Å; K561-I565 VanDerWaalsContact O-CG1 3.26Å; K561-I565 WeakPolarHBondContact O-CG1 3.42Å; K561-I565 PolarHBondContact O-N 3.22Å; A562-I565 PolarHBondContact O-N 2.96Å; I565-Q567 VanDerWaalsContact C-N 3.29Å; I565-Q567 PolarHBondContact O-N 3.3Å
566	Q	74.1	Confident	72.6	Confident	163 Å²	163	78.7 Å²	78.7	76%	0.762	41%	0.407	S	S	*	.	H	α-helix	trans	-69.5	-22.9	176.3	-69.4	178.5	6.8	0	0	113.7	A562 L564 K568	A562-Q566 WeakPolarHBondContact O-CG 3.16Å; A562-Q566 PolarHBondContact O-N 3.28Å; L564-Q566 VanDerWaalsContact C-N 3.31Å; Q566-K568 PolarHBondContact O-N 3.1Å
567	Q	67.2	Low	71.5	Confident	78 Å²	78	82.3 Å²	82.3	36%	0.364	43%	0.426	S	S	.	.	S	Bend	trans	-74.3	97.9	173.3	-73	-179.3	-11.7	0	0	109.8	E563 L564 I565	E563-Q567 PolarHBondContact O-N 3.42Å; L564-Q567 PolarHBondContact O-N 3.25Å; I565-Q567 VanDerWaalsContact C-N 3.29Å; I565-Q567 PolarHBondContact O-N 3.3Å
568	K	52	Low	70.6	Confident	183 Å²	183	84.3 Å²	84.3	80%	0.796	44%	0.436	S	S	*	.			trans	-33	131.9	174.3	-120	-179.5	-178.8	-175.1	0	112.2	Q566 D570	Q566-K568 PolarHBondContact O-N 3.1Å; K568-D570 VanDerWaalsContact C-N 3.31Å; K568-D570 PolarHBondContact O-N 3.42Å
569	N	54	Low	69.7	Low	152 Å²	152	83 Å²	83	81%	0.813	43%	0.43	S	S	*	.			trans	-20	81.2	177.6	-71.1	-16.5	0	0	0	115	V571	N569-V571 PolarHBondContact O-N 2.71Å
570	D	54	Low	68.7	Low	43 Å²	43	84.1 Å²	84.1	23%	0.23	43%	0.43	C	S	.	.			trans	-58.2	120.8	175.9	-78.9	-21.4	0	0	0	108.7	R75 K568 T572	R75-D570 VanDerWaalsContact CZ-CG 3.49Å; R75-D570 IonicContact CZ-OD1 2.74Å; R75-D570 VanDerWaalsContact CZ-OD1 3.22Å; R75-D570 IonicContact CZ-OD2 2.9Å; R75-D570 VanDerWaalsContact NH1-CG 3.31Å; R75-D570 IonicContact NH1-OD1 3.87Å; R75-D570 PolarHBondContact NH1-OD1 3.41Å; R75-D570 IonicContact NH1-OD2 2.63Å; R75-D570 IonicContact NH2-OD1 2.95Å; R75-D570 PolarHBondContact NH2-OD1 3.23Å; R75-D570 IonicContact NH2-OD2 3.82Å; R75-D570 PolarHBondContact NH2-OD2 3.16Å; K568-D570 VanDerWaalsContact C-N 3.31Å; K568-D570 PolarHBondContact O-N 3.42Å; D570-T572 PolarHBondContact O-N 2.92Å
571	V	55.7	Low	67.9	Low	85 Å²	85	87 Å²	87	52%	0.515	45%	0.454	S	S	.	.			trans	-42.2	104.6	172.5	-175.6	0	0	0	0	108.3	N569 L573 H575 I576	N569-V571 PolarHBondContact O-N 2.71Å; V571-L573 PolarHBondContact O-N 2.9Å; V571-H575 HydrophobicContact CG1-CB 4.04Å; V571-I576 HydrophobicContact CG1-CD1 4.08Å; V571-I576 HydrophobicContact CG1-CG1 3.73Å
572	T	59	Low	67.3	Low	100 Å²	100	88 Å²	88	61%	0.613	46%	0.458	S	S	*	.			trans	-58	140.9	-174.4	38.2	0	0	0	0	108.8	D570 G574 H575 I576	D570-T572 PolarHBondContact O-N 2.92Å; T572-G574 PolarHBondContact O-N 3.15Å; T572-H575 WeakPolarHBondContact O-CA 3.43Å; T572-H575 WeakPolarHBondContact O-CB 3.45Å; T572-H575 PolarHBondContact O-N 3.49Å; T572-I576 PolarHBondContact O-N 3.35Å
573	L	58.7	Low	66.7	Low	51 Å²	51	89.2 Å²	89.2	27%	0.267	46%	0.458	S	S	.	.	H	α-helix	trans	-47.3	-37.4	175.6	178.7	61.1	0	0	0	111.1	I79 I452 V571 H575 I576 L577	I79-L573 HydrophobicContact CG2-CD1 4.4Å; I452-L573 HydrophobicContact CG2-CB 4.3Å; I452-L573 HydrophobicContact CG2-CD1 3.57Å; I452-L573 HydrophobicContact CG2-CD2 3.9Å; I452-L573 HydrophobicContact CG2-CG 4.11Å; V571-L573 PolarHBondContact O-N 2.9Å; L573-H575 PolarHBondContact O-N 3.29Å; L573-I576 PolarHBondContact O-N 3.41Å; L573-L577 HydrophobicContact CD1-CD1 4.15Å; L573-L577 HydrophobicContact CD1-CG 4.11Å; L573-L577 HydrophobicContact CD2-CD1 4.29Å; L573-L577 HydrophobicContact CG-CD1 3.8Å; L573-L577 HydrophobicContact CG-CG 4.21Å; L573-L577 WeakPolarHBondContact O-CB 3.24Å; L573-L577 WeakPolarHBondContact O-CG 3.26Å; L573-L577 PolarHBondContact O-N 3.49Å
574	G	61.9	Low	65.9	Low	46 Å²	46	91.7 Å²	91.7	47%	0.474	47%	0.472	S	S	.	.	H	α-helix	trans	-54.4	-44.2	173.1	0	0	0	0	0	113.7	T572 L577 K578	T572-G574 PolarHBondContact O-N 3.15Å; G574-L577 PolarHBondContact O-N 3.33Å; G574-K578 WeakPolarHBondContact O-CB 3.29Å; G574-K578 PolarHBondContact O-N 3.47Å
575	H	64.8	Low	65.4	Low	110 Å²	110	94.1 Å²	94.1	51%	0.509	49%	0.493	S	S	.	.	H	α-helix	trans	-66.3	-40.1	177.9	-171.6	-96.9	0	0	0	112.3	V571 T572 L573 K579	V571-H575 HydrophobicContact CG1-CB 4.04Å; T572-H575 WeakPolarHBondContact O-CA 3.43Å; T572-H575 WeakPolarHBondContact O-CB 3.45Å; T572-H575 PolarHBondContact O-N 3.49Å; L573-H575 PolarHBondContact O-N 3.29Å; H575-K579 VanDerWaalsContact O-CB 3.29Å; H575-K579 WeakPolarHBondContact O-CB 3.39Å; H575-K579 PolarHBondContact O-N 2.89Å
576	I	66.4	Low	64.9	Low	27 Å²	27	95.2 Å²	95.2	14%	0.138	49%	0.494	C	S	.	.	H	α-helix	trans	-69.1	-43.3	177.7	-64.6	169.9	0	0	0	111.2	I79 V571 T572 L573 K579 K580	I79-I576 HydrophobicContact CB-CD1 4.49Å; I79-I576 HydrophobicContact CD1-CD1 3.26Å; I79-I576 HydrophobicContact CG1-CD1 4.43Å; I79-I576 HydrophobicContact CG2-CD1 4.2Å; I79-I576 HydrophobicContact CG2-CG2 4.26Å; V571-I576 HydrophobicContact CG1-CD1 4.08Å; V571-I576 HydrophobicContact CG1-CG1 3.73Å; T572-I576 PolarHBondContact O-N 3.35Å; L573-I576 PolarHBondContact O-N 3.41Å; I576-K579 PolarHBondContact O-N 3.34Å; I576-K580 PolarHBondContact O-N 3.14Å
577	L	66.9	Low	64.2	Low	80 Å²	80	96.9 Å²	96.9	42%	0.419	49%	0.493	S	S	.	.	H	α-helix	trans	-64.9	-44.5	176	-72.1	174.3	0	0	0	110.9	L83 L573 G574 K579 K580 A581	L83-L577 HydrophobicContact CD1-CD2 4.26Å; L573-L577 HydrophobicContact CD1-CD1 4.15Å; L573-L577 HydrophobicContact CD1-CG 4.11Å; L573-L577 HydrophobicContact CD2-CD1 4.29Å; L573-L577 HydrophobicContact CG-CD1 3.8Å; L573-L577 HydrophobicContact CG-CG 4.21Å; L573-L577 WeakPolarHBondContact O-CB 3.24Å; L573-L577 WeakPolarHBondContact O-CG 3.26Å; L573-L577 PolarHBondContact O-N 3.49Å; G574-L577 PolarHBondContact O-N 3.33Å; L577-K579 VanDerWaalsContact C-N 3.32Å; L577-K579 PolarHBondContact O-N 3.38Å; L577-K580 PolarHBondContact O-N 3.49Å; L577-A581 WeakPolarHBondContact O-CB 3.22Å; L577-A581 PolarHBondContact O-N 3.1Å
578	K	70.1	Confident	63.8	Low	135 Å²	135	97.1 Å²	97.1	59%	0.587	50%	0.499	S	S	*	.	H	α-helix	trans	-60.2	-41.5	175.2	-168.1	173.6	-173.8	178.4	0	110.8	G574 K582	G574-K578 WeakPolarHBondContact O-CB 3.29Å; G574-K578 PolarHBondContact O-N 3.47Å; K578-K582 VanDerWaalsContact O-CB 3.3Å; K578-K582 WeakPolarHBondContact O-CB 3.39Å; K578-K582 VanDerWaalsContact O-CG 3.26Å; K578-K582 WeakPolarHBondContact O-CG 3.26Å; K578-K582 PolarHBondContact O-N 3.28Å
579	K	71.4	Confident	63.8	Low	93 Å²	93	94.9 Å²	94.9	40%	0.404	49%	0.492	S	S	.	.	H	α-helix	trans	-66.3	-46.6	175.2	-172.2	168	-176.2	160	0	112.5	H575 I576 L577 A581 K582 D583	H575-K579 VanDerWaalsContact O-CB 3.29Å; H575-K579 WeakPolarHBondContact O-CB 3.39Å; H575-K579 PolarHBondContact O-N 2.89Å; I576-K579 PolarHBondContact O-N 3.34Å; L577-K579 VanDerWaalsContact C-N 3.32Å; L577-K579 PolarHBondContact O-N 3.38Å; K579-A581 PolarHBondContact O-N 3.43Å; K579-K582 CarbonylContact O-C 3.48Å; K579-K582 WeakPolarHBondContact O-CB 3.36Å; K579-K582 PolarHBondContact O-N 3.08Å; K579-D583 WeakPolarHBondContact O-CB 3.47Å; K579-D583 VanDerWaalsContact O-CG 3.25Å; K579-D583 PolarHBondContact O-N 2.9Å
580	K	68.1	Low	63.7	Low	87 Å²	87	96.1 Å²	96.1	38%	0.378	49%	0.49	S	S	.	.	H	α-helix	trans	-63	-41.1	175.6	-80.3	-167.8	-177	-177.5	0	112.1	I576 L577 D583 L584	I576-K580 PolarHBondContact O-N 3.14Å; L577-K580 PolarHBondContact O-N 3.49Å; K580-D583 PolarHBondContact O-N 2.95Å; K580-L584 WeakPolarHBondContact O-CB 3.44Å; K580-L584 PolarHBondContact O-N 3.49Å
581	A	71.3	Confident	63.4	Low	60 Å²	60	103.2 Å²	103.2	50%	0.496	52%	0.519	S	S	.	.	H	α-helix	trans	-63	-43.8	175.3	0	0	0	0	0	110.8	L577 K579 L584 A585	L577-A581 WeakPolarHBondContact O-CB 3.22Å; L577-A581 PolarHBondContact O-N 3.1Å; K579-A581 PolarHBondContact O-N 3.43Å; A581-L584 PolarHBondContact O-N 2.87Å; A581-A585 VanDerWaalsContact O-CB 3.23Å; A581-A585 WeakPolarHBondContact O-CB 3.41Å; A581-A585 PolarHBondContact O-N 2.71Å
582	K	74.2	Confident	63	Low	122 Å²	122	109 Å²	109	53%	0.53	53%	0.531	S	S	.	.	H	α-helix	trans	-60.2	-43.7	171.3	-78.6	-178.7	177.5	-171	0	111.8	K578 K579 A585 K586	K578-K582 VanDerWaalsContact O-CB 3.3Å; K578-K582 WeakPolarHBondContact O-CB 3.39Å; K578-K582 VanDerWaalsContact O-CG 3.26Å; K578-K582 WeakPolarHBondContact O-CG 3.26Å; K578-K582 PolarHBondContact O-N 3.28Å; K579-K582 CarbonylContact O-C 3.48Å; K579-K582 WeakPolarHBondContact O-CB 3.36Å; K579-K582 PolarHBondContact O-N 3.08Å; K582-A585 PolarHBondContact O-N 3.18Å; K582-K586 WeakPolarHBondContact O-CB 3.4Å; K582-K586 VanDerWaalsContact O-CG 3.28Å; K582-K586 WeakPolarHBondContact O-CG 3.47Å; K582-K586 PolarHBondContact O-N 2.95Å
583	D	73	Confident	62.3	Low	73 Å²	73	108.2 Å²	108.2	39%	0.39	53%	0.53	S	S	.	.	H	α-helix	trans	-67	-37.7	178.5	-71.1	-20.6	0	0	0	112.1	K579 K580 K586 R587	K579-D583 WeakPolarHBondContact O-CB 3.47Å; K579-D583 VanDerWaalsContact O-CG 3.25Å; K579-D583 PolarHBondContact O-N 2.9Å; K580-D583 PolarHBondContact O-N 2.95Å; D583-K586 PolarHBondContact O-N 2.99Å; D583-R587 WeakPolarHBondContact O-CB 3.49Å; D583-R587 WeakPolarHBondContact O-CG 3.39Å; D583-R587 PolarHBondContact O-N 3.2Å
584	L	67	Low	62.2	Low	115 Å²	115	109.5 Å²	109.5	60%	0.602	53%	0.533	S	S	*	.	H	α-helix	trans	-69.2	-43	174.7	-127.8	142	0	0	0	110.7	K580 A581 R587 V588	K580-L584 WeakPolarHBondContact O-CB 3.44Å; K580-L584 PolarHBondContact O-N 3.49Å; A581-L584 PolarHBondContact O-N 2.87Å; L584-R587 PolarHBondContact O-N 2.77Å; L584-V588 HydrophobicContact CD2-CG2 4.37Å; L584-V588 WeakPolarHBondContact O-CB 3.28Å; L584-V588 VanDerWaalsContact O-CG2 3.29Å; L584-V588 WeakPolarHBondContact O-CG2 3.46Å; L584-V588 PolarHBondContact O-N 3.42Å
585	A	66.8	Low	62.3	Low	57 Å²	57	108.8 Å²	108.8	47%	0.471	52%	0.521	S	S	.	.	H	α-helix	trans	-59.4	-45.7	172.5	0	0	0	0	0	110.9	A581 K582 R587 V588 Q589	A581-A585 VanDerWaalsContact O-CB 3.23Å; A581-A585 WeakPolarHBondContact O-CB 3.41Å; A581-A585 PolarHBondContact O-N 2.71Å; K582-A585 PolarHBondContact O-N 3.18Å; A585-R587 PolarHBondContact O-N 3.48Å; A585-V588 PolarHBondContact O-N 2.83Å; A585-Q589 VanDerWaalsContact O-CB 3.24Å; A585-Q589 WeakPolarHBondContact O-CB 3.29Å; A585-Q589 PolarHBondContact O-N 3.4Å
586	K	65.8	Low	62.6	Low	139 Å²	139	104.4 Å²	104.4	60%	0.604	50%	0.501	S	S	*	.	H	α-helix	trans	-59.8	-41.7	173.1	-76.5	-179.2	-179.3	-170.5	0	111.8	K582 D583 Q589 K590	K582-K586 WeakPolarHBondContact O-CB 3.4Å; K582-K586 VanDerWaalsContact O-CG 3.28Å; K582-K586 WeakPolarHBondContact O-CG 3.47Å; K582-K586 PolarHBondContact O-N 2.95Å; D583-K586 PolarHBondContact O-N 2.99Å; K586-Q589 PolarHBondContact O-N 2.86Å; K586-K590 VanDerWaalsContact O-CB 3.26Å; K586-K590 WeakPolarHBondContact O-CB 3.48Å; K586-K590 PolarHBondContact O-N 3.3Å
587	R	59.1	Low	62.8	Low	199 Å²	199	103.2 Å²	103.2	75%	0.751	50%	0.495	S	S	*	.	H	α-helix	trans	-66.9	-40.8	176.3	-78.4	177.9	-178.1	-171.8	1.1	112.6	D583 L584 A585 K590 K591	D583-R587 WeakPolarHBondContact O-CB 3.49Å; D583-R587 WeakPolarHBondContact O-CG 3.39Å; D583-R587 PolarHBondContact O-N 3.2Å; L584-R587 PolarHBondContact O-N 2.77Å; A585-R587 PolarHBondContact O-N 3.48Å; R587-K590 PolarHBondContact O-N 3.28Å; R587-K591 PolarHBondContact O-N 2.79Å
588	V	58.7	Low	63.1	Low	82 Å²	82	106.6 Å²	106.6	50%	0.497	50%	0.502	S	S	.	.	H	α-helix	trans	-66.4	-42.1	175.6	171.9	0	0	0	0	110.3	L584 A585 K591 R592	L584-V588 HydrophobicContact CD2-CG2 4.37Å; L584-V588 WeakPolarHBondContact O-CB 3.28Å; L584-V588 VanDerWaalsContact O-CG2 3.29Å; L584-V588 WeakPolarHBondContact O-CG2 3.46Å; L584-V588 PolarHBondContact O-N 3.42Å; A585-V588 PolarHBondContact O-N 2.83Å; V588-K591 PolarHBondContact O-N 3.28Å; V588-R592 PolarHBondContact O-N 3.37Å
589	Q	53.8	Low	63.3	Low	136 Å²	136	100.2 Å²	100.2	64%	0.636	48%	0.475	S	S	*	.	H	α-helix	trans	-64.4	-41.8	175.4	-167.1	173.4	15	0	0	111.8	A585 K586 K591 R592 S593	A585-Q589 VanDerWaalsContact O-CB 3.24Å; A585-Q589 WeakPolarHBondContact O-CB 3.29Å; A585-Q589 PolarHBondContact O-N 3.4Å; K586-Q589 PolarHBondContact O-N 2.86Å; Q589-K591 VanDerWaalsContact C-N 3.26Å; Q589-K591 PolarHBondContact O-N 2.83Å; Q589-R592 PolarHBondContact O-N 2.88Å; Q589-R592 VanDerWaalsContact O-N 3.12Å; Q589-S593 WeakPolarHBondContact O-CB 3.49Å; Q589-S593 PolarHBondContact O-N 3.5Å
590	K	51.7	Low	63.7	Low	178 Å²	178	96 Å²	96	77%	0.774	46%	0.456	S	S	*	.	H	α-helix	trans	-66.8	-26	175.3	-152.7	173.3	-168.5	175.4	0	112.7	K586 R587	K586-K590 VanDerWaalsContact O-CB 3.26Å; K586-K590 WeakPolarHBondContact O-CB 3.48Å; K586-K590 PolarHBondContact O-N 3.3Å; R587-K590 PolarHBondContact O-N 3.28Å
591	K	47.1	Very low	64.3	Low	192 Å²	192	99 Å²	99	84%	0.835	47%	0.466	S	S	*	.	H	α-helix	trans	-78.6	-26.8	172.4	-135.9	-179.2	-176	-172.9	0	112.8	R587 V588 Q589	R587-K591 PolarHBondContact O-N 2.79Å; V588-K591 PolarHBondContact O-N 3.28Å; Q589-K591 VanDerWaalsContact C-N 3.26Å; Q589-K591 PolarHBondContact O-N 2.83Å
592	R	46.3	Very low	64.5	Low	207 Å²	207	101 Å²	101	78%	0.781	46%	0.464	S	S	*	.	H	α-helix	trans	-79.1	-30.3	171.2	-82.9	-173.9	168	-176.6	-4.1	113.3	V588 Q589 K594	V588-R592 PolarHBondContact O-N 3.37Å; Q589-R592 PolarHBondContact O-N 2.88Å; Q589-R592 VanDerWaalsContact O-N 3.12Å; R592-K594 PolarHBondContact O-N 3.43Å
593	S	45	Very low	64.7	Low	83 Å²	83	100.4 Å²	100.4	58%	0.58	46%	0.46	S	S	*	.			trans	-92.2	65.9	-179.2	168.4	0	0	0	0	112.1	Q589	Q589-S593 WeakPolarHBondContact O-CB 3.49Å; Q589-S593 PolarHBondContact O-N 3.5Å
594	K	55.9	Low	64.9	Low	78 Å²	78	99.2 Å²	99.2	34%	0.339	46%	0.464	S	S	.	.			trans	-72.3	132.8	148.7	-82.6	-171.5	177.2	-171.8	0	105.8	R592 I596 I599 E602 H623 Y625	R592-K594 PolarHBondContact O-N 3.43Å; K594-I596 PolarHBondContact O-N 2.69Å; K594-I599 HydrophobicContact CB-CD1 4Å; K594-I599 HydrophobicContact CB-CG1 4.01Å; K594-I599 HydrophobicContact CD-CG1 4.33Å; K594-E602 IonicContact NZ-OE1 2.96Å; K594-E602 PolarHBondContact NZ-OE1 3.05Å; K594-E602 IonicContact NZ-OE2 3.13Å; K594-E602 PolarHBondContact NZ-OE2 3Å; K594-H623 PolarHBondContact NZ-NE2 3.47Å; K594-Y625 PolarHBondContact O-OH 3.46Å
595	S	65.8	Low	65.5	Low	31 Å²	31	94.1 Å²	94.1	22%	0.217	44%	0.438	C	S	.	.			trans	-60.8	141.1	176.8	59.4	0	0	0	0	110.1	V597 R598 I599	S595-V597 PolarHBondContact O-N 3.17Å; S595-R598 WeakPolarHBondContact O-CB 3.39Å; S595-R598 PolarHBondContact O-N 2.83Å; S595-R598 WeakPolarHBondContact OG-CB 3.44Å; S595-R598 PolarHBondContact OG-N 2.79Å; S595-I599 PolarHBondContact O-N 3.47Å; S595-I599 VanDerWaalsContact O-N 3.17Å
596	I	70.7	Confident	65.9	Low	18 Å²	18	93.8 Å²	93.8	9%	0.092	43%	0.427	C	S	.	.	H	α-helix	trans	-49.9	-43.3	176.1	-70.3	169.5	0	0	0	110.1	K594 R598 I599 L600 Y616 L620 Y625 T633 L653 I657	K594-I596 PolarHBondContact O-N 2.69Å; I596-R598 PolarHBondContact O-N 2.89Å; I596-I599 WeakPolarHBondContact O-CB 3.21Å; I596-I599 PolarHBondContact O-N 3.18Å; I596-I599 VanDerWaalsContact O-N 3.14Å; I596-L600 HydrophobicContact CG2-CD1 3.83Å; I596-L600 HydrophobicContact CG2-CG 4.38Å; I596-L600 WeakPolarHBondContact O-CG 3.34Å; I596-L600 PolarHBondContact O-N 3.36Å; I596-Y616 HydrophobicContact CG2-CE2 4.14Å; I596-L620 HydrophobicContact CB-CD2 4.15Å; I596-L620 HydrophobicContact CG1-CD1 4.45Å; I596-L620 HydrophobicContact CG1-CD2 3.85Å; I596-L620 HydrophobicContact CG2-CD1 4.05Å; I596-L620 HydrophobicContact CG2-CD2 3.99Å; I596-Y625 HydrophobicContact CD1-CE1 4.21Å; I596-Y625 HydrophobicContact CG1-CE1 3.86Å; I596-T633 HydrophobicContact CD1-CG2 3.87Å; I596-L653 HydrophobicContact CG2-CD2 4.48Å; I596-I657 HydrophobicContact CB-CD1 4.04Å; I596-I657 HydrophobicContact CD1-CD1 4.44Å; I596-I657 HydrophobicContact CG2-CD1 4.3Å
597	V	70.7	Confident	66.4	Low	2 Å²	2	89.8 Å²	89.8	1%	0.012	43%	0.425	C	S	.	.	H	α-helix	trans	-51.6	-49.8	173.4	175.4	0	0	0	0	111.8	S595 I599 L600 R601 M606 L653 A654 I657	S595-V597 PolarHBondContact O-N 3.17Å; V597-I599 VanDerWaalsContact C-N 3.32Å; V597-I599 PolarHBondContact O-N 3.49Å; V597-L600 PolarHBondContact O-N 3.26Å; V597-R601 WeakPolarHBondContact O-CB 3.36Å; V597-R601 PolarHBondContact O-N 2.89Å; V597-M606 HydrophobicContact CB-CE 3.92Å; V597-M606 HydrophobicContact CG1-CE 3.28Å; V597-M606 HydrophobicContact CG1-SD 4.27Å; V597-M606 WeakPolarHBondContact O-CE 3.19Å; V597-L653 HydrophobicContact CG2-CD2 3.85Å; V597-A654 HydrophobicContact CG1-CB 4.38Å; V597-A654 HydrophobicContact CG2-CB 4.47Å; V597-I657 HydrophobicContact CB-CG2 4.44Å; V597-I657 HydrophobicContact CG2-CB 3.67Å; V597-I657 HydrophobicContact CG2-CD1 3.91Å; V597-I657 HydrophobicContact CG2-CG1 4.34Å; V597-I657 HydrophobicContact CG2-CG2 3.67Å
598	R	72	Confident	67.4	Low	152 Å²	152	84.8 Å²	84.8	57%	0.574	41%	0.409	S	S	*	.	H	α-helix	trans	-66	-36	-179.5	-170.6	175.3	178.9	167.6	5.6	112.3	S595 I596 R601 E602	S595-R598 WeakPolarHBondContact O-CB 3.39Å; S595-R598 PolarHBondContact O-N 2.83Å; S595-R598 WeakPolarHBondContact OG-CB 3.44Å; S595-R598 PolarHBondContact OG-N 2.79Å; I596-R598 PolarHBondContact O-N 2.89Å; R598-R601 PolarHBondContact O-N 3.43Å; R598-E602 IonicContact NE-OE1 2.75Å; R598-E602 WeakPolarHBondContact O-CG 3.23Å; R598-E602 PolarHBondContact O-N 3.48Å
599	I	75.3	Confident	68.4	Low	1 Å²	1	89.3 Å²	89.3	1%	0.005	42%	0.424	C	S	.	.	H	α-helix	trans	-66	-46.2	176.8	-65.2	163.9	0	0	0	110.5	K594 S595 I596 V597 R601 E602 Y603 A619 L620 H623 Y625	K594-I599 HydrophobicContact CB-CD1 4Å; K594-I599 HydrophobicContact CB-CG1 4.01Å; K594-I599 HydrophobicContact CD-CG1 4.33Å; S595-I599 PolarHBondContact O-N 3.47Å; S595-I599 VanDerWaalsContact O-N 3.17Å; I596-I599 WeakPolarHBondContact O-CB 3.21Å; I596-I599 PolarHBondContact O-N 3.18Å; I596-I599 VanDerWaalsContact O-N 3.14Å; V597-I599 VanDerWaalsContact C-N 3.32Å; V597-I599 PolarHBondContact O-N 3.49Å; I599-R601 VanDerWaalsContact C-N 3.29Å; I599-R601 PolarHBondContact O-N 2.88Å; I599-E602 PolarHBondContact O-N 2.92Å; I599-Y603 HydrophobicContact CG2-CD2 4.27Å; I599-Y603 PolarHBondContact O-N 3.14Å; I599-A619 HydrophobicContact CG2-CB 4.34Å; I599-A619 WeakPolarHBondContact CG2-O 3.34Å; I599-L620 HydrophobicContact CB-CD2 4.41Å; I599-L620 HydrophobicContact CD1-CD2 4.03Å; I599-L620 HydrophobicContact CG2-CD2 4.25Å; I599-H623 HydrophobicContact CD1-CB 3.68Å; I599-H623 HydrophobicContact CG1-CB 4.33Å; I599-H623 HydrophobicContact CG2-CB 4.39Å; I599-H623 WeakPolarHBondContact CG2-ND1 3.47Å; I599-Y625 HydrophobicContact CD1-CD2 4.24Å; I599-Y625 HydrophobicContact CD1-CE2 3.38Å
600	L	80	Confident	69.7	Low	4 Å²	4	88.2 Å²	88.2	2%	0.021	42%	0.418	C	S	.	.	H	α-helix	trans	-63.2	-36.3	177.2	-66.1	170.2	0	0	0	112	I596 V597 Y603 G604 L605 M606 L611 Y616 A619 L653	I596-L600 HydrophobicContact CG2-CD1 3.83Å; I596-L600 HydrophobicContact CG2-CG 4.38Å; I596-L600 WeakPolarHBondContact O-CG 3.34Å; I596-L600 PolarHBondContact O-N 3.36Å; V597-L600 PolarHBondContact O-N 3.26Å; L600-Y603 PolarHBondContact O-N 3.43Å; L600-G604 PolarHBondContact O-N 3.29Å; L600-L605 HydrophobicContact CD2-CB 4.39Å; L600-L605 HydrophobicContact CD2-CD1 4.01Å; L600-L605 PolarHBondContact O-N 3.33Å; L600-M606 HydrophobicContact CB-CE 4.26Å; L600-L611 HydrophobicContact CD1-CD2 4.47Å; L600-L611 HydrophobicContact CD2-CD2 4.3Å; L600-Y616 HydrophobicContact CD1-CD2 3.84Å; L600-Y616 HydrophobicContact CD1-CE2 3.72Å; L600-Y616 HydrophobicContact CD2-CD2 3.73Å; L600-Y616 HydrophobicContact CD2-CE2 4.31Å; L600-Y616 HydrophobicContact CD2-CG 4.43Å; L600-Y616 HydrophobicContact CG-CD2 4.39Å; L600-A619 HydrophobicContact CD2-CB 4.13Å; L600-L653 HydrophobicContact CD1-CD2 4.21Å
601	R	79.3	Confident	71.2	Confident	151 Å²	151	79.9 Å²	79.9	57%	0.57	38%	0.381	S	S	*	.	H	α-helix	trans	-68.7	-38.8	174.2	-161.6	179	-70	160.9	0.9	112.2	V597 R598 I599 Y603 G604 M606	V597-R601 WeakPolarHBondContact O-CB 3.36Å; V597-R601 PolarHBondContact O-N 2.89Å; R598-R601 PolarHBondContact O-N 3.43Å; I599-R601 VanDerWaalsContact C-N 3.29Å; I599-R601 PolarHBondContact O-N 2.88Å; R601-Y603 VanDerWaalsContact C-N 3.31Å; R601-Y603 PolarHBondContact O-N 3.04Å; R601-G604 PolarHBondContact O-N 3.22Å; R601-M606 HydrophobicContact CB-CE 4.09Å; R601-M606 HydrophobicContact CB-SD 4.48Å
602	E	76.2	Confident	73.1	Confident	101 Å²	101	72.7 Å²	72.7	47%	0.472	35%	0.354	S	S	.	.	H	α-helix	trans	-62.5	-35.9	174.2	-79.5	175.8	-168.4	0	0	112.1	K594 R598 I599 G604 H623	K594-E602 IonicContact NZ-OE1 2.96Å; K594-E602 PolarHBondContact NZ-OE1 3.05Å; K594-E602 IonicContact NZ-OE2 3.13Å; K594-E602 PolarHBondContact NZ-OE2 3Å; R598-E602 IonicContact NE-OE1 2.75Å; R598-E602 WeakPolarHBondContact O-CG 3.23Å; R598-E602 PolarHBondContact O-N 3.48Å; I599-E602 PolarHBondContact O-N 2.92Å; E602-G604 VanDerWaalsContact C-N 3.26Å; E602-G604 PolarHBondContact O-N 3.12Å; E602-H623 IonicContact OE2-NE2 2.9Å
603	Y	77.9	Confident	75	Confident	110 Å²	110	65 Å²	65	43%	0.431	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-2.9	173.5	-88.7	-92.5	0	0	0	114.1	I599 L600 R601 L605 A619 S622 H623	I599-Y603 HydrophobicContact CG2-CD2 4.27Å; I599-Y603 PolarHBondContact O-N 3.14Å; L600-Y603 PolarHBondContact O-N 3.43Å; R601-Y603 VanDerWaalsContact C-N 3.31Å; R601-Y603 PolarHBondContact O-N 3.04Å; Y603-L605 HydrophobicContact CG-CD1 4.37Å; Y603-L605 PolarHBondContact O-N 3.39Å; Y603-A619 HydrophobicContact CD1-CB 4.3Å; Y603-A619 HydrophobicContact CD2-CB 3.71Å; Y603-A619 HydrophobicContact CE2-CB 4.12Å; Y603-A619 HydrophobicContact CG-CB 3.83Å; Y603-S622 WeakPolarHBondContact CE2-OG 3.34Å; Y603-S622 VanDerWaalsContact OH-CB 3.23Å; Y603-S622 WeakPolarHBondContact OH-CB 3.26Å; Y603-S622 PolarHBondContact OH-OG 3.01Å; Y603-H623 AromaticContact CE2-CE1 3.93Å
604	G	77.4	Confident	76.8	Confident	47 Å²	47	68.4 Å²	68.4	49%	0.485	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	26.7	-176.2	0	0	0	0	0	113.6	L600 R601 E602 K608	L600-G604 PolarHBondContact O-N 3.29Å; R601-G604 PolarHBondContact O-N 3.22Å; E602-G604 VanDerWaalsContact C-N 3.26Å; E602-G604 PolarHBondContact O-N 3.12Å; G604-K608 WeakPolarHBondContact O-CE 3.49Å
605	L	80.9	Confident	78.3	Confident	9 Å²	9	67.4 Å²	67.4	5%	0.047	33%	0.331	C	S	.	.			trans	-89.3	-20.5	-177.7	-71.6	171	0	0	0	113.1	L600 Y603 L611 D615 A619	L600-L605 HydrophobicContact CD2-CB 4.39Å; L600-L605 HydrophobicContact CD2-CD1 4.01Å; L600-L605 PolarHBondContact O-N 3.33Å; Y603-L605 HydrophobicContact CG-CD1 4.37Å; Y603-L605 PolarHBondContact O-N 3.39Å; L605-L611 HydrophobicContact CB-CD1 3.73Å; L605-L611 HydrophobicContact CD1-CD1 4.25Å; L605-L611 HydrophobicContact CD2-CD1 3.79Å; L605-L611 HydrophobicContact CG-CD1 4.11Å; L605-D615 HydrophobicContact CD1-CB 4.27Å; L605-D615 HydrophobicContact CD2-CB 3.74Å; L605-A619 HydrophobicContact CD1-CB 3.63Å
606	M	75.2	Confident	79.2	Confident	50 Å²	50	66 Å²	66	25%	0.246	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	129.2	-177.6	-160.8	-171.7	-72.4	0	0	111.1	V597 L600 R601	V597-M606 HydrophobicContact CB-CE 3.92Å; V597-M606 HydrophobicContact CG1-CE 3.28Å; V597-M606 HydrophobicContact CG1-SD 4.27Å; V597-M606 WeakPolarHBondContact O-CE 3.19Å; L600-M606 HydrophobicContact CB-CE 4.26Å; R601-M606 HydrophobicContact CB-CE 4.09Å; R601-M606 HydrophobicContact CB-SD 4.48Å
607	G	76	Confident	79.9	Confident	54 Å²	54	69.8 Å²	69.8	56%	0.557	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	95	4.6	-179.1	0	0	0	0	0	115
608	K	80.1	Confident	80.6	Confident	94 Å²	94	76.7 Å²	76.7	41%	0.409	36%	0.364	S	S	.	.	S	Bend	trans	-74.3	147.6	167.3	-65.2	-176.6	179.8	-178.4	0	109.3	G604 K610 Q650	G604-K608 WeakPolarHBondContact O-CE 3.49Å; K608-K610 PolarHBondContact O-N 2.71Å; K608-Q650 PolarHBondContact O-NE2 2.8Å
609	E	78.4	Confident	81.2	Confident	178 Å²	178	69.5 Å²	69.5	83%	0.832	34%	0.337	S	S	*	.	S	Bend	trans	-53.9	-36.3	178.5	-74.3	-179	169	0	0	112.7
610	K	81.7	Confident	81.5	Confident	113 Å²	113	69.5 Å²	69.5	49%	0.491	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	134.6	172	-66	-166.3	169.5	-141.3	0	110.6	K608 D642 N644	K608-K610 PolarHBondContact O-N 2.71Å; K610-D642 IonicContact NZ-OD2 3.88Å; K610-D642 PolarHBondContact NZ-OD2 3.48Å; K610-N644 HydrophobicContact CB-CB 4.16Å; K610-N644 HydrophobicContact CD-CB 4.48Å
611	L	84.4	Confident	81.6	Confident	2 Å²	2	74.3 Å²	74.3	1%	0.01	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	101.9	173.5	172.8	59.7	0	0	0	110	L600 L605 D615 Y616 N644 L645 Q650	L600-L611 HydrophobicContact CD1-CD2 4.47Å; L600-L611 HydrophobicContact CD2-CD2 4.3Å; L605-L611 HydrophobicContact CB-CD1 3.73Å; L605-L611 HydrophobicContact CD1-CD1 4.25Å; L605-L611 HydrophobicContact CD2-CD1 3.79Å; L605-L611 HydrophobicContact CG-CD1 4.11Å; L611-D615 HydrophobicContact CD1-CB 4.17Å; L611-Y616 HydrophobicContact CD2-CD2 4.07Å; L611-N644 CarbonylContact O-C 3.55Å; L611-N644 VanDerWaalsContact O-CA 3.26Å; L611-N644 WeakPolarHBondContact O-CA 3.24Å; L611-L645 HydrophobicContact CB-CB 4.19Å; L611-L645 HydrophobicContact CD2-CD1 4.23Å; L611-L645 PolarHBondContact N-O 2.95Å; L611-L645 PolarHBondContact O-N 2.92Å; L611-Q650 HydrophobicContact CB-CG 4.46Å
612	P	86.5	Confident	81.5	Confident	42 Å²	42	70.1 Å²	70.1	27%	0.273	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	144.7	-179.4	24.7	-31.3	0	0	0	112.4	E614 D615 Y616 N644	P612-E614 PolarHBondContact O-N 3.2Å; P612-E614 VanDerWaalsContact O-N 3.14Å; P612-D615 HydrophobicContact CG-CB 4.11Å; P612-D615 PolarHBondContact O-N 2.92Å; P612-D615 VanDerWaalsContact O-N 3.11Å; P612-Y616 PolarHBondContact O-N 3.39Å; P612-Y616 VanDerWaalsContact O-N 3.17Å; P612-N644 VanDerWaalsContact CA-OD1 3.26Å; P612-N644 WeakPolarHBondContact CA-OD1 3.3Å; P612-N644 WeakPolarHBondContact CB-OD1 3.47Å
613	Y	85.1	Confident	81.3	Confident	46 Å²	46	68.4 Å²	68.4	18%	0.18	34%	0.343	C	S	.	.	H	α-helix	trans	-52	-36.9	178.5	177.9	-118.9	0	0	0	113.3	D615 Y616 R617 I630 F631 F634 N643	Y613-D615 PolarHBondContact O-N 3.14Å; Y613-Y616 HydrophobicContact CD2-CD1 4.46Å; Y613-Y616 PolarHBondContact O-N 2.96Å; Y613-R617 HydrophobicContact CE2-CB 4.48Å; Y613-R617 WeakPolarHBondContact O-CB 3.44Å; Y613-R617 PolarHBondContact O-N 2.95Å; Y613-I630 HydrophobicContact CE2-CG2 4.22Å; Y613-F631 HydrophobicContact CE2-CD2 4.49Å; Y613-F634 HydrophobicContact CD2-CB 3.87Å; Y613-F634 AromaticContact CD2-CD1 3.43Å; Y613-F634 HydrophobicContact CD2-CD1 3.43Å; Y613-F634 VanDerWaalsContact CD2-CD1 3.43Å; Y613-F634 AromaticContact CD2-CD2 3.67Å; Y613-F634 HydrophobicContact CD2-CD2 3.67Å; Y613-F634 AromaticContact CD2-CE1 3.8Å; Y613-F634 HydrophobicContact CD2-CE1 3.8Å; Y613-F634 AromaticContact CD2-CE2 3.98Å; Y613-F634 HydrophobicContact CD2-CE2 3.98Å; Y613-F634 AromaticContact CD2-CG 3.36Å; Y613-F634 HydrophobicContact CD2-CG 3.36Å; Y613-F634 HydrophobicContact CD2-CZ 4.04Å; Y613-F634 HydrophobicContact CE2-CB 3.83Å; Y613-F634 HydrophobicContact CE2-CD1 4.11Å; Y613-F634 HydrophobicContact CE2-CD2 4.41Å; Y613-F634 AromaticContact CE2-CG 3.87Å; Y613-F634 HydrophobicContact CE2-CG 3.87Å; Y613-F634 HydrophobicContact CG-CD1 4.16Å; Y613-F634 HydrophobicContact CG-CE1 4.12Å; Y613-F634 HydrophobicContact CG-CG 4.42Å; Y613-F634 HydrophobicContact CG-CZ 4.3Å; Y613-N643 WeakPolarHBondContact CB-O 3.43Å; Y613-N643 PolarHBondContact N-O 3.17Å
614	E	84.1	Confident	81	Confident	153 Å²	153	66.5 Å²	66.5	72%	0.715	36%	0.357	S	S	*	.	H	α-helix	trans	-63	-41.6	-179.6	-63.5	-166.7	159.9	0	0	112.9	P612 K618	P612-E614 PolarHBondContact O-N 3.2Å; P612-E614 VanDerWaalsContact O-N 3.14Å; E614-K618 VanDerWaalsContact O-CB 3.29Å; E614-K618 WeakPolarHBondContact O-CB 3.48Å; E614-K618 PolarHBondContact O-N 3.08Å
615	D	86.2	Confident	80.9	Confident	58 Å²	58	66.4 Å²	66.4	31%	0.31	34%	0.342	S	S	.	.	H	α-helix	trans	-70.8	-41.7	177.9	-82	-15.4	0	0	0	111	L605 L611 P612 Y613 K618 A619	L605-D615 HydrophobicContact CD1-CB 4.27Å; L605-D615 HydrophobicContact CD2-CB 3.74Å; L611-D615 HydrophobicContact CD1-CB 4.17Å; P612-D615 HydrophobicContact CG-CB 4.11Å; P612-D615 PolarHBondContact O-N 2.92Å; P612-D615 VanDerWaalsContact O-N 3.11Å; Y613-D615 PolarHBondContact O-N 3.14Å; D615-K618 PolarHBondContact O-N 3.29Å; D615-A619 WeakPolarHBondContact O-CB 3.44Å; D615-A619 PolarHBondContact O-N 3.45Å
616	Y	85.3	Confident	80.5	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-57.8	-49.2	173.2	178.3	-89.6	0	0	0	111.5	I596 L600 L611 P612 Y613 K618 A619 L620 I630 F634 L645 L653	I596-Y616 HydrophobicContact CG2-CE2 4.14Å; L600-Y616 HydrophobicContact CD1-CD2 3.84Å; L600-Y616 HydrophobicContact CD1-CE2 3.72Å; L600-Y616 HydrophobicContact CD2-CD2 3.73Å; L600-Y616 HydrophobicContact CD2-CE2 4.31Å; L600-Y616 HydrophobicContact CD2-CG 4.43Å; L600-Y616 HydrophobicContact CG-CD2 4.39Å; L611-Y616 HydrophobicContact CD2-CD2 4.07Å; P612-Y616 PolarHBondContact O-N 3.39Å; P612-Y616 VanDerWaalsContact O-N 3.17Å; Y613-Y616 HydrophobicContact CD2-CD1 4.46Å; Y613-Y616 PolarHBondContact O-N 2.96Å; Y616-K618 PolarHBondContact O-N 3.35Å; Y616-A619 PolarHBondContact O-N 2.89Å; Y616-L620 HydrophobicContact CD1-CD1 3.92Å; Y616-L620 HydrophobicContact CE1-CD1 3.3Å; Y616-L620 HydrophobicContact CE2-CD1 4Å; Y616-L620 HydrophobicContact CG-CD1 4.48Å; Y616-L620 PolarHBondContact O-N 2.75Å; Y616-L620 VanDerWaalsContact O-N 3.08Å; Y616-I630 HydrophobicContact CD1-CG2 3.93Å; Y616-I630 HydrophobicContact CE1-CG2 3.86Å; Y616-F634 HydrophobicContact CD1-CB 4.07Å; Y616-F634 AromaticContact CD1-CD2 3.44Å; Y616-F634 HydrophobicContact CD1-CD2 3.44Å; Y616-F634 VanDerWaalsContact CD1-CD2 3.44Å; Y616-F634 HydrophobicContact CD1-CE2 4.28Å; Y616-F634 HydrophobicContact CD1-CG 4.16Å; Y616-F634 AromaticContact CD2-CD2 3.93Å; Y616-F634 HydrophobicContact CD2-CD2 3.93Å; Y616-F634 HydrophobicContact CD2-CE2 4.38Å; Y616-F634 HydrophobicContact CE1-CB 3.74Å; Y616-F634 AromaticContact CE1-CD2 3.8Å; Y616-F634 HydrophobicContact CE1-CD2 3.8Å; Y616-F634 HydrophobicContact CE1-CG 4.26Å; Y616-F634 HydrophobicContact CE2-CD2 4.24Å; Y616-F634 AromaticContact CG-CD2 3.52Å; Y616-F634 HydrophobicContact CG-CD2 3.52Å; Y616-F634 AromaticContact CG-CE2 3.98Å; Y616-F634 HydrophobicContact CG-CE2 3.98Å; Y616-L645 HydrophobicContact CD2-CD1 4.15Å; Y616-L645 HydrophobicContact CE2-CD1 4.25Å; Y616-L653 HydrophobicContact CE2-CD1 4.03Å
617	R	84.9	Confident	80.5	Confident	98 Å²	98	69.3 Å²	69.3	37%	0.37	36%	0.36	S	S	.	.	H	α-helix	trans	-61.6	-44.1	177.5	176.9	179.5	171.4	-137.1	5	111.6	Y613 L620 K621 E627 I630	Y613-R617 HydrophobicContact CE2-CB 4.48Å; Y613-R617 WeakPolarHBondContact O-CB 3.44Å; Y613-R617 PolarHBondContact O-N 2.95Å; R617-L620 PolarHBondContact O-N 2.96Å; R617-K621 WeakPolarHBondContact O-CB 3.3Å; R617-K621 PolarHBondContact O-N 2.66Å; R617-E627 IonicContact CZ-OE1 2.97Å; R617-E627 IonicContact NE-OE1 3.99Å; R617-E627 PolarHBondContact NE-OE1 3.14Å; R617-E627 IonicContact NH2-OE1 2.69Å; R617-E627 PolarHBondContact NH2-OE1 3.18Å; R617-I630 HydrophobicContact CB-CG2 4.03Å; R617-I630 HydrophobicContact CG-CG2 4.19Å
618	K	86.6	Confident	80.4	Confident	148 Å²	148	70.9 Å²	70.9	64%	0.643	36%	0.361	S	S	*	.	H	α-helix	trans	-62.2	-43.4	178.3	-172.8	178.7	-178.5	-179.5	0	111.8	E614 D615 Y616 S622	E614-K618 VanDerWaalsContact O-CB 3.29Å; E614-K618 WeakPolarHBondContact O-CB 3.48Å; E614-K618 PolarHBondContact O-N 3.08Å; D615-K618 PolarHBondContact O-N 3.29Å; Y616-K618 PolarHBondContact O-N 3.35Å; K618-S622 PolarHBondContact O-N 2.78Å
619	A	83.3	Confident	80.3	Confident	1 Å²	1	71.3 Å²	71.3	1%	0.008	36%	0.364	C	S	.	.	H	α-helix	trans	-64.2	-44.2	178.6	0	0	0	0	0	112.1	I599 L600 Y603 L605 D615 Y616 S622 H623	I599-A619 HydrophobicContact CG2-CB 4.34Å; I599-A619 WeakPolarHBondContact CG2-O 3.34Å; L600-A619 HydrophobicContact CD2-CB 4.13Å; Y603-A619 HydrophobicContact CD1-CB 4.3Å; Y603-A619 HydrophobicContact CD2-CB 3.71Å; Y603-A619 HydrophobicContact CE2-CB 4.12Å; Y603-A619 HydrophobicContact CG-CB 3.83Å; L605-A619 HydrophobicContact CD1-CB 3.63Å; D615-A619 WeakPolarHBondContact O-CB 3.44Å; D615-A619 PolarHBondContact O-N 3.45Å; Y616-A619 PolarHBondContact O-N 2.89Å; A619-S622 PolarHBondContact O-OG 3.49Å; A619-H623 PolarHBondContact O-ND1 2.92Å
620	L	82.9	Confident	80.3	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-76.6	-36.7	-179.2	-72.2	176	0	0	0	113.8	I596 I599 Y616 R617 S622 H623 G624 Y625 I630	I596-L620 HydrophobicContact CB-CD2 4.15Å; I596-L620 HydrophobicContact CG1-CD1 4.45Å; I596-L620 HydrophobicContact CG1-CD2 3.85Å; I596-L620 HydrophobicContact CG2-CD1 4.05Å; I596-L620 HydrophobicContact CG2-CD2 3.99Å; I599-L620 HydrophobicContact CB-CD2 4.41Å; I599-L620 HydrophobicContact CD1-CD2 4.03Å; I599-L620 HydrophobicContact CG2-CD2 4.25Å; Y616-L620 HydrophobicContact CD1-CD1 3.92Å; Y616-L620 HydrophobicContact CE1-CD1 3.3Å; Y616-L620 HydrophobicContact CE2-CD1 4Å; Y616-L620 HydrophobicContact CG-CD1 4.48Å; Y616-L620 PolarHBondContact O-N 2.75Å; Y616-L620 VanDerWaalsContact O-N 3.08Å; R617-L620 PolarHBondContact O-N 2.96Å; L620-S622 VanDerWaalsContact C-N 3.26Å; L620-S622 PolarHBondContact O-N 2.8Å; L620-H623 PolarHBondContact O-N 3.17Å; L620-G624 PolarHBondContact O-N 2.92Å; L620-Y625 HydrophobicContact CB-CD2 4.22Å; L620-Y625 HydrophobicContact CB-CG 4.26Å; L620-Y625 HydrophobicContact CD2-CD2 3.72Å; L620-Y625 HydrophobicContact CD2-CE2 3.85Å; L620-Y625 HydrophobicContact CD2-CG 4.14Å; L620-Y625 WeakPolarHBondContact O-CD2 3.48Å; L620-Y625 PolarHBondContact O-N 3.11Å; L620-I630 HydrophobicContact CB-CD1 3.77Å; L620-I630 HydrophobicContact CB-CG1 3.74Å; L620-I630 HydrophobicContact CD1-CG1 4.15Å; L620-I630 HydrophobicContact CD1-CG2 4.38Å
621	K	80.4	Confident	80.1	Confident	105 Å²	105	62.5 Å²	62.5	46%	0.457	32%	0.324	S	S	.	.	H	α-helix	trans	-62.1	-35.7	175.3	-167	165.1	-173.8	155.4	0	111.9	R617 H623 G624 E627 I630	R617-K621 WeakPolarHBondContact O-CB 3.3Å; R617-K621 PolarHBondContact O-N 2.66Å; K621-H623 PolarHBondContact O-N 3.38Å; K621-G624 PolarHBondContact O-N 2.9Å; K621-E627 WeakPolarHBondContact CE-OE2 3.37Å; K621-E627 VanDerWaalsContact NZ-CD 3.29Å; K621-E627 IonicContact NZ-OE1 2.78Å; K621-E627 PolarHBondContact NZ-OE1 2.84Å; K621-E627 IonicContact NZ-OE2 2.66Å; K621-E627 PolarHBondContact NZ-OE2 3.49Å; K621-I630 HydrophobicContact CB-CD1 4.19Å
622	S	76.9	Confident	79.9	Confident	63 Å²	63	66.9 Å²	66.9	44%	0.441	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.6	174.5	78.1	0	0	0	0	114.1	Y603 K618 A619 L620	Y603-S622 WeakPolarHBondContact CE2-OG 3.34Å; Y603-S622 VanDerWaalsContact OH-CB 3.23Å; Y603-S622 WeakPolarHBondContact OH-CB 3.26Å; Y603-S622 PolarHBondContact OH-OG 3.01Å; K618-S622 PolarHBondContact O-N 2.78Å; A619-S622 PolarHBondContact O-OG 3.49Å; L620-S622 VanDerWaalsContact C-N 3.26Å; L620-S622 PolarHBondContact O-N 2.8Å
623	H	73.6	Confident	79.5	Confident	65 Å²	65	66.5 Å²	66.5	30%	0.301	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	6.7	-178.9	-80.9	77.9	0	0	0	113.3	K594 I599 E602 Y603 A619 L620 K621 Y625	K594-H623 PolarHBondContact NZ-NE2 3.47Å; I599-H623 HydrophobicContact CD1-CB 3.68Å; I599-H623 HydrophobicContact CG1-CB 4.33Å; I599-H623 HydrophobicContact CG2-CB 4.39Å; I599-H623 WeakPolarHBondContact CG2-ND1 3.47Å; E602-H623 IonicContact OE2-NE2 2.9Å; Y603-H623 AromaticContact CE2-CE1 3.93Å; A619-H623 PolarHBondContact O-ND1 2.92Å; L620-H623 PolarHBondContact O-N 3.17Å; K621-H623 PolarHBondContact O-N 3.38Å; H623-Y625 HydrophobicContact CB-CD2 4.2Å; H623-Y625 HydrophobicContact CB-CE2 4.31Å
624	G	69.9	Low	79.3	Confident	70 Å²	70	64.3 Å²	64.3	72%	0.722	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	17.8	172.8	0	0	0	0	0	115.6	L620 K621	L620-G624 PolarHBondContact O-N 2.92Å; K621-G624 PolarHBondContact O-N 2.9Å
625	Y	75.5	Confident	79.2	Confident	46 Å²	46	61 Å²	61	18%	0.18	32%	0.324	C	S	.	.			trans	-70.9	144.7	169.7	-75.1	-96	0	0	0	111.1	K594 I596 I599 L620 H623	K594-Y625 PolarHBondContact O-OH 3.46Å; I596-Y625 HydrophobicContact CD1-CE1 4.21Å; I596-Y625 HydrophobicContact CG1-CE1 3.86Å; I599-Y625 HydrophobicContact CD1-CD2 4.24Å; I599-Y625 HydrophobicContact CD1-CE2 3.38Å; L620-Y625 HydrophobicContact CB-CD2 4.22Å; L620-Y625 HydrophobicContact CB-CG 4.26Å; L620-Y625 HydrophobicContact CD2-CD2 3.72Å; L620-Y625 HydrophobicContact CD2-CE2 3.85Å; L620-Y625 HydrophobicContact CD2-CG 4.14Å; L620-Y625 WeakPolarHBondContact O-CD2 3.48Å; L620-Y625 PolarHBondContact O-N 3.11Å; H623-Y625 HydrophobicContact CB-CD2 4.2Å; H623-Y625 HydrophobicContact CB-CE2 4.31Å
626	S	73.5	Confident	78.9	Confident	49 Å²	49	64.1 Å²	64.1	34%	0.343	34%	0.335	S	S	.	.			trans	-78.4	148.9	179	69.3	0	0	0	0	111.9	P628 E629 I630	S626-P628 VanDerWaalsContact C-CD 3.43Å; S626-E629 PolarHBondContact N-OE2 2.97Å; S626-E629 VanDerWaalsContact N-OE2 3.14Å; S626-E629 PolarHBondContact O-N 3.01Å; S626-E629 WeakPolarHBondContact OG-CB 3.48Å; S626-E629 WeakPolarHBondContact OG-CG 3.36Å; S626-E629 PolarHBondContact OG-OE2 3.33Å; S626-I630 WeakPolarHBondContact O-CG1 3.19Å; S626-I630 PolarHBondContact O-N 3.46Å
627	E	75.1	Confident	78.7	Confident	70 Å²	70	64.7 Å²	64.7	33%	0.327	34%	0.337	S	S	.	.	H	α-helix	trans	-51.8	-44.9	179.1	-132.1	86.7	-167.9	0	0	114.6	R617 K621 I630 F631	R617-E627 IonicContact CZ-OE1 2.97Å; R617-E627 IonicContact NE-OE1 3.99Å; R617-E627 PolarHBondContact NE-OE1 3.14Å; R617-E627 IonicContact NH2-OE1 2.69Å; R617-E627 PolarHBondContact NH2-OE1 3.18Å; K621-E627 WeakPolarHBondContact CE-OE2 3.37Å; K621-E627 VanDerWaalsContact NZ-CD 3.29Å; K621-E627 IonicContact NZ-OE1 2.78Å; K621-E627 PolarHBondContact NZ-OE1 2.84Å; K621-E627 IonicContact NZ-OE2 2.66Å; K621-E627 PolarHBondContact NZ-OE2 3.49Å; E627-I630 PolarHBondContact O-N 2.94Å; E627-F631 PolarHBondContact O-N 3.42Å
628	P	74.5	Confident	78.6	Confident	87 Å²	87	60.5 Å²	60.5	57%	0.565	32%	0.322	S	S	*	.	H	α-helix	trans	-67.2	-39.9	178.2	10.3	-8.8	0	0	0	112.1	S626 I630 F631 T632	S626-P628 VanDerWaalsContact C-CD 3.43Å; P628-I630 PolarHBondContact O-N 3.33Å; P628-F631 PolarHBondContact O-N 3.04Å; P628-T632 WeakPolarHBondContact O-CB 3.26Å; P628-T632 PolarHBondContact O-N 3.32Å; P628-T632 PolarHBondContact O-OG1 3.29Å
629	E	77.3	Confident	78.2	Confident	104 Å²	104	60.2 Å²	60.2	49%	0.486	32%	0.323	S	S	.	.	H	α-helix	trans	-61.2	-45	176	-72.9	167.4	157	0	0	111.1	S626 F631 T633	S626-E629 PolarHBondContact N-OE2 2.97Å; S626-E629 VanDerWaalsContact N-OE2 3.14Å; S626-E629 PolarHBondContact O-N 3.01Å; S626-E629 WeakPolarHBondContact OG-CB 3.48Å; S626-E629 WeakPolarHBondContact OG-CG 3.36Å; S626-E629 PolarHBondContact OG-OE2 3.33Å; E629-F631 PolarHBondContact O-N 3.39Å; E629-T633 VanDerWaalsContact O-CB 3.32Å; E629-T633 WeakPolarHBondContact O-CB 2.94Å; E629-T633 PolarHBondContact O-N 3.44Å; E629-T633 PolarHBondContact O-OG1 3Å
630	I	77.6	Confident	78.1	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-58.8	-49	178	-66.1	170.8	0	0	0	110.3	Y613 Y616 R617 L620 K621 S626 E627 P628 F634	Y613-I630 HydrophobicContact CE2-CG2 4.22Å; Y616-I630 HydrophobicContact CD1-CG2 3.93Å; Y616-I630 HydrophobicContact CE1-CG2 3.86Å; R617-I630 HydrophobicContact CB-CG2 4.03Å; R617-I630 HydrophobicContact CG-CG2 4.19Å; L620-I630 HydrophobicContact CB-CD1 3.77Å; L620-I630 HydrophobicContact CB-CG1 3.74Å; L620-I630 HydrophobicContact CD1-CG1 4.15Å; L620-I630 HydrophobicContact CD1-CG2 4.38Å; K621-I630 HydrophobicContact CB-CD1 4.19Å; S626-I630 WeakPolarHBondContact O-CG1 3.19Å; S626-I630 PolarHBondContact O-N 3.46Å; E627-I630 PolarHBondContact O-N 2.94Å; P628-I630 PolarHBondContact O-N 3.33Å; I630-F634 WeakPolarHBondContact O-CB 3.48Å; I630-F634 PolarHBondContact O-N 3.04Å
631	F	77.4	Confident	77.8	Confident	106 Å²	106	67.1 Å²	67.1	47%	0.465	37%	0.371	S	S	.	.	H	α-helix	trans	-64.7	-50.5	-178.8	-179.6	-105.3	0	0	0	112	Y613 E627 P628 E629 T633 F634 M635	Y613-F631 HydrophobicContact CE2-CD2 4.49Å; E627-F631 PolarHBondContact O-N 3.42Å; P628-F631 PolarHBondContact O-N 3.04Å; E629-F631 PolarHBondContact O-N 3.39Å; F631-T633 VanDerWaalsContact C-N 3.29Å; F631-T633 PolarHBondContact O-N 3.01Å; F631-F634 PolarHBondContact O-N 3.32Å; F631-M635 HydrophobicContact CD1-CG 4.21Å; F631-M635 HydrophobicContact CD2-CG 4.03Å; F631-M635 HydrophobicContact CE1-CG 3.83Å; F631-M635 HydrophobicContact CE2-CG 3.64Å; F631-M635 HydrophobicContact CE2-SD 3.84Å; F631-M635 HydrophobicContact CG-CG 4.31Å; F631-M635 HydrophobicContact CZ-CG 3.53Å; F631-M635 HydrophobicContact CZ-SD 3.94Å; F631-M635 WeakPolarHBondContact O-CB 3.39Å; F631-M635 VanDerWaalsContact O-CG 3.31Å; F631-M635 WeakPolarHBondContact O-CG 3.45Å; F631-M635 PolarHBondContact O-N 3.47Å
632	T	80.5	Confident	77.9	Confident	93 Å²	93	64.7 Å²	64.7	57%	0.571	36%	0.363	S	S	*	.	H	α-helix	trans	-62.9	-37.2	-179.4	-53.4	0	0	0	0	112	P628 K636	P628-T632 WeakPolarHBondContact O-CB 3.26Å; P628-T632 PolarHBondContact O-N 3.32Å; P628-T632 PolarHBondContact O-OG1 3.29Å; T632-K636 WeakPolarHBondContact O-CB 3.42Å; T632-K636 PolarHBondContact O-N 2.93Å
633	T	78.9	Confident	78.2	Confident	35 Å²	35	65.9 Å²	65.9	22%	0.215	37%	0.365	C	S	.	.	H	α-helix	trans	-70.9	-39.7	178	-41.4	0	0	0	0	111	I596 E629 F631 K636 Y637	I596-T633 HydrophobicContact CD1-CG2 3.87Å; E629-T633 VanDerWaalsContact O-CB 3.32Å; E629-T633 WeakPolarHBondContact O-CB 2.94Å; E629-T633 PolarHBondContact O-N 3.44Å; E629-T633 PolarHBondContact O-OG1 3Å; F631-T633 VanDerWaalsContact C-N 3.29Å; F631-T633 PolarHBondContact O-N 3.01Å; T633-K636 PolarHBondContact O-N 3.04Å; T633-Y637 HydrophobicContact CG2-CD2 4.43Å; T633-Y637 HydrophobicContact CG2-CE2 3.99Å; T633-Y637 WeakPolarHBondContact O-CD2 3.41Å
634	F	81.3	Confident	78.8	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-65	-51.5	177.2	-169.9	-91.7	0	0	0	112	Y613 Y616 I630 F631 K636 Y637 D638 N643 L645	Y613-F634 HydrophobicContact CD2-CB 3.87Å; Y613-F634 AromaticContact CD2-CD1 3.43Å; Y613-F634 HydrophobicContact CD2-CD1 3.43Å; Y613-F634 VanDerWaalsContact CD2-CD1 3.43Å; Y613-F634 AromaticContact CD2-CD2 3.67Å; Y613-F634 HydrophobicContact CD2-CD2 3.67Å; Y613-F634 AromaticContact CD2-CE1 3.8Å; Y613-F634 HydrophobicContact CD2-CE1 3.8Å; Y613-F634 AromaticContact CD2-CE2 3.98Å; Y613-F634 HydrophobicContact CD2-CE2 3.98Å; Y613-F634 AromaticContact CD2-CG 3.36Å; Y613-F634 HydrophobicContact CD2-CG 3.36Å; Y613-F634 HydrophobicContact CD2-CZ 4.04Å; Y613-F634 HydrophobicContact CE2-CB 3.83Å; Y613-F634 HydrophobicContact CE2-CD1 4.11Å; Y613-F634 HydrophobicContact CE2-CD2 4.41Å; Y613-F634 AromaticContact CE2-CG 3.87Å; Y613-F634 HydrophobicContact CE2-CG 3.87Å; Y613-F634 HydrophobicContact CG-CD1 4.16Å; Y613-F634 HydrophobicContact CG-CE1 4.12Å; Y613-F634 HydrophobicContact CG-CG 4.42Å; Y613-F634 HydrophobicContact CG-CZ 4.3Å; Y616-F634 HydrophobicContact CD1-CB 4.07Å; Y616-F634 AromaticContact CD1-CD2 3.44Å; Y616-F634 HydrophobicContact CD1-CD2 3.44Å; Y616-F634 VanDerWaalsContact CD1-CD2 3.44Å; Y616-F634 HydrophobicContact CD1-CE2 4.28Å; Y616-F634 HydrophobicContact CD1-CG 4.16Å; Y616-F634 AromaticContact CD2-CD2 3.93Å; Y616-F634 HydrophobicContact CD2-CD2 3.93Å; Y616-F634 HydrophobicContact CD2-CE2 4.38Å; Y616-F634 HydrophobicContact CE1-CB 3.74Å; Y616-F634 AromaticContact CE1-CD2 3.8Å; Y616-F634 HydrophobicContact CE1-CD2 3.8Å; Y616-F634 HydrophobicContact CE1-CG 4.26Å; Y616-F634 HydrophobicContact CE2-CD2 4.24Å; Y616-F634 AromaticContact CG-CD2 3.52Å; Y616-F634 HydrophobicContact CG-CD2 3.52Å; Y616-F634 AromaticContact CG-CE2 3.98Å; Y616-F634 HydrophobicContact CG-CE2 3.98Å; I630-F634 WeakPolarHBondContact O-CB 3.48Å; I630-F634 PolarHBondContact O-N 3.04Å; F631-F634 PolarHBondContact O-N 3.32Å; F634-K636 PolarHBondContact O-N 2.69Å; F634-K636 VanDerWaalsContact O-N 3.11Å; F634-Y637 PolarHBondContact O-N 2.88Å; F634-D638 HydrophobicContact CD1-CB 4.31Å; F634-D638 HydrophobicContact CE1-CB 4.14Å; F634-D638 PolarHBondContact O-N 3.45Å; F634-D638 VanDerWaalsContact O-N 3.08Å; F634-N643 WeakPolarHBondContact CZ-O 3.47Å; F634-L645 HydrophobicContact CD2-CD1 3.63Å; F634-L645 HydrophobicContact CD2-CG 4.08Å; F634-L645 HydrophobicContact CE2-CD1 3.47Å; F634-L645 VanDerWaalsContact CE2-CD1 3.47Å; F634-L645 HydrophobicContact CE2-CG 3.58Å; F634-L645 HydrophobicContact CZ-CD1 4.31Å; F634-L645 HydrophobicContact CZ-CG 3.93Å
635	M	80.6	Confident	79.4	Confident	83 Å²	83	61.4 Å²	61.4	41%	0.409	33%	0.326	S	S	.	.	H	α-helix	trans	-61.2	-21.4	178.8	-68.6	-59	-54.5	0	0	113.9	F631 Y637	F631-M635 HydrophobicContact CD1-CG 4.21Å; F631-M635 HydrophobicContact CD2-CG 4.03Å; F631-M635 HydrophobicContact CE1-CG 3.83Å; F631-M635 HydrophobicContact CE2-CG 3.64Å; F631-M635 HydrophobicContact CE2-SD 3.84Å; F631-M635 HydrophobicContact CG-CG 4.31Å; F631-M635 HydrophobicContact CZ-CG 3.53Å; F631-M635 HydrophobicContact CZ-SD 3.94Å; F631-M635 WeakPolarHBondContact O-CB 3.39Å; F631-M635 VanDerWaalsContact O-CG 3.31Å; F631-M635 WeakPolarHBondContact O-CG 3.45Å; F631-M635 PolarHBondContact O-N 3.47Å; M635-Y637 VanDerWaalsContact C-N 3.33Å
636	K	80.2	Confident	79.8	Confident	123 Å²	123	61.6 Å²	61.6	54%	0.535	33%	0.33	S	S	.	.	H	α-helix	trans	-70.2	-33.1	176.5	-176.6	-173.6	168.3	-150.1	0	111.9	T632 T633 F634 E656	T632-K636 WeakPolarHBondContact O-CB 3.42Å; T632-K636 PolarHBondContact O-N 2.93Å; T633-K636 PolarHBondContact O-N 3.04Å; F634-K636 PolarHBondContact O-N 2.69Å; F634-K636 VanDerWaalsContact O-N 3.11Å; K636-E656 IonicContact NZ-OE2 2.7Å; K636-E656 PolarHBondContact NZ-OE2 3.48Å
637	Y	81.4	Confident	80.3	Confident	12 Å²	12	63 Å²	63	5%	0.047	33%	0.334	C	S	.	.	H	α-helix	trans	-103.7	-16.1	-174.5	-64.8	-71.2	0	0	0	113.4	T633 F634 M635 E639 E649 Q652 L653 E656	T633-Y637 HydrophobicContact CG2-CD2 4.43Å; T633-Y637 HydrophobicContact CG2-CE2 3.99Å; T633-Y637 WeakPolarHBondContact O-CD2 3.41Å; F634-Y637 PolarHBondContact O-N 2.88Å; M635-Y637 VanDerWaalsContact C-N 3.33Å; Y637-E639 PolarHBondContact O-N 3.3Å; Y637-E649 WeakPolarHBondContact O-CB 3.29Å; Y637-E649 VanDerWaalsContact O-CD 3.25Å; Y637-E649 WeakPolarHBondContact O-CG 3.49Å; Y637-Q652 HydrophobicContact CD1-CB 4.44Å; Y637-L653 HydrophobicContact CD1-CB 3.95Å; Y637-L653 HydrophobicContact CD2-CB 3.97Å; Y637-L653 HydrophobicContact CD2-CD1 3.55Å; Y637-L653 HydrophobicContact CD2-CG 3.79Å; Y637-L653 HydrophobicContact CE1-CB 4.21Å; Y637-L653 HydrophobicContact CE2-CB 4.23Å; Y637-L653 HydrophobicContact CE2-CD1 4.07Å; Y637-L653 HydrophobicContact CE2-CG 3.9Å; Y637-L653 HydrophobicContact CG-CB 3.85Å; Y637-L653 HydrophobicContact CG-CD1 4.07Å; Y637-L653 HydrophobicContact CG-CG 4.2Å; Y637-E656 HydrophobicContact CE1-CB 4.33Å; Y637-E656 HydrophobicContact CE1-CG 4.32Å; Y637-E656 WeakPolarHBondContact CE1-OE2 3.2Å; Y637-E656 VanDerWaalsContact CZ-OE2 3.32Å; Y637-E656 PolarHBondContact OH-OE2 3.46Å
638	D	82.9	Confident	80.6	Confident	10 Å²	10	63.8 Å²	63.8	5%	0.053	34%	0.343	C	S	.	.			trans	-78.1	88.4	170.7	-176.9	-0.9	0	0	0	108.3	F634 G641 D642 N643 L645	F634-D638 HydrophobicContact CD1-CB 4.31Å; F634-D638 HydrophobicContact CE1-CB 4.14Å; F634-D638 PolarHBondContact O-N 3.45Å; F634-D638 VanDerWaalsContact O-N 3.08Å; D638-G641 WeakPolarHBondContact OD1-CA 3.3Å; D638-G641 PolarHBondContact OD1-N 3.43Å; D638-D642 PolarHBondContact OD1-N 2.98Å; D638-N643 VanDerWaalsContact OD2-CA 3.3Å; D638-N643 WeakPolarHBondContact OD2-CA 3.35Å; D638-N643 PolarHBondContact OD2-N 3.49Å; D638-N643 VanDerWaalsContact OD2-N 3.11Å; D638-L645 HydrophobicContact CB-CD2 4.36Å
639	E	78	Confident	81.1	Confident	143 Å²	143	60 Å²	60	67%	0.668	32%	0.318	S	S	*	.	S	Bend	trans	-78	-31	-176.2	-71.3	-173.6	-178.3	0	0	111.6	Y637 E649 Q652	Y637-E639 PolarHBondContact O-N 3.3Å; E639-E649 PolarHBondContact N-OE1 2.54Å; E639-Q652 PolarHBondContact OE1-NE2 3.42Å; E639-Q652 VanDerWaalsContact OE1-NE2 3.11Å; E639-Q652 PolarHBondContact OE1-OE1 2.81Å
640	D	80.8	Confident	81.3	Confident	99 Å²	99	55.5 Å²	55.5	53%	0.529	30%	0.297	S	S	.	.	S	Bend	trans	-89.4	-15.9	-178.3	77.8	2.6	0	0	0	114	D642	D640-D642 VanDerWaalsContact OD1-CB 3.28Å; D640-D642 WeakPolarHBondContact OD1-CB 3.43Å; D640-D642 PolarHBondContact OD1-N 2.99Å
641	G	78.5	Confident	81.4	Confident	47 Å²	47	61.1 Å²	61.1	49%	0.485	32%	0.323	S	S	.	.			trans	75.4	19.8	177.9	0	0	0	0	0	113.8	D638 N643	D638-G641 WeakPolarHBondContact OD1-CA 3.3Å; D638-G641 PolarHBondContact OD1-N 3.43Å; G641-N643 PolarHBondContact O-N 3.3Å
642	D	81.9	Confident	81.6	Confident	54 Å²	54	59.7 Å²	59.7	29%	0.289	32%	0.318	S	S	.	.	S	Bend	trans	-80.4	0.3	-177	96.2	2.5	0	0	0	114	K610 D638 D640 N644	K610-D642 IonicContact NZ-OD2 3.88Å; K610-D642 PolarHBondContact NZ-OD2 3.48Å; D638-D642 PolarHBondContact OD1-N 2.98Å; D640-D642 VanDerWaalsContact OD1-CB 3.28Å; D640-D642 WeakPolarHBondContact OD1-CB 3.43Å; D640-D642 PolarHBondContact OD1-N 2.99Å; D642-N644 PolarHBondContact O-N 3.04Å; D642-N644 PolarHBondContact O-ND2 3.28Å; D642-N644 VanDerWaalsContact OD1-CA 3.28Å; D642-N644 WeakPolarHBondContact OD1-CA 3.31Å; D642-N644 WeakPolarHBondContact OD1-CB 3.42Å; D642-N644 PolarHBondContact OD1-N 3.05Å; D642-N644 PolarHBondContact OD1-ND2 2.72Å
643	N	83.6	Confident	81.7	Confident	88 Å²	88	55.4 Å²	55.4	47%	0.471	29%	0.292	S	S	.	.	S	Bend	trans	63.1	17.4	-172.8	-66.3	-66	0	0	0	114.7	Y613 F634 D638 G641	Y613-N643 WeakPolarHBondContact CB-O 3.43Å; Y613-N643 PolarHBondContact N-O 3.17Å; F634-N643 WeakPolarHBondContact CZ-O 3.47Å; D638-N643 VanDerWaalsContact OD2-CA 3.3Å; D638-N643 WeakPolarHBondContact OD2-CA 3.35Å; D638-N643 PolarHBondContact OD2-N 3.49Å; D638-N643 VanDerWaalsContact OD2-N 3.11Å; G641-N643 PolarHBondContact O-N 3.3Å
644	N	85.5	Confident	81.6	Confident	41 Å²	41	54.5 Å²	54.5	22%	0.219	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	138.6	171.4	-41.4	-76.8	0	0	0	110.1	K610 L611 P612 D642 D646	K610-N644 HydrophobicContact CB-CB 4.16Å; K610-N644 HydrophobicContact CD-CB 4.48Å; L611-N644 CarbonylContact O-C 3.55Å; L611-N644 VanDerWaalsContact O-CA 3.26Å; L611-N644 WeakPolarHBondContact O-CA 3.24Å; P612-N644 VanDerWaalsContact CA-OD1 3.26Å; P612-N644 WeakPolarHBondContact CA-OD1 3.3Å; P612-N644 WeakPolarHBondContact CB-OD1 3.47Å; D642-N644 PolarHBondContact O-N 3.04Å; D642-N644 PolarHBondContact O-ND2 3.28Å; D642-N644 VanDerWaalsContact OD1-CA 3.28Å; D642-N644 WeakPolarHBondContact OD1-CA 3.31Å; D642-N644 WeakPolarHBondContact OD1-CB 3.42Å; D642-N644 PolarHBondContact OD1-N 3.05Å; D642-N644 PolarHBondContact OD1-ND2 2.72Å; N644-D646 PolarHBondContact O-N 3.34Å
645	L	82.5	Confident	81.4	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	117.9	172.6	-65.9	161	0	0	0	109.7	L611 Y616 F634 D638 E649 Q650 L653	L611-L645 HydrophobicContact CB-CB 4.19Å; L611-L645 HydrophobicContact CD2-CD1 4.23Å; L611-L645 PolarHBondContact N-O 2.95Å; L611-L645 PolarHBondContact O-N 2.92Å; Y616-L645 HydrophobicContact CD2-CD1 4.15Å; Y616-L645 HydrophobicContact CE2-CD1 4.25Å; F634-L645 HydrophobicContact CD2-CD1 3.63Å; F634-L645 HydrophobicContact CD2-CG 4.08Å; F634-L645 HydrophobicContact CE2-CD1 3.47Å; F634-L645 VanDerWaalsContact CE2-CD1 3.47Å; F634-L645 HydrophobicContact CE2-CG 3.58Å; F634-L645 HydrophobicContact CZ-CD1 4.31Å; F634-L645 HydrophobicContact CZ-CG 3.93Å; D638-L645 HydrophobicContact CB-CD2 4.36Å; L645-E649 VanDerWaalsContact CA-OE2 3.28Å; L645-E649 WeakPolarHBondContact CA-OE2 3.32Å; L645-E649 HydrophobicContact CB-CB 4.41Å; L645-E649 HydrophobicContact CD2-CB 3.88Å; L645-Q650 HydrophobicContact CB-CG 3.93Å; L645-Q650 PolarHBondContact O-NE2 3.46Å; L645-L653 HydrophobicContact CD1-CD1 3.96Å
646	D	84.5	Confident	81.1	Confident	49 Å²	49	62.5 Å²	62.5	26%	0.262	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	177.9	173.5	81.8	11.3	0	0	0	111.8	N644 T648 E649 Q650	N644-D646 PolarHBondContact O-N 3.34Å; D646-T648 VanDerWaalsContact C-N 3.29Å; D646-T648 PolarHBondContact O-N 2.93Å; D646-T648 WeakPolarHBondContact OD1-CA 3.42Å; D646-T648 WeakPolarHBondContact OD1-CB 3.5Å; D646-T648 PolarHBondContact OD1-N 3.39Å; D646-T648 PolarHBondContact OD1-OG1 3.4Å; D646-T648 PolarHBondContact OD2-OG1 2.89Å; D646-E649 PolarHBondContact N-OE2 3.15Å; D646-E649 WeakPolarHBondContact OD1-CB 3.13Å; D646-E649 VanDerWaalsContact OD1-CG 3.3Å; D646-E649 WeakPolarHBondContact OD1-CG 3.46Å; D646-E649 PolarHBondContact OD1-N 3.01Å; D646-Q650 VanDerWaalsContact O-CB 3.26Å; D646-Q650 WeakPolarHBondContact O-CB 3.26Å; D646-Q650 WeakPolarHBondContact O-CG 3.3Å; D646-Q650 PolarHBondContact O-N 2.62Å; D646-Q650 PolarHBondContact O-NE2 3.36Å
647	L	83.4	Confident	80.6	Confident	80 Å²	80	58.1 Å²	58.1	42%	0.419	30%	0.3	S	S	.	.	H	α-helix	trans	-66.2	-32	-177.8	-164.5	72.7	0	0	0	112.5	Q651	L647-Q651 WeakPolarHBondContact O-CB 3.28Å; L647-Q651 WeakPolarHBondContact O-CG 3.33Å; L647-Q651 PolarHBondContact O-N 2.8Å; L647-Q651 VanDerWaalsContact O-N 3.09Å
648	T	81.6	Confident	79.9	Confident	85 Å²	85	60.9 Å²	60.9	52%	0.521	32%	0.316	S	S	.	.	H	α-helix	trans	-73	-43.5	178.7	24.9	0	0	0	0	111.9	D646 Q651 Q652	D646-T648 VanDerWaalsContact C-N 3.29Å; D646-T648 PolarHBondContact O-N 2.93Å; D646-T648 WeakPolarHBondContact OD1-CA 3.42Å; D646-T648 WeakPolarHBondContact OD1-CB 3.5Å; D646-T648 PolarHBondContact OD1-N 3.39Å; D646-T648 PolarHBondContact OD1-OG1 3.4Å; D646-T648 PolarHBondContact OD2-OG1 2.89Å; T648-Q651 WeakPolarHBondContact O-CB 3.36Å; T648-Q651 PolarHBondContact O-N 3.02Å; T648-Q652 WeakPolarHBondContact O-CG 3.47Å; T648-Q652 PolarHBondContact O-N 3.24Å
649	E	84.6	Confident	78.8	Confident	7 Å²	7	62.7 Å²	62.7	3%	0.033	33%	0.325	C	S	.	.	H	α-helix	trans	-67.5	-39.6	175	-66.2	172.6	152.3	0	0	111.4	Y637 E639 L645 D646 Q651 Q652 L653	Y637-E649 WeakPolarHBondContact O-CB 3.29Å; Y637-E649 VanDerWaalsContact O-CD 3.25Å; Y637-E649 WeakPolarHBondContact O-CG 3.49Å; E639-E649 PolarHBondContact N-OE1 2.54Å; L645-E649 VanDerWaalsContact CA-OE2 3.28Å; L645-E649 WeakPolarHBondContact CA-OE2 3.32Å; L645-E649 HydrophobicContact CB-CB 4.41Å; L645-E649 HydrophobicContact CD2-CB 3.88Å; D646-E649 PolarHBondContact N-OE2 3.15Å; D646-E649 WeakPolarHBondContact OD1-CB 3.13Å; D646-E649 VanDerWaalsContact OD1-CG 3.3Å; D646-E649 WeakPolarHBondContact OD1-CG 3.46Å; D646-E649 PolarHBondContact OD1-N 3.01Å; E649-Q651 VanDerWaalsContact C-N 3.28Å; E649-Q651 PolarHBondContact O-N 2.88Å; E649-Q652 PolarHBondContact O-N 2.88Å; E649-L653 VanDerWaalsContact O-CB 3.31Å; E649-L653 WeakPolarHBondContact O-CB 3.42Å; E649-L653 PolarHBondContact O-N 3.27Å
650	Q	81	Confident	77.7	Confident	10 Å²	10	57.5 Å²	57.5	5%	0.047	31%	0.311	C	S	.	.	H	α-helix	trans	-60.3	-38.5	170.7	-77.2	175.2	51.6	0	0	111.8	K608 L611 L645 D646 A654	K608-Q650 PolarHBondContact O-NE2 2.8Å; L611-Q650 HydrophobicContact CB-CG 4.46Å; L645-Q650 HydrophobicContact CB-CG 3.93Å; L645-Q650 PolarHBondContact O-NE2 3.46Å; D646-Q650 VanDerWaalsContact O-CB 3.26Å; D646-Q650 WeakPolarHBondContact O-CB 3.26Å; D646-Q650 WeakPolarHBondContact O-CG 3.3Å; D646-Q650 PolarHBondContact O-N 2.62Å; D646-Q650 PolarHBondContact O-NE2 3.36Å; Q650-A654 VanDerWaalsContact O-CB 3.3Å; Q650-A654 WeakPolarHBondContact O-CB 3.4Å; Q650-A654 PolarHBondContact O-N 2.85Å
651	Q	81.1	Confident	76.3	Confident	119 Å²	119	55.9 Å²	55.9	56%	0.556	30%	0.304	S	S	*	.	H	α-helix	trans	-69.1	-41.3	175.7	-77.1	172	16.5	0	0	111.6	L647 T648 E649 A654 Y655	L647-Q651 WeakPolarHBondContact O-CB 3.28Å; L647-Q651 WeakPolarHBondContact O-CG 3.33Å; L647-Q651 PolarHBondContact O-N 2.8Å; L647-Q651 VanDerWaalsContact O-N 3.09Å; T648-Q651 WeakPolarHBondContact O-CB 3.36Å; T648-Q651 PolarHBondContact O-N 3.02Å; E649-Q651 VanDerWaalsContact C-N 3.28Å; E649-Q651 PolarHBondContact O-N 2.88Å; Q651-A654 PolarHBondContact O-N 2.79Å; Q651-Y655 WeakPolarHBondContact O-CB 3.41Å; Q651-Y655 PolarHBondContact O-N 3.05Å
652	Q	81	Confident	74.6	Confident	75 Å²	75	59 Å²	59	35%	0.35	31%	0.308	S	S	.	.	H	α-helix	trans	-61	-47.1	173.3	-72.2	-176.8	-1.5	0	0	111.4	Y637 E639 T648 E649 A654 Y655 E656	Y637-Q652 HydrophobicContact CD1-CB 4.44Å; E639-Q652 PolarHBondContact OE1-NE2 3.42Å; E639-Q652 VanDerWaalsContact OE1-NE2 3.11Å; E639-Q652 PolarHBondContact OE1-OE1 2.81Å; T648-Q652 WeakPolarHBondContact O-CG 3.47Å; T648-Q652 PolarHBondContact O-N 3.24Å; E649-Q652 PolarHBondContact O-N 2.88Å; Q652-A654 VanDerWaalsContact C-N 3.33Å; Q652-A654 PolarHBondContact O-N 3.39Å; Q652-Y655 PolarHBondContact O-N 2.96Å; Q652-E656 WeakPolarHBondContact O-CB 3.33Å; Q652-E656 PolarHBondContact O-N 2.81Å
653	L	81.6	Confident	72.7	Confident	4 Å²	4	64.9 Å²	64.9	2%	0.021	33%	0.328	C	S	.	.	H	α-helix	trans	-58.1	-45.4	175.7	-177.7	154.4	0	0	0	111.2	I596 V597 L600 Y616 Y637 L645 E649 I657	I596-L653 HydrophobicContact CG2-CD2 4.48Å; V597-L653 HydrophobicContact CG2-CD2 3.85Å; L600-L653 HydrophobicContact CD1-CD2 4.21Å; Y616-L653 HydrophobicContact CE2-CD1 4.03Å; Y637-L653 HydrophobicContact CD1-CB 3.95Å; Y637-L653 HydrophobicContact CD2-CB 3.97Å; Y637-L653 HydrophobicContact CD2-CD1 3.55Å; Y637-L653 HydrophobicContact CD2-CG 3.79Å; Y637-L653 HydrophobicContact CE1-CB 4.21Å; Y637-L653 HydrophobicContact CE2-CB 4.23Å; Y637-L653 HydrophobicContact CE2-CD1 4.07Å; Y637-L653 HydrophobicContact CE2-CG 3.9Å; Y637-L653 HydrophobicContact CG-CB 3.85Å; Y637-L653 HydrophobicContact CG-CD1 4.07Å; Y637-L653 HydrophobicContact CG-CG 4.2Å; L645-L653 HydrophobicContact CD1-CD1 3.96Å; E649-L653 VanDerWaalsContact O-CB 3.31Å; E649-L653 WeakPolarHBondContact O-CB 3.42Å; E649-L653 PolarHBondContact O-N 3.27Å; L653-I657 HydrophobicContact CD2-CD1 3.8Å; L653-I657 HydrophobicContact CG-CD1 3.95Å; L653-I657 WeakPolarHBondContact O-CB 3.43Å; L653-I657 WeakPolarHBondContact O-CD1 3.43Å; L653-I657 VanDerWaalsContact O-CG1 3.24Å; L653-I657 WeakPolarHBondContact O-CG1 3.35Å; L653-I657 PolarHBondContact O-N 2.78Å
654	A	78.7	Confident	70.6	Confident	15 Å²	15	69.1 Å²	69.1	12%	0.124	34%	0.342	C	S	.	.	H	α-helix	trans	-64.6	-44.7	177.3	0	0	0	0	0	111.9	V597 Q650 Q651 Q652 D658	V597-A654 HydrophobicContact CG1-CB 4.38Å; V597-A654 HydrophobicContact CG2-CB 4.47Å; Q650-A654 VanDerWaalsContact O-CB 3.3Å; Q650-A654 WeakPolarHBondContact O-CB 3.4Å; Q650-A654 PolarHBondContact O-N 2.85Å; Q651-A654 PolarHBondContact O-N 2.79Å; Q652-A654 VanDerWaalsContact C-N 3.33Å; Q652-A654 PolarHBondContact O-N 3.39Å; A654-D658 VanDerWaalsContact O-CB 3.26Å; A654-D658 WeakPolarHBondContact O-CB 3.15Å; A654-D658 PolarHBondContact O-N 2.88Å
655	Y	76.5	Confident	68.3	Low	163 Å²	163	73.5 Å²	73.5	64%	0.639	36%	0.364	S	S	*	.	H	α-helix	trans	-66	-49.8	-177.6	-176.6	-104.6	0	0	0	112	Q651 Q652 I657 D658 L659	Q651-Y655 WeakPolarHBondContact O-CB 3.41Å; Q651-Y655 PolarHBondContact O-N 3.05Å; Q652-Y655 PolarHBondContact O-N 2.96Å; Y655-I657 PolarHBondContact O-N 3.36Å; Y655-D658 PolarHBondContact O-N 3.44Å; Y655-L659 HydrophobicContact CD1-CD1 3.64Å; Y655-L659 HydrophobicContact CD2-CD1 3.87Å; Y655-L659 HydrophobicContact CE1-CD1 3.21Å; Y655-L659 HydrophobicContact CE2-CD1 3.45Å; Y655-L659 VanDerWaalsContact CE2-CD1 3.45Å; Y655-L659 HydrophobicContact CG-CD1 3.96Å; Y655-L659 WeakPolarHBondContact O-CB 3.45Å; Y655-L659 PolarHBondContact O-N 2.92Å; Y655-L659 WeakPolarHBondContact OH-CD1 3.24Å
656	E	74.1	Confident	65.9	Low	88 Å²	88	76.2 Å²	76.2	41%	0.411	39%	0.392	S	S	.	.	H	α-helix	trans	-65.3	-40.8	-179.6	-76.7	-161.6	164.3	0	0	112.7	K636 Y637 Q652 L659 G660	K636-E656 IonicContact NZ-OE2 2.7Å; K636-E656 PolarHBondContact NZ-OE2 3.48Å; Y637-E656 HydrophobicContact CE1-CB 4.33Å; Y637-E656 HydrophobicContact CE1-CG 4.32Å; Y637-E656 WeakPolarHBondContact CE1-OE2 3.2Å; Y637-E656 VanDerWaalsContact CZ-OE2 3.32Å; Y637-E656 PolarHBondContact OH-OE2 3.46Å; Q652-E656 WeakPolarHBondContact O-CB 3.33Å; Q652-E656 PolarHBondContact O-N 2.81Å; E656-L659 PolarHBondContact O-N 3.07Å; E656-G660 PolarHBondContact O-N 2.74Å
657	I	69	Low	63.3	Low	31 Å²	31	81.2 Å²	81.2	16%	0.159	41%	0.414	C	S	.	.	H	α-helix	trans	-70.4	-39.9	-179.7	-67.6	175.2	0	0	0	110.3	I596 V597 L653 Y655 G660 V661	I596-I657 HydrophobicContact CB-CD1 4.04Å; I596-I657 HydrophobicContact CD1-CD1 4.44Å; I596-I657 HydrophobicContact CG2-CD1 4.3Å; V597-I657 HydrophobicContact CB-CG2 4.44Å; V597-I657 HydrophobicContact CG2-CB 3.67Å; V597-I657 HydrophobicContact CG2-CD1 3.91Å; V597-I657 HydrophobicContact CG2-CG1 4.34Å; V597-I657 HydrophobicContact CG2-CG2 3.67Å; L653-I657 HydrophobicContact CD2-CD1 3.8Å; L653-I657 HydrophobicContact CG-CD1 3.95Å; L653-I657 WeakPolarHBondContact O-CB 3.43Å; L653-I657 WeakPolarHBondContact O-CD1 3.43Å; L653-I657 VanDerWaalsContact O-CG1 3.24Å; L653-I657 WeakPolarHBondContact O-CG1 3.35Å; L653-I657 PolarHBondContact O-N 2.78Å; Y655-I657 PolarHBondContact O-N 3.36Å; I657-G660 PolarHBondContact O-N 3.25Å; I657-V661 WeakPolarHBondContact O-CG2 3.5Å; I657-V661 PolarHBondContact O-N 2.94Å; I657-V661 VanDerWaalsContact O-N 3.07Å
658	D	66.4	Low	60.9	Low	70 Å²	70	83.2 Å²	83.2	37%	0.374	43%	0.432	S	S	.	.	H	α-helix	trans	-68.4	-37	175.7	-75.4	-14.1	0	0	0	111.4	A654 Y655 V661 I662	A654-D658 VanDerWaalsContact O-CB 3.26Å; A654-D658 WeakPolarHBondContact O-CB 3.15Å; A654-D658 PolarHBondContact O-N 2.88Å; Y655-D658 PolarHBondContact O-N 3.44Å; D658-V661 WeakPolarHBondContact O-CB 3.32Å; D658-V661 PolarHBondContact O-N 3.37Å; D658-I662 WeakPolarHBondContact O-CG1 3.32Å; D658-I662 PolarHBondContact O-N 3.01Å; D658-I662 VanDerWaalsContact O-N 3.09Å
659	L	60	Low	58.7	Low	48 Å²	48	84.8 Å²	84.8	25%	0.251	44%	0.441	S	S	.	.	H	α-helix	trans	-65.7	-40.3	171.2	-103.9	128.6	0	0	0	113	Y655 E656 V661 I662 Y663	Y655-L659 HydrophobicContact CD1-CD1 3.64Å; Y655-L659 HydrophobicContact CD2-CD1 3.87Å; Y655-L659 HydrophobicContact CE1-CD1 3.21Å; Y655-L659 HydrophobicContact CE2-CD1 3.45Å; Y655-L659 VanDerWaalsContact CE2-CD1 3.45Å; Y655-L659 HydrophobicContact CG-CD1 3.96Å; Y655-L659 WeakPolarHBondContact O-CB 3.45Å; Y655-L659 PolarHBondContact O-N 2.92Å; Y655-L659 WeakPolarHBondContact OH-CD1 3.24Å; E656-L659 PolarHBondContact O-N 3.07Å; L659-V661 PolarHBondContact O-N 3.39Å; L659-I662 WeakPolarHBondContact O-CB 3.34Å; L659-I662 PolarHBondContact O-N 3.43Å; L659-Y663 HydrophobicContact CD2-CD2 4.12Å; L659-Y663 HydrophobicContact CD2-CE2 3.61Å; L659-Y663 WeakPolarHBondContact O-CD2 3.26Å; L659-Y663 PolarHBondContact O-N 3.22Å
660	G	55.9	Low	56.2	Low	35 Å²	35	91.6 Å²	91.6	36%	0.361	48%	0.478	S	S	.	.	H	α-helix	trans	-61.4	-30.1	173.9	0	0	0	0	0	112.6	E656 I657 K664	E656-G660 PolarHBondContact O-N 2.74Å; I657-G660 PolarHBondContact O-N 3.25Å; G660-K664 WeakPolarHBondContact O-CB 3.3Å; G660-K664 PolarHBondContact O-N 3.47Å
661	V	50.7	Low	53.7	Low	65 Å²	65	98.2 Å²	98.2	39%	0.394	51%	0.509	S	S	.	.	H	α-helix	trans	-70.4	-40.8	170.7	172.6	0	0	0	0	111.1	I657 D658 L659 K664 I665	I657-V661 WeakPolarHBondContact O-CG2 3.5Å; I657-V661 PolarHBondContact O-N 2.94Å; I657-V661 VanDerWaalsContact O-N 3.07Å; D658-V661 WeakPolarHBondContact O-CB 3.32Å; D658-V661 PolarHBondContact O-N 3.37Å; L659-V661 PolarHBondContact O-N 3.39Å; V661-K664 PolarHBondContact O-N 3.06Å; V661-I665 HydrophobicContact CG1-CD1 3.77Å; V661-I665 WeakPolarHBondContact O-CD1 3.35Å; V661-I665 WeakPolarHBondContact O-CG1 3.31Å; V661-I665 PolarHBondContact O-N 3.44Å; V661-I665 VanDerWaalsContact O-N 3.11Å
662	I	43.8	Very low	51.3	Low	112 Å²	112	95.7 Å²	95.7	57%	0.574	52%	0.515	S	S	*	.	H	α-helix	trans	-64.3	-45.7	178.1	-64.3	165.5	0	0	0	111	D658 L659 K664 I665 G666	D658-I662 WeakPolarHBondContact O-CG1 3.32Å; D658-I662 PolarHBondContact O-N 3.01Å; D658-I662 VanDerWaalsContact O-N 3.09Å; L659-I662 WeakPolarHBondContact O-CB 3.34Å; L659-I662 PolarHBondContact O-N 3.43Å; I662-K664 PolarHBondContact O-N 3.35Å; I662-I665 PolarHBondContact O-N 3.01Å; I662-G666 PolarHBondContact O-N 2.57Å; I662-G666 VanDerWaalsContact O-N 3.16Å
663	Y	41.1	Very low	48.7	Very low	177 Å²	177	98.4 Å²	98.4	69%	0.694	53%	0.53	S	S	*	.	H	α-helix	trans	-67	-36	178.1	-82.1	-76.3	0	0	0	113	L659 I665 G666 E667	L659-Y663 HydrophobicContact CD2-CD2 4.12Å; L659-Y663 HydrophobicContact CD2-CE2 3.61Å; L659-Y663 WeakPolarHBondContact O-CD2 3.26Å; L659-Y663 PolarHBondContact O-N 3.22Å; Y663-I665 VanDerWaalsContact C-N 3.28Å; Y663-I665 PolarHBondContact O-N 3.47Å; Y663-G666 PolarHBondContact O-N 2.94Å; Y663-E667 PolarHBondContact O-N 3.18Å
664	K	39.1	Very low	46.3	Very low	177 Å²	177	101.2 Å²	101.2	77%	0.77	56%	0.56	S	S	*	*	H	α-helix	trans	-69	-22.7	173.1	-84.3	-179.7	175.6	172.2	0	114.2	G660 V661 I662 G666	G660-K664 WeakPolarHBondContact O-CB 3.3Å; G660-K664 PolarHBondContact O-N 3.47Å; V661-K664 PolarHBondContact O-N 3.06Å; I662-K664 PolarHBondContact O-N 3.35Å; K664-G666 VanDerWaalsContact C-N 3.31Å
665	I	37.3	Very low	43.8	Very low	133 Å²	133	106 Å²	106	68%	0.682	59%	0.588	S	S	*	*	H	α-helix	trans	-79.4	-22.1	171.4	-65.5	161.9	0	0	0	110.5	V661 I662 Y663	V661-I665 HydrophobicContact CG1-CD1 3.77Å; V661-I665 WeakPolarHBondContact O-CD1 3.35Å; V661-I665 WeakPolarHBondContact O-CG1 3.31Å; V661-I665 PolarHBondContact O-N 3.44Å; V661-I665 VanDerWaalsContact O-N 3.11Å; I662-I665 PolarHBondContact O-N 3.01Å; Y663-I665 VanDerWaalsContact C-N 3.28Å; Y663-I665 PolarHBondContact O-N 3.47Å
666	G	31.5	Very low	41.6	Very low	58 Å²	58	105.1 Å²	105.1	60%	0.598	59%	0.594	S	S	*	*	H	α-helix	trans	-86.8	-9.5	-177.3	0	0	0	0	0	116.5	I662 Y663 K664	I662-G666 PolarHBondContact O-N 2.57Å; I662-G666 VanDerWaalsContact O-N 3.16Å; Y663-G666 PolarHBondContact O-N 2.94Å; K664-G666 VanDerWaalsContact C-N 3.31Å
667	E	30.2	Very low	39.4	Very low	154 Å²	154	108.5 Å²	108.5	72%	0.72	61%	0.61	S	S	*	*	S	Bend	trans	-66	122.4	167.2	-85.1	-177.4	-179.4	0	0	108.9	Y663 V669	Y663-E667 PolarHBondContact O-N 3.18Å; E667-V669 PolarHBondContact O-N 2.92Å
668	P	33	Very low	37.4	Very low	121 Å²	121	114.5 Å²	114.5	79%	0.786	64%	0.642	S	S	*	*			trans	-59.7	126.2	-171.5	22	-30.6	0	0	0	109.6	D670	P668-D670 PolarHBondContact O-N 3.42Å
669	V	36.3	Very low	35.7	Very low	119 Å²	119	117.3 Å²	117.3	72%	0.721	66%	0.662	S	S	*	*			trans	-56.3	111.7	159.7	-178.5	0	0	0	0	104.9	E667 E671	E667-V669 PolarHBondContact O-N 2.92Å; V669-E671 HydrophobicContact CG1-CG 4.2Å; V669-E671 PolarHBondContact O-N 3.35Å
670	D	30.9	Very low	34.2	Very low	150 Å²	150	122.4 Å²	122.4	80%	0.802	69%	0.69	S	S	*	*			trans	-57.3	83.2	167.8	178.7	20.6	0	0	0	108.3	P668 G672	P668-D670 PolarHBondContact O-N 3.42Å; D670-G672 PolarHBondContact O-N 3.01Å; D670-G672 PolarHBondContact OD1-N 3.09Å
671	E	30.4	Very low	32.8	Very low	149 Å²	149	124.2 Å²	124.2	70%	0.696	71%	0.709	S	S	*	*			trans	-77	70.3	163.6	-69.8	-168.7	175	0	0	106.3	V669 I673	V669-E671 HydrophobicContact CG1-CG 4.2Å; V669-E671 PolarHBondContact O-N 3.35Å; E671-I673 PolarHBondContact O-N 3.19Å
672	G	29.8	Very low	31.8	Very low	66 Å²	66	128.7 Å²	128.7	68%	0.68	73%	0.731	S	S	*	*			trans	-61.9	72.5	160.2	0	0	0	0	0	109.6	D670 G674	D670-G672 PolarHBondContact O-N 3.01Å; D670-G672 PolarHBondContact OD1-N 3.09Å; G672-G674 VanDerWaalsContact C-N 3.26Å; G672-G674 PolarHBondContact O-N 2.89Å
673	I	25.5	Very low	31.2	Very low	131 Å²	131	128.4 Å²	128.4	67%	0.672	74%	0.738	S	S	*	*			trans	-78.7	89.8	153.4	-62.9	175.3	0	0	0	103.3	E671 T675	E671-I673 PolarHBondContact O-N 3.19Å; I673-T675 PolarHBondContact O-N 3.4Å
674	G	32	Very low	30.7	Very low	63 Å²	63	126.2 Å²	126.2	65%	0.649	74%	0.743	S	S	*	*			trans	-56.4	109.2	165.8	0	0	0	0	0	107.7	G672 D676	G672-G674 VanDerWaalsContact C-N 3.26Å; G672-G674 PolarHBondContact O-N 2.89Å; G674-D676 PolarHBondContact O-N 2.89Å
675	T	27.2	Very low	30.4	Very low	115 Å²	115	126.6 Å²	126.6	71%	0.706	75%	0.745	S	S	*	*			trans	-62.7	108.7	160.9	41.5	0	0	0	0	106.4	I673 E677	I673-T675 PolarHBondContact O-N 3.4Å; T675-E677 PolarHBondContact O-N 2.88Å
676	D	28.4	Very low	30.2	Very low	145 Å²	145	127.3 Å²	127.3	78%	0.775	75%	0.75	S	S	*	*			trans	-61	90.8	163.7	-70.7	-42.6	0	0	0	107	G674 D678	G674-D676 PolarHBondContact O-N 2.89Å; D676-D678 PolarHBondContact O-N 3.2Å
677	E	29.4	Very low	30.4	Very low	160 Å²	160	133.8 Å²	133.8	75%	0.748	77%	0.765	S	S	*	*			trans	-76.5	106.6	164.5	-77.6	-167.3	163.5	0	0	108.1	T675 T679	T675-E677 PolarHBondContact O-N 2.88Å; E677-T679 VanDerWaalsContact C-N 3.26Å; E677-T679 PolarHBondContact O-N 3.45Å; E677-T679 PolarHBondContact O-OG1 2.92Å
678	D	27.4	Very low	30.9	Very low	156 Å²	156	133.3 Å²	133.3	83%	0.834	77%	0.767	S	S	*	*			trans	-54.3	85.4	166.7	-70.4	-43.6	0	0	0	110.4	D676 N680	D676-D678 PolarHBondContact O-N 3.2Å; D678-N680 PolarHBondContact O-N 2.75Å
679	T	29.3	Very low	31.6	Very low	130 Å²	130	134.8 Å²	134.8	80%	0.798	77%	0.768	S	S	*	*			trans	-87.1	102.1	164.4	18.2	0	0	0	0	108.4	E677 G681	E677-T679 VanDerWaalsContact C-N 3.26Å; E677-T679 PolarHBondContact O-N 3.45Å; E677-T679 PolarHBondContact O-OG1 2.92Å; T679-G681 PolarHBondContact O-N 3.42Å
680	N	28.7	Very low	32.1	Very low	154 Å²	154	138.5 Å²	138.5	82%	0.824	77%	0.771	S	S	*	*			trans	-40.2	131.1	169.9	-84.8	-38	0	0	0	111.6	D678 N682	D678-N680 PolarHBondContact O-N 2.75Å; N680-N682 PolarHBondContact O-N 2.77Å; N680-N682 VanDerWaalsContact O-N 3.16Å
681	G	27	Very low	33.5	Very low	74 Å²	74	135.9 Å²	135.9	76%	0.763	76%	0.76	S	S	*	*			trans	-55.9	118.4	178.3	0	0	0	0	0	111.6	T679	T679-G681 PolarHBondContact O-N 3.42Å
682	N	29.4	Very low	35.3	Very low	159 Å²	159	132.1 Å²	132.1	85%	0.85	74%	0.744	S	S	*	*			trans	-114.9	129.4	151	-88.4	-18.4	0	0	0	108.5	N680	N680-N682 PolarHBondContact O-N 2.77Å; N680-N682 VanDerWaalsContact O-N 3.16Å
683	S	31.1	Very low	37.1	Very low	105 Å²	105	132 Å²	132	73%	0.734	73%	0.732	S	S	*	*			trans	-37	129.5	179.8	48.7	0	0	0	0	114.6	K685	S683-K685 PolarHBondContact O-N 2.63Å; S683-K685 VanDerWaalsContact O-N 3.13Å
684	V	31.9	Very low	39.3	Very low	131 Å²	131	133 Å²	133	79%	0.794	73%	0.734	S	S	*	*			trans	-47.1	110.2	162.4	-179.8	0	0	0	0	109.7
685	K	31.2	Very low	41.2	Very low	186 Å²	186	134.7 Å²	134.7	81%	0.809	73%	0.728	S	S	*	*			trans	-125.8	123.9	152.4	-83	-172.3	174.4	-178	0	106.6	S683 E687	S683-K685 PolarHBondContact O-N 2.63Å; S683-K685 VanDerWaalsContact O-N 3.13Å; K685-E687 PolarHBondContact O-N 3.33Å
686	D	34.6	Very low	43.4	Very low	148 Å²	148	135.9 Å²	135.9	79%	0.791	72%	0.72	S	S	*	*			trans	-53.1	116.6	179.6	-55.4	-65.4	0	0	0	111.1
687	E	35.7	Very low	45.6	Very low	194 Å²	194	136.8 Å²	136.8	91%	0.907	71%	0.714	S	S	*	*			trans	-135.1	123.4	151.9	-82	-168.7	167.7	0	0	108.9	K685	K685-E687 PolarHBondContact O-N 3.33Å
688	D	40.6	Very low	47.9	Very low	144 Å²	144	134.7 Å²	134.7	77%	0.77	70%	0.704	S	S	*	*			trans	-67.9	142.3	-170.4	-67.4	-62.7	0	0	0	113.9	Y690	D688-Y690 PolarHBondContact O-N 3.04Å
689	N	46	Very low	50.3	Low	151 Å²	151	132.8 Å²	132.8	81%	0.807	69%	0.694	S	S	*	*			trans	50.7	48.9	144.2	-66.1	-21.8	0	0	0	119.3
690	Y	48	Very low	52.6	Low	197 Å²	197	129.4 Å²	129.4	77%	0.773	67%	0.67	S	S	*	*			trans	-88.5	99.3	153	-165.3	-99.6	0	0	0	109.3	D688	D688-Y690 PolarHBondContact O-N 3.04Å
691	V	59.6	Low	55.1	Low	95 Å²	95	128.8 Å²	128.8	58%	0.576	66%	0.662	S	S	*	*			trans	-85.4	122.2	166.9	179.8	0	0	0	0	106.8
692	D	67.7	Low	57.6	Low	70 Å²	70	129.3 Å²	129.3	37%	0.374	65%	0.647	S	S	.	*			trans	-56.9	128.8	177.1	-165.9	-39.3	0	0	0	109.6	E694 D695 Y696	D692-E694 PolarHBondContact O-N 3.23Å; D692-E694 PolarHBondContact OD1-N 3.49Å; D692-D695 HydrophobicContact CB-CB 4.12Å; D692-D695 PolarHBondContact O-N 3.36Å; D692-Y696 PolarHBondContact O-N 3.42Å
693	P	68.6	Low	59.9	Low	64 Å²	64	125.4 Å²	125.4	42%	0.416	63%	0.629	S	S	.	*	H	α-helix	trans	-51.5	-35.9	174.5	-26.8	34	0	0	0	113.4	Y696 Y697	P693-Y696 PolarHBondContact O-N 3.47Å; P693-Y697 WeakPolarHBondContact O-CD2 3.19Å; P693-Y697 PolarHBondContact O-N 3.32Å
694	E	71.1	Confident	62.3	Low	153 Å²	153	124.7 Å²	124.7	72%	0.715	62%	0.617	S	S	*	*	H	α-helix	trans	-67.8	-44.7	178.9	-67.1	-166.9	173.6	0	0	111.8	D692 Y696 Y697 E698	D692-E694 PolarHBondContact O-N 3.23Å; D692-E694 PolarHBondContact OD1-N 3.49Å; E694-Y696 VanDerWaalsContact C-N 3.28Å; E694-Y696 PolarHBondContact O-N 2.79Å; E694-Y697 PolarHBondContact O-N 2.71Å; E694-E698 PolarHBondContact O-N 3.38Å
695	D	73	Confident	64.8	Low	97 Å²	97	125.2 Å²	125.2	52%	0.519	61%	0.609	S	S	.	*	H	α-helix	trans	-61.2	-37.9	174.9	-76.2	-13.9	0	0	0	111.4	D692 E698 L699	D692-D695 HydrophobicContact CB-CB 4.12Å; D692-D695 PolarHBondContact O-N 3.36Å; D695-E698 PolarHBondContact O-N 3.06Å; D695-L699 WeakPolarHBondContact O-CB 3.46Å; D695-L699 PolarHBondContact O-N 3.05Å
696	Y	72.9	Confident	67.2	Low	140 Å²	140	121.6 Å²	121.6	55%	0.549	60%	0.596	S	S	.	*	H	α-helix	trans	-65.2	-42.3	176.1	-178.5	-103.2	0	0	0	112.1	D692 P693 E694 L699 I700	D692-Y696 PolarHBondContact O-N 3.42Å; P693-Y696 PolarHBondContact O-N 3.47Å; E694-Y696 VanDerWaalsContact C-N 3.28Å; E694-Y696 PolarHBondContact O-N 2.79Å; Y696-L699 PolarHBondContact O-N 2.76Å; Y696-I700 HydrophobicContact CD1-CD1 3.72Å; Y696-I700 HydrophobicContact CE1-CD1 3.21Å; Y696-I700 HydrophobicContact CE1-CG1 4.29Å; Y696-I700 HydrophobicContact CE2-CD1 4.31Å; Y696-I700 HydrophobicContact CG-CD1 4.46Å; Y696-I700 WeakPolarHBondContact O-CG1 3.4Å; Y696-I700 PolarHBondContact O-N 3.2Å
697	Y	74.6	Confident	69.3	Low	165 Å²	165	120 Å²	120	65%	0.647	58%	0.584	S	S	*	*	H	α-helix	trans	-67	-39.6	175.6	-81.2	-66.3	0	0	0	112.5	P693 E694 L699 I700 Q701	P693-Y697 WeakPolarHBondContact O-CD2 3.19Å; P693-Y697 PolarHBondContact O-N 3.32Å; E694-Y697 PolarHBondContact O-N 2.71Å; Y697-L699 VanDerWaalsContact C-N 3.33Å; Y697-I700 PolarHBondContact O-N 3Å; Y697-Q701 PolarHBondContact O-N 2.97Å
698	E	77.6	Confident	71.5	Confident	116 Å²	116	113.5 Å²	113.5	54%	0.542	56%	0.564	S	S	.	*	H	α-helix	trans	-65.1	-39	174.9	-161.1	-168.8	155.2	0	0	111.1	E694 D695 Q701 N702	E694-E698 PolarHBondContact O-N 3.38Å; D695-E698 PolarHBondContact O-N 3.06Å; E698-Q701 PolarHBondContact O-N 3.06Å; E698-N702 WeakPolarHBondContact O-CB 3.26Å; E698-N702 VanDerWaalsContact O-CG 3.3Å; E698-N702 PolarHBondContact O-N 3.12Å; E698-N702 PolarHBondContact O-ND2 3.31Å
699	L	77.1	Confident	73.6	Confident	116 Å²	116	109 Å²	109	61%	0.607	54%	0.541	S	S	*	.	H	α-helix	trans	-63.9	-43.1	176.3	-146.3	98.1	0	0	0	111.5	D695 Y696 Y697 N702 V703	D695-L699 WeakPolarHBondContact O-CB 3.46Å; D695-L699 PolarHBondContact O-N 3.05Å; Y696-L699 PolarHBondContact O-N 2.76Å; Y697-L699 VanDerWaalsContact C-N 3.33Å; L699-N702 PolarHBondContact O-N 3.25Å; L699-V703 VanDerWaalsContact O-CG2 3.28Å; L699-V703 WeakPolarHBondContact O-CG2 3.28Å; L699-V703 PolarHBondContact O-N 2.68Å
700	I	78.6	Confident	75.2	Confident	59 Å²	59	106.1 Å²	106.1	30%	0.303	53%	0.526	S	S	.	.	H	α-helix	trans	-60.2	-49	175.2	-72.7	170.9	0	0	0	110.5	Y696 Y697 N702 V703 D704	Y696-I700 HydrophobicContact CD1-CD1 3.72Å; Y696-I700 HydrophobicContact CE1-CD1 3.21Å; Y696-I700 HydrophobicContact CE1-CG1 4.29Å; Y696-I700 HydrophobicContact CE2-CD1 4.31Å; Y696-I700 HydrophobicContact CG-CD1 4.46Å; Y696-I700 WeakPolarHBondContact O-CG1 3.4Å; Y696-I700 PolarHBondContact O-N 3.2Å; Y697-I700 PolarHBondContact O-N 3Å; I700-N702 VanDerWaalsContact C-N 3.27Å; I700-N702 PolarHBondContact O-N 2.72Å; I700-V703 PolarHBondContact O-N 3.26Å; I700-V703 VanDerWaalsContact O-N 3.11Å; I700-D704 PolarHBondContact O-N 3.18Å
701	Q	80	Confident	76.9	Confident	141 Å²	141	101.3 Å²	101.3	66%	0.659	51%	0.512	S	S	*	.	H	α-helix	trans	-60.1	-38.8	177.7	-83.9	-169.4	-8.3	0	0	112.5	Y697 E698 F705	Y697-Q701 PolarHBondContact O-N 2.97Å; E698-Q701 PolarHBondContact O-N 3.06Å; Q701-F705 VanDerWaalsContact O-CB 3.31Å; Q701-F705 WeakPolarHBondContact O-CB 3.15Å; Q701-F705 PolarHBondContact O-N 3.38Å
702	N	80.7	Confident	78.1	Confident	84 Å²	84	99.5 Å²	99.5	45%	0.449	50%	0.504	S	S	.	.	H	α-helix	trans	-66.7	-37.1	176.5	-79.6	-44.8	0	0	0	112.2	E698 L699 I700 M706	E698-N702 WeakPolarHBondContact O-CB 3.26Å; E698-N702 VanDerWaalsContact O-CG 3.3Å; E698-N702 PolarHBondContact O-N 3.12Å; E698-N702 PolarHBondContact O-ND2 3.31Å; L699-N702 PolarHBondContact O-N 3.25Å; I700-N702 VanDerWaalsContact C-N 3.27Å; I700-N702 PolarHBondContact O-N 2.72Å; N702-M706 WeakPolarHBondContact O-CB 3.18Å; N702-M706 WeakPolarHBondContact O-CG 3.13Å; N702-M706 PolarHBondContact O-N 2.9Å
703	V	78.4	Confident	78.9	Confident	77 Å²	77	100.3 Å²	100.3	47%	0.467	51%	0.507	S	S	.	.	H	α-helix	trans	-69.1	-45.8	175.1	171.2	0	0	0	0	110.8	L699 I700 F705 M706 E707	L699-V703 VanDerWaalsContact O-CG2 3.28Å; L699-V703 WeakPolarHBondContact O-CG2 3.28Å; L699-V703 PolarHBondContact O-N 2.68Å; I700-V703 PolarHBondContact O-N 3.26Å; I700-V703 VanDerWaalsContact O-N 3.11Å; V703-F705 VanDerWaalsContact C-N 3.33Å; V703-F705 PolarHBondContact O-N 2.9Å; V703-M706 CarbonylContact O-C 3.56Å; V703-M706 WeakPolarHBondContact O-CA 3.26Å; V703-M706 WeakPolarHBondContact O-CB 3.28Å; V703-M706 PolarHBondContact O-N 3.39Å; V703-M706 VanDerWaalsContact O-N 3.1Å; V703-E707 PolarHBondContact O-N 3.31Å
704	D	80.6	Confident	79.6	Confident	91 Å²	91	101.7 Å²	101.7	49%	0.487	51%	0.51	S	S	.	.	H	α-helix	trans	-61.1	-41.8	176.7	-72.6	-12.6	0	0	0	111.3	I700 E707 A708	I700-D704 PolarHBondContact O-N 3.18Å; D704-E707 PolarHBondContact O-N 2.99Å; D704-A708 WeakPolarHBondContact O-CB 3.39Å; D704-A708 PolarHBondContact O-N 3.29Å
705	F	85.1	Confident	80.3	Confident	142 Å²	142	97.8 Å²	97.8	62%	0.623	50%	0.497	S	S	*	.	H	α-helix	trans	-63.8	-42.5	173.9	-178.3	-96.8	0	0	0	111.5	Q701 V703 A708 T709	Q701-F705 VanDerWaalsContact O-CB 3.31Å; Q701-F705 WeakPolarHBondContact O-CB 3.15Å; Q701-F705 PolarHBondContact O-N 3.38Å; V703-F705 VanDerWaalsContact C-N 3.33Å; V703-F705 PolarHBondContact O-N 2.9Å; F705-A708 PolarHBondContact O-N 3.32Å; F705-T709 HydrophobicContact CD1-CG2 4.14Å; F705-T709 HydrophobicContact CE1-CG2 3.7Å; F705-T709 HydrophobicContact CE2-CG2 4.4Å; F705-T709 HydrophobicContact CZ-CG2 3.85Å; F705-T709 WeakPolarHBondContact O-CG2 3.45Å; F705-T709 PolarHBondContact O-N 3.04Å; F705-T709 PolarHBondContact O-OG1 3.16Å
706	M	79.8	Confident	80.9	Confident	110 Å²	110	101.6 Å²	101.6	54%	0.542	50%	0.504	S	S	.	.	H	α-helix	trans	-60.9	-43.8	174.2	-88	-177.4	37.8	0	0	111.8	N702 V703 T709 L710	N702-M706 WeakPolarHBondContact O-CB 3.18Å; N702-M706 WeakPolarHBondContact O-CG 3.13Å; N702-M706 PolarHBondContact O-N 2.9Å; V703-M706 CarbonylContact O-C 3.56Å; V703-M706 WeakPolarHBondContact O-CA 3.26Å; V703-M706 WeakPolarHBondContact O-CB 3.28Å; V703-M706 PolarHBondContact O-N 3.39Å; V703-M706 VanDerWaalsContact O-N 3.1Å; M706-T709 WeakPolarHBondContact CA-OG1 3.43Å; M706-T709 PolarHBondContact O-N 3.36Å; M706-T709 PolarHBondContact O-OG1 3.4Å; M706-L710 WeakPolarHBondContact O-CB 3.26Å; M706-L710 WeakPolarHBondContact O-CG 3.48Å; M706-L710 PolarHBondContact O-N 3.2Å
707	E	79.1	Confident	81.4	Confident	113 Å²	113	99.1 Å²	99.1	53%	0.528	50%	0.499	S	S	.	.	H	α-helix	trans	-61.3	-47.5	177.6	-169.7	177.2	175.9	0	0	111.2	V703 D704 T709 L710 I711	V703-E707 PolarHBondContact O-N 3.31Å; D704-E707 PolarHBondContact O-N 2.99Å; E707-T709 VanDerWaalsContact C-N 3.32Å; E707-T709 PolarHBondContact O-N 2.9Å; E707-L710 PolarHBondContact O-N 3.11Å; E707-L710 VanDerWaalsContact O-N 3.15Å; E707-I711 HydrophobicContact CG-CD1 4.18Å; E707-I711 WeakPolarHBondContact O-CG1 3.47Å; E707-I711 PolarHBondContact O-N 3.45Å
708	A	81.7	Confident	81.9	Confident	59 Å²	59	95.6 Å²	95.6	49%	0.488	49%	0.491	S	S	.	.	H	α-helix	trans	-59.7	-41	175.3	0	0	0	0	0	112.3	D704 F705 I711 S712	D704-A708 WeakPolarHBondContact O-CB 3.39Å; D704-A708 PolarHBondContact O-N 3.29Å; F705-A708 PolarHBondContact O-N 3.32Å; A708-I711 PolarHBondContact O-N 3.17Å; A708-S712 PolarHBondContact O-N 2.93Å
709	T	84.8	Confident	82.4	Confident	48 Å²	48	96.5 Å²	96.5	29%	0.294	50%	0.496	S	S	.	.	H	α-helix	trans	-67	-38.9	175.6	60.7	0	0	0	0	112.3	F705 M706 E707 S712 I713	F705-T709 HydrophobicContact CD1-CG2 4.14Å; F705-T709 HydrophobicContact CE1-CG2 3.7Å; F705-T709 HydrophobicContact CE2-CG2 4.4Å; F705-T709 HydrophobicContact CZ-CG2 3.85Å; F705-T709 WeakPolarHBondContact O-CG2 3.45Å; F705-T709 PolarHBondContact O-N 3.04Å; F705-T709 PolarHBondContact O-OG1 3.16Å; M706-T709 WeakPolarHBondContact CA-OG1 3.43Å; M706-T709 PolarHBondContact O-N 3.36Å; M706-T709 PolarHBondContact O-OG1 3.4Å; E707-T709 VanDerWaalsContact C-N 3.32Å; E707-T709 PolarHBondContact O-N 2.9Å; T709-S712 PolarHBondContact O-N 3.43Å; T709-S712 PolarHBondContact O-OG 3.05Å; T709-I713 VanDerWaalsContact O-CG1 3.31Å; T709-I713 WeakPolarHBondContact O-CG1 3.3Å; T709-I713 PolarHBondContact O-N 3.03Å
710	L	80.9	Confident	82.8	Confident	92 Å²	92	96.1 Å²	96.1	48%	0.482	49%	0.494	S	S	.	.	H	α-helix	trans	-64.1	-44.2	176.3	-80.5	166.2	0	0	0	111.2	M706 E707 S712 I713 I714	M706-L710 WeakPolarHBondContact O-CB 3.26Å; M706-L710 WeakPolarHBondContact O-CG 3.48Å; M706-L710 PolarHBondContact O-N 3.2Å; E707-L710 PolarHBondContact O-N 3.11Å; E707-L710 VanDerWaalsContact O-N 3.15Å; L710-S712 VanDerWaalsContact C-N 3.29Å; L710-S712 PolarHBondContact O-N 3.5Å; L710-I713 PolarHBondContact O-N 3.09Å; L710-I713 VanDerWaalsContact O-N 3.12Å; L710-I714 VanDerWaalsContact O-CG1 3.3Å; L710-I714 WeakPolarHBondContact O-CG1 3.48Å; L710-I714 PolarHBondContact O-N 3.25Å
711	I	83.2	Confident	83.1	Confident	95 Å²	95	97.7 Å²	97.7	49%	0.487	50%	0.502	S	S	.	.	H	α-helix	trans	-57.7	-44.3	173.8	-66.9	167	0	0	0	110.2	E707 A708 I713 I714 T715	E707-I711 HydrophobicContact CG-CD1 4.18Å; E707-I711 WeakPolarHBondContact O-CG1 3.47Å; E707-I711 PolarHBondContact O-N 3.45Å; A708-I711 PolarHBondContact O-N 3.17Å; I711-I713 VanDerWaalsContact C-N 3.31Å; I711-I713 PolarHBondContact O-N 3.31Å; I711-I714 PolarHBondContact O-N 2.83Å; I711-T715 WeakPolarHBondContact O-CG2 3.43Å; I711-T715 PolarHBondContact O-N 3.49Å; I711-T715 PolarHBondContact O-OG1 2.81Å
712	S	85.2	Confident	83.3	Confident	57 Å²	57	93.2 Å²	93.2	40%	0.399	49%	0.49	S	S	.	.	H	α-helix	trans	-66.5	-29.2	177.7	82.1	0	0	0	0	114.4	A708 T709 L710 T715 R716	A708-S712 PolarHBondContact O-N 2.93Å; T709-S712 PolarHBondContact O-N 3.43Å; T709-S712 PolarHBondContact O-OG 3.05Å; L710-S712 VanDerWaalsContact C-N 3.29Å; L710-S712 PolarHBondContact O-N 3.5Å; S712-T715 WeakPolarHBondContact CA-OG1 3.31Å; S712-T715 PolarHBondContact O-OG1 3.25Å; S712-R716 PolarHBondContact O-N 2.86Å
713	I	83.8	Confident	83.5	Confident	87 Å²	87	91.4 Å²	91.4	45%	0.446	48%	0.483	S	S	.	.	H	α-helix	trans	-75	-42.7	176.1	-70.2	165.2	0	0	0	109.4	T709 L710 I711 R716 I717	T709-I713 VanDerWaalsContact O-CG1 3.31Å; T709-I713 WeakPolarHBondContact O-CG1 3.3Å; T709-I713 PolarHBondContact O-N 3.03Å; L710-I713 PolarHBondContact O-N 3.09Å; L710-I713 VanDerWaalsContact O-N 3.12Å; I711-I713 VanDerWaalsContact C-N 3.31Å; I711-I713 PolarHBondContact O-N 3.31Å; I713-R716 PolarHBondContact O-N 2.88Å; I713-I717 HydrophobicContact CG2-CD1 3.8Å; I713-I717 HydrophobicContact CG2-CG1 4.4Å; I713-I717 WeakPolarHBondContact O-CG1 3.38Å; I713-I717 PolarHBondContact O-N 3.46Å
714	I	83.3	Confident	83.8	Confident	94 Å²	94	92.5 Å²	92.5	48%	0.482	49%	0.486	S	S	.	.	H	α-helix	trans	-60.3	-47.4	177.5	-68.4	165.2	0	0	0	110	L710 I711 R716 I717 D718	L710-I714 VanDerWaalsContact O-CG1 3.3Å; L710-I714 WeakPolarHBondContact O-CG1 3.48Å; L710-I714 PolarHBondContact O-N 3.25Å; I711-I714 PolarHBondContact O-N 2.83Å; I714-R716 VanDerWaalsContact C-N 3.31Å; I714-R716 PolarHBondContact O-N 2.64Å; I714-I717 WeakPolarHBondContact O-CB 3.5Å; I714-I717 PolarHBondContact O-N 3.2Å; I714-D718 PolarHBondContact O-N 2.91Å
715	T	87	Confident	84.2	Confident	71 Å²	71	94.3 Å²	94.3	44%	0.436	49%	0.492	S	S	.	.	H	α-helix	trans	-62	-36.9	177.6	56.1	0	0	0	0	112.8	I711 S712 D718 E719	I711-T715 WeakPolarHBondContact O-CG2 3.43Å; I711-T715 PolarHBondContact O-N 3.49Å; I711-T715 PolarHBondContact O-OG1 2.81Å; S712-T715 WeakPolarHBondContact CA-OG1 3.31Å; S712-T715 PolarHBondContact O-OG1 3.25Å; T715-D718 PolarHBondContact O-N 2.87Å; T715-E719 WeakPolarHBondContact O-CG 3.47Å; T715-E719 PolarHBondContact O-N 3.26Å
716	R	84.7	Confident	84.2	Confident	177 Å²	177	94.3 Å²	94.3	67%	0.668	49%	0.493	S	S	*	.	H	α-helix	trans	-67.1	-36.3	172.4	-88.4	-177.5	171.8	174.2	2.6	113.5	S712 I713 I714 D718 L720	S712-R716 PolarHBondContact O-N 2.86Å; I713-R716 PolarHBondContact O-N 2.88Å; I714-R716 VanDerWaalsContact C-N 3.31Å; I714-R716 PolarHBondContact O-N 2.64Å; R716-D718 VanDerWaalsContact C-N 3.32Å; R716-L720 WeakPolarHBondContact O-CB 3.39Å; R716-L720 VanDerWaalsContact O-CG 3.3Å; R716-L720 WeakPolarHBondContact O-CG 3.43Å; R716-L720 PolarHBondContact O-N 3.36Å
717	I	83.2	Confident	84.6	Confident	87 Å²	87	93 Å²	93	45%	0.446	49%	0.488	S	S	.	.	H	α-helix	trans	-65.6	-41.2	174.9	-71.4	167.5	0	0	0	109.4	I713 I714 L720 L721	I713-I717 HydrophobicContact CG2-CD1 3.8Å; I713-I717 HydrophobicContact CG2-CG1 4.4Å; I713-I717 WeakPolarHBondContact O-CG1 3.38Å; I713-I717 PolarHBondContact O-N 3.46Å; I714-I717 WeakPolarHBondContact O-CB 3.5Å; I714-I717 PolarHBondContact O-N 3.2Å; I717-L720 PolarHBondContact O-N 3.39Å; I717-L721 HydrophobicContact CG2-CD1 3.87Å; I717-L721 HydrophobicContact CG2-CG 4.44Å; I717-L721 WeakPolarHBondContact O-CB 3.41Å; I717-L721 WeakPolarHBondContact O-CG 3.39Å; I717-L721 PolarHBondContact O-N 3.08Å
718	D	86	Confident	84.9	Confident	91 Å²	91	94.1 Å²	94.1	49%	0.487	49%	0.493	S	S	.	.	H	α-helix	trans	-64.5	-41.8	175.9	-68.1	-24.2	0	0	0	111.9	I714 T715 R716 L720 L721 A722	I714-D718 PolarHBondContact O-N 2.91Å; T715-D718 PolarHBondContact O-N 2.87Å; R716-D718 VanDerWaalsContact C-N 3.32Å; D718-L720 PolarHBondContact O-N 3.04Å; D718-L721 PolarHBondContact O-N 3.23Å; D718-A722 WeakPolarHBondContact O-CB 3.47Å; D718-A722 PolarHBondContact O-N 2.82Å
719	E	87.3	Confident	85.1	Confident	135 Å²	135	96 Å²	96	63%	0.631	49%	0.494	S	S	*	.	H	α-helix	trans	-60.9	-42.1	172.1	-76.9	178.4	178.6	0	0	112.2	T715 A722 S723	T715-E719 WeakPolarHBondContact O-CG 3.47Å; T715-E719 PolarHBondContact O-N 3.26Å; E719-A722 PolarHBondContact O-N 2.88Å; E719-S723 WeakPolarHBondContact O-CB 3.15Å; E719-S723 PolarHBondContact O-N 2.89Å
720	L	84.8	Confident	85.2	Confident	108 Å²	108	96.2 Å²	96.2	57%	0.565	50%	0.501	S	S	*	.	H	α-helix	trans	-67.2	-40.9	177.2	-76.1	174.2	0	0	0	111.8	R716 I717 D718 S723 L724	R716-L720 WeakPolarHBondContact O-CB 3.39Å; R716-L720 VanDerWaalsContact O-CG 3.3Å; R716-L720 WeakPolarHBondContact O-CG 3.43Å; R716-L720 PolarHBondContact O-N 3.36Å; I717-L720 PolarHBondContact O-N 3.39Å; D718-L720 PolarHBondContact O-N 3.04Å; L720-S723 PolarHBondContact O-N 3.11Å; L720-S723 PolarHBondContact O-OG 3.46Å; L720-L724 WeakPolarHBondContact O-CB 3.49Å; L720-L724 PolarHBondContact O-N 2.92Å
721	L	84.7	Confident	85.4	Confident	93 Å²	93	98.1 Å²	98.1	49%	0.487	51%	0.505	S	S	.	.	H	α-helix	trans	-61.6	-45.8	174.1	-81.1	165.1	0	0	0	110.9	I717 D718 S723 L724 E725	I717-L721 HydrophobicContact CG2-CD1 3.87Å; I717-L721 HydrophobicContact CG2-CG 4.44Å; I717-L721 WeakPolarHBondContact O-CB 3.41Å; I717-L721 WeakPolarHBondContact O-CG 3.39Å; I717-L721 PolarHBondContact O-N 3.08Å; D718-L721 PolarHBondContact O-N 3.23Å; L721-S723 VanDerWaalsContact C-N 3.3Å; L721-S723 PolarHBondContact O-N 2.73Å; L721-L724 WeakPolarHBondContact O-CB 3.14Å; L721-L724 PolarHBondContact O-N 2.84Å; L721-L724 VanDerWaalsContact O-N 3.14Å; L721-E725 PolarHBondContact O-N 3.25Å
722	A	85.9	Confident	85.6	Confident	47 Å²	47	102.5 Å²	102.5	39%	0.388	52%	0.515	S	S	.	.	H	α-helix	trans	-60.4	-39.2	174.6	0	0	0	0	0	112	D718 E719 E725 Q726	D718-A722 WeakPolarHBondContact O-CB 3.47Å; D718-A722 PolarHBondContact O-N 2.82Å; E719-A722 PolarHBondContact O-N 2.88Å; A722-E725 PolarHBondContact O-N 2.94Å; A722-Q726 WeakPolarHBondContact O-CG 3.45Å; A722-Q726 PolarHBondContact O-N 2.69Å
723	S	85.2	Confident	85.6	Confident	46 Å²	46	105.2 Å²	105.2	32%	0.322	52%	0.522	S	S	.	.	H	α-helix	trans	-66.9	-37.2	175.4	80.6	0	0	0	0	112.7	E719 L720 L721 Q726 I727	E719-S723 WeakPolarHBondContact O-CB 3.15Å; E719-S723 PolarHBondContact O-N 2.89Å; L720-S723 PolarHBondContact O-N 3.11Å; L720-S723 PolarHBondContact O-OG 3.46Å; L721-S723 VanDerWaalsContact C-N 3.3Å; L721-S723 PolarHBondContact O-N 2.73Å; S723-Q726 PolarHBondContact O-N 2.84Å; S723-I727 VanDerWaalsContact O-CG1 3.29Å; S723-I727 WeakPolarHBondContact O-CG1 3.47Å; S723-I727 PolarHBondContact O-N 3.38Å
724	L	84.2	Confident	85.6	Confident	100 Å²	100	106.3 Å²	106.3	52%	0.524	53%	0.525	S	S	.	.	H	α-helix	trans	-66.1	-43	175.1	-93.7	156.1	0	0	0	111	L720 L721 Q726 I727 E728	L720-L724 WeakPolarHBondContact O-CB 3.49Å; L720-L724 PolarHBondContact O-N 2.92Å; L721-L724 WeakPolarHBondContact O-CB 3.14Å; L721-L724 PolarHBondContact O-N 2.84Å; L721-L724 VanDerWaalsContact O-N 3.14Å; L724-Q726 VanDerWaalsContact C-N 3.34Å; L724-Q726 PolarHBondContact O-N 3.2Å; L724-I727 PolarHBondContact O-N 3.11Å; L724-E728 PolarHBondContact O-N 2.82Å
725	E	87.7	Confident	85.7	Confident	129 Å²	129	110.7 Å²	110.7	60%	0.603	54%	0.535	S	S	*	.	H	α-helix	trans	-60.4	-43	173.7	-75.6	-173.6	165.5	0	0	111.6	L721 A722 I727 E728 I729	L721-E725 PolarHBondContact O-N 3.25Å; A722-E725 PolarHBondContact O-N 2.94Å; E725-I727 VanDerWaalsContact C-N 3.33Å; E725-I727 PolarHBondContact O-N 2.89Å; E725-E728 PolarHBondContact O-N 3.3Å; E725-I729 VanDerWaalsContact O-CG1 3.3Å; E725-I729 WeakPolarHBondContact O-CG1 3.18Å; E725-I729 PolarHBondContact O-N 2.82Å
726	Q	86.9	Confident	85.6	Confident	141 Å²	141	112.4 Å²	112.4	66%	0.659	54%	0.541	S	S	*	.	H	α-helix	trans	-61.1	-40.5	173.9	-74.1	-175.7	0.5	0	0	112.4	A722 S723 L724 E728 I729 A730	A722-Q726 WeakPolarHBondContact O-CG 3.45Å; A722-Q726 PolarHBondContact O-N 2.69Å; S723-Q726 PolarHBondContact O-N 2.84Å; L724-Q726 VanDerWaalsContact C-N 3.34Å; L724-Q726 PolarHBondContact O-N 3.2Å; Q726-E728 VanDerWaalsContact C-N 3.34Å; Q726-I729 PolarHBondContact O-N 2.88Å; Q726-A730 WeakPolarHBondContact O-CB 3.31Å; Q726-A730 PolarHBondContact O-N 3.19Å
727	I	86.2	Confident	85.5	Confident	84 Å²	84	109.9 Å²	109.9	43%	0.431	54%	0.537	S	S	.	.	H	α-helix	trans	-65.1	-38.5	175.5	-69	165.1	0	0	0	111	S723 L724 E725 A730 K731	S723-I727 VanDerWaalsContact O-CG1 3.29Å; S723-I727 WeakPolarHBondContact O-CG1 3.47Å; S723-I727 PolarHBondContact O-N 3.38Å; L724-I727 PolarHBondContact O-N 3.11Å; E725-I727 VanDerWaalsContact C-N 3.33Å; E725-I727 PolarHBondContact O-N 2.89Å; I727-A730 PolarHBondContact O-N 2.99Å; I727-K731 HydrophobicContact CG2-CD 4.35Å; I727-K731 WeakPolarHBondContact O-CB 3.3Å; I727-K731 WeakPolarHBondContact O-CG 3.37Å; I727-K731 PolarHBondContact O-N 2.8Å
728	E	85.5	Confident	85.4	Confident	135 Å²	135	110 Å²	110	63%	0.631	54%	0.537	S	S	*	.	H	α-helix	trans	-67.4	-41.7	175.5	-75	-162.4	161.2	0	0	112.4	L724 E725 Q726 K731 R732	L724-E728 PolarHBondContact O-N 2.82Å; E725-E728 PolarHBondContact O-N 3.3Å; Q726-E728 VanDerWaalsContact C-N 3.34Å; E728-K731 PolarHBondContact O-N 3.33Å; E728-R732 WeakPolarHBondContact O-CB 3.36Å; E728-R732 PolarHBondContact O-N 3.4Å
729	I	86.7	Confident	85.2	Confident	99 Å²	99	108.5 Å²	108.5	51%	0.508	53%	0.534	S	S	.	.	H	α-helix	trans	-59.9	-48	173.2	-68	166.2	0	0	0	109.9	E725 Q726 K731 R732 E733	E725-I729 VanDerWaalsContact O-CG1 3.3Å; E725-I729 WeakPolarHBondContact O-CG1 3.18Å; E725-I729 PolarHBondContact O-N 2.82Å; Q726-I729 PolarHBondContact O-N 2.88Å; I729-K731 PolarHBondContact O-N 3.32Å; I729-R732 WeakPolarHBondContact O-CA 3.44Å; I729-R732 WeakPolarHBondContact O-CB 3.3Å; I729-R732 PolarHBondContact O-N 2.76Å; I729-E733 PolarHBondContact O-N 2.89Å
730	A	86.6	Confident	85	Confident	53 Å²	53	103.5 Å²	103.5	44%	0.438	52%	0.519	S	S	.	.	H	α-helix	trans	-61.4	-41.4	177	0	0	0	0	0	112.5	Q726 I727 R732 E733 H734	Q726-A730 WeakPolarHBondContact O-CB 3.31Å; Q726-A730 PolarHBondContact O-N 3.19Å; I727-A730 PolarHBondContact O-N 2.99Å; A730-R732 VanDerWaalsContact C-N 3.29Å; A730-R732 PolarHBondContact O-N 3.45Å; A730-E733 PolarHBondContact O-N 3.49Å; A730-H734 WeakPolarHBondContact O-CB 3.44Å; A730-H734 PolarHBondContact O-N 2.86Å
731	K	85.5	Confident	84.9	Confident	131 Å²	131	103.2 Å²	103.2	57%	0.57	52%	0.517	S	S	*	.	H	α-helix	trans	-61.6	-37.3	172.9	-82.5	175.9	178.2	172.6	0	111.7	I727 E728 I729 R735	I727-K731 HydrophobicContact CG2-CD 4.35Å; I727-K731 WeakPolarHBondContact O-CB 3.3Å; I727-K731 WeakPolarHBondContact O-CG 3.37Å; I727-K731 PolarHBondContact O-N 2.8Å; E728-K731 PolarHBondContact O-N 3.33Å; I729-K731 PolarHBondContact O-N 3.32Å; K731-R735 WeakPolarHBondContact O-CG 3.28Å; K731-R735 PolarHBondContact O-N 3.26Å
732	R	86.8	Confident	84.7	Confident	187 Å²	187	103 Å²	103	71%	0.706	52%	0.519	S	S	*	.	H	α-helix	trans	-70.2	-43.7	178.6	-161	176.3	-173.6	176.9	1.5	111.3	E728 I729 A730 R735 I736	E728-R732 WeakPolarHBondContact O-CB 3.36Å; E728-R732 PolarHBondContact O-N 3.4Å; I729-R732 WeakPolarHBondContact O-CA 3.44Å; I729-R732 WeakPolarHBondContact O-CB 3.3Å; I729-R732 PolarHBondContact O-N 2.76Å; A730-R732 VanDerWaalsContact C-N 3.29Å; A730-R732 PolarHBondContact O-N 3.45Å; R732-R735 PolarHBondContact O-N 3.04Å; R732-I736 WeakPolarHBondContact O-CG1 3.18Å; R732-I736 PolarHBondContact O-N 2.95Å
733	E	85.6	Confident	84.5	Confident	114 Å²	114	107.6 Å²	107.6	53%	0.533	53%	0.53	S	S	.	.	H	α-helix	trans	-60.1	-45.1	172.7	-72.2	-178.7	167.8	0	0	111.7	I729 A730 R735 I736 Q737	I729-E733 PolarHBondContact O-N 2.89Å; A730-E733 PolarHBondContact O-N 3.49Å; E733-R735 VanDerWaalsContact C-N 3.32Å; E733-R735 PolarHBondContact O-N 2.7Å; E733-I736 PolarHBondContact O-N 3.16Å; E733-I736 VanDerWaalsContact O-N 3.1Å; E733-Q737 PolarHBondContact O-N 3.15Å
734	H	84.1	Confident	84.3	Confident	110 Å²	110	109.9 Å²	109.9	51%	0.509	54%	0.539	S	S	.	.	H	α-helix	trans	-61.5	-39.3	176.2	-171.8	-96.9	0	0	0	112.1	A730 Q737 L738	A730-H734 WeakPolarHBondContact O-CB 3.44Å; A730-H734 PolarHBondContact O-N 2.86Å; H734-Q737 PolarHBondContact O-N 3.36Å; H734-L738 WeakPolarHBondContact CE1-CD1 3.41Å; H734-L738 WeakPolarHBondContact O-CB 3.38Å; H734-L738 PolarHBondContact O-N 3.38Å
735	R	85.6	Confident	84	Confident	187 Å²	187	110.6 Å²	110.6	71%	0.706	54%	0.541	S	S	*	.	H	α-helix	trans	-64.4	-39.9	172.6	-75.4	-179.7	-167.9	-170.5	5.4	112.2	K731 R732 E733 L738 S739	K731-R735 WeakPolarHBondContact O-CG 3.28Å; K731-R735 PolarHBondContact O-N 3.26Å; R732-R735 PolarHBondContact O-N 3.04Å; E733-R735 VanDerWaalsContact C-N 3.32Å; E733-R735 PolarHBondContact O-N 2.7Å; R735-L738 PolarHBondContact O-N 3.24Å; R735-S739 WeakPolarHBondContact O-CB 3.47Å; R735-S739 PolarHBondContact O-N 3.11Å
736	I	84.8	Confident	83.5	Confident	106 Å²	106	107.1 Å²	107.1	54%	0.544	53%	0.531	S	S	.	.	H	α-helix	trans	-64.2	-45.1	176.6	-68.4	165.2	0	0	0	110	R732 E733 S739 G740	R732-I736 WeakPolarHBondContact O-CG1 3.18Å; R732-I736 PolarHBondContact O-N 2.95Å; E733-I736 PolarHBondContact O-N 3.16Å; E733-I736 VanDerWaalsContact O-N 3.1Å; I736-S739 PolarHBondContact O-N 3.42Å; I736-S739 PolarHBondContact O-OG 3.3Å; I736-G740 PolarHBondContact O-N 2.92Å
737	Q	82.7	Confident	83	Confident	125 Å²	125	108.2 Å²	108.2	58%	0.584	53%	0.529	S	S	*	.	H	α-helix	trans	-60.1	-47.7	175.2	-73	-178.6	-0.7	0	0	112.1	E733 H734 S739 G740 I741	E733-Q737 PolarHBondContact O-N 3.15Å; H734-Q737 PolarHBondContact O-N 3.36Å; Q737-S739 VanDerWaalsContact C-N 3.3Å; Q737-S739 PolarHBondContact O-N 3.03Å; Q737-G740 WeakPolarHBondContact O-CA 3.43Å; Q737-G740 PolarHBondContact O-N 3.32Å; Q737-G740 VanDerWaalsContact O-N 3.09Å; Q737-I741 WeakPolarHBondContact O-CG1 3.45Å; Q737-I741 PolarHBondContact O-N 3.4Å
738	L	80.8	Confident	82.6	Confident	88 Å²	88	108.2 Å²	108.2	46%	0.461	53%	0.533	S	S	.	.	H	α-helix	trans	-57.2	-43	174	-104.9	150.3	0	0	0	111.8	H734 R735 G740 I741 V742	H734-L738 WeakPolarHBondContact CE1-CD1 3.41Å; H734-L738 WeakPolarHBondContact O-CB 3.38Å; H734-L738 PolarHBondContact O-N 3.38Å; R735-L738 PolarHBondContact O-N 3.24Å; L738-G740 VanDerWaalsContact C-N 3.31Å; L738-G740 PolarHBondContact O-N 2.9Å; L738-I741 PolarHBondContact O-N 2.83Å; L738-V742 WeakPolarHBondContact O-CB 3.32Å; L738-V742 VanDerWaalsContact O-CG2 3.25Å; L738-V742 WeakPolarHBondContact O-CG2 3.34Å; L738-V742 PolarHBondContact O-N 2.97Å
739	S	82.1	Confident	82	Confident	61 Å²	61	107.7 Å²	107.7	43%	0.427	53%	0.534	S	S	.	.	H	α-helix	trans	-65.8	-34.2	176.8	80.3	0	0	0	0	112.7	R735 I736 Q737 K743	R735-S739 WeakPolarHBondContact O-CB 3.47Å; R735-S739 PolarHBondContact O-N 3.11Å; I736-S739 PolarHBondContact O-N 3.42Å; I736-S739 PolarHBondContact O-OG 3.3Å; Q737-S739 VanDerWaalsContact C-N 3.3Å; Q737-S739 PolarHBondContact O-N 3.03Å; S739-K743 WeakPolarHBondContact O-CB 3.43Å; S739-K743 WeakPolarHBondContact O-CG 3.37Å; S739-K743 PolarHBondContact O-N 2.93Å
740	G	82.9	Confident	81.2	Confident	29 Å²	29	110.8 Å²	110.8	30%	0.299	55%	0.546	S	S	.	.	H	α-helix	trans	-65.3	-48.2	173.5	0	0	0	0	0	111.6	I736 Q737 L738 V742 K743 D744	I736-G740 PolarHBondContact O-N 2.92Å; Q737-G740 WeakPolarHBondContact O-CA 3.43Å; Q737-G740 PolarHBondContact O-N 3.32Å; Q737-G740 VanDerWaalsContact O-N 3.09Å; L738-G740 VanDerWaalsContact C-N 3.31Å; L738-G740 PolarHBondContact O-N 2.9Å; G740-V742 VanDerWaalsContact C-N 3.34Å; G740-V742 PolarHBondContact O-N 2.92Å; G740-K743 WeakPolarHBondContact O-CB 3.21Å; G740-K743 PolarHBondContact O-N 3.13Å; G740-K743 VanDerWaalsContact O-N 3.14Å; G740-D744 PolarHBondContact O-N 3.02Å
741	I	81.8	Confident	80.4	Confident	102 Å²	102	116 Å²	116	52%	0.523	57%	0.566	S	S	.	*	H	α-helix	trans	-60.6	-43.8	176.5	-65.7	165.2	0	0	0	110.9	Q737 L738 K743 D744 M745	Q737-I741 WeakPolarHBondContact O-CG1 3.45Å; Q737-I741 PolarHBondContact O-N 3.4Å; L738-I741 PolarHBondContact O-N 2.83Å; I741-K743 VanDerWaalsContact C-N 3.33Å; I741-K743 PolarHBondContact O-N 3.42Å; I741-D744 PolarHBondContact O-N 3.1Å; I741-M745 HydrophobicContact CG2-SD 4.47Å; I741-M745 WeakPolarHBondContact O-CB 3.42Å; I741-M745 WeakPolarHBondContact O-CG 3.46Å; I741-M745 PolarHBondContact O-N 3.11Å
742	V	81.3	Confident	79.1	Confident	90 Å²	90	120.5 Å²	120.5	55%	0.545	59%	0.586	S	S	.	*	H	α-helix	trans	-63.4	-39.9	176.5	171.6	0	0	0	0	111	L738 G740 S746	L738-V742 WeakPolarHBondContact O-CB 3.32Å; L738-V742 VanDerWaalsContact O-CG2 3.25Å; L738-V742 WeakPolarHBondContact O-CG2 3.34Å; L738-V742 PolarHBondContact O-N 2.97Å; G740-V742 VanDerWaalsContact C-N 3.34Å; G740-V742 PolarHBondContact O-N 2.92Å; V742-S746 WeakPolarHBondContact O-CB 3.28Å; V742-S746 PolarHBondContact O-N 3.19Å
743	K	81.4	Confident	78.7	Confident	142 Å²	142	117.2 Å²	117.2	62%	0.617	58%	0.58	S	S	*	*	H	α-helix	trans	-64.7	-43.8	174	-86	-178.3	176.6	177.8	0	112.3	S739 G740 I741 S746 R747	S739-K743 WeakPolarHBondContact O-CB 3.43Å; S739-K743 WeakPolarHBondContact O-CG 3.37Å; S739-K743 PolarHBondContact O-N 2.93Å; G740-K743 WeakPolarHBondContact O-CB 3.21Å; G740-K743 PolarHBondContact O-N 3.13Å; G740-K743 VanDerWaalsContact O-N 3.14Å; I741-K743 VanDerWaalsContact C-N 3.33Å; I741-K743 PolarHBondContact O-N 3.42Å; K743-S746 WeakPolarHBondContact CA-OG 3.35Å; K743-S746 PolarHBondContact O-N 3.04Å; K743-S746 PolarHBondContact O-OG 3.3Å; K743-R747 PolarHBondContact O-N 3.4Å
744	D	81.9	Confident	78.3	Confident	94 Å²	94	117.4 Å²	117.4	50%	0.503	58%	0.582	S	S	.	*	H	α-helix	trans	-67.6	-39.3	178.2	-76.1	-17.3	0	0	0	111.7	G740 I741 S746 R747 T748	G740-D744 PolarHBondContact O-N 3.02Å; I741-D744 PolarHBondContact O-N 3.1Å; D744-S746 VanDerWaalsContact C-N 3.33Å; D744-S746 PolarHBondContact O-N 3.2Å; D744-R747 PolarHBondContact O-N 2.93Å; D744-T748 WeakPolarHBondContact O-CB 3.31Å; D744-T748 PolarHBondContact O-N 3.37Å; D744-T748 PolarHBondContact O-OG1 3.01Å
745	M	76.6	Confident	78	Confident	115 Å²	115	117.8 Å²	117.8	57%	0.567	59%	0.586	S	S	*	*	H	α-helix	trans	-58.5	-44.7	169.4	-83.2	-176.7	55.3	0	0	111.7	I741 T748 L749	I741-M745 HydrophobicContact CG2-SD 4.47Å; I741-M745 WeakPolarHBondContact O-CB 3.42Å; I741-M745 WeakPolarHBondContact O-CG 3.46Å; I741-M745 PolarHBondContact O-N 3.11Å; M745-T748 PolarHBondContact O-N 3.47Å; M745-L749 WeakPolarHBondContact O-CB 3.48Å; M745-L749 WeakPolarHBondContact O-CG 3.4Å; M745-L749 PolarHBondContact O-N 2.92Å
746	S	78.9	Confident	77.6	Confident	56 Å²	56	113.7 Å²	113.7	39%	0.392	58%	0.579	S	S	.	*	H	α-helix	trans	-64.6	-39.2	177.9	76.5	0	0	0	0	112.5	V742 K743 D744 L749 Q750	V742-S746 WeakPolarHBondContact O-CB 3.28Å; V742-S746 PolarHBondContact O-N 3.19Å; K743-S746 WeakPolarHBondContact CA-OG 3.35Å; K743-S746 PolarHBondContact O-N 3.04Å; K743-S746 PolarHBondContact O-OG 3.3Å; D744-S746 VanDerWaalsContact C-N 3.33Å; D744-S746 PolarHBondContact O-N 3.2Å; S746-L749 PolarHBondContact O-N 3Å; S746-Q750 WeakPolarHBondContact O-CG 3.05Å; S746-Q750 PolarHBondContact O-N 3.39Å
747	R	76.3	Confident	77.1	Confident	165 Å²	165	114.2 Å²	114.2	62%	0.623	58%	0.581	S	S	*	*	H	α-helix	trans	-66.7	-41.1	174.5	-80.5	-179.8	169.3	178.6	-4.7	112	K743 D744 L749 Q750 L751	K743-R747 PolarHBondContact O-N 3.4Å; D744-R747 PolarHBondContact O-N 2.93Å; R747-L749 VanDerWaalsContact C-N 3.29Å; R747-L749 PolarHBondContact O-N 3.38Å; R747-Q750 PolarHBondContact O-N 3.28Å; R747-Q750 VanDerWaalsContact O-N 3.17Å; R747-L751 PolarHBondContact O-N 2.95Å
748	T	77.2	Confident	76.8	Confident	84 Å²	84	113.5 Å²	113.5	52%	0.515	58%	0.581	S	S	.	*	H	α-helix	trans	-66.1	-35.1	177.9	-46.1	0	0	0	0	111.1	D744 M745 K752	D744-T748 WeakPolarHBondContact O-CB 3.31Å; D744-T748 PolarHBondContact O-N 3.37Å; D744-T748 PolarHBondContact O-OG1 3.01Å; M745-T748 PolarHBondContact O-N 3.47Å; T748-K752 PolarHBondContact O-N 3.2Å
749	L	73.2	Confident	76.5	Confident	123 Å²	123	115.3 Å²	115.3	64%	0.644	59%	0.59	S	S	*	*	H	α-helix	trans	-73.1	-23.5	173.3	-77	166.5	0	0	0	113.7	M745 S746 R747	M745-L749 WeakPolarHBondContact O-CB 3.48Å; M745-L749 WeakPolarHBondContact O-CG 3.4Å; M745-L749 PolarHBondContact O-N 2.92Å; S746-L749 PolarHBondContact O-N 3Å; R747-L749 VanDerWaalsContact C-N 3.29Å; R747-L749 PolarHBondContact O-N 3.38Å
750	Q	68.3	Low	76	Confident	165 Å²	165	119.5 Å²	119.5	77%	0.771	60%	0.602	S	S	*	*	H	α-helix	trans	-85.4	-24.3	173.5	-77.5	-172.7	-22.5	0	0	113.6	S746 R747	S746-Q750 WeakPolarHBondContact O-CG 3.05Å; S746-Q750 PolarHBondContact O-N 3.39Å; R747-Q750 PolarHBondContact O-N 3.28Å; R747-Q750 VanDerWaalsContact O-N 3.17Å
751	L	70.2	Confident	75.5	Confident	162 Å²	162	127 Å²	127	85%	0.848	63%	0.628	S	S	*	*	H	α-helix	trans	-84	-19	175.7	-77.2	166.7	0	0	0	113.2	R747	R747-L751 PolarHBondContact O-N 2.95Å
752	K	58.4	Low	74.9	Confident	226 Å²	226	129.3 Å²	129.3	98%	0.983	64%	0.637	S	S	*	*			trans	-87.2	0	166.5	-89.6	-175.2	173	-178.8	0	110	T748	T748-K752 PolarHBondContact O-N 3.2Å

Retrieved 752 of 752 residues in 1783.3 ms (Link to these results)

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