A0A096MUN3_PAPAN Loading...

GDNF family receptor alpha-3

Receptor for artemin (ARTN), a growth factor that supports the survival of sensory and sympathetic peripheral neurons. ARTN-binding leads to autophosphorylation and activation of the RET receptor.

AlphaFold DB , UniProt , Accession A0A096MUN3, Species PAPAN (Papio anubis, Olive baboon), Gene GFRA3, Length 403 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.5	Very low	54.8	Low	245 Å²	245	151.4 Å²	151.4	100%	1.207	82%	0.815	S	S	*	*				0	108.1	0	-77.1	171.8	176.7	0	0	108.4
2	V	43.5	Very low	55.6	Low	146 Å²	146	147 Å²	147	89%	0.885	80%	0.801	S	S	*	*			trans	-134.1	118.2	171.4	177.8	0	0	0	0	106.1
3	R	48.7	Very low	56.5	Low	238 Å²	238	143.4 Å²	143.4	90%	0.898	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-71.8	142	177.9	-90.2	-178.7	178.5	176.7	-0.3	110
4	P	51.7	Low	57.3	Low	115 Å²	115	137.2 Å²	137.2	75%	0.747	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-74.9	150.3	171.8	31.8	-31.9	0	0	0	110.7
5	P	51.8	Low	58	Low	126 Å²	126	135.1 Å²	135.1	82%	0.818	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-74.5	138.8	178.9	28.9	-31.5	0	0	0	111.5
6	S	56	Low	58.4	Low	105 Å²	105	134.1 Å²	134.1	73%	0.734	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-65.3	141.8	173.5	46.9	0	0	0	0	112.1
7	P	54.4	Low	58.9	Low	130 Å²	130	132.6 Å²	132.6	84%	0.844	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-68.3	135.2	-179.6	26.8	-31.9	0	0	0	111.4
8	R	61.1	Low	59.3	Low	236 Å²	236	130.3 Å²	130.3	89%	0.891	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-72.7	141.3	174.4	-66.9	-178.5	-178.9	-175.8	0.1	109.9
9	P	60	Low	59.7	Low	124 Å²	124	128.4 Å²	128.4	81%	0.805	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-66.4	140.3	175.5	26.5	-31.4	0	0	0	110.8
10	L	61.6	Low	59.9	Low	127 Å²	127	127.6 Å²	127.6	67%	0.665	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-66.3	138.6	177.6	-80.9	146.3	0	0	0	110.4	V14	L10-V14 HydrophobicContact CD2-CB 4.46Å; L10-V14 HydrophobicContact CD2-CG1 3.99Å
11	P	68.4	Low	59.9	Low	73 Å²	73	127 Å²	127	47%	0.474	69%	0.687	S	S	.	*	P	Polyproline II helix	trans	-63.4	145.8	-179.9	22.6	-29.5	0	0	0	111.2	V13 V14	P11-V13 PolarHBondContact O-N 3.27Å; P11-V14 HydrophobicContact CG-CG2 3.88Å; P11-V14 PolarHBondContact O-N 3.33Å
12	P	64.3	Low	60.7	Low	99 Å²	99	122.4 Å²	122.4	64%	0.643	67%	0.667	S	S	*	*	H	α-helix	trans	-59.4	-24.3	-171.1	21.1	-32.3	0	0	0	113.7	V14 L15 M16	P12-V14 VanDerWaalsContact C-N 3.33Å; P12-V14 PolarHBondContact O-N 3.13Å; P12-L15 PolarHBondContact O-N 3.47Å; P12-M16 WeakPolarHBondContact O-CG 3.44Å; P12-M16 PolarHBondContact O-N 3.41Å
13	V	67.1	Low	61.3	Low	100 Å²	100	122.2 Å²	122.2	61%	0.606	66%	0.66	S	S	*	*	H	α-helix	trans	-65.5	-35.7	175.8	-175.1	0	0	0	0	112	P11 L17	P11-V13 PolarHBondContact O-N 3.27Å; V13-L17 HydrophobicContact CG1-CD1 4.35Å; V13-L17 PolarHBondContact O-N 3.43Å
14	V	67.8	Low	61.4	Low	57 Å²	57	116.8 Å²	116.8	35%	0.345	65%	0.648	S	S	.	*	H	α-helix	trans	-74.3	-36.3	179.2	177.8	0	0	0	0	110.6	L10 P11 P12 L17 L18	L10-V14 HydrophobicContact CD2-CB 4.46Å; L10-V14 HydrophobicContact CD2-CG1 3.99Å; P11-V14 HydrophobicContact CG-CG2 3.88Å; P11-V14 PolarHBondContact O-N 3.33Å; P12-V14 VanDerWaalsContact C-N 3.33Å; P12-V14 PolarHBondContact O-N 3.13Å; V14-L17 PolarHBondContact O-N 3.41Å; V14-L18 HydrophobicContact CG1-CD1 4.03Å; V14-L18 WeakPolarHBondContact O-CB 3.47Å; V14-L18 WeakPolarHBondContact O-CD1 2.96Å; V14-L18 WeakPolarHBondContact O-CG 3.32Å; V14-L18 PolarHBondContact O-N 3.46Å
15	L	67.8	Low	61.6	Low	105 Å²	105	116.3 Å²	116.3	55%	0.55	65%	0.645	S	S	.	*	H	α-helix	trans	-66.1	-41.1	174.5	-158.7	79.7	0	0	0	111.4	P12 L18 L19	P12-L15 PolarHBondContact O-N 3.47Å; L15-L18 PolarHBondContact O-N 3.45Å; L15-L19 HydrophobicContact CG-CD1 4.23Å; L15-L19 WeakPolarHBondContact O-CD1 3.03Å; L15-L19 PolarHBondContact O-N 3.13Å
16	M	64.5	Low	61.5	Low	119 Å²	119	116.5 Å²	116.5	59%	0.586	65%	0.646	S	S	*	*	H	α-helix	trans	-65.1	-39.1	175.3	-76.3	-66.7	-67.6	0	0	112.6	P12 L19 L20	P12-M16 WeakPolarHBondContact O-CG 3.44Å; P12-M16 PolarHBondContact O-N 3.41Å; M16-L19 PolarHBondContact O-N 3.17Å; M16-L20 WeakPolarHBondContact O-CD1 3.26Å; M16-L20 PolarHBondContact O-N 3.41Å
17	L	66.8	Low	61	Low	109 Å²	109	116 Å²	116	57%	0.571	64%	0.643	S	S	*	*	H	α-helix	trans	-64.9	-40.4	174.5	-114.9	108.2	0	0	0	112.3	V13 V14 L20 L21	V13-L17 HydrophobicContact CG1-CD1 4.35Å; V13-L17 PolarHBondContact O-N 3.43Å; V14-L17 PolarHBondContact O-N 3.41Å; L17-L20 PolarHBondContact O-N 3.29Å; L17-L21 WeakPolarHBondContact O-CD1 3.36Å; L17-L21 WeakPolarHBondContact O-CG 3.46Å; L17-L21 PolarHBondContact O-N 3.15Å; L17-L21 VanDerWaalsContact O-N 3.07Å
18	L	65.9	Low	60.3	Low	91 Å²	91	115.9 Å²	115.9	48%	0.476	64%	0.642	S	S	.	*	H	α-helix	trans	-65.8	-38.3	176.9	-82	157.6	0	0	0	112.2	V14 L15 L21 L22	V14-L18 HydrophobicContact CG1-CD1 4.03Å; V14-L18 WeakPolarHBondContact O-CB 3.47Å; V14-L18 WeakPolarHBondContact O-CD1 2.96Å; V14-L18 WeakPolarHBondContact O-CG 3.32Å; V14-L18 PolarHBondContact O-N 3.46Å; L15-L18 PolarHBondContact O-N 3.45Å; L18-L21 PolarHBondContact O-N 2.88Å; L18-L22 PolarHBondContact O-N 3.45Å
19	L	66.9	Low	59.2	Low	94 Å²	94	112 Å²	112	49%	0.492	64%	0.638	S	S	.	*	H	α-helix	trans	-69	-36.5	174.1	-98.6	115.1	0	0	0	112.7	L15 M16 L21 L22	L15-L19 HydrophobicContact CG-CD1 4.23Å; L15-L19 WeakPolarHBondContact O-CD1 3.03Å; L15-L19 PolarHBondContact O-N 3.13Å; M16-L19 PolarHBondContact O-N 3.17Å; L19-L21 VanDerWaalsContact C-N 3.33Å; L19-L22 PolarHBondContact O-N 3.13Å
20	L	63.6	Low	58	Low	112 Å²	112	111.8 Å²	111.8	59%	0.586	64%	0.637	S	S	*	*	H	α-helix	trans	-66.6	-33.3	174.2	-101	107.4	0	0	0	112.7	M16 L17 L22 L23	M16-L20 WeakPolarHBondContact O-CD1 3.26Å; M16-L20 PolarHBondContact O-N 3.41Å; L17-L20 PolarHBondContact O-N 3.29Å; L20-L22 VanDerWaalsContact C-N 3.29Å; L20-L22 PolarHBondContact O-N 3.46Å; L20-L23 PolarHBondContact O-N 3.4Å
21	L	60.8	Low	56.7	Low	116 Å²	116	113.8 Å²	113.8	61%	0.607	65%	0.647	S	S	*	*	H	α-helix	trans	-68	-25.6	175.1	-80.7	156.2	0	0	0	113.2	L17 L18 L19	L17-L21 WeakPolarHBondContact O-CD1 3.36Å; L17-L21 WeakPolarHBondContact O-CG 3.46Å; L17-L21 PolarHBondContact O-N 3.15Å; L17-L21 VanDerWaalsContact O-N 3.07Å; L18-L21 PolarHBondContact O-N 2.88Å; L19-L21 VanDerWaalsContact C-N 3.33Å
22	L	61.8	Low	55	Low	149 Å²	149	114.9 Å²	114.9	78%	0.78	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-12.8	178.3	-74.6	161.8	0	0	0	113.8	L18 L19 L20	L18-L22 PolarHBondContact O-N 3.45Å; L19-L22 PolarHBondContact O-N 3.13Å; L20-L22 VanDerWaalsContact C-N 3.29Å; L20-L22 PolarHBondContact O-N 3.46Å
23	L	56.6	Low	53.6	Low	142 Å²	142	115.2 Å²	115.2	74%	0.743	67%	0.673	S	S	*	*	S	Bend	trans	-102.3	-1.2	-177.2	-72.6	165.7	0	0	0	113.8	L20	L20-L23 PolarHBondContact O-N 3.4Å
24	L	51.3	Low	52	Low	123 Å²	123	113.4 Å²	113.4	64%	0.644	68%	0.675	S	S	*	*	S	Bend	trans	-82.5	126.1	173.9	-81.3	144.5	0	0	0	110
25	P	54.7	Low	50.3	Low	106 Å²	106	117.9 Å²	117.9	69%	0.688	70%	0.697	S	S	*	*			trans	-63.5	145.2	174	27.2	-32.5	0	0	0	109.7	S27	P25-S27 PolarHBondContact O-N 2.97Å
26	P	49.7	Very low	48.7	Very low	129 Å²	129	118.7 Å²	118.7	84%	0.838	71%	0.709	S	S	*	*			trans	-64.1	109.7	-178	24.8	-31.9	0	0	0	109.8
27	S	45.8	Very low	47.5	Very low	96 Å²	96	120.2 Å²	120.2	67%	0.671	72%	0.719	S	S	*	*			trans	-62.1	130.3	166.9	48.4	0	0	0	0	109.2	P25 L29	P25-S27 PolarHBondContact O-N 2.97Å; S27-L29 PolarHBondContact O-N 3.4Å
28	P	39.9	Very low	46.1	Very low	126 Å²	126	119.7 Å²	119.7	82%	0.818	72%	0.722	S	S	*	*			trans	-66.3	109.4	177.7	25.7	-30.8	0	0	0	109.2
29	L	39	Very low	44.6	Very low	154 Å²	154	119.6 Å²	119.6	81%	0.806	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-63.1	134.6	168.3	-79.1	158.7	0	0	0	108.7	S27 L31	S27-L29 PolarHBondContact O-N 3.4Å; L29-L31 PolarHBondContact O-N 3.27Å; L29-L31 VanDerWaalsContact O-N 3.09Å
30	P	34.6	Very low	43.2	Very low	120 Å²	120	122.9 Å²	122.9	78%	0.779	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-65.3	116.1	173.7	26	-29.7	0	0	0	108.1	A32	P30-A32 PolarHBondContact O-N 3.37Å; P30-A32 VanDerWaalsContact O-N 3.08Å
31	L	33.2	Very low	42.1	Very low	169 Å²	169	121.5 Å²	121.5	89%	0.885	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-49	116.8	168.5	-83.5	149.5	0	0	0	108.5	L29 A33	L29-L31 PolarHBondContact O-N 3.27Å; L29-L31 VanDerWaalsContact O-N 3.09Å; L31-A33 PolarHBondContact O-N 3.44Å; L31-A33 VanDerWaalsContact O-N 3.1Å
32	A	33.7	Very low	41.5	Very low	96 Å²	96	122 Å²	122	79%	0.793	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-51.4	119.6	160.9	0	0	0	0	0	107.1	P30 G34	P30-A32 PolarHBondContact O-N 3.37Å; P30-A32 VanDerWaalsContact O-N 3.08Å; A32-G34 VanDerWaalsContact C-N 3.26Å; A32-G34 PolarHBondContact O-N 2.87Å
33	A	34	Very low	41	Very low	106 Å²	106	119.1 Å²	119.1	88%	0.876	72%	0.716	S	S	*	*			trans	-60.8	92.2	174	0	0	0	0	0	108.3	L31	L31-A33 PolarHBondContact O-N 3.44Å; L31-A33 VanDerWaalsContact O-N 3.1Å
34	G	32.8	Very low	40.9	Very low	62 Å²	62	117 Å²	117	64%	0.639	70%	0.704	S	S	*	*			trans	-58.1	138	162.3	0	0	0	0	0	108.1	A32	A32-G34 VanDerWaalsContact C-N 3.26Å; A32-G34 PolarHBondContact O-N 2.87Å
35	D	33.3	Very low	41.8	Very low	151 Å²	151	116.3 Å²	116.3	81%	0.807	70%	0.7	S	S	*	*			trans	-39.9	133.9	170.3	-77	-53.1	0	0	0	110.2	L37	D35-L37 PolarHBondContact O-N 3.18Å
36	P	34.3	Very low	43.4	Very low	122 Å²	122	111.6 Å²	111.6	79%	0.792	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-59.6	117.1	179.7	22.1	-29.4	0	0	0	108.6
37	L	39.6	Very low	45.4	Very low	152 Å²	152	105.4 Å²	105.4	80%	0.796	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-47.8	140.8	162.3	-135.7	101.2	0	0	0	107.3	D35 T39	D35-L37 PolarHBondContact O-N 3.18Å; L37-T39 PolarHBondContact O-N 2.02Å
38	P	35.8	Very low	47.7	Very low	98 Å²	98	102.4 Å²	102.4	64%	0.636	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-57.6	119.9	175.7	-8.9	21.5	0	0	0	107.6	E40	P38-E40 PolarHBondContact O-N 3.1Å
39	T	35	Very low	50.2	Low	88 Å²	88	98.7 Å²	98.7	54%	0.54	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-50	131.2	-179.4	-34	0	0	0	0	109.6	L37 S41 R42	L37-T39 PolarHBondContact O-N 2.02Å; T39-S41 PolarHBondContact O-N 2.99Å; T39-R42 PolarHBondContact O-N 3.5Å
40	E	38.4	Very low	52.7	Low	163 Å²	163	91.6 Å²	91.6	76%	0.762	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-53.4	-18.1	-179.6	-161.3	161.3	-168.7	0	0	113.3	P38 R42	P38-E40 PolarHBondContact O-N 3.1Å; E40-R42 VanDerWaalsContact C-N 3.35Å; E40-R42 PolarHBondContact O-N 3.44Å
41	S	40.4	Very low	55.6	Low	83 Å²	83	86.9 Å²	86.9	58%	0.58	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-69.3	-22.1	173.8	84.3	0	0	0	0	114.8	T39 L43	T39-S41 PolarHBondContact O-N 2.99Å; S41-L43 VanDerWaalsContact C-N 3.33Å; S41-L43 PolarHBondContact O-N 3.37Å
42	R	48.5	Very low	58.5	Low	127 Å²	127	86.9 Å²	86.9	48%	0.479	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-78.6	-13	179.9	-70.7	-173.4	-170.6	179.7	2.5	114	T39 E40	T39-R42 PolarHBondContact O-N 3.5Å; E40-R42 VanDerWaalsContact C-N 3.35Å; E40-R42 PolarHBondContact O-N 3.44Å
43	L	51.2	Low	61.3	Low	88 Å²	88	87.4 Å²	87.4	46%	0.461	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-89.1	-3.9	-179.8	-74	171.1	0	0	0	113.8	S41 N45 S46 Q49	S41-L43 VanDerWaalsContact C-N 3.33Å; S41-L43 PolarHBondContact O-N 3.37Å; L43-N45 PolarHBondContact O-N 2.89Å; L43-S46 WeakPolarHBondContact O-CB 3.3Å; L43-S46 PolarHBondContact O-N 2.97Å; L43-S46 PolarHBondContact O-OG 2.99Å; L43-S46 VanDerWaalsContact O-OG 3.11Å; L43-Q49 PolarHBondContact O-OE1 3.03Å
44	M	53.3	Low	64.1	Low	99 Å²	99	82.6 Å²	82.6	49%	0.488	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-21.1	-170.2	-80	-69	140.3	0	0	114.8	Q49	M44-Q49 VanDerWaalsContact CA-OE1 3.25Å; M44-Q49 PolarHBondContact O-OE1 3.09Å
45	N	69.9	Low	67.1	Low	107 Å²	107	84.6 Å²	84.6	57%	0.572	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.7	17.7	178.1	-61.7	-16.7	0	0	0	113.9	L43 C104 M105	L43-N45 PolarHBondContact O-N 2.89Å; N45-C104 VanDerWaalsContact O-CA 3.29Å; N45-C104 WeakPolarHBondContact O-CA 3.5Å; N45-M105 PolarHBondContact O-N 3.1Å
46	S	88.8	Confident	69.9	Low	7 Å²	7	81.6 Å²	81.6	5%	0.049	43%	0.429	C	S	.	.	B	Isolated β-bridge	trans	-69.8	140.4	178.9	68.2	0	0	0	0	111.9	L43 L48 Q49 A50 M105	L43-S46 WeakPolarHBondContact O-CB 3.3Å; L43-S46 PolarHBondContact O-N 2.97Å; L43-S46 PolarHBondContact O-OG 2.99Å; L43-S46 VanDerWaalsContact O-OG 3.11Å; S46-L48 PolarHBondContact O-N 2.86Å; S46-L48 VanDerWaalsContact O-N 3.15Å; S46-Q49 PolarHBondContact O-N 2.84Å; S46-Q49 WeakPolarHBondContact OG-CB 3.36Å; S46-Q49 PolarHBondContact OG-N 3.29Å; S46-A50 PolarHBondContact O-N 3.23Å; S46-M105 VanDerWaalsContact CA-O 3.32Å; S46-M105 WeakPolarHBondContact CA-O 3.41Å
47	C	92.8	Very high	72.8	Confident	0 Å²	0	79.3 Å²	79.3	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-58	-31.2	177.7	-63.9	0	0	0	0	113.3	R51 C104 M105 I119	C47-R51 VanDerWaalsContact O-CB 3.31Å; C47-R51 WeakPolarHBondContact O-CB 3.28Å; C47-R51 PolarHBondContact O-N 3.06Å; C47-C104 VanDerWaalsContact CA-CB 3.5Å; C47-C104 WeakPolarHBondContact CA-SG 3.3Å; C47-C104 HydrophobicContact CB-CB 3.83Å; C47-C104 WeakPolarHBondContact CB-SG 3.48Å; C47-C104 WeakPolarHBondContact SG-CB 3.24Å; C47-C104 PolarHBondContact SG-O 3.49Å; C47-C104 CovalentContact SG-SG 2.04Å; C47-C104 PolarHBondContact SG-SG 3.28Å; C47-M105 PolarHBondContact N-O 2.79Å; C47-M105 VanDerWaalsContact N-O 3.15Å; C47-I119 HydrophobicContact CB-CB 4.12Å; C47-I119 HydrophobicContact CB-CG2 3.83Å
48	L	93.4	Very high	75.4	Confident	32 Å²	32	77 Å²	77	17%	0.168	40%	0.404	C	S	.	.	H	α-helix	trans	-63.9	-42.5	173.9	-65.1	173.4	0	0	0	112.5	S46 R52 M110 N112 A115 C116 I119	S46-L48 PolarHBondContact O-N 2.86Å; S46-L48 VanDerWaalsContact O-N 3.15Å; L48-R52 WeakPolarHBondContact O-CG 3.44Å; L48-R52 PolarHBondContact O-N 2.9Å; L48-M110 HydrophobicContact CD1-CE 3.35Å; L48-M110 HydrophobicContact CG-CE 4.16Å; L48-N112 HydrophobicContact CD1-CB 3.7Å; L48-A115 HydrophobicContact CD2-CB 4.06Å; L48-C116 HydrophobicContact CD1-CB 4.47Å; L48-C116 HydrophobicContact CD2-CB 4.48Å; L48-C116 HydrophobicContact CG-CB 4.12Å; L48-I119 HydrophobicContact CD2-CD1 3.82Å
49	Q	91.9	Very high	78	Confident	49 Å²	49	78 Å²	78	23%	0.229	40%	0.403	C	S	.	.	H	α-helix	trans	-73.1	-41	178.3	-169.5	-180	21.4	0	0	111.3	L43 M44 S46 R51 R52 K53	L43-Q49 PolarHBondContact O-OE1 3.03Å; M44-Q49 VanDerWaalsContact CA-OE1 3.25Å; M44-Q49 PolarHBondContact O-OE1 3.09Å; S46-Q49 PolarHBondContact O-N 2.84Å; S46-Q49 WeakPolarHBondContact OG-CB 3.36Å; S46-Q49 PolarHBondContact OG-N 3.29Å; Q49-R51 VanDerWaalsContact C-N 3.29Å; Q49-R51 PolarHBondContact O-N 2.91Å; Q49-R52 PolarHBondContact O-N 3.03Å; Q49-K53 PolarHBondContact O-N 3.24Å
50	A	92.9	Very high	80.8	Confident	5 Å²	5	74.4 Å²	74.4	4%	0.041	38%	0.382	C	S	.	.	H	α-helix	trans	-58.7	-41.6	174.6	0	0	0	0	0	111.6	S46 K53 C54 S100 L101 C104	S46-A50 PolarHBondContact O-N 3.23Å; A50-K53 PolarHBondContact O-N 3.25Å; A50-C54 WeakPolarHBondContact O-CB 3.42Å; A50-C54 PolarHBondContact O-N 3.37Å; A50-S100 WeakPolarHBondContact CB-O 3.39Å; A50-L101 HydrophobicContact CB-CD2 3.88Å; A50-L101 HydrophobicContact CB-CG 4.31Å; A50-C104 HydrophobicContact CB-CB 3.95Å
51	R	94.4	Very high	83.4	Confident	21 Å²	21	67.7 Å²	67.7	8%	0.079	35%	0.353	C	S	.	.	H	α-helix	trans	-63.2	-42.8	174.7	-178.8	59.4	177.1	119.1	3.3	112.6	C47 Q49 K53 C54 Q55 Y64 H65 L101 I119	C47-R51 VanDerWaalsContact O-CB 3.31Å; C47-R51 WeakPolarHBondContact O-CB 3.28Å; C47-R51 PolarHBondContact O-N 3.06Å; Q49-R51 VanDerWaalsContact C-N 3.29Å; Q49-R51 PolarHBondContact O-N 2.91Å; R51-K53 VanDerWaalsContact C-N 3.34Å; R51-K53 PolarHBondContact O-N 2.97Å; R51-C54 WeakPolarHBondContact O-CB 3.35Å; R51-C54 PolarHBondContact O-N 2.79Å; R51-Q55 VanDerWaalsContact O-CG 3.31Å; R51-Q55 WeakPolarHBondContact O-CG 3.47Å; R51-Q55 PolarHBondContact O-N 2.91Å; R51-Y64 VanDerWaalsContact NE-CE1 3.35Å; R51-H65 PolarHBondContact NH2-CE1 3.34Å; R51-H65 PolarHBondContact NH2-NE2 3.26Å; R51-L101 HydrophobicContact CB-CD2 4.17Å; R51-I119 HydrophobicContact CB-CD1 3.73Å; R51-I119 HydrophobicContact CB-CG1 4.32Å; R51-I119 HydrophobicContact CB-CG2 4.2Å; R51-I119 HydrophobicContact CG-CD1 3.98Å; R51-I119 HydrophobicContact CG-CG1 4.32Å
52	R	93.7	Very high	85.9	Confident	168 Å²	168	66.7 Å²	66.7	63%	0.634	35%	0.35	S	S	*	.	H	α-helix	trans	-61.6	-40.9	175.3	-71.4	175.7	-170.2	167.6	1.4	112.4	L48 Q49 Q55 A56	L48-R52 WeakPolarHBondContact O-CG 3.44Å; L48-R52 PolarHBondContact O-N 2.9Å; Q49-R52 PolarHBondContact O-N 3.03Å; R52-Q55 PolarHBondContact O-N 3.4Å; R52-A56 PolarHBondContact O-N 3.42Å
53	K	92.4	Very high	88	Confident	108 Å²	108	60.8 Å²	60.8	47%	0.47	33%	0.328	S	S	.	.	H	α-helix	trans	-62.5	-45.1	174.2	-71.1	177.7	179.1	174.6	0	111	Q49 A50 R51 Q55 A56	Q49-K53 PolarHBondContact O-N 3.24Å; A50-K53 PolarHBondContact O-N 3.25Å; R51-K53 VanDerWaalsContact C-N 3.34Å; R51-K53 PolarHBondContact O-N 2.97Å; K53-Q55 VanDerWaalsContact C-N 3.32Å; K53-Q55 PolarHBondContact O-N 3.01Å; K53-A56 PolarHBondContact O-N 3.06Å
54	C	93.4	Very high	89.9	Confident	4 Å²	4	57 Å²	57	3%	0.027	31%	0.308	C	S	.	.	H	α-helix	trans	-63.6	-33.8	176.6	-175.9	0	0	0	0	113.1	A50 R51 A56 D57 C60 S61 L101	A50-C54 WeakPolarHBondContact O-CB 3.42Å; A50-C54 PolarHBondContact O-N 3.37Å; R51-C54 WeakPolarHBondContact O-CB 3.35Å; R51-C54 PolarHBondContact O-N 2.79Å; C54-A56 PolarHBondContact O-N 3.33Å; C54-D57 PolarHBondContact O-N 3.44Å; C54-C60 VanDerWaalsContact CA-SG 3.55Å; C54-C60 HydrophobicContact CB-CB 4.07Å; C54-C60 WeakPolarHBondContact CB-SG 3.32Å; C54-C60 WeakPolarHBondContact SG-CB 3.44Å; C54-C60 PolarHBondContact SG-O 2.88Å; C54-C60 CovalentContact SG-SG 2.04Å; C54-C60 PolarHBondContact SG-SG 3.3Å; C54-S61 PolarHBondContact O-N 3.09Å; C54-L101 HydrophobicContact CB-CD1 3.73Å; C54-L101 HydrophobicContact CB-CG 4.23Å; C54-L101 WeakPolarHBondContact SG-CD1 3.33Å
55	Q	94.8	Very high	91.8	Very high	104 Å²	104	56.7 Å²	56.7	49%	0.486	31%	0.305	S	S	.	.	H	α-helix	trans	-64.1	-28.6	175.7	-77	173.4	-22.9	0	0	113.2	R51 R52 K53 D57	R51-Q55 VanDerWaalsContact O-CG 3.31Å; R51-Q55 WeakPolarHBondContact O-CG 3.47Å; R51-Q55 PolarHBondContact O-N 2.91Å; R52-Q55 PolarHBondContact O-N 3.4Å; K53-Q55 VanDerWaalsContact C-N 3.32Å; K53-Q55 PolarHBondContact O-N 3.01Å; Q55-D57 VanDerWaalsContact C-N 3.32Å
56	A	93.9	Very high	92.7	Very high	88 Å²	88	55.6 Å²	55.6	73%	0.727	30%	0.296	S	S	*	.	H	α-helix	trans	-78.2	-18.3	177.7	0	0	0	0	0	113	R52 K53 C54	R52-A56 PolarHBondContact O-N 3.42Å; K53-A56 PolarHBondContact O-N 3.06Å; C54-A56 PolarHBondContact O-N 3.33Å
57	D	93.8	Very high	92.6	Very high	74 Å²	74	55.4 Å²	55.4	40%	0.396	30%	0.295	S	S	.	.	S	Bend	trans	-98.1	116.8	175.4	178.7	-23.1	0	0	0	109.3	C54 Q55 I59 C60 S61	C54-D57 PolarHBondContact O-N 3.44Å; Q55-D57 VanDerWaalsContact C-N 3.32Å; D57-I59 VanDerWaalsContact C-N 3.28Å; D57-I59 PolarHBondContact O-N 2.86Å; D57-I59 WeakPolarHBondContact OD1-CB 3.41Å; D57-I59 PolarHBondContact OD1-N 3.25Å; D57-C60 HydrophobicContact CB-CB 3.84Å; D57-C60 PolarHBondContact O-N 3.25Å; D57-C60 PolarHBondContact OD1-N 3.34Å; D57-S61 VanDerWaalsContact O-CB 3.28Å; D57-S61 WeakPolarHBondContact O-CB 3.42Å; D57-S61 PolarHBondContact O-N 3.22Å
58	P	93.7	Very high	92.4	Very high	103 Å²	103	57.8 Å²	57.8	67%	0.669	31%	0.307	S	S	*	.	H	α-helix	trans	-62.2	-33.6	-176.6	25.3	-33.5	0	0	0	113.1	A62	P58-A62 VanDerWaalsContact O-CB 3.32Å; P58-A62 WeakPolarHBondContact O-CB 3.45Å; P58-A62 PolarHBondContact O-N 3.26Å
59	I	91.6	Very high	91.9	Very high	119 Å²	119	60 Å²	60	61%	0.61	33%	0.326	S	S	*	.	H	α-helix	trans	-70.6	-49.6	179.6	-60.5	171.3	0	0	0	108.9	D57 S61 A62 A63	D57-I59 VanDerWaalsContact C-N 3.28Å; D57-I59 PolarHBondContact O-N 2.86Å; D57-I59 WeakPolarHBondContact OD1-CB 3.41Å; D57-I59 PolarHBondContact OD1-N 3.25Å; I59-S61 VanDerWaalsContact C-N 3.35Å; I59-S61 PolarHBondContact O-N 3.38Å; I59-A62 PolarHBondContact O-N 3.36Å; I59-A63 WeakPolarHBondContact O-CB 3.38Å; I59-A63 PolarHBondContact O-N 3.37Å
60	C	92.8	Very high	91.3	Very high	13 Å²	13	58.1 Å²	58.1	9%	0.088	32%	0.318	C	S	.	.	H	α-helix	trans	-61.5	-44.2	178.3	-170.1	0	0	0	0	111.7	C54 D57 A63 Y64	C54-C60 VanDerWaalsContact CA-SG 3.55Å; C54-C60 HydrophobicContact CB-CB 4.07Å; C54-C60 WeakPolarHBondContact CB-SG 3.32Å; C54-C60 WeakPolarHBondContact SG-CB 3.44Å; C54-C60 PolarHBondContact SG-O 2.88Å; C54-C60 CovalentContact SG-SG 2.04Å; C54-C60 PolarHBondContact SG-SG 3.3Å; D57-C60 HydrophobicContact CB-CB 3.84Å; D57-C60 PolarHBondContact O-N 3.25Å; D57-C60 PolarHBondContact OD1-N 3.34Å; C60-A63 PolarHBondContact O-N 2.94Å; C60-Y64 WeakPolarHBondContact O-CB 3.35Å; C60-Y64 PolarHBondContact O-N 2.95Å
61	S	94.2	Very high	90.2	Very high	22 Å²	22	59 Å²	59	15%	0.154	32%	0.322	C	S	.	.	H	α-helix	trans	-62.2	-45.9	-179.5	-166.1	0	0	0	0	111.7	C54 D57 I59 Y64 H65	C54-S61 PolarHBondContact O-N 3.09Å; D57-S61 VanDerWaalsContact O-CB 3.28Å; D57-S61 WeakPolarHBondContact O-CB 3.42Å; D57-S61 PolarHBondContact O-N 3.22Å; I59-S61 VanDerWaalsContact C-N 3.35Å; I59-S61 PolarHBondContact O-N 3.38Å; S61-Y64 PolarHBondContact O-N 3.19Å; S61-H65 PolarHBondContact O-CD2 3.11Å; S61-H65 PolarHBondContact O-N 3.31Å
62	A	93.3	Very high	88.6	Confident	63 Å²	63	62.5 Å²	62.5	52%	0.521	35%	0.35	S	S	.	.	H	α-helix	trans	-61.6	-47.2	176.5	0	0	0	0	0	111.8	P58 I59 Y64 H65 H66	P58-A62 VanDerWaalsContact O-CB 3.32Å; P58-A62 WeakPolarHBondContact O-CB 3.45Å; P58-A62 PolarHBondContact O-N 3.26Å; I59-A62 PolarHBondContact O-N 3.36Å; A62-Y64 VanDerWaalsContact C-N 3.33Å; A62-Y64 PolarHBondContact O-N 3.46Å; A62-H65 PolarHBondContact O-N 3.38Å; A62-H66 WeakPolarHBondContact O-CB 3.37Å; A62-H66 PolarHBondContact O-N 3.24Å
63	A	91.4	Very high	86.5	Confident	3 Å²	3	58.3 Å²	58.3	3%	0.025	35%	0.347	C	S	.	.	H	α-helix	trans	-59.7	-41.7	177.4	0	0	0	0	0	112.2	I59 C60 H66 L67 Q95 L96	I59-A63 WeakPolarHBondContact O-CB 3.38Å; I59-A63 PolarHBondContact O-N 3.37Å; C60-A63 PolarHBondContact O-N 2.94Å; A63-H66 PolarHBondContact O-N 3.22Å; A63-L67 WeakPolarHBondContact O-CB 3.44Å; A63-L67 PolarHBondContact O-N 3.24Å; A63-Q95 HydrophobicContact CB-CB 3.96Å; A63-L96 HydrophobicContact CB-CD2 3.88Å; A63-L96 HydrophobicContact CB-CG 3.99Å
64	Y	92.1	Very high	84.7	Confident	8 Å²	8	56.3 Å²	56.3	3%	0.031	34%	0.341	C	S	.	.	H	α-helix	trans	-62.1	-48.9	175.6	-177.3	-82.1	0	0	0	112.1	R51 C60 S61 A62 H66 L67 D68 L101 I119 T122 V123	R51-Y64 VanDerWaalsContact NE-CE1 3.35Å; C60-Y64 WeakPolarHBondContact O-CB 3.35Å; C60-Y64 PolarHBondContact O-N 2.95Å; S61-Y64 PolarHBondContact O-N 3.19Å; A62-Y64 VanDerWaalsContact C-N 3.33Å; A62-Y64 PolarHBondContact O-N 3.46Å; Y64-H66 VanDerWaalsContact C-N 3.28Å; Y64-H66 PolarHBondContact O-N 3.31Å; Y64-L67 PolarHBondContact O-N 3.06Å; Y64-D68 HydrophobicContact CE1-CB 4.3Å; Y64-D68 WeakPolarHBondContact O-CB 3.38Å; Y64-D68 PolarHBondContact O-N 3.21Å; Y64-L101 HydrophobicContact CD2-CD1 3.8Å; Y64-L101 HydrophobicContact CE2-CD1 4.47Å; Y64-I119 HydrophobicContact CE2-CG2 4.19Å; Y64-T122 HydrophobicContact CE2-CG2 4Å; Y64-V123 HydrophobicContact CD2-CG2 4.21Å; Y64-V123 HydrophobicContact CE2-CG2 3.97Å
65	H	91.9	Very high	82	Confident	93 Å²	93	61 Å²	61	43%	0.431	37%	0.373	S	S	.	.	H	α-helix	trans	-64	-34.9	-179.7	-79	-65	0	0	0	112.6	R51 S61 A62 S69	R51-H65 PolarHBondContact NH2-CE1 3.34Å; R51-H65 PolarHBondContact NH2-NE2 3.26Å; S61-H65 PolarHBondContact O-CD2 3.11Å; S61-H65 PolarHBondContact O-N 3.31Å; A62-H65 PolarHBondContact O-N 3.38Å; H65-S69 PolarHBondContact O-N 3.44Å; H65-S69 VanDerWaalsContact O-N 3.13Å; H65-S69 PolarHBondContact O-OG 3.08Å
66	H	89.5	Confident	79.5	Confident	84 Å²	84	60.5 Å²	60.5	39%	0.389	38%	0.378	S	S	.	.	H	α-helix	trans	-64.8	-48.6	173.6	-165	-94.4	0	0	0	111.3	A62 A63 Y64 D68 S69 C70 D88 A92	A62-H66 WeakPolarHBondContact O-CB 3.37Å; A62-H66 PolarHBondContact O-N 3.24Å; A63-H66 PolarHBondContact O-N 3.22Å; Y64-H66 VanDerWaalsContact C-N 3.28Å; Y64-H66 PolarHBondContact O-N 3.31Å; H66-D68 VanDerWaalsContact C-N 3.34Å; H66-D68 PolarHBondContact O-N 2.86Å; H66-S69 WeakPolarHBondContact O-CB 3.42Å; H66-S69 PolarHBondContact O-N 3.36Å; H66-C70 PolarHBondContact O-N 3.29Å; H66-C70 VanDerWaalsContact O-N 3.15Å; H66-C70 PolarHBondContact O-SG 3.35Å; H66-D88 PolarHBondContact CE1-O 3.47Å; H66-D88 PolarHBondContact ND1-O 3.42Å; H66-A92 HydrophobicContact CB-CB 4.13Å
67	L	86.9	Confident	76.8	Confident	3 Å²	3	60 Å²	60	2%	0.016	37%	0.367	C	S	.	.	H	α-helix	trans	-62	-39.8	178.2	-175.4	62.7	0	0	0	112.6	A63 Y64 S69 C70 T71 A92 A93 L96 T122 A126	A63-L67 WeakPolarHBondContact O-CB 3.44Å; A63-L67 PolarHBondContact O-N 3.24Å; Y64-L67 PolarHBondContact O-N 3.06Å; L67-S69 VanDerWaalsContact C-N 3.31Å; L67-S69 PolarHBondContact O-N 3.42Å; L67-C70 VanDerWaalsContact O-CB 3.26Å; L67-C70 WeakPolarHBondContact O-CB 3.47Å; L67-C70 PolarHBondContact O-N 3.19Å; L67-C70 VanDerWaalsContact O-N 3.13Å; L67-T71 WeakPolarHBondContact O-CG2 3.31Å; L67-T71 PolarHBondContact O-N 3.18Å; L67-T71 VanDerWaalsContact O-N 3.1Å; L67-A92 HydrophobicContact CB-CB 4.33Å; L67-A93 HydrophobicContact CD1-CB 4.42Å; L67-L96 HydrophobicContact CB-CD1 4.39Å; L67-L96 HydrophobicContact CD2-CD1 3.61Å; L67-T122 HydrophobicContact CD2-CG2 4.45Å; L67-T122 VanDerWaalsContact CD2-O 3.32Å; L67-T122 WeakPolarHBondContact CD2-O 3.43Å; L67-T122 HydrophobicContact CG-CG2 4.33Å; L67-A126 HydrophobicContact CD1-CB 4.03Å; L67-A126 HydrophobicContact CD2-CB 3.7Å
68	D	87.6	Confident	74	Confident	49 Å²	49	62.8 Å²	62.8	26%	0.262	38%	0.381	S	S	.	.	H	α-helix	trans	-62.8	-36	175.7	-171.3	45.3	0	0	0	112.6	Y64 H66 C70 T71 S72 T122	Y64-D68 HydrophobicContact CE1-CB 4.3Å; Y64-D68 WeakPolarHBondContact O-CB 3.38Å; Y64-D68 PolarHBondContact O-N 3.21Å; H66-D68 VanDerWaalsContact C-N 3.34Å; H66-D68 PolarHBondContact O-N 2.86Å; D68-C70 VanDerWaalsContact C-N 3.3Å; D68-C70 PolarHBondContact O-N 3.05Å; D68-T71 PolarHBondContact O-N 3.2Å; D68-T71 PolarHBondContact O-OG1 3.4Å; D68-S72 PolarHBondContact O-N 2.99Å; D68-S72 PolarHBondContact O-OG 3.22Å; D68-T122 HydrophobicContact CB-CG2 4.1Å
69	S	84.6	Confident	71.5	Confident	79 Å²	79	62.6 Å²	62.6	55%	0.552	38%	0.38	S	S	*	.	H	α-helix	trans	-67.2	-34.8	173.9	-56.4	0	0	0	0	111.5	H65 H66 L67 S72 S73	H65-S69 PolarHBondContact O-N 3.44Å; H65-S69 VanDerWaalsContact O-N 3.13Å; H65-S69 PolarHBondContact O-OG 3.08Å; H66-S69 WeakPolarHBondContact O-CB 3.42Å; H66-S69 PolarHBondContact O-N 3.36Å; L67-S69 VanDerWaalsContact C-N 3.31Å; L67-S69 PolarHBondContact O-N 3.42Å; S69-S72 PolarHBondContact O-N 3.45Å; S69-S73 PolarHBondContact O-N 3.46Å
70	C	79.6	Confident	68.8	Low	9 Å²	9	61.7 Å²	61.7	6%	0.061	38%	0.384	C	S	.	.	H	α-helix	trans	-67.1	-33.3	174	-59.5	0	0	0	0	113	H66 L67 D68 S72 S73 I74 C89	H66-C70 PolarHBondContact O-N 3.29Å; H66-C70 VanDerWaalsContact O-N 3.15Å; H66-C70 PolarHBondContact O-SG 3.35Å; L67-C70 VanDerWaalsContact O-CB 3.26Å; L67-C70 WeakPolarHBondContact O-CB 3.47Å; L67-C70 PolarHBondContact O-N 3.19Å; L67-C70 VanDerWaalsContact O-N 3.13Å; D68-C70 VanDerWaalsContact C-N 3.3Å; D68-C70 PolarHBondContact O-N 3.05Å; C70-S72 VanDerWaalsContact C-N 3.26Å; C70-S72 PolarHBondContact O-N 3.48Å; C70-S73 PolarHBondContact O-N 3.48Å; C70-S73 PolarHBondContact O-OG 2.04Å; C70-I74 WeakPolarHBondContact O-CD1 3.41Å; C70-I74 WeakPolarHBondContact O-CG1 3.48Å; C70-I74 PolarHBondContact O-N 2.92Å; C70-C89 HydrophobicContact CB-CB 3.74Å; C70-C89 WeakPolarHBondContact CB-SG 3.07Å; C70-C89 WeakPolarHBondContact SG-CB 3.41Å; C70-C89 CovalentContact SG-SG 2.02Å; C70-C89 PolarHBondContact SG-SG 3.48Å
71	T	68	Low	66.1	Low	23 Å²	23	68.9 Å²	68.9	14%	0.141	42%	0.416	C	S	.	.	H	α-helix	trans	-71.2	-27.5	-179.4	66	0	0	0	0	112.5	L67 D68 T122 R125	L67-T71 WeakPolarHBondContact O-CG2 3.31Å; L67-T71 PolarHBondContact O-N 3.18Å; L67-T71 VanDerWaalsContact O-N 3.1Å; D68-T71 PolarHBondContact O-N 3.2Å; D68-T71 PolarHBondContact O-OG1 3.4Å; T71-T122 HydrophobicContact CG2-CG2 4.33Å; T71-R125 PolarHBondContact O-NH1 2.77Å
72	S	60.8	Low	63.5	Low	95 Å²	95	76 Å²	76	66%	0.664	45%	0.447	S	S	*	.	H	α-helix	trans	-79.4	-25.9	178.7	-59.8	0	0	0	0	113.3	D68 S69 C70	D68-S72 PolarHBondContact O-N 2.99Å; D68-S72 PolarHBondContact O-OG 3.22Å; S69-S72 PolarHBondContact O-N 3.45Å; C70-S72 VanDerWaalsContact C-N 3.26Å; C70-S72 PolarHBondContact O-N 3.48Å
73	S	51.4	Low	61.4	Low	81 Å²	81	77.4 Å²	77.4	57%	0.566	45%	0.451	S	S	*	.	H	α-helix	trans	-88.8	-19.6	-179.4	68.4	0	0	0	0	114.1	S69 C70 S75	S69-S73 PolarHBondContact O-N 3.46Å; C70-S73 PolarHBondContact O-N 3.48Å; C70-S73 PolarHBondContact O-OG 2.04Å; S73-S75 PolarHBondContact O-N 2.88Å
74	I	52.8	Low	59.6	Low	66 Å²	66	82.6 Å²	82.6	34%	0.338	49%	0.487	S	S	.	.			trans	-76.1	80.6	173.4	-60.6	163.3	0	0	0	108.2	C70	C70-I74 WeakPolarHBondContact O-CD1 3.41Å; C70-I74 WeakPolarHBondContact O-CG1 3.48Å; C70-I74 PolarHBondContact O-N 2.92Å
75	S	38.3	Very low	58.1	Low	102 Å²	102	83.6 Å²	83.6	71%	0.713	49%	0.494	S	S	*	.			trans	-65.2	142.5	160	-66.2	0	0	0	0	109.2	S73	S73-S75 PolarHBondContact O-N 2.88Å
76	T	41	Very low	57.2	Low	94 Å²	94	82.1 Å²	82.1	58%	0.577	49%	0.492	S	S	*	.			trans	-27.3	126.6	-179.8	-33.2	0	0	0	0	115	L78	T76-L78 PolarHBondContact O-N 3.37Å
77	P	37.9	Very low	56.5	Low	76 Å²	76	81.6 Å²	81.6	49%	0.494	50%	0.503	S	S	.	.			trans	-67.6	128.6	175.8	-13.2	26.7	0	0	0	110.9
78	L	34.2	Very low	56.1	Low	134 Å²	134	86.2 Å²	86.2	70%	0.702	53%	0.528	S	S	*	.			trans	-68.3	153.4	154.8	-112.4	79.3	0	0	0	108.8	T76 S80	T76-L78 PolarHBondContact O-N 3.37Å; L78-S80 PolarHBondContact O-N 3.07Å
79	P	42.6	Very low	55.8	Low	99 Å²	99	84.1 Å²	84.1	64%	0.643	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	10.8	-168.3	-16	30.8	0	0	0	116.4
80	S	33.6	Very low	55.5	Low	99 Å²	99	83.5 Å²	83.5	69%	0.692	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.4	-0.3	-163.4	46.5	0	0	0	0	115.8	L78	L78-S80 PolarHBondContact O-N 3.07Å
81	E	36.1	Very low	55.7	Low	165 Å²	165	88.3 Å²	88.3	77%	0.771	53%	0.529	S	S	*	.	S	Bend	trans	-125.9	121.9	174	-71.3	-175.9	150.4	0	0	108.9
82	E	40.7	Very low	56.5	Low	171 Å²	171	87.4 Å²	87.4	80%	0.799	52%	0.523	S	S	*	.			trans	-55.9	126	165.3	-75.4	-165.1	149.8	0	0	107.4	S84	E82-S84 PolarHBondContact O-N 3.19Å
83	P	48.3	Very low	57.5	Low	92 Å²	92	83.4 Å²	83.4	60%	0.597	50%	0.496	S	S	*	.			trans	-67.4	100.1	-177.6	25.8	-30.7	0	0	0	108.4	V85	P83-V85 VanDerWaalsContact C-N 3.3Å; P83-V85 PolarHBondContact O-N 3.4Å
84	S	53.1	Low	59	Low	113 Å²	113	86.2 Å²	86.2	79%	0.79	50%	0.5	S	S	*	.			trans	-70.5	93.5	170.4	64.1	0	0	0	0	107.8	E82	E82-S84 PolarHBondContact O-N 3.19Å
85	V	61.8	Low	60.6	Low	28 Å²	28	87.7 Å²	87.7	17%	0.17	51%	0.505	C	S	.	.			trans	-60.8	128.2	173.4	-178.3	0	0	0	0	107.7	P83 A87 C89 L90 L129	P83-V85 VanDerWaalsContact C-N 3.3Å; P83-V85 PolarHBondContact O-N 3.4Å; V85-A87 PolarHBondContact O-N 3.32Å; V85-C89 HydrophobicContact CG1-CB 3.91Å; V85-L90 HydrophobicContact CB-CD2 4.37Å; V85-L90 HydrophobicContact CB-CG 4.34Å; V85-L90 HydrophobicContact CG1-CD2 3.98Å; V85-L90 HydrophobicContact CG1-CG 3.93Å; V85-L129 HydrophobicContact CB-CD2 4.41Å; V85-L129 HydrophobicContact CG1-CB 4.38Å; V85-L129 HydrophobicContact CG1-CD1 3.8Å; V85-L129 HydrophobicContact CG1-CD2 4.12Å; V85-L129 HydrophobicContact CG1-CG 4.26Å; V85-L129 HydrophobicContact CG2-CB 4.17Å; V85-L129 HydrophobicContact CG2-CD2 3.41Å; V85-L129 VanDerWaalsContact CG2-CD2 3.41Å; V85-L129 HydrophobicContact CG2-CG 4.18Å
86	P	72.3	Confident	63	Low	62 Å²	62	82.9 Å²	82.9	40%	0.403	47%	0.472	S	S	.	.			trans	-54.5	134.7	176.8	-23	31.7	0	0	0	110.4	D88 C89 L90	P86-D88 PolarHBondContact O-N 3.01Å; P86-D88 VanDerWaalsContact O-N 3.13Å; P86-C89 VanDerWaalsContact O-CB 3.3Å; P86-C89 WeakPolarHBondContact O-CB 3.44Å; P86-C89 PolarHBondContact O-N 2.95Å; P86-L90 PolarHBondContact O-N 3.33Å
87	A	75.6	Confident	64.9	Low	74 Å²	74	85.2 Å²	85.2	61%	0.612	47%	0.47	S	S	*	.	H	α-helix	trans	-53.6	-37	-177.1	0	0	0	0	0	112.1	V85 C89 L90 E91	V85-A87 PolarHBondContact O-N 3.32Å; A87-C89 VanDerWaalsContact C-N 3.26Å; A87-C89 PolarHBondContact O-N 3.09Å; A87-L90 WeakPolarHBondContact O-CB 3.36Å; A87-L90 PolarHBondContact O-N 2.94Å; A87-L90 VanDerWaalsContact O-N 3.1Å; A87-E91 PolarHBondContact O-N 2.83Å
88	D	78.6	Confident	67	Low	100 Å²	100	89.4 Å²	89.4	54%	0.535	49%	0.489	S	S	.	.	H	α-helix	trans	-63.8	-29.1	178.4	-49.9	-26	0	0	0	112.8	H66 P86 A92	H66-D88 PolarHBondContact CE1-O 3.47Å; H66-D88 PolarHBondContact ND1-O 3.42Å; P86-D88 PolarHBondContact O-N 3.01Å; P86-D88 VanDerWaalsContact O-N 3.13Å; D88-A92 WeakPolarHBondContact O-CB 3.28Å; D88-A92 PolarHBondContact O-N 3.2Å
89	C	81.1	Confident	69.5	Low	4 Å²	4	84.1 Å²	84.1	3%	0.027	46%	0.463	C	S	.	.	H	α-helix	trans	-74.5	-36.3	175.2	-57.5	0	0	0	0	111.6	C70 V85 P86 A87 E91 A93	C70-C89 HydrophobicContact CB-CB 3.74Å; C70-C89 WeakPolarHBondContact CB-SG 3.07Å; C70-C89 WeakPolarHBondContact SG-CB 3.41Å; C70-C89 CovalentContact SG-SG 2.02Å; C70-C89 PolarHBondContact SG-SG 3.48Å; V85-C89 HydrophobicContact CG1-CB 3.91Å; P86-C89 VanDerWaalsContact O-CB 3.3Å; P86-C89 WeakPolarHBondContact O-CB 3.44Å; P86-C89 PolarHBondContact O-N 2.95Å; A87-C89 VanDerWaalsContact C-N 3.26Å; A87-C89 PolarHBondContact O-N 3.09Å; C89-E91 VanDerWaalsContact C-N 3.34Å; C89-A93 WeakPolarHBondContact O-CB 3.02Å; C89-A93 PolarHBondContact O-N 2.91Å
90	L	78.3	Confident	71.6	Confident	67 Å²	67	82.3 Å²	82.3	35%	0.351	45%	0.452	S	S	.	.	H	α-helix	trans	-66.5	-38.3	173	-65.4	173.4	0	0	0	111	V85 P86 A87 A93 Q94 L129	V85-L90 HydrophobicContact CB-CD2 4.37Å; V85-L90 HydrophobicContact CB-CG 4.34Å; V85-L90 HydrophobicContact CG1-CD2 3.98Å; V85-L90 HydrophobicContact CG1-CG 3.93Å; P86-L90 PolarHBondContact O-N 3.33Å; A87-L90 WeakPolarHBondContact O-CB 3.36Å; A87-L90 PolarHBondContact O-N 2.94Å; A87-L90 VanDerWaalsContact O-N 3.1Å; L90-A93 WeakPolarHBondContact O-CB 3.27Å; L90-A93 PolarHBondContact O-N 2.69Å; L90-Q94 WeakPolarHBondContact O-CB 3.42Å; L90-Q94 PolarHBondContact O-N 3.1Å; L90-L129 HydrophobicContact CD2-CB 3.45Å; L90-L129 VanDerWaalsContact CD2-CB 3.45Å; L90-L129 HydrophobicContact CD2-CD1 4.43Å; L90-L129 WeakPolarHBondContact CD2-O 3.49Å
91	E	82.7	Confident	74.2	Confident	110 Å²	110	77.6 Å²	77.6	51%	0.514	42%	0.419	S	S	.	.	H	α-helix	trans	-64.9	-47.1	175.6	-168.2	-177.2	165.4	0	0	111.5	A87 C89 A93 Q94 Q95	A87-E91 PolarHBondContact O-N 2.83Å; C89-E91 VanDerWaalsContact C-N 3.34Å; E91-A93 VanDerWaalsContact C-N 3.3Å; E91-A93 PolarHBondContact O-N 3.28Å; E91-Q94 WeakPolarHBondContact O-CB 3.47Å; E91-Q94 PolarHBondContact O-N 3.01Å; E91-Q95 WeakPolarHBondContact O-CG 3.46Å; E91-Q95 PolarHBondContact O-N 2.94Å; E91-Q95 PolarHBondContact OE1-NE2 3.35Å
92	A	84.6	Confident	76.5	Confident	3 Å²	3	71.9 Å²	71.9	3%	0.025	39%	0.393	C	S	.	.	H	α-helix	trans	-59	-41.1	175.1	0	0	0	0	0	112	H66 L67 D88 Q94 Q95 L96	H66-A92 HydrophobicContact CB-CB 4.13Å; L67-A92 HydrophobicContact CB-CB 4.33Å; D88-A92 WeakPolarHBondContact O-CB 3.28Å; D88-A92 PolarHBondContact O-N 3.2Å; A92-Q94 VanDerWaalsContact C-N 3.33Å; A92-Q94 PolarHBondContact O-N 3.2Å; A92-Q95 PolarHBondContact O-N 3.46Å; A92-L96 WeakPolarHBondContact O-CG 3.38Å; A92-L96 PolarHBondContact O-N 3.39Å
93	A	82.8	Confident	78.5	Confident	12 Å²	12	66.2 Å²	66.2	10%	0.099	38%	0.381	C	S	.	.	H	α-helix	trans	-58.9	-43.3	172.8	0	0	0	0	0	112.2	L67 C89 L90 E91 L96 R97 A126	L67-A93 HydrophobicContact CD1-CB 4.42Å; C89-A93 WeakPolarHBondContact O-CB 3.02Å; C89-A93 PolarHBondContact O-N 2.91Å; L90-A93 WeakPolarHBondContact O-CB 3.27Å; L90-A93 PolarHBondContact O-N 2.69Å; E91-A93 VanDerWaalsContact C-N 3.3Å; E91-A93 PolarHBondContact O-N 3.28Å; A93-L96 PolarHBondContact O-N 3.13Å; A93-R97 PolarHBondContact O-N 3.22Å; A93-A126 HydrophobicContact CB-CB 3.31Å
94	Q	82.8	Confident	80.5	Confident	140 Å²	140	61.9 Å²	61.9	65%	0.654	35%	0.353	S	S	*	.	H	α-helix	trans	-66.3	-38.8	179.3	-172.5	169.5	-4.6	0	0	112	L90 E91 A92 L96 R97	L90-Q94 WeakPolarHBondContact O-CB 3.42Å; L90-Q94 PolarHBondContact O-N 3.1Å; E91-Q94 WeakPolarHBondContact O-CB 3.47Å; E91-Q94 PolarHBondContact O-N 3.01Å; A92-Q94 VanDerWaalsContact C-N 3.33Å; A92-Q94 PolarHBondContact O-N 3.2Å; Q94-L96 VanDerWaalsContact C-N 3.26Å; Q94-L96 PolarHBondContact O-N 2.89Å; Q94-R97 WeakPolarHBondContact O-CB 3.46Å; Q94-R97 PolarHBondContact O-N 3.46Å
95	Q	86.6	Confident	82.3	Confident	96 Å²	96	59.3 Å²	59.3	45%	0.449	33%	0.329	S	S	.	.	H	α-helix	trans	-63.1	-33.1	175.1	-68.2	177.1	13.4	0	0	112.2	A63 E91 A92	A63-Q95 HydrophobicContact CB-CB 3.96Å; E91-Q95 WeakPolarHBondContact O-CG 3.46Å; E91-Q95 PolarHBondContact O-N 2.94Å; E91-Q95 PolarHBondContact OE1-NE2 3.35Å; A92-Q95 PolarHBondContact O-N 3.46Å
96	L	87.7	Confident	83.6	Confident	2 Å²	2	58 Å²	58	1%	0.01	32%	0.321	C	S	.	.	H	α-helix	trans	-79.2	-12.3	177.4	-65.5	177.5	0	0	0	114.2	A63 L67 A92 A93 Q94 N98 S99 L101	A63-L96 HydrophobicContact CB-CD2 3.88Å; A63-L96 HydrophobicContact CB-CG 3.99Å; L67-L96 HydrophobicContact CB-CD1 4.39Å; L67-L96 HydrophobicContact CD2-CD1 3.61Å; A92-L96 WeakPolarHBondContact O-CG 3.38Å; A92-L96 PolarHBondContact O-N 3.39Å; A93-L96 PolarHBondContact O-N 3.13Å; Q94-L96 VanDerWaalsContact C-N 3.26Å; Q94-L96 PolarHBondContact O-N 2.89Å; L96-N98 VanDerWaalsContact C-N 3.25Å; L96-N98 PolarHBondContact O-N 2.88Å; L96-S99 WeakPolarHBondContact O-CB 3.17Å; L96-S99 PolarHBondContact O-N 2.65Å; L96-S99 PolarHBondContact O-OG 2.79Å; L96-L101 HydrophobicContact CD2-CD1 4.13Å
97	R	82.1	Confident	84.3	Confident	143 Å²	143	56.5 Å²	56.5	54%	0.54	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-35	-177.8	-85.9	-167.8	155.4	-163.4	-3.2	113.9	A93 Q94 S99 I102	A93-R97 PolarHBondContact O-N 3.22Å; Q94-R97 WeakPolarHBondContact O-CB 3.46Å; Q94-R97 PolarHBondContact O-N 3.46Å; R97-S99 VanDerWaalsContact C-N 3.31Å; R97-I102 WeakPolarHBondContact O-CG2 3.27Å
98	N	81.3	Confident	84.6	Confident	164 Å²	164	57 Å²	57	88%	0.877	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	2.7	-179.1	-66	-21.8	0	0	0	113	L96	L96-N98 VanDerWaalsContact C-N 3.25Å; L96-N98 PolarHBondContact O-N 2.88Å
99	S	86.6	Confident	84.7	Confident	23 Å²	23	59 Å²	59	16%	0.161	30%	0.295	C	S	.	.	S	Bend	trans	-88.7	160.4	-178.9	79.3	0	0	0	0	112.1	L96 R97 L101 I102	L96-S99 WeakPolarHBondContact O-CB 3.17Å; L96-S99 PolarHBondContact O-N 2.65Å; L96-S99 PolarHBondContact O-OG 2.79Å; R97-S99 VanDerWaalsContact C-N 3.31Å; S99-L101 PolarHBondContact O-N 3.15Å; S99-L101 WeakPolarHBondContact OG-CB 3.39Å; S99-L101 PolarHBondContact OG-N 3.08Å; S99-I102 WeakPolarHBondContact O-CG2 3.19Å; S99-I102 PolarHBondContact O-N 3.37Å
100	S	86.6	Confident	84.9	Confident	60 Å²	60	60.4 Å²	60.4	42%	0.42	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-8.7	172.7	63.9	0	0	0	0	114.6	A50	A50-S100 WeakPolarHBondContact CB-O 3.39Å
101	L	88.5	Confident	85.1	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-29.5	179	-73.4	165.9	0	0	0	113	A50 R51 C54 Y64 L96 S99 G103 C104 I119 V123	A50-L101 HydrophobicContact CB-CD2 3.88Å; A50-L101 HydrophobicContact CB-CG 4.31Å; R51-L101 HydrophobicContact CB-CD2 4.17Å; C54-L101 HydrophobicContact CB-CD1 3.73Å; C54-L101 HydrophobicContact CB-CG 4.23Å; C54-L101 WeakPolarHBondContact SG-CD1 3.33Å; Y64-L101 HydrophobicContact CD2-CD1 3.8Å; Y64-L101 HydrophobicContact CE2-CD1 4.47Å; L96-L101 HydrophobicContact CD2-CD1 4.13Å; S99-L101 PolarHBondContact O-N 3.15Å; S99-L101 WeakPolarHBondContact OG-CB 3.39Å; S99-L101 PolarHBondContact OG-N 3.08Å; L101-G103 VanDerWaalsContact C-N 3.3Å; L101-G103 PolarHBondContact O-N 2.99Å; L101-C104 PolarHBondContact O-N 3.11Å; L101-C104 PolarHBondContact O-SG 2.96Å; L101-I119 HydrophobicContact CD2-CG2 3.74Å; L101-V123 HydrophobicContact CB-CG1 4.03Å; L101-V123 HydrophobicContact CB-CG2 3.97Å; L101-V123 HydrophobicContact CD1-CG2 4.3Å; L101-V123 HydrophobicContact CD2-CG2 4.36Å; L101-V123 HydrophobicContact CG-CG2 4.47Å
102	I	83.9	Confident	85.3	Confident	45 Å²	45	66.4 Å²	66.4	23%	0.231	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-28.4	-173.4	-160.7	60.6	0	0	0	113.3	R97 S99 V123 H124	R97-I102 WeakPolarHBondContact O-CG2 3.27Å; S99-I102 WeakPolarHBondContact O-CG2 3.19Å; S99-I102 PolarHBondContact O-N 3.37Å; I102-V123 HydrophobicContact CD1-CG1 4.06Å; I102-H124 PolarHBondContact O-CE1 3.13Å; I102-H124 PolarHBondContact O-NE2 2.9Å
103	G	83.5	Confident	85.4	Confident	52 Å²	52	66.9 Å²	66.9	54%	0.536	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	12.8	-179.6	0	0	0	0	0	113.1	L101	L101-G103 VanDerWaalsContact C-N 3.3Å; L101-G103 PolarHBondContact O-N 2.99Å
104	C	89.6	Confident	85.8	Confident	1 Å²	1	71.1 Å²	71.1	1%	0.007	35%	0.353	C	S	.	.			trans	-75.4	147.1	-176.5	80.7	0	0	0	0	111.2	N45 C47 A50 L101 Y120	N45-C104 VanDerWaalsContact O-CA 3.29Å; N45-C104 WeakPolarHBondContact O-CA 3.5Å; C47-C104 VanDerWaalsContact CA-CB 3.5Å; C47-C104 WeakPolarHBondContact CA-SG 3.3Å; C47-C104 HydrophobicContact CB-CB 3.83Å; C47-C104 WeakPolarHBondContact CB-SG 3.48Å; C47-C104 WeakPolarHBondContact SG-CB 3.24Å; C47-C104 PolarHBondContact SG-O 3.49Å; C47-C104 CovalentContact SG-SG 2.04Å; C47-C104 PolarHBondContact SG-SG 3.28Å; A50-C104 HydrophobicContact CB-CB 3.95Å; L101-C104 PolarHBondContact O-N 3.11Å; L101-C104 PolarHBondContact O-SG 2.96Å; C104-Y120 WeakPolarHBondContact O-CD2 3.31Å
105	M	90.4	Very high	86.2	Confident	59 Å²	59	66.5 Å²	66.5	29%	0.291	34%	0.339	S	S	.	.	B	Isolated β-bridge	trans	-127.3	161.4	175.9	-58.7	-166.3	84.3	0	0	111.2	N45 S46 C47 Y139 E140	N45-M105 PolarHBondContact O-N 3.1Å; S46-M105 VanDerWaalsContact CA-O 3.32Å; S46-M105 WeakPolarHBondContact CA-O 3.41Å; C47-M105 PolarHBondContact N-O 2.79Å; C47-M105 VanDerWaalsContact N-O 3.15Å; M105-Y139 VanDerWaalsContact CE-O 3.22Å; M105-Y139 WeakPolarHBondContact CE-O 3.39Å; M105-E140 HydrophobicContact CB-CB 4.05Å; M105-E140 HydrophobicContact CE-CB 4.48Å; M105-E140 HydrophobicContact SD-CB 4.07Å; M105-E140 HydrophobicContact SD-CG 4.2Å
106	C	91	Very high	86.5	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-107.6	162.3	173.4	-65.3	0	0	0	0	110.8	M110 C116 L117 P138 Y139 E140	C106-M110 HydrophobicContact CB-SD 4.22Å; C106-C116 WeakPolarHBondContact CA-SG 3.48Å; C106-C116 HydrophobicContact CB-CB 4.04Å; C106-C116 WeakPolarHBondContact CB-SG 3.41Å; C106-C116 WeakPolarHBondContact SG-CB 3.44Å; C106-C116 PolarHBondContact SG-O 3.3Å; C106-C116 CovalentContact SG-SG 2.04Å; C106-C116 PolarHBondContact SG-SG 2.88Å; C106-L117 HydrophobicContact CB-CD2 3.98Å; C106-P138 WeakPolarHBondContact CB-O 3.41Å; C106-P138 PolarHBondContact N-O 2.96Å; C106-Y139 HydrophobicContact CB-CD1 4.32Å; C106-Y139 CarbonylContact O-C 3.5Å; C106-Y139 VanDerWaalsContact O-CA 3.27Å; C106-Y139 WeakPolarHBondContact O-CA 3.4Å; C106-E140 PolarHBondContact O-N 2.94Å
107	H	85.9	Confident	86.8	Confident	31 Å²	31	61.9 Å²	61.9	14%	0.144	32%	0.318	C	S	.	.			trans	-116.9	140.5	177.2	-72.2	71.1	0	0	0	109.4	M110 E140	H107-M110 HydrophobicContact CB-CB 4.37Å; H107-M110 HydrophobicContact CB-SD 4.37Å; H107-M110 PolarHBondContact N-SD 3.02Å; H107-M110 WeakPolarHBondContact O-CG 2.98Å; H107-E140 IonicContact CE1-OE2 3.66Å; H107-E140 PolarHBondContact CE1-OE2 3.16Å; H107-E140 IonicContact ND1-OE2 3.89Å; H107-E140 IonicContact NE2-OE2 3.99Å; H107-E140 PolarHBondContact NE2-OE2 2.89Å
108	R	82	Confident	87.2	Confident	85 Å²	85	58.6 Å²	58.6	32%	0.321	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	143	170.5	-65.7	-176.7	174.6	-155.9	15.1	109.4	M110 Y139 D270 R293	R108-M110 PolarHBondContact O-N 3.5Å; R108-Y139 HydrophobicContact CG-CD1 3.67Å; R108-Y139 HydrophobicContact CG-CD2 4.46Å; R108-Y139 HydrophobicContact CG-CE1 4.03Å; R108-Y139 HydrophobicContact CG-CG 3.9Å; R108-D270 IonicContact CZ-OD2 3.65Å; R108-D270 VanDerWaalsContact CZ-OD2 3.29Å; R108-D270 IonicContact NE-OD2 3.34Å; R108-D270 PolarHBondContact NE-OD2 3.2Å; R108-D270 IonicContact NH2-OD2 3.79Å; R108-D270 PolarHBondContact NH2-OD2 3.45Å; R108-R293 PolarHBondContact NH1-O 2.76Å; R108-R293 PolarHBondContact NH2-O 2.8Å
109	R	80.5	Confident	87.7	Confident	142 Å²	142	51.4 Å²	51.4	54%	0.536	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	18.6	176.1	-50.6	167.2	174.7	-172.5	-12	114.4	E208 A210	R109-E208 WeakPolarHBondContact CA-OE1 3.44Å; R109-E208 WeakPolarHBondContact CD-O 3.35Å; R109-E208 HydrophobicContact CG-CG 3.72Å; R109-E208 PolarHBondContact NE-O 2.94Å; R109-E208 PolarHBondContact NH2-O 3.01Å; R109-A210 PolarHBondContact NH2-O 3.48Å
110	M	85	Confident	87.9	Confident	34 Å²	34	50.6 Å²	50.6	17%	0.167	27%	0.266	C	S	.	.			trans	-77.2	145.7	173.4	69.7	-175.1	-68.2	0	0	110.6	L48 C106 H107 R108 N112 Q113 C116	L48-M110 HydrophobicContact CD1-CE 3.35Å; L48-M110 HydrophobicContact CG-CE 4.16Å; C106-M110 HydrophobicContact CB-SD 4.22Å; H107-M110 HydrophobicContact CB-CB 4.37Å; H107-M110 HydrophobicContact CB-SD 4.37Å; H107-M110 PolarHBondContact N-SD 3.02Å; H107-M110 WeakPolarHBondContact O-CG 2.98Å; R108-M110 PolarHBondContact O-N 3.5Å; M110-N112 VanDerWaalsContact C-N 3.25Å; M110-N112 PolarHBondContact O-N 3.43Å; M110-Q113 VanDerWaalsContact CG-CA 3.43Å; M110-Q113 HydrophobicContact CG-CB 3.6Å; M110-Q113 HydrophobicContact CG-CG 4.2Å; M110-Q113 WeakPolarHBondContact O-CB 3.44Å; M110-Q113 PolarHBondContact O-N 2.76Å; M110-C116 HydrophobicContact CE-CB 3.68Å; M110-C116 HydrophobicContact SD-CB 3.63Å
111	K	82.2	Confident	88	Confident	213 Å²	213	48.3 Å²	48.3	93%	0.926	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-39.2	-176.5	-71.4	-177.8	178.1	178.7	0	113.4
112	N	87.1	Confident	87.9	Confident	90 Å²	90	48.5 Å²	48.5	48%	0.481	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	42.6	-176.2	-64.5	-12.3	0	0	0	111.2	L48 M110 V114 A115 C116	L48-N112 HydrophobicContact CD1-CB 3.7Å; M110-N112 VanDerWaalsContact C-N 3.25Å; M110-N112 PolarHBondContact O-N 3.43Å; N112-V114 PolarHBondContact O-N 3.34Å; N112-A115 HydrophobicContact CB-CB 4.5Å; N112-A115 PolarHBondContact O-N 2.95Å; N112-C116 PolarHBondContact O-N 3.18Å
113	Q	88.4	Confident	87.9	Confident	12 Å²	12	46.4 Å²	46.4	6%	0.056	24%	0.238	C	C	.	.	H	α-helix	trans	-59.3	-45.4	-174.7	-175.2	165.9	-24	0	0	112.1	M110 A115 C116 L117 Y139 E208	M110-Q113 VanDerWaalsContact CG-CA 3.43Å; M110-Q113 HydrophobicContact CG-CB 3.6Å; M110-Q113 HydrophobicContact CG-CG 4.2Å; M110-Q113 WeakPolarHBondContact O-CB 3.44Å; M110-Q113 PolarHBondContact O-N 2.76Å; Q113-A115 PolarHBondContact O-N 3.11Å; Q113-C116 WeakPolarHBondContact O-CB 3.44Å; Q113-C116 PolarHBondContact O-N 2.89Å; Q113-C116 VanDerWaalsContact O-N 3.15Å; Q113-L117 HydrophobicContact CG-CD1 4.01Å; Q113-L117 HydrophobicContact CG-CG 4.32Å; Q113-L117 VanDerWaalsContact O-CG 3.3Å; Q113-L117 WeakPolarHBondContact O-CG 3.48Å; Q113-L117 PolarHBondContact O-N 2.71Å; Q113-Y139 HydrophobicContact CG-CE1 4.35Å; Q113-Y139 VanDerWaalsContact NE2-CE1 3.32Å; Q113-Y139 PolarHBondContact NE2-OH 3.4Å; Q113-E208 PolarHBondContact OE1-OE1 3Å
114	V	89.2	Confident	87.6	Confident	101 Å²	101	45 Å²	45	61%	0.612	22%	0.218	S	C	*	.	H	α-helix	trans	-56.9	-50.5	179	178.9	0	0	0	0	111.1	N112 C116 L117 D118	N112-V114 PolarHBondContact O-N 3.34Å; V114-C116 VanDerWaalsContact C-N 3.31Å; V114-C116 PolarHBondContact O-N 3.43Å; V114-L117 PolarHBondContact O-N 3.19Å; V114-D118 WeakPolarHBondContact O-CB 3.25Å; V114-D118 PolarHBondContact O-N 3.07Å
115	A	92.1	Very high	86.5	Confident	44 Å²	44	48.2 Å²	48.2	36%	0.364	23%	0.23	S	C	.	.	H	α-helix	trans	-63.4	-35	178.3	0	0	0	0	0	112.9	L48 N112 Q113 I119	L48-A115 HydrophobicContact CD2-CB 4.06Å; N112-A115 HydrophobicContact CB-CB 4.5Å; N112-A115 PolarHBondContact O-N 2.95Å; Q113-A115 PolarHBondContact O-N 3.11Å; A115-I119 VanDerWaalsContact O-CD1 3.31Å; A115-I119 WeakPolarHBondContact O-CD1 3.28Å; A115-I119 VanDerWaalsContact O-CG1 3.28Å; A115-I119 WeakPolarHBondContact O-CG1 3.45Å; A115-I119 PolarHBondContact O-N 3.4Å
116	C	93.9	Very high	84.6	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.6	-47.2	175.3	-172.6	0	0	0	0	111.7	L48 C106 M110 N112 Q113 V114 D118 I119 Y120	L48-C116 HydrophobicContact CD1-CB 4.47Å; L48-C116 HydrophobicContact CD2-CB 4.48Å; L48-C116 HydrophobicContact CG-CB 4.12Å; C106-C116 WeakPolarHBondContact CA-SG 3.48Å; C106-C116 HydrophobicContact CB-CB 4.04Å; C106-C116 WeakPolarHBondContact CB-SG 3.41Å; C106-C116 WeakPolarHBondContact SG-CB 3.44Å; C106-C116 PolarHBondContact SG-O 3.3Å; C106-C116 CovalentContact SG-SG 2.04Å; C106-C116 PolarHBondContact SG-SG 2.88Å; M110-C116 HydrophobicContact CE-CB 3.68Å; M110-C116 HydrophobicContact SD-CB 3.63Å; N112-C116 PolarHBondContact O-N 3.18Å; Q113-C116 WeakPolarHBondContact O-CB 3.44Å; Q113-C116 PolarHBondContact O-N 2.89Å; Q113-C116 VanDerWaalsContact O-N 3.15Å; V114-C116 VanDerWaalsContact C-N 3.31Å; V114-C116 PolarHBondContact O-N 3.43Å; C116-D118 VanDerWaalsContact C-N 3.32Å; C116-D118 PolarHBondContact O-N 2.74Å; C116-I119 PolarHBondContact O-N 3.25Å; C116-Y120 PolarHBondContact O-N 3.15Å
117	L	92.5	Very high	82.8	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.3	-38.1	-179.8	-65.3	175	0	0	0	111.6	C106 Q113 V114 Y120 W121 P138 Y139 P262 L263 S266	C106-L117 HydrophobicContact CB-CD2 3.98Å; Q113-L117 HydrophobicContact CG-CD1 4.01Å; Q113-L117 HydrophobicContact CG-CG 4.32Å; Q113-L117 VanDerWaalsContact O-CG 3.3Å; Q113-L117 WeakPolarHBondContact O-CG 3.48Å; Q113-L117 PolarHBondContact O-N 2.71Å; V114-L117 PolarHBondContact O-N 3.19Å; L117-Y120 WeakPolarHBondContact O-CB 3.29Å; L117-Y120 PolarHBondContact O-N 3.21Å; L117-W121 WeakPolarHBondContact O-CB 3.47Å; L117-W121 PolarHBondContact O-N 3.21Å; L117-P138 HydrophobicContact CD2-CB 3.81Å; L117-P138 HydrophobicContact CD2-CG 3.75Å; L117-Y139 WeakPolarHBondContact CD1-OH 3.45Å; L117-Y139 HydrophobicContact CD2-CE1 3.99Å; L117-P262 HydrophobicContact CB-CB 4.27Å; L117-L263 HydrophobicContact CD1-CB 4.47Å; L117-L263 HydrophobicContact CD1-CD1 3.98Å; L117-S266 VanDerWaalsContact CD2-OG 3.31Å; L117-S266 WeakPolarHBondContact CD2-OG 3.37Å
118	D	90.9	Very high	81.1	Confident	75 Å²	75	52.1 Å²	52.1	40%	0.401	25%	0.253	S	S	.	.	H	α-helix	trans	-58.7	-47.4	175.2	-171.3	61.5	0	0	0	111.7	V114 C116 Y120 W121 T122	V114-D118 WeakPolarHBondContact O-CB 3.25Å; V114-D118 PolarHBondContact O-N 3.07Å; C116-D118 VanDerWaalsContact C-N 3.32Å; C116-D118 PolarHBondContact O-N 2.74Å; D118-Y120 PolarHBondContact O-N 3.49Å; D118-W121 PolarHBondContact O-N 2.95Å; D118-T122 WeakPolarHBondContact O-CB 3.31Å; D118-T122 PolarHBondContact O-N 3.42Å; D118-T122 PolarHBondContact O-OG1 3.41Å
119	I	92	Very high	79.5	Confident	13 Å²	13	50.2 Å²	50.2	7%	0.067	25%	0.249	C	C	.	.	H	α-helix	trans	-61	-46.5	173.3	-64.7	158.7	0	0	0	111	C47 L48 R51 Y64 L101 A115 C116 W121 T122 V123	C47-I119 HydrophobicContact CB-CB 4.12Å; C47-I119 HydrophobicContact CB-CG2 3.83Å; L48-I119 HydrophobicContact CD2-CD1 3.82Å; R51-I119 HydrophobicContact CB-CD1 3.73Å; R51-I119 HydrophobicContact CB-CG1 4.32Å; R51-I119 HydrophobicContact CB-CG2 4.2Å; R51-I119 HydrophobicContact CG-CD1 3.98Å; R51-I119 HydrophobicContact CG-CG1 4.32Å; Y64-I119 HydrophobicContact CE2-CG2 4.19Å; L101-I119 HydrophobicContact CD2-CG2 3.74Å; A115-I119 VanDerWaalsContact O-CD1 3.31Å; A115-I119 WeakPolarHBondContact O-CD1 3.28Å; A115-I119 VanDerWaalsContact O-CG1 3.28Å; A115-I119 WeakPolarHBondContact O-CG1 3.45Å; A115-I119 PolarHBondContact O-N 3.4Å; C116-I119 PolarHBondContact O-N 3.25Å; I119-W121 PolarHBondContact O-N 3.37Å; I119-T122 PolarHBondContact O-N 3Å; I119-V123 WeakPolarHBondContact O-CG2 3.44Å; I119-V123 PolarHBondContact O-N 3.02Å
120	Y	91.2	Very high	77.6	Confident	5 Å²	5	46.3 Å²	46.3	2%	0.02	25%	0.253	C	S	.	.	H	α-helix	trans	-57.3	-51.8	179.9	179.2	-85.2	0	0	0	111.1	C104 C116 L117 D118 T122 V123 H124 V136 P138	C104-Y120 WeakPolarHBondContact O-CD2 3.31Å; C116-Y120 PolarHBondContact O-N 3.15Å; L117-Y120 WeakPolarHBondContact O-CB 3.29Å; L117-Y120 PolarHBondContact O-N 3.21Å; D118-Y120 PolarHBondContact O-N 3.49Å; Y120-T122 VanDerWaalsContact C-N 3.33Å; Y120-T122 PolarHBondContact O-N 3.31Å; Y120-V123 PolarHBondContact O-N 3.35Å; Y120-H124 HydrophobicContact CD1-CB 4.16Å; Y120-H124 AromaticContact CD1-ND1 3.9Å; Y120-H124 AromaticContact CD2-CE1 3.42Å; Y120-H124 VanDerWaalsContact CD2-CE1 3.42Å; Y120-H124 WeakPolarHBondContact CD2-CE1 3.28Å; Y120-H124 AromaticContact CD2-ND1 3.45Å; Y120-H124 WeakPolarHBondContact CD2-ND1 3.43Å; Y120-H124 HydrophobicContact CE1-CB 3.76Å; Y120-H124 AromaticContact CE1-CG 3.6Å; Y120-H124 AromaticContact CE1-ND1 3.86Å; Y120-H124 AromaticContact CE2-CD2 3.68Å; Y120-H124 AromaticContact CE2-CE1 3.16Å; Y120-H124 WeakPolarHBondContact CE2-CE1 3.01Å; Y120-H124 AromaticContact CE2-CG 3.72Å; Y120-H124 AromaticContact CE2-ND1 3.4Å; Y120-H124 WeakPolarHBondContact CE2-ND1 3.42Å; Y120-H124 AromaticContact CE2-NE2 3.33Å; Y120-H124 VanDerWaalsContact CE2-NE2 3.33Å; Y120-H124 WeakPolarHBondContact CE2-NE2 3.4Å; Y120-H124 AromaticContact CG-ND1 3.71Å; Y120-H124 AromaticContact CZ-CD2 3.4Å; Y120-H124 VanDerWaalsContact CZ-CD2 3.4Å; Y120-H124 AromaticContact CZ-CE1 3.71Å; Y120-H124 AromaticContact CZ-CG 3.41Å; Y120-H124 VanDerWaalsContact CZ-CG 3.41Å; Y120-H124 AromaticContact CZ-ND1 3.6Å; Y120-H124 AromaticContact CZ-NE2 3.59Å; Y120-H124 WeakPolarHBondContact O-CB 3.23Å; Y120-H124 PolarHBondContact O-N 3.31Å; Y120-H124 PolarHBondContact O-ND1 2.03Å; Y120-H124 PolarHBondContact OH-CD2 3.36Å; Y120-H124 VanDerWaalsContact OH-CD2 3.28Å; Y120-V136 PolarHBondContact OH-O 3.43Å; Y120-P138 HydrophobicContact CD1-CB 3.52Å; Y120-P138 HydrophobicContact CD2-CB 3.89Å; Y120-P138 HydrophobicContact CE1-CB 3.62Å; Y120-P138 HydrophobicContact CE1-CG 4.48Å; Y120-P138 HydrophobicContact CE2-CB 3.98Å; Y120-P138 HydrophobicContact CG-CB 3.66Å
121	W	88.1	Confident	75.3	Confident	12 Å²	12	49.1 Å²	49.1	5%	0.045	27%	0.269	C	S	.	.	H	α-helix	trans	-70.5	-28.6	-176.1	-73.6	119.2	0	0	0	113.1	L117 D118 I119 V123 R125 D135 P138 P262 R265 S266 V269	L117-W121 WeakPolarHBondContact O-CB 3.47Å; L117-W121 PolarHBondContact O-N 3.21Å; D118-W121 PolarHBondContact O-N 2.95Å; I119-W121 PolarHBondContact O-N 3.37Å; W121-V123 VanDerWaalsContact C-N 3.33Å; W121-R125 WeakPolarHBondContact O-CB 3.1Å; W121-R125 PolarHBondContact O-N 3.12Å; W121-R125 VanDerWaalsContact O-N 3.1Å; W121-D135 HydrophobicContact CH2-CB 4.22Å; W121-D135 HydrophobicContact CZ3-CB 4.32Å; W121-P138 HydrophobicContact CZ2-CG 4.15Å; W121-P262 PolarHBondContact NE1-O 3.36Å; W121-R265 HydrophobicContact CD2-CG 4.4Å; W121-R265 VanDerWaalsContact CE3-NH1 3.31Å; W121-R265 HydrophobicContact CH2-CG 4.06Å; W121-R265 HydrophobicContact CZ2-CB 4.46Å; W121-R265 HydrophobicContact CZ2-CG 3.67Å; W121-R265 VanDerWaalsContact CZ3-NH2 3.33Å; W121-S266 PolarHBondContact NE1-OG 3.18Å; W121-V269 HydrophobicContact CH2-CB 4.42Å; W121-V269 HydrophobicContact CH2-CG2 3.96Å; W121-V269 HydrophobicContact CZ2-CG2 4.38Å
122	T	87.3	Confident	73.2	Confident	4 Å²	4	50.2 Å²	50.2	3%	0.025	27%	0.269	C	S	.	.	H	α-helix	trans	-59.8	-46.3	170.7	-60.6	0	0	0	0	110.7	Y64 L67 D68 T71 D118 I119 Y120	Y64-T122 HydrophobicContact CE2-CG2 4Å; L67-T122 HydrophobicContact CD2-CG2 4.45Å; L67-T122 VanDerWaalsContact CD2-O 3.32Å; L67-T122 WeakPolarHBondContact CD2-O 3.43Å; L67-T122 HydrophobicContact CG-CG2 4.33Å; D68-T122 HydrophobicContact CB-CG2 4.1Å; T71-T122 HydrophobicContact CG2-CG2 4.33Å; D118-T122 WeakPolarHBondContact O-CB 3.31Å; D118-T122 PolarHBondContact O-N 3.42Å; D118-T122 PolarHBondContact O-OG1 3.41Å; I119-T122 PolarHBondContact O-N 3Å; Y120-T122 VanDerWaalsContact C-N 3.33Å; Y120-T122 PolarHBondContact O-N 3.31Å
123	V	83.2	Confident	71.3	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-83.9	-34.1	-174.4	-178.1	0	0	0	0	112.8	Y64 L101 I102 I119 Y120 W121 A126	Y64-V123 HydrophobicContact CD2-CG2 4.21Å; Y64-V123 HydrophobicContact CE2-CG2 3.97Å; L101-V123 HydrophobicContact CB-CG1 4.03Å; L101-V123 HydrophobicContact CB-CG2 3.97Å; L101-V123 HydrophobicContact CD1-CG2 4.3Å; L101-V123 HydrophobicContact CD2-CG2 4.36Å; L101-V123 HydrophobicContact CG-CG2 4.47Å; I102-V123 HydrophobicContact CD1-CG1 4.06Å; I119-V123 WeakPolarHBondContact O-CG2 3.44Å; I119-V123 PolarHBondContact O-N 3.02Å; Y120-V123 PolarHBondContact O-N 3.35Å; W121-V123 VanDerWaalsContact C-N 3.33Å; V123-A126 WeakPolarHBondContact O-CB 3.37Å; V123-A126 PolarHBondContact O-N 3.32Å
124	H	76.3	Confident	69.8	Low	22 Å²	22	56.1 Å²	56.1	10%	0.102	30%	0.297	C	S	.	.	H	α-helix	trans	-85.1	-21.8	-177.4	-72.3	73.5	0	0	0	113.1	I102 Y120 A126 R127	I102-H124 PolarHBondContact O-CE1 3.13Å; I102-H124 PolarHBondContact O-NE2 2.9Å; Y120-H124 HydrophobicContact CD1-CB 4.16Å; Y120-H124 AromaticContact CD1-ND1 3.9Å; Y120-H124 AromaticContact CD2-CE1 3.42Å; Y120-H124 VanDerWaalsContact CD2-CE1 3.42Å; Y120-H124 WeakPolarHBondContact CD2-CE1 3.28Å; Y120-H124 AromaticContact CD2-ND1 3.45Å; Y120-H124 WeakPolarHBondContact CD2-ND1 3.43Å; Y120-H124 HydrophobicContact CE1-CB 3.76Å; Y120-H124 AromaticContact CE1-CG 3.6Å; Y120-H124 AromaticContact CE1-ND1 3.86Å; Y120-H124 AromaticContact CE2-CD2 3.68Å; Y120-H124 AromaticContact CE2-CE1 3.16Å; Y120-H124 WeakPolarHBondContact CE2-CE1 3.01Å; Y120-H124 AromaticContact CE2-CG 3.72Å; Y120-H124 AromaticContact CE2-ND1 3.4Å; Y120-H124 WeakPolarHBondContact CE2-ND1 3.42Å; Y120-H124 AromaticContact CE2-NE2 3.33Å; Y120-H124 VanDerWaalsContact CE2-NE2 3.33Å; Y120-H124 WeakPolarHBondContact CE2-NE2 3.4Å; Y120-H124 AromaticContact CG-ND1 3.71Å; Y120-H124 AromaticContact CZ-CD2 3.4Å; Y120-H124 VanDerWaalsContact CZ-CD2 3.4Å; Y120-H124 AromaticContact CZ-CE1 3.71Å; Y120-H124 AromaticContact CZ-CG 3.41Å; Y120-H124 VanDerWaalsContact CZ-CG 3.41Å; Y120-H124 AromaticContact CZ-ND1 3.6Å; Y120-H124 AromaticContact CZ-NE2 3.59Å; Y120-H124 WeakPolarHBondContact O-CB 3.23Å; Y120-H124 PolarHBondContact O-N 3.31Å; Y120-H124 PolarHBondContact O-ND1 2.03Å; Y120-H124 PolarHBondContact OH-CD2 3.36Å; Y120-H124 VanDerWaalsContact OH-CD2 3.28Å; H124-A126 PolarHBondContact O-N 2.55Å; H124-R127 WeakPolarHBondContact O-CB 3.3Å; H124-R127 PolarHBondContact O-N 3.48Å; H124-R127 VanDerWaalsContact O-N 3.11Å
125	R	66.6	Low	68.7	Low	69 Å²	69	53.5 Å²	53.5	26%	0.26	28%	0.28	S	S	.	.	H	α-helix	trans	-56.6	-42.7	166	-171.5	-177.8	-66.9	-174.4	2.1	109.7	T71 W121 R127 S128 L129	T71-R125 PolarHBondContact O-NH1 2.77Å; W121-R125 WeakPolarHBondContact O-CB 3.1Å; W121-R125 PolarHBondContact O-N 3.12Å; W121-R125 VanDerWaalsContact O-N 3.1Å; R125-R127 PolarHBondContact O-N 2.88Å; R125-R127 VanDerWaalsContact O-N 3.15Å; R125-S128 WeakPolarHBondContact O-CB 3.47Å; R125-S128 PolarHBondContact O-N 3.08Å; R125-L129 HydrophobicContact CG-CD2 4.4Å; R125-L129 WeakPolarHBondContact O-CG 3.48Å; R125-L129 PolarHBondContact O-N 3.1Å
126	A	52.3	Low	68.1	Low	17 Å²	17	55.1 Å²	55.1	14%	0.14	29%	0.285	C	S	.	.	H	α-helix	trans	-56.1	-25.5	175.7	0	0	0	0	0	115.4	L67 A93 V123 H124	L67-A126 HydrophobicContact CD1-CB 4.03Å; L67-A126 HydrophobicContact CD2-CB 3.7Å; A93-A126 HydrophobicContact CB-CB 3.31Å; V123-A126 WeakPolarHBondContact O-CB 3.37Å; V123-A126 PolarHBondContact O-N 3.32Å; H124-A126 PolarHBondContact O-N 2.55Å
127	R	52.2	Low	67.7	Low	96 Å²	96	55.5 Å²	55.5	36%	0.362	29%	0.288	S	S	.	.	H	α-helix	trans	-77.3	-32.8	175.6	-164.6	171.6	176.7	159.5	-6.7	112.3	H124 R125 E133	H124-R127 WeakPolarHBondContact O-CB 3.3Å; H124-R127 PolarHBondContact O-N 3.48Å; H124-R127 VanDerWaalsContact O-N 3.11Å; R125-R127 PolarHBondContact O-N 2.88Å; R125-R127 VanDerWaalsContact O-N 3.15Å; R127-E133 WeakPolarHBondContact CG-OE2 3.01Å; R127-E133 IonicContact CZ-OE1 2.75Å; R127-E133 VanDerWaalsContact CZ-OE1 3.29Å; R127-E133 IonicContact CZ-OE2 3.17Å; R127-E133 VanDerWaalsContact NE-CD 3.26Å; R127-E133 IonicContact NE-OE1 2.67Å; R127-E133 PolarHBondContact NE-OE1 2.95Å; R127-E133 IonicContact NE-OE2 3.78Å; R127-E133 PolarHBondContact NE-OE2 3.5Å; R127-E133 IonicContact NH2-OE1 3.88Å; R127-E133 PolarHBondContact NH2-OE1 3.34Å; R127-E133 IonicContact NH2-OE2 3.36Å
128	S	50.1	Low	67.4	Low	60 Å²	60	55.5 Å²	55.5	42%	0.42	29%	0.288	S	S	.	.	H	α-helix	trans	-78.4	-17.1	177.5	-162	0	0	0	0	113.2	R125 G130	R125-S128 WeakPolarHBondContact O-CB 3.47Å; R125-S128 PolarHBondContact O-N 3.08Å; S128-G130 PolarHBondContact O-N 2.86Å
129	L	49.3	Very low	67.2	Low	44 Å²	44	52.1 Å²	52.1	23%	0.23	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-4.2	179.9	-54	169.4	0	0	0	114	V85 L90 R125	V85-L129 HydrophobicContact CB-CD2 4.41Å; V85-L129 HydrophobicContact CG1-CB 4.38Å; V85-L129 HydrophobicContact CG1-CD1 3.8Å; V85-L129 HydrophobicContact CG1-CD2 4.12Å; V85-L129 HydrophobicContact CG1-CG 4.26Å; V85-L129 HydrophobicContact CG2-CB 4.17Å; V85-L129 HydrophobicContact CG2-CD2 3.41Å; V85-L129 VanDerWaalsContact CG2-CD2 3.41Å; V85-L129 HydrophobicContact CG2-CG 4.18Å; L90-L129 HydrophobicContact CD2-CB 3.45Å; L90-L129 VanDerWaalsContact CD2-CB 3.45Å; L90-L129 HydrophobicContact CD2-CD1 4.43Å; L90-L129 WeakPolarHBondContact CD2-O 3.49Å; R125-L129 HydrophobicContact CG-CD2 4.4Å; R125-L129 WeakPolarHBondContact O-CG 3.48Å; R125-L129 PolarHBondContact O-N 3.1Å
130	G	39.7	Very low	66.7	Low	61 Å²	61	54.9 Å²	54.9	63%	0.629	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137	-17.8	-177.7	0	0	0	0	0	116.2	S128	S128-G130 PolarHBondContact O-N 2.86Å
131	N	36.7	Very low	65.5	Low	93 Å²	93	58.4 Å²	58.4	50%	0.497	30%	0.301	S	S	.	.	S	Bend	trans	-138.5	140.5	178.3	-72.6	-18.6	0	0	0	108.4	E133	N131-E133 PolarHBondContact O-N 3.24Å
132	Y	39.1	Very low	64.1	Low	235 Å²	235	60.4 Å²	60.4	92%	0.922	32%	0.315	S	S	*	.			trans	-65	50.2	171.5	-76.4	-95.8	0	0	0	112.4
133	E	46.9	Very low	62.3	Low	71 Å²	71	65.8 Å²	65.8	33%	0.332	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-88.4	125.7	-179.3	-159.3	170	-179.6	0	0	108.8	R127 N131	R127-E133 WeakPolarHBondContact CG-OE2 3.01Å; R127-E133 IonicContact CZ-OE1 2.75Å; R127-E133 VanDerWaalsContact CZ-OE1 3.29Å; R127-E133 IonicContact CZ-OE2 3.17Å; R127-E133 VanDerWaalsContact NE-CD 3.26Å; R127-E133 IonicContact NE-OE1 2.67Å; R127-E133 PolarHBondContact NE-OE1 2.95Å; R127-E133 IonicContact NE-OE2 3.78Å; R127-E133 PolarHBondContact NE-OE2 3.5Å; R127-E133 IonicContact NH2-OE1 3.88Å; R127-E133 PolarHBondContact NH2-OE1 3.34Å; R127-E133 IonicContact NH2-OE2 3.36Å; N131-E133 PolarHBondContact O-N 3.24Å
134	L	56.4	Low	60.8	Low	155 Å²	155	69.4 Å²	69.4	81%	0.812	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-57	141.9	177.2	-90.6	81.5	0	0	0	110.4	V136	L134-V136 PolarHBondContact O-N 3.27Å
135	D	66.7	Low	59.8	Low	47 Å²	47	73.2 Å²	73.2	25%	0.251	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-53.6	122.3	170.5	-86.9	-15.2	0	0	0	109.3	W121 R265 V269	W121-D135 HydrophobicContact CH2-CB 4.22Å; W121-D135 HydrophobicContact CZ3-CB 4.32Å; D135-R265 VanDerWaalsContact CG-NH2 3.32Å; D135-R265 IonicContact OD1-NH2 2.79Å; D135-R265 PolarHBondContact OD1-NH2 2.75Å; D135-R265 VanDerWaalsContact OD1-NH2 3.08Å; D135-R265 IonicContact OD2-CZ 3.09Å; D135-R265 IonicContact OD2-NE 3.08Å; D135-R265 PolarHBondContact OD2-NE 3.21Å; D135-R265 IonicContact OD2-NH2 3.81Å; D135-R265 PolarHBondContact OD2-NH2 2.78Å; D135-V269 HydrophobicContact CB-CG1 3.96Å; D135-V269 HydrophobicContact CB-CG2 3.76Å; D135-V269 WeakPolarHBondContact O-CG1 3.35Å
136	V	79.7	Confident	59.4	Low	78 Å²	78	78.3 Å²	78.3	47%	0.473	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-88.6	145.4	177.6	-178.7	0	0	0	0	109.2	Y120 L134	Y120-V136 PolarHBondContact OH-O 3.43Å; L134-V136 PolarHBondContact O-N 3.27Å
137	S	83.8	Confident	60	Low	7 Å²	7	81.8 Å²	81.8	5%	0.049	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-59.6	129.2	176.2	-175	0	0	0	0	110.8	Y139 D270	S137-Y139 PolarHBondContact O-N 2.04Å; S137-D270 WeakPolarHBondContact OG-CB 3.17Å; S137-D270 VanDerWaalsContact OG-CG 3.28Å; S137-D270 PolarHBondContact OG-OD1 3.22Å
138	P	86.9	Confident	61	Low	0 Å²	0	80 Å²	80	0%	0	44%	0.437	C	S	.	.	S	Bend	trans	-73.6	-9.2	179.5	28	-34.1	0	0	0	113.5	C106 L117 Y120 W121 S266	C106-P138 WeakPolarHBondContact CB-O 3.41Å; C106-P138 PolarHBondContact N-O 2.96Å; L117-P138 HydrophobicContact CD2-CB 3.81Å; L117-P138 HydrophobicContact CD2-CG 3.75Å; Y120-P138 HydrophobicContact CD1-CB 3.52Å; Y120-P138 HydrophobicContact CD2-CB 3.89Å; Y120-P138 HydrophobicContact CE1-CB 3.62Å; Y120-P138 HydrophobicContact CE1-CG 4.48Å; Y120-P138 HydrophobicContact CE2-CB 3.98Å; Y120-P138 HydrophobicContact CG-CB 3.66Å; W121-P138 HydrophobicContact CZ2-CG 4.15Å; P138-S266 VanDerWaalsContact CG-CB 3.49Å; P138-S266 WeakPolarHBondContact CG-OG 2.99Å
139	Y	87.3	Confident	62.2	Low	5 Å²	5	84.8 Å²	84.8	2%	0.02	45%	0.451	C	S	.	.	B	Isolated β-bridge	trans	-94.9	133.2	-172.8	-63.5	-70.3	0	0	0	112.4	M105 C106 R108 Q113 L117 S137 D270	M105-Y139 VanDerWaalsContact CE-O 3.22Å; M105-Y139 WeakPolarHBondContact CE-O 3.39Å; C106-Y139 HydrophobicContact CB-CD1 4.32Å; C106-Y139 CarbonylContact O-C 3.5Å; C106-Y139 VanDerWaalsContact O-CA 3.27Å; C106-Y139 WeakPolarHBondContact O-CA 3.4Å; R108-Y139 HydrophobicContact CG-CD1 3.67Å; R108-Y139 HydrophobicContact CG-CD2 4.46Å; R108-Y139 HydrophobicContact CG-CE1 4.03Å; R108-Y139 HydrophobicContact CG-CG 3.9Å; Q113-Y139 HydrophobicContact CG-CE1 4.35Å; Q113-Y139 VanDerWaalsContact NE2-CE1 3.32Å; Q113-Y139 PolarHBondContact NE2-OH 3.4Å; L117-Y139 WeakPolarHBondContact CD1-OH 3.45Å; L117-Y139 HydrophobicContact CD2-CE1 3.99Å; S137-Y139 PolarHBondContact O-N 2.04Å; Y139-D270 HydrophobicContact CD2-CB 4.39Å
140	E	80.4	Confident	63.5	Low	70 Å²	70	83.6 Å²	83.6	33%	0.327	44%	0.444	S	S	.	.			trans	-71.1	132.1	173.3	-170.8	172.9	171.3	0	0	111.2	M105 C106 H107 T142	M105-E140 HydrophobicContact CB-CB 4.05Å; M105-E140 HydrophobicContact CE-CB 4.48Å; M105-E140 HydrophobicContact SD-CB 4.07Å; M105-E140 HydrophobicContact SD-CG 4.2Å; C106-E140 PolarHBondContact O-N 2.94Å; H107-E140 IonicContact CE1-OE2 3.66Å; H107-E140 PolarHBondContact CE1-OE2 3.16Å; H107-E140 IonicContact ND1-OE2 3.89Å; H107-E140 IonicContact NE2-OE2 3.99Å; H107-E140 PolarHBondContact NE2-OE2 2.89Å; E140-T142 HydrophobicContact CG-CG2 4.38Å; E140-T142 PolarHBondContact O-N 3.34Å
141	D	65.6	Low	65.3	Low	80 Å²	80	85.7 Å²	85.7	43%	0.428	44%	0.441	S	S	.	.			trans	-77.2	69.4	178.3	-79.1	-34.2	0	0	0	111.7	V143 H274 R290	D141-V143 PolarHBondContact O-N 2.94Å; D141-H274 IonicContact OD1-CE1 3.38Å; D141-H274 IonicContact OD1-NE2 3.5Å; D141-H274 PolarHBondContact OD1-NE2 2.02Å; D141-H274 IonicContact OD2-NE2 2.79Å; D141-R290 VanDerWaalsContact CB-NH1 3.34Å; D141-R290 IonicContact OD1-NH1 3.84Å; D141-R290 PolarHBondContact OD1-NH1 3.23Å; D141-R290 VanDerWaalsContact OD1-NH1 3.17Å; D141-R290 IonicContact OD2-NH1 3.63Å; D141-R290 PolarHBondContact OD2-NH1 3.47Å
142	T	59.6	Low	67.3	Low	53 Å²	53	83.6 Å²	83.6	33%	0.325	43%	0.43	S	S	.	.			trans	-66.9	107	174.2	59.7	0	0	0	0	109.8	E140 T144	E140-T142 HydrophobicContact CG-CG2 4.38Å; E140-T142 PolarHBondContact O-N 3.34Å; T142-T144 PolarHBondContact O-N 2.97Å
143	V	49	Very low	68.7	Low	117 Å²	117	76.7 Å²	76.7	71%	0.709	42%	0.415	S	S	*	.			trans	-67.2	76.5	171.3	-174.9	0	0	0	0	108.3	D141	D141-V143 PolarHBondContact O-N 2.94Å
144	T	52.2	Low	69.6	Low	77 Å²	77	78.3 Å²	78.3	47%	0.472	42%	0.421	S	S	.	.			trans	-127.1	66.4	164.4	46.9	0	0	0	0	108.1	T142 K146	T142-T144 PolarHBondContact O-N 2.97Å; T144-K146 PolarHBondContact O-N 3.28Å
145	S	54.8	Low	70	Confident	103 Å²	103	72.7 Å²	72.7	72%	0.72	39%	0.392	S	S	*	.			trans	-60.7	81.6	158	160.1	0	0	0	0	107.5
146	K	60	Low	69.5	Low	175 Å²	175	77.5 Å²	77.5	76%	0.761	42%	0.418	S	S	*	.			trans	-60.7	135.5	163	-71.4	-171.7	178.2	-173	0	106.1	T144 W148	T144-K146 PolarHBondContact O-N 3.28Å; K146-W148 PolarHBondContact O-N 3.19Å
147	P	64.6	Low	68.4	Low	91 Å²	91	80.7 Å²	80.7	59%	0.591	43%	0.429	S	S	*	.			trans	-51.2	136.1	178.4	-24.1	31.1	0	0	0	110	K149	P147-K149 HydrophobicContact CB-CG 4.29Å; P147-K149 PolarHBondContact O-N 2.96Å
148	W	72.2	Confident	67.5	Low	58 Å²	58	81.1 Å²	81.1	22%	0.22	43%	0.431	C	S	.	.			trans	-60.1	106.6	174.6	-168.6	98	0	0	0	107.8	K146 M150 P213 F354 L358	K146-W148 PolarHBondContact O-N 3.19Å; W148-M150 HydrophobicContact CE3-CB 4.46Å; W148-M150 HydrophobicContact CH2-CB 3.53Å; W148-M150 HydrophobicContact CH2-CG 4.25Å; W148-M150 HydrophobicContact CH2-SD 4.08Å; W148-M150 HydrophobicContact CZ2-CB 4.29Å; W148-M150 HydrophobicContact CZ2-SD 4.16Å; W148-M150 HydrophobicContact CZ3-CB 3.66Å; W148-P213 HydrophobicContact CD2-CB 4.02Å; W148-P213 HydrophobicContact CD2-CG 4.19Å; W148-P213 HydrophobicContact CG-CB 4.31Å; W148-P213 HydrophobicContact CG-CG 4.01Å; W148-P213 HydrophobicContact CH2-CB 4.44Å; W148-P213 HydrophobicContact CZ2-CB 3.75Å; W148-F354 AromaticContact CD2-CE1 3.64Å; W148-F354 HydrophobicContact CD2-CE1 3.64Å; W148-F354 HydrophobicContact CD2-CZ 4.01Å; W148-F354 AromaticContact CE2-CE1 3.87Å; W148-F354 AromaticContact CE3-CE1 3.77Å; W148-F354 HydrophobicContact CE3-CE1 3.77Å; W148-F354 AromaticContact CE3-CZ 3.83Å; W148-F354 HydrophobicContact CE3-CZ 3.83Å; W148-F354 HydrophobicContact CG-CE1 4.09Å; W148-F354 HydrophobicContact CG-CZ 4.37Å; W148-F354 HydrophobicContact CH2-CE1 4.47Å; W148-F354 HydrophobicContact CZ2-CE1 4.3Å; W148-F354 HydrophobicContact CZ3-CE1 4.2Å; W148-F354 HydrophobicContact CZ3-CZ 4.42Å; W148-L358 HydrophobicContact CE3-CD1 4.24Å; W148-L358 HydrophobicContact CE3-CD2 4.37Å; W148-L358 HydrophobicContact CH2-CD1 3.13Å; W148-L358 HydrophobicContact CH2-CD2 4.43Å; W148-L358 HydrophobicContact CH2-CG 4.39Å; W148-L358 HydrophobicContact CZ2-CD1 3.85Å; W148-L358 HydrophobicContact CZ3-CD1 3.34Å; W148-L358 HydrophobicContact CZ3-CD2 3.77Å; W148-L358 HydrophobicContact CZ3-CG 4.21Å
149	K	74.8	Confident	66.6	Low	161 Å²	161	87.8 Å²	87.8	70%	0.7	46%	0.46	S	S	*	.			trans	-125.6	118.5	-177	-74.1	-176.6	-178.5	-173.7	0	109.2	P147	P147-K149 HydrophobicContact CB-CG 4.29Å; P147-K149 PolarHBondContact O-N 2.96Å
150	M	78.1	Confident	65.6	Low	18 Å²	18	92.6 Å²	92.6	9%	0.089	49%	0.492	C	S	.	.			trans	-129.3	133.7	172.8	-162.7	127.2	140.8	0	0	107.7	W148 L152 F168 L171 P213	W148-M150 HydrophobicContact CE3-CB 4.46Å; W148-M150 HydrophobicContact CH2-CB 3.53Å; W148-M150 HydrophobicContact CH2-CG 4.25Å; W148-M150 HydrophobicContact CH2-SD 4.08Å; W148-M150 HydrophobicContact CZ2-CB 4.29Å; W148-M150 HydrophobicContact CZ2-SD 4.16Å; W148-M150 HydrophobicContact CZ3-CB 3.66Å; M150-L152 PolarHBondContact O-N 3.43Å; M150-F168 HydrophobicContact CE-CD1 3.63Å; M150-F168 HydrophobicContact CE-CE1 4.06Å; M150-L171 HydrophobicContact CE-CB 3.47Å; M150-L171 VanDerWaalsContact CE-CB 3.47Å; M150-L171 HydrophobicContact CE-CD1 3.42Å; M150-L171 VanDerWaalsContact CE-CD1 3.42Å; M150-L171 HydrophobicContact CE-CG 4.06Å; M150-L171 HydrophobicContact CG-CD1 4.36Å; M150-P213 HydrophobicContact CB-CB 4.26Å; M150-P213 HydrophobicContact SD-CB 3.74Å
151	N	77.6	Confident	65.3	Low	106 Å²	106	95.9 Å²	95.9	57%	0.567	51%	0.512	S	S	*	.			trans	-77.3	96.2	-178.7	-171	-15.2	0	0	0	109.6	S153	N151-S153 VanDerWaalsContact C-N 3.34Å; N151-S153 VanDerWaalsContact OD1-CB 3.28Å; N151-S153 WeakPolarHBondContact OD1-CB 3.05Å; N151-S153 PolarHBondContact OD1-N 3.36Å; N151-S153 PolarHBondContact OD1-OG 3.35Å
152	L	77.1	Confident	66.2	Low	49 Å²	49	92.8 Å²	92.8	26%	0.257	50%	0.496	S	S	.	.			trans	-85.6	-4	178.1	-64.6	151.8	0	0	0	112.2	M150 K154 L155 L171 L358 F359	M150-L152 PolarHBondContact O-N 3.43Å; L152-K154 PolarHBondContact O-N 3.37Å; L152-L155 HydrophobicContact CB-CD1 3.97Å; L152-L155 HydrophobicContact CD2-CD1 3.41Å; L152-L155 VanDerWaalsContact CD2-CD1 3.41Å; L152-L155 HydrophobicContact CD2-CD2 4.19Å; L152-L155 HydrophobicContact CD2-CG 4.45Å; L152-L155 HydrophobicContact CG-CD1 4.28Å; L152-L155 WeakPolarHBondContact O-CB 3.48Å; L152-L155 PolarHBondContact O-N 2.91Å; L152-L171 HydrophobicContact CD2-CD1 3.95Å; L152-L358 HydrophobicContact CD1-CD2 4.38Å; L152-F359 HydrophobicContact CD2-CE1 4.27Å; L152-F359 HydrophobicContact CD2-CZ 4.37Å
153	S	69.2	Low	67.8	Low	89 Å²	89	91.6 Å²	91.6	62%	0.622	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-19.2	-175.7	65.7	0	0	0	0	114.4	N151	N151-S153 VanDerWaalsContact C-N 3.34Å; N151-S153 VanDerWaalsContact OD1-CB 3.28Å; N151-S153 WeakPolarHBondContact OD1-CB 3.05Å; N151-S153 PolarHBondContact OD1-N 3.36Å; N151-S153 PolarHBondContact OD1-OG 3.35Å
154	K	66.4	Low	69.9	Low	105 Å²	105	87.2 Å²	87.2	46%	0.457	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	12.6	175	-63.3	-175.6	179.9	-178.6	0	113.1	L152 N156 M157 L174	L152-K154 PolarHBondContact O-N 3.37Å; K154-N156 PolarHBondContact O-N 3.04Å; K154-M157 PolarHBondContact O-N 3.11Å; K154-L174 HydrophobicContact CB-CD1 3.82Å; K154-L174 HydrophobicContact CD-CD1 4.47Å
155	L	64.2	Low	71.9	Confident	37 Å²	37	83.7 Å²	83.7	19%	0.194	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-57	-34.3	175.6	-117.5	57.7	0	0	0	112.1	L152 M157 L158 L171 F359	L152-L155 HydrophobicContact CB-CD1 3.97Å; L152-L155 HydrophobicContact CD2-CD1 3.41Å; L152-L155 VanDerWaalsContact CD2-CD1 3.41Å; L152-L155 HydrophobicContact CD2-CD2 4.19Å; L152-L155 HydrophobicContact CD2-CG 4.45Å; L152-L155 HydrophobicContact CG-CD1 4.28Å; L152-L155 WeakPolarHBondContact O-CB 3.48Å; L152-L155 PolarHBondContact O-N 2.91Å; L155-M157 PolarHBondContact O-N 3.26Å; L155-L158 HydrophobicContact CB-CD1 4.11Å; L155-L158 HydrophobicContact CD1-CD1 3.63Å; L155-L158 HydrophobicContact CG-CD1 3.58Å; L155-L158 WeakPolarHBondContact O-CA 2.99Å; L155-L158 WeakPolarHBondContact O-CB 3.42Å; L155-L158 WeakPolarHBondContact O-CD1 3.33Å; L155-L158 VanDerWaalsContact O-CG 3.22Å; L155-L158 WeakPolarHBondContact O-CG 3.37Å; L155-L158 PolarHBondContact O-N 3.47Å; L155-L171 HydrophobicContact CD1-CD1 4.22Å; L155-L171 HydrophobicContact CD1-CD2 3.89Å; L155-L171 HydrophobicContact CD1-CG 4.42Å; L155-F359 HydrophobicContact CD1-CD1 4.17Å; L155-F359 HydrophobicContact CD1-CE1 3.68Å; L155-F359 HydrophobicContact CD2-CD1 3.68Å; L155-F359 HydrophobicContact CD2-CE1 4.08Å; L155-F359 HydrophobicContact CG-CD1 4.06Å; L155-F359 HydrophobicContact CG-CE1 4.05Å
156	N	56	Low	73.8	Confident	148 Å²	148	81.1 Å²	81.1	79%	0.791	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-66.4	-11.3	-176.5	-61.9	-5.7	0	0	0	113	K154	K154-N156 PolarHBondContact O-N 3.04Å
157	M	56.5	Low	75.3	Confident	146 Å²	146	74.7 Å²	74.7	72%	0.719	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-88.7	-4.7	170.6	-61	-174.2	71.4	0	0	113.2	K154 L155	K154-M157 PolarHBondContact O-N 3.11Å; L155-M157 PolarHBondContact O-N 3.26Å
158	L	65.7	Low	76.7	Confident	16 Å²	16	70.4 Å²	70.4	8%	0.084	36%	0.361	C	S	.	.	S	Bend	trans	-79.7	141.6	176.1	-58.9	166.3	0	0	0	109.6	L155 K167 M170 F359	L155-L158 HydrophobicContact CB-CD1 4.11Å; L155-L158 HydrophobicContact CD1-CD1 3.63Å; L155-L158 HydrophobicContact CG-CD1 3.58Å; L155-L158 WeakPolarHBondContact O-CA 2.99Å; L155-L158 WeakPolarHBondContact O-CB 3.42Å; L155-L158 WeakPolarHBondContact O-CD1 3.33Å; L155-L158 VanDerWaalsContact O-CG 3.22Å; L155-L158 WeakPolarHBondContact O-CG 3.37Å; L155-L158 PolarHBondContact O-N 3.47Å; L158-K167 HydrophobicContact CD1-CB 4.03Å; L158-K167 HydrophobicContact CD1-CD 4.22Å; L158-K167 HydrophobicContact CD1-CG 4Å; L158-M170 HydrophobicContact CD2-CB 3.23Å; L158-M170 HydrophobicContact CD2-CE 3.57Å; L158-M170 HydrophobicContact CD2-CG 3.84Å; L158-M170 HydrophobicContact CD2-SD 3.32Å; L158-M170 WeakPolarHBondContact CD2-SD 3.02Å; L158-F359 HydrophobicContact CD1-CE1 4.41Å
159	K	66.8	Low	77.8	Confident	139 Å²	139	67.8 Å²	67.8	60%	0.604	35%	0.351	S	S	*	.			trans	-60.7	125.7	174.1	-169.1	178.1	-178.5	-177.2	0	108.9	D161 S162	K159-D161 PolarHBondContact O-N 2.03Å; K159-S162 WeakPolarHBondContact O-CB 3.45Å; K159-S162 PolarHBondContact O-N 3.19Å; K159-S162 PolarHBondContact O-OG 2.89Å
160	P	66.5	Low	78.6	Confident	106 Å²	106	62.9 Å²	62.9	69%	0.688	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-38.5	-175.2	19.4	-30.7	0	0	0	111.9	S162	P160-S162 VanDerWaalsContact C-N 3.27Å; P160-S162 PolarHBondContact O-N 3.29Å
161	D	74.6	Confident	79.3	Confident	140 Å²	140	62.3 Å²	62.3	75%	0.749	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	8.6	-178.5	-45.9	-40.5	0	0	0	114.9	K159	K159-D161 PolarHBondContact O-N 2.03Å
162	S	85.6	Confident	80.1	Confident	15 Å²	15	57.2 Å²	57.2	11%	0.105	30%	0.302	C	S	.	.			trans	-77.6	142.9	179.7	56.1	0	0	0	0	112.5	K159 P160 K167	K159-S162 WeakPolarHBondContact O-CB 3.45Å; K159-S162 PolarHBondContact O-N 3.19Å; K159-S162 PolarHBondContact O-OG 2.89Å; P160-S162 VanDerWaalsContact C-N 3.27Å; P160-S162 PolarHBondContact O-N 3.29Å; S162-K167 VanDerWaalsContact O-CE 3.24Å; S162-K167 WeakPolarHBondContact O-CE 3.4Å; S162-K167 WeakPolarHBondContact OG-CE 3.42Å; S162-K167 WeakPolarHBondContact OG-CG 3.36Å
163	D	91.7	Very high	80.9	Confident	28 Å²	28	57.8 Å²	57.8	15%	0.15	31%	0.308	C	S	.	.			trans	-63.4	155.9	171.7	72.2	77.1	0	0	0	111.9	C165 L166 K167 C230 R233	D163-C165 VanDerWaalsContact C-N 3.29Å; D163-C165 PolarHBondContact O-N 2.86Å; D163-C165 WeakPolarHBondContact OD1-CA 3.42Å; D163-C165 WeakPolarHBondContact OD1-CB 3.16Å; D163-C165 PolarHBondContact OD1-N 3.47Å; D163-L166 WeakPolarHBondContact O-CB 3.4Å; D163-L166 PolarHBondContact O-N 3.33Å; D163-L166 VanDerWaalsContact O-N 3.12Å; D163-L166 PolarHBondContact OD1-N 2.79Å; D163-K167 PolarHBondContact O-N 3.12Å; D163-C230 HydrophobicContact CB-CB 3.79Å; D163-R233 IonicContact OD1-NE 2.91Å; D163-R233 IonicContact OD2-NE 3.34Å; D163-R233 PolarHBondContact OD2-NE 2.87Å
164	L	92.5	Very high	82	Confident	24 Å²	24	57 Å²	57	13%	0.126	30%	0.296	C	S	.	.	H	α-helix	trans	-64.2	-33	-175.4	-67.2	175.4	0	0	0	112.3	L166 K167 F168 P222 F359	L164-L166 VanDerWaalsContact C-N 3.35Å; L164-K167 HydrophobicContact CD2-CD 4.2Å; L164-K167 PolarHBondContact O-N 3.06Å; L164-F168 WeakPolarHBondContact O-CD2 3.4Å; L164-F168 PolarHBondContact O-N 3.17Å; L164-P222 HydrophobicContact CB-CG 4.2Å; L164-P222 HydrophobicContact CD1-CB 4.41Å; L164-P222 HydrophobicContact CD1-CG 3.57Å; L164-F359 HydrophobicContact CD2-CB 3.92Å; L164-F359 HydrophobicContact CD2-CD2 3.82Å; L164-F359 HydrophobicContact CD2-CE2 4.5Å; L164-F359 HydrophobicContact CD2-CG 3.87Å
165	C	95.8	Very high	83.3	Confident	3 Å²	3	54.7 Å²	54.7	2%	0.02	29%	0.289	C	S	.	.	H	α-helix	trans	-64.2	-39.6	174.4	-67.5	0	0	0	0	111.9	D163 F168 A169 C221 C223 C230 R233	D163-C165 VanDerWaalsContact C-N 3.29Å; D163-C165 PolarHBondContact O-N 2.86Å; D163-C165 WeakPolarHBondContact OD1-CA 3.42Å; D163-C165 WeakPolarHBondContact OD1-CB 3.16Å; D163-C165 PolarHBondContact OD1-N 3.47Å; C165-F168 PolarHBondContact O-N 3.22Å; C165-A169 WeakPolarHBondContact O-CB 3.45Å; C165-A169 PolarHBondContact O-N 3.3Å; C165-C221 VanDerWaalsContact CA-SG 3.52Å; C165-C221 HydrophobicContact CB-CB 3.75Å; C165-C221 WeakPolarHBondContact CB-SG 3.48Å; C165-C221 WeakPolarHBondContact SG-CB 3.13Å; C165-C221 CovalentContact SG-SG 2.01Å; C165-C221 PolarHBondContact SG-SG 3.34Å; C165-C223 PolarHBondContact SG-SG 2.8Å; C165-C230 PolarHBondContact SG-SG 2.98Å; C165-R233 HydrophobicContact CB-CG 4.25Å
166	L	93.9	Very high	84.8	Confident	49 Å²	49	59.8 Å²	59.8	26%	0.257	32%	0.316	S	S	.	.	H	α-helix	trans	-65.6	-41.3	174	-178.2	55.1	0	0	0	111.3	D163 L164 F168 A169 M170	D163-L166 WeakPolarHBondContact O-CB 3.4Å; D163-L166 PolarHBondContact O-N 3.33Å; D163-L166 VanDerWaalsContact O-N 3.12Å; D163-L166 PolarHBondContact OD1-N 2.79Å; L164-L166 VanDerWaalsContact C-N 3.35Å; L166-F168 PolarHBondContact O-N 2.72Å; L166-A169 WeakPolarHBondContact O-CB 3.02Å; L166-A169 PolarHBondContact O-N 3.03Å; L166-M170 HydrophobicContact CD1-CG 4.29Å; L166-M170 HydrophobicContact CG-SD 4.32Å; L166-M170 WeakPolarHBondContact O-CG 3.45Å; L166-M170 PolarHBondContact O-N 3.03Å
167	K	92.3	Very high	86.7	Confident	40 Å²	40	58.8 Å²	58.8	17%	0.174	30%	0.304	C	S	.	.	H	α-helix	trans	-59	-45.7	174.7	-65.7	-172.3	-173.1	174.9	0	112	L158 S162 D163 L164 A169 M170 L171 F359	L158-K167 HydrophobicContact CD1-CB 4.03Å; L158-K167 HydrophobicContact CD1-CD 4.22Å; L158-K167 HydrophobicContact CD1-CG 4Å; S162-K167 VanDerWaalsContact O-CE 3.24Å; S162-K167 WeakPolarHBondContact O-CE 3.4Å; S162-K167 WeakPolarHBondContact OG-CE 3.42Å; S162-K167 WeakPolarHBondContact OG-CG 3.36Å; D163-K167 PolarHBondContact O-N 3.12Å; L164-K167 HydrophobicContact CD2-CD 4.2Å; L164-K167 PolarHBondContact O-N 3.06Å; K167-A169 PolarHBondContact O-N 3.28Å; K167-M170 PolarHBondContact O-N 3.23Å; K167-L171 WeakPolarHBondContact O-CG 2.99Å; K167-L171 PolarHBondContact O-N 3.46Å; K167-F359 HydrophobicContact CB-CD1 4.4Å; K167-F359 HydrophobicContact CB-CE1 3.7Å; K167-F359 HydrophobicContact CB-CZ 3.95Å; K167-F359 HydrophobicContact CD-CD1 3.8Å; K167-F359 HydrophobicContact CD-CE1 3.96Å; K167-F359 HydrophobicContact CD-CG 4.49Å; K167-F359 HydrophobicContact CG-CE1 4.42Å
168	F	94.3	Very high	88.7	Confident	1 Å²	1	51.9 Å²	51.9	0%	0.004	27%	0.271	C	S	.	.	H	α-helix	trans	-62.9	-39.2	174.1	-81.2	-67.5	0	0	0	113.2	M150 L164 C165 L166 M170 L171 C172 G217 C221 H355 F359	M150-F168 HydrophobicContact CE-CD1 3.63Å; M150-F168 HydrophobicContact CE-CE1 4.06Å; L164-F168 WeakPolarHBondContact O-CD2 3.4Å; L164-F168 PolarHBondContact O-N 3.17Å; C165-F168 PolarHBondContact O-N 3.22Å; L166-F168 PolarHBondContact O-N 2.72Å; F168-M170 VanDerWaalsContact C-N 3.34Å; F168-M170 PolarHBondContact O-N 2.01Å; F168-L171 HydrophobicContact CD1-CD1 4.42Å; F168-L171 PolarHBondContact O-N 3.16Å; F168-C172 PolarHBondContact O-N 3.37Å; F168-C172 VanDerWaalsContact O-N 3.1Å; F168-G217 WeakPolarHBondContact CB-O 3.36Å; F168-G217 WeakPolarHBondContact CD2-O 3.27Å; F168-G217 VanDerWaalsContact CG-O 3.25Å; F168-G217 WeakPolarHBondContact CG-O 3.46Å; F168-C221 HydrophobicContact CD2-CB 3.83Å; F168-C221 HydrophobicContact CE2-CB 4.41Å; F168-H355 HydrophobicContact CE2-CB 3.74Å; F168-H355 AromaticContact CE2-CG 3.91Å; F168-H355 HydrophobicContact CZ-CB 3.55Å; F168-H355 AromaticContact CZ-CD2 3.65Å; F168-H355 AromaticContact CZ-CG 3.44Å; F168-H355 VanDerWaalsContact CZ-CG 3.44Å; F168-H355 AromaticContact CZ-ND1 3.95Å; F168-F359 HydrophobicContact CD1-CE2 4.44Å; F168-F359 HydrophobicContact CD1-CZ 4.38Å; F168-F359 HydrophobicContact CD2-CE2 4.11Å; F168-F359 HydrophobicContact CD2-CZ 4.44Å; F168-F359 AromaticContact CE1-CE2 3.95Å; F168-F359 HydrophobicContact CE1-CE2 3.95Å; F168-F359 HydrophobicContact CE1-CZ 4.23Å; F168-F359 HydrophobicContact CE2-CD2 4.45Å; F168-F359 AromaticContact CE2-CE2 3.55Å; F168-F359 HydrophobicContact CE2-CE2 3.55Å; F168-F359 HydrophobicContact CE2-CZ 4.27Å; F168-F359 HydrophobicContact CG-CZ 4.49Å; F168-F359 HydrophobicContact CZ-CD2 4.48Å; F168-F359 AromaticContact CZ-CE2 3.48Å; F168-F359 HydrophobicContact CZ-CE2 3.48Å; F168-F359 VanDerWaalsContact CZ-CE2 3.48Å; F168-F359 HydrophobicContact CZ-CZ 4.19Å
169	A	94.8	Very high	90.2	Very high	3 Å²	3	52.2 Å²	52.2	3%	0.025	27%	0.273	C	S	.	.	H	α-helix	trans	-63.1	-40.2	175.1	0	0	0	0	0	112.4	C165 L166 K167 C172 T173 L218	C165-A169 WeakPolarHBondContact O-CB 3.45Å; C165-A169 PolarHBondContact O-N 3.3Å; L166-A169 WeakPolarHBondContact O-CB 3.02Å; L166-A169 PolarHBondContact O-N 3.03Å; K167-A169 PolarHBondContact O-N 3.28Å; A169-C172 PolarHBondContact O-N 3.5Å; A169-T173 PolarHBondContact O-N 2.92Å; A169-T173 PolarHBondContact O-OG1 3.25Å; A169-L218 HydrophobicContact CB-CD1 3.81Å
170	M	92	Very high	91.7	Very high	59 Å²	59	54.5 Å²	54.5	29%	0.291	28%	0.277	S	S	.	.	H	α-helix	trans	-67.2	-39.5	175.3	-71.5	179.1	76.8	0	0	111.7	L158 L166 K167 F168 C172 T173 L174	L158-M170 HydrophobicContact CD2-CB 3.23Å; L158-M170 HydrophobicContact CD2-CE 3.57Å; L158-M170 HydrophobicContact CD2-CG 3.84Å; L158-M170 HydrophobicContact CD2-SD 3.32Å; L158-M170 WeakPolarHBondContact CD2-SD 3.02Å; L166-M170 HydrophobicContact CD1-CG 4.29Å; L166-M170 HydrophobicContact CG-SD 4.32Å; L166-M170 WeakPolarHBondContact O-CG 3.45Å; L166-M170 PolarHBondContact O-N 3.03Å; K167-M170 PolarHBondContact O-N 3.23Å; F168-M170 VanDerWaalsContact C-N 3.34Å; F168-M170 PolarHBondContact O-N 2.01Å; M170-C172 VanDerWaalsContact C-N 3.3Å; M170-C172 PolarHBondContact O-N 2.03Å; M170-T173 CarbonylContact O-C 3.54Å; M170-T173 WeakPolarHBondContact O-CA 3.5Å; M170-T173 VanDerWaalsContact O-CB 3.31Å; M170-T173 WeakPolarHBondContact O-CB 3.49Å; M170-T173 PolarHBondContact O-N 2.83Å; M170-L174 WeakPolarHBondContact O-CG 3.44Å; M170-L174 PolarHBondContact O-N 3.19Å
171	L	92.2	Very high	93.2	Very high	5 Å²	5	50.1 Å²	50.1	3%	0.026	25%	0.248	C	C	.	.	H	α-helix	trans	-61.8	-36.9	174.3	-70.4	169.4	0	0	0	112.7	M150 L152 L155 K167 F168 T173 L174 N175 F359	M150-L171 HydrophobicContact CE-CB 3.47Å; M150-L171 VanDerWaalsContact CE-CB 3.47Å; M150-L171 HydrophobicContact CE-CD1 3.42Å; M150-L171 VanDerWaalsContact CE-CD1 3.42Å; M150-L171 HydrophobicContact CE-CG 4.06Å; M150-L171 HydrophobicContact CG-CD1 4.36Å; L152-L171 HydrophobicContact CD2-CD1 3.95Å; L155-L171 HydrophobicContact CD1-CD1 4.22Å; L155-L171 HydrophobicContact CD1-CD2 3.89Å; L155-L171 HydrophobicContact CD1-CG 4.42Å; K167-L171 WeakPolarHBondContact O-CG 2.99Å; K167-L171 PolarHBondContact O-N 3.46Å; F168-L171 HydrophobicContact CD1-CD1 4.42Å; F168-L171 PolarHBondContact O-N 3.16Å; L171-T173 VanDerWaalsContact C-N 3.35Å; L171-L174 PolarHBondContact O-N 3.09Å; L171-N175 PolarHBondContact O-N 2.97Å; L171-F359 HydrophobicContact CD1-CE1 4.13Å; L171-F359 HydrophobicContact CD1-CZ 3.76Å
172	C	94.8	Very high	94.4	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-64.6	-40.4	169.7	179.7	0	0	0	0	111.7	F168 A169 M170 L174 N175 C178 D179	F168-C172 PolarHBondContact O-N 3.37Å; F168-C172 VanDerWaalsContact O-N 3.1Å; A169-C172 PolarHBondContact O-N 3.5Å; M170-C172 VanDerWaalsContact C-N 3.3Å; M170-C172 PolarHBondContact O-N 2.03Å; C172-L174 VanDerWaalsContact C-N 3.28Å; C172-L174 PolarHBondContact O-N 3.1Å; C172-N175 PolarHBondContact O-N 3.3Å; C172-N175 VanDerWaalsContact O-N 3.1Å; C172-C178 HydrophobicContact CB-CB 4.03Å; C172-C178 WeakPolarHBondContact CB-SG 3.49Å; C172-C178 WeakPolarHBondContact O-CB 3.06Å; C172-C178 WeakPolarHBondContact SG-CB 3.04Å; C172-C178 CovalentContact SG-SG 2.04Å; C172-C178 PolarHBondContact SG-SG 2.9Å; C172-D179 PolarHBondContact O-N 2.95Å; C172-D179 VanDerWaalsContact O-N 3.17Å
173	T	94.1	Very high	95	Very high	61 Å²	61	51.7 Å²	51.7	37%	0.374	24%	0.244	S	C	.	.	H	α-helix	trans	-64.1	-32.9	178.6	-50.9	0	0	0	0	112.1	A169 M170 L171 N175 R182	A169-T173 PolarHBondContact O-N 2.92Å; A169-T173 PolarHBondContact O-OG1 3.25Å; M170-T173 CarbonylContact O-C 3.54Å; M170-T173 WeakPolarHBondContact O-CA 3.5Å; M170-T173 VanDerWaalsContact O-CB 3.31Å; M170-T173 WeakPolarHBondContact O-CB 3.49Å; M170-T173 PolarHBondContact O-N 2.83Å; L171-T173 VanDerWaalsContact C-N 3.35Å; T173-N175 VanDerWaalsContact C-N 3.27Å; T173-N175 PolarHBondContact O-N 3.06Å; T173-R182 PolarHBondContact OG1-NH1 2.98Å
174	L	91.6	Very high	95.3	Very high	71 Å²	71	51.8 Å²	51.8	37%	0.372	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-7.6	176.3	-67.9	172.2	0	0	0	113.8	K154 M170 L171 C172	K154-L174 HydrophobicContact CB-CD1 3.82Å; K154-L174 HydrophobicContact CD-CD1 4.47Å; M170-L174 WeakPolarHBondContact O-CG 3.44Å; M170-L174 PolarHBondContact O-N 3.19Å; L171-L174 PolarHBondContact O-N 3.09Å; C172-L174 VanDerWaalsContact C-N 3.28Å; C172-L174 PolarHBondContact O-N 3.1Å
175	N	93.5	Very high	95.6	Very high	58 Å²	58	51.2 Å²	51.2	31%	0.31	25%	0.245	S	C	.	.	S	Bend	trans	-107.1	109	176.3	-179.6	-87.6	0	0	0	109.6	L171 C172 T173 K177 C178 D179	L171-N175 PolarHBondContact O-N 2.97Å; C172-N175 PolarHBondContact O-N 3.3Å; C172-N175 VanDerWaalsContact O-N 3.1Å; T173-N175 VanDerWaalsContact C-N 3.27Å; T173-N175 PolarHBondContact O-N 3.06Å; N175-K177 PolarHBondContact O-N 3.38Å; N175-K177 PolarHBondContact OD1-N 3.33Å; N175-C178 HydrophobicContact CB-CB 3.94Å; N175-C178 PolarHBondContact O-N 3.06Å; N175-C178 WeakPolarHBondContact OD1-CB 3.49Å; N175-C178 PolarHBondContact OD1-N 3.44Å; N175-D179 WeakPolarHBondContact O-CB 3.34Å; N175-D179 PolarHBondContact O-N 3.47Å
176	D	95.4	Very high	95.6	Very high	143 Å²	143	52.3 Å²	52.3	77%	0.765	26%	0.257	S	S	*	.	H	α-helix	trans	-50.2	-40.4	-173.8	-58.2	-23.6	0	0	0	113.8	R180	D176-R180 WeakPolarHBondContact O-CB 3.32Å; D176-R180 PolarHBondContact O-N 2.93Å
177	K	96.7	Very high	95.8	Very high	127 Å²	127	57.1 Å²	57.1	55%	0.552	28%	0.278	S	S	*	.	H	α-helix	trans	-68.4	-45.3	178.5	-175.1	179.3	174.3	-171.2	0	111.6	N175 L181 K209	N175-K177 PolarHBondContact O-N 3.38Å; N175-K177 PolarHBondContact OD1-N 3.33Å; K177-L181 HydrophobicContact CG-CD1 4.27Å; K177-L181 WeakPolarHBondContact O-CD1 3.34Å; K177-L181 VanDerWaalsContact O-CG 3.27Å; K177-L181 WeakPolarHBondContact O-CG 3.3Å; K177-L181 PolarHBondContact O-N 3.15Å; K177-K209 WeakPolarHBondContact CE-O 3.45Å; K177-K209 PolarHBondContact NZ-O 3.02Å
178	C	97.3	Very high	96.1	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.007	28%	0.279	C	S	.	.	H	α-helix	trans	-67.9	-46.7	178.8	-166.6	0	0	0	0	111.3	C172 N175 R180 L181 R182 H214	C172-C178 HydrophobicContact CB-CB 4.03Å; C172-C178 WeakPolarHBondContact CB-SG 3.49Å; C172-C178 WeakPolarHBondContact O-CB 3.06Å; C172-C178 WeakPolarHBondContact SG-CB 3.04Å; C172-C178 CovalentContact SG-SG 2.04Å; C172-C178 PolarHBondContact SG-SG 2.9Å; N175-C178 HydrophobicContact CB-CB 3.94Å; N175-C178 PolarHBondContact O-N 3.06Å; N175-C178 WeakPolarHBondContact OD1-CB 3.49Å; N175-C178 PolarHBondContact OD1-N 3.44Å; C178-R180 PolarHBondContact O-N 2.82Å; C178-L181 PolarHBondContact O-N 3.11Å; C178-R182 VanDerWaalsContact O-CB 3.28Å; C178-R182 WeakPolarHBondContact O-CB 3.4Å; C178-R182 PolarHBondContact O-N 2.79Å; C178-H214 HydrophobicContact CB-CB 4.39Å; C178-H214 VanDerWaalsContact SG-CB 3.57Å
179	D	97.8	Very high	96.2	Very high	24 Å²	24	56.5 Å²	56.5	13%	0.128	28%	0.28	C	S	.	.	H	α-helix	trans	-57.2	-48.3	178.1	-176.1	55	0	0	0	111.7	C172 N175 L181 R182 K183	C172-D179 PolarHBondContact O-N 2.95Å; C172-D179 VanDerWaalsContact O-N 3.17Å; N175-D179 WeakPolarHBondContact O-CB 3.34Å; N175-D179 PolarHBondContact O-N 3.47Å; D179-L181 PolarHBondContact O-N 3.35Å; D179-R182 PolarHBondContact O-N 3.48Å; D179-R182 VanDerWaalsContact O-N 3.17Å; D179-K183 WeakPolarHBondContact O-CB 3.44Å; D179-K183 WeakPolarHBondContact O-CG 3.06Å; D179-K183 PolarHBondContact O-N 2.72Å; D179-K183 WeakPolarHBondContact OD1-CE 3.39Å; D179-K183 IonicContact OD1-NZ 2.72Å; D179-K183 WeakPolarHBondContact OD2-CE 3.47Å; D179-K183 IonicContact OD2-NZ 3.29Å; D179-K183 PolarHBondContact OD2-NZ 3.42Å
180	R	98.6	Very high	96.2	Very high	186 Å²	186	60.1 Å²	60.1	70%	0.702	31%	0.305	S	S	*	.	H	α-helix	trans	-58.1	-46.4	176.2	179.9	179.9	173.8	-104.8	-2	112.4	D176 C178 R182 A184	D176-R180 WeakPolarHBondContact O-CB 3.32Å; D176-R180 PolarHBondContact O-N 2.93Å; C178-R180 PolarHBondContact O-N 2.82Å; R180-R182 VanDerWaalsContact C-N 3.33Å; R180-A184 WeakPolarHBondContact O-CB 3.45Å; R180-A184 PolarHBondContact O-N 3.42Å; R180-A184 VanDerWaalsContact O-N 3.12Å
181	L	98.6	Very high	96	Very high	15 Å²	15	59.9 Å²	59.9	8%	0.079	32%	0.319	C	S	.	.	H	α-helix	trans	-66.9	-37	178.5	-68.6	168.1	0	0	0	111.2	K177 C178 D179 A184 Y185 T205 F206 K209 A210	K177-L181 HydrophobicContact CG-CD1 4.27Å; K177-L181 WeakPolarHBondContact O-CD1 3.34Å; K177-L181 VanDerWaalsContact O-CG 3.27Å; K177-L181 WeakPolarHBondContact O-CG 3.3Å; K177-L181 PolarHBondContact O-N 3.15Å; C178-L181 PolarHBondContact O-N 3.11Å; D179-L181 PolarHBondContact O-N 3.35Å; L181-A184 PolarHBondContact O-N 2.67Å; L181-Y185 WeakPolarHBondContact O-CD1 3.46Å; L181-Y185 PolarHBondContact O-N 3.05Å; L181-T205 HydrophobicContact CD2-CG2 4.12Å; L181-F206 HydrophobicContact CB-CD2 3.64Å; L181-F206 HydrophobicContact CB-CE2 4.34Å; L181-K209 HydrophobicContact CD1-CB 3.86Å; L181-K209 HydrophobicContact CD2-CB 4.3Å; L181-A210 HydrophobicContact CD1-CB 4.2Å
182	R	98.4	Very high	95.6	Very high	73 Å²	73	65.7 Å²	65.7	28%	0.275	36%	0.357	S	S	.	.	H	α-helix	trans	-67.7	-44.3	179.7	-175.6	176.6	175.8	-129.3	-3.6	112.1	T173 C178 D179 R180 A184 Y185 G186 F206	T173-R182 PolarHBondContact OG1-NH1 2.98Å; C178-R182 VanDerWaalsContact O-CB 3.28Å; C178-R182 WeakPolarHBondContact O-CB 3.4Å; C178-R182 PolarHBondContact O-N 2.79Å; D179-R182 PolarHBondContact O-N 3.48Å; D179-R182 VanDerWaalsContact O-N 3.17Å; R180-R182 VanDerWaalsContact C-N 3.33Å; R182-A184 VanDerWaalsContact C-N 3.34Å; R182-Y185 VanDerWaalsContact CA-CE1 3.46Å; R182-Y185 HydrophobicContact CB-CE1 4.01Å; R182-Y185 HydrophobicContact CG-CE1 3.78Å; R182-Y185 WeakPolarHBondContact O-CD1 3.3Å; R182-G186 PolarHBondContact O-N 3.28Å; R182-F206 HydrophobicContact CB-CD2 4.43Å; R182-F206 HydrophobicContact CB-CE2 4.01Å
183	K	98.3	Very high	95.4	Very high	114 Å²	114	74.1 Å²	74.1	50%	0.496	40%	0.395	S	S	.	.	H	α-helix	trans	-60.8	-43.5	173.5	-74.5	172.7	175.5	165.1	0	111.4	D179 Y185 G186 E187	D179-K183 WeakPolarHBondContact O-CB 3.44Å; D179-K183 WeakPolarHBondContact O-CG 3.06Å; D179-K183 PolarHBondContact O-N 2.72Å; D179-K183 WeakPolarHBondContact OD1-CE 3.39Å; D179-K183 IonicContact OD1-NZ 2.72Å; D179-K183 WeakPolarHBondContact OD2-CE 3.47Å; D179-K183 IonicContact OD2-NZ 3.29Å; D179-K183 PolarHBondContact OD2-NZ 3.42Å; K183-Y185 PolarHBondContact O-N 2.95Å; K183-G186 PolarHBondContact O-N 3.37Å; K183-G186 VanDerWaalsContact O-N 3.14Å; K183-E187 WeakPolarHBondContact O-CB 3.28Å; K183-E187 WeakPolarHBondContact O-CG 3.4Å; K183-E187 PolarHBondContact O-N 3.22Å
184	A	98.3	Very high	95.4	Very high	30 Å²	30	72.8 Å²	72.8	25%	0.248	39%	0.388	C	S	.	.	H	α-helix	trans	-58.6	-45.1	-179.8	0	0	0	0	0	113.5	R180 L181 R182 A188	R180-A184 WeakPolarHBondContact O-CB 3.45Å; R180-A184 PolarHBondContact O-N 3.42Å; R180-A184 VanDerWaalsContact O-N 3.12Å; L181-A184 PolarHBondContact O-N 2.67Å; R182-A184 VanDerWaalsContact C-N 3.34Å; A184-A188 WeakPolarHBondContact O-CB 3.31Å; A184-A188 PolarHBondContact O-N 2.76Å
185	Y	98.3	Very high	95.6	Very high	13 Å²	13	75 Å²	75	5%	0.051	40%	0.397	C	S	.	.	H	α-helix	trans	-76.5	-33.2	174.5	84.4	-105.8	0	0	0	112.1	L181 R182 K183 E187 A188 C189 L203 F206 T237	L181-Y185 WeakPolarHBondContact O-CD1 3.46Å; L181-Y185 PolarHBondContact O-N 3.05Å; R182-Y185 VanDerWaalsContact CA-CE1 3.46Å; R182-Y185 HydrophobicContact CB-CE1 4.01Å; R182-Y185 HydrophobicContact CG-CE1 3.78Å; R182-Y185 WeakPolarHBondContact O-CD1 3.3Å; K183-Y185 PolarHBondContact O-N 2.95Å; Y185-E187 VanDerWaalsContact C-N 3.33Å; Y185-E187 PolarHBondContact O-N 2.04Å; Y185-A188 PolarHBondContact O-N 3.15Å; Y185-C189 WeakPolarHBondContact O-CB 3.35Å; Y185-C189 PolarHBondContact O-N 2.98Å; Y185-C189 PolarHBondContact O-SG 3.43Å; Y185-L203 HydrophobicContact CD2-CD2 3.65Å; Y185-L203 HydrophobicContact CD2-CG 4.45Å; Y185-L203 HydrophobicContact CE2-CD2 4.03Å; Y185-L203 HydrophobicContact CG-CD2 3.95Å; Y185-F206 HydrophobicContact CD1-CB 3.79Å; Y185-F206 HydrophobicContact CD1-CD1 4.47Å; Y185-F206 AromaticContact CD1-CD2 3.78Å; Y185-F206 HydrophobicContact CD1-CD2 3.78Å; Y185-F206 AromaticContact CD1-CG 3.75Å; Y185-F206 HydrophobicContact CD1-CG 3.75Å; Y185-F206 HydrophobicContact CE1-CB 4.28Å; Y185-F206 HydrophobicContact CE1-CD1 4.11Å; Y185-F206 AromaticContact CE1-CD2 3.62Å; Y185-F206 HydrophobicContact CE1-CD2 3.62Å; Y185-F206 HydrophobicContact CE1-CE1 4.42Å; Y185-F206 AromaticContact CE1-CE2 3.97Å; Y185-F206 HydrophobicContact CE1-CE2 3.97Å; Y185-F206 AromaticContact CE1-CG 3.73Å; Y185-F206 HydrophobicContact CE1-CG 3.73Å; Y185-F206 HydrophobicContact CE1-CZ 4.37Å; Y185-T237 WeakPolarHBondContact CE2-O 3.3Å; Y185-T237 PolarHBondContact OH-O 2.86Å
186	G	97.7	Very high	95.7	Very high	26 Å²	26	76.5 Å²	76.5	27%	0.268	40%	0.398	S	S	.	.	H	α-helix	trans	-57	-46.2	174.6	0	0	0	0	0	112.1	R182 K183 S190	R182-G186 PolarHBondContact O-N 3.28Å; K183-G186 PolarHBondContact O-N 3.37Å; K183-G186 VanDerWaalsContact O-N 3.14Å; G186-S190 VanDerWaalsContact O-CB 3.25Å; G186-S190 WeakPolarHBondContact O-CB 3.35Å; G186-S190 PolarHBondContact O-N 3.36Å; G186-S190 PolarHBondContact O-OG 3.27Å
187	E	97.1	Very high	95.7	Very high	149 Å²	149	74.8 Å²	74.8	70%	0.696	39%	0.385	S	S	*	.	H	α-helix	trans	-64.6	-48.3	175.5	-72.2	169.1	-168.8	0	0	111.8	K183 Y185 C189 S190	K183-E187 WeakPolarHBondContact O-CB 3.28Å; K183-E187 WeakPolarHBondContact O-CG 3.4Å; K183-E187 PolarHBondContact O-N 3.22Å; Y185-E187 VanDerWaalsContact C-N 3.33Å; Y185-E187 PolarHBondContact O-N 2.04Å; E187-C189 VanDerWaalsContact C-N 3.25Å; E187-C189 PolarHBondContact O-N 3.06Å; E187-S190 PolarHBondContact O-N 3.05Å
188	A	97.6	Very high	95.8	Very high	22 Å²	22	71 Å²	71	18%	0.182	37%	0.373	C	S	.	.	H	α-helix	trans	-67.1	-24.1	-178.2	0	0	0	0	0	114.3	A184 Y185 C194 V198 Q202	A184-A188 WeakPolarHBondContact O-CB 3.31Å; A184-A188 PolarHBondContact O-N 2.76Å; Y185-A188 PolarHBondContact O-N 3.15Å; A188-C194 PolarHBondContact O-SG 3.48Å; A188-V198 HydrophobicContact CB-CG1 4.08Å; A188-Q202 HydrophobicContact CB-CB 4.18Å; A188-Q202 HydrophobicContact CB-CG 3.68Å
189	C	97.7	Very high	95.8	Very high	6 Å²	6	71 Å²	71	4%	0.041	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	3.5	-178	-59.9	0	0	0	0	113.8	Y185 E187 C194 C199 A239	Y185-C189 WeakPolarHBondContact O-CB 3.35Å; Y185-C189 PolarHBondContact O-N 2.98Å; Y185-C189 PolarHBondContact O-SG 3.43Å; E187-C189 VanDerWaalsContact C-N 3.25Å; E187-C189 PolarHBondContact O-N 3.06Å; C189-C194 VanDerWaalsContact C-SG 3.52Å; C189-C194 WeakPolarHBondContact CA-SG 3.46Å; C189-C199 HydrophobicContact CB-CB 3.94Å; C189-C199 WeakPolarHBondContact CB-SG 3.38Å; C189-C199 WeakPolarHBondContact SG-CA 3.49Å; C189-C199 WeakPolarHBondContact SG-CB 3.18Å; C189-C199 CovalentContact SG-SG 2.03Å; C189-C199 PolarHBondContact SG-SG 2.6Å; C189-A239 HydrophobicContact CB-CB 3.55Å
190	S	94	Very high	95.8	Very high	79 Å²	79	70.7 Å²	70.7	55%	0.552	37%	0.371	S	S	*	.			trans	-102.1	158.7	-175.8	-70.6	0	0	0	0	113.2	G186 E187	G186-S190 VanDerWaalsContact O-CB 3.25Å; G186-S190 WeakPolarHBondContact O-CB 3.35Å; G186-S190 PolarHBondContact O-N 3.36Å; G186-S190 PolarHBondContact O-OG 3.27Å; E187-S190 PolarHBondContact O-N 3.05Å
191	G	88.7	Confident	95.8	Very high	55 Å²	55	69.4 Å²	69.4	57%	0.567	37%	0.366	S	S	*	.	S	Bend	trans	88.4	165.9	173.6	0	0	0	0	0	114.7	H193	G191-H193 VanDerWaalsContact C-N 3.31Å; G191-H193 PolarHBondContact O-N 3.28Å
192	P	84.1	Confident	95.8	Very high	127 Å²	127	71.6 Å²	71.6	83%	0.825	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-24.3	-175.6	28.4	-34.9	0	0	0	113.4
193	H	88.9	Confident	95.8	Very high	176 Å²	176	68.1 Å²	68.1	82%	0.815	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	37.4	179.6	-58.9	-60.2	0	0	0	112.2	G191 Q195	G191-H193 VanDerWaalsContact C-N 3.31Å; G191-H193 PolarHBondContact O-N 3.28Å; H193-Q195 PolarHBondContact O-N 3.01Å
194	C	94.5	Very high	95.7	Very high	33 Å²	33	64 Å²	64	22%	0.223	35%	0.346	C	S	.	.			trans	-63.2	127.5	-179.2	-176.8	0	0	0	0	111.6	A188 C189 R196 C242	A188-C194 PolarHBondContact O-SG 3.48Å; C189-C194 VanDerWaalsContact C-SG 3.52Å; C189-C194 WeakPolarHBondContact CA-SG 3.46Å; C194-R196 PolarHBondContact O-N 2.99Å; C194-C242 HydrophobicContact CB-CB 3.7Å; C194-C242 WeakPolarHBondContact CB-SG 3.03Å; C194-C242 WeakPolarHBondContact SG-CB 3.43Å; C194-C242 CovalentContact SG-SG 2.01Å; C194-C242 PolarHBondContact SG-SG 3.13Å
195	Q	96	Very high	95.6	Very high	118 Å²	118	64.4 Å²	64.4	55%	0.551	35%	0.345	S	S	*	.			trans	-89.3	100.4	175.3	-64.6	-174.8	30.2	0	0	109.8	H193 H197 V198 C199	H193-Q195 PolarHBondContact O-N 3.01Å; Q195-H197 VanDerWaalsContact C-N 3.27Å; Q195-H197 PolarHBondContact O-N 3.25Å; Q195-H197 VanDerWaalsContact O-N 3.11Å; Q195-H197 PolarHBondContact OE1-CE1 3.41Å; Q195-V198 HydrophobicContact CB-CB 4.24Å; Q195-V198 HydrophobicContact CB-CG2 3.83Å; Q195-V198 PolarHBondContact O-N 2.99Å; Q195-C199 PolarHBondContact O-N 3.26Å; Q195-C199 VanDerWaalsContact O-N 3.07Å
196	R	95.8	Very high	95.6	Very high	89 Å²	89	63.8 Å²	63.8	34%	0.336	34%	0.343	S	S	.	.	H	α-helix	trans	-47.4	-44.6	-176.3	178.1	169.4	177.1	-105.5	-2.9	113.8	C194 V198 C199 L200 C242 A243	C194-R196 PolarHBondContact O-N 2.99Å; R196-V198 VanDerWaalsContact C-N 3.33Å; R196-V198 PolarHBondContact O-N 3.18Å; R196-C199 WeakPolarHBondContact O-CB 3.37Å; R196-C199 PolarHBondContact O-N 2.85Å; R196-L200 HydrophobicContact CG-CD1 3.9Å; R196-L200 HydrophobicContact CG-CG 4.19Å; R196-L200 WeakPolarHBondContact O-CB 3.5Å; R196-L200 VanDerWaalsContact O-CG 3.28Å; R196-L200 WeakPolarHBondContact O-CG 3.32Å; R196-L200 PolarHBondContact O-N 3.3Å; R196-C242 WeakPolarHBondContact CD-O 3.29Å; R196-C242 VanDerWaalsContact CG-O 3.25Å; R196-C242 WeakPolarHBondContact CG-O 3.07Å; R196-A243 PolarHBondContact NE-O 2.78Å
197	H	95.8	Very high	95.6	Very high	108 Å²	108	63.3 Å²	63.3	50%	0.5	33%	0.333	S	S	.	.	H	α-helix	trans	-65.5	-33.2	-178.8	72.6	-86.6	0	0	0	113.4	Q195 R201	Q195-H197 VanDerWaalsContact C-N 3.27Å; Q195-H197 PolarHBondContact O-N 3.25Å; Q195-H197 VanDerWaalsContact O-N 3.11Å; Q195-H197 PolarHBondContact OE1-CE1 3.41Å; H197-R201 WeakPolarHBondContact O-CB 3.37Å; H197-R201 PolarHBondContact O-N 2.85Å
198	V	97.7	Very high	95.3	Very high	47 Å²	47	58 Å²	58	29%	0.285	31%	0.309	S	S	.	.	H	α-helix	trans	-72.3	-44.7	174.9	-173.9	0	0	0	0	110	A188 Q195 R196 L200 R201 Q202	A188-V198 HydrophobicContact CB-CG1 4.08Å; Q195-V198 HydrophobicContact CB-CB 4.24Å; Q195-V198 HydrophobicContact CB-CG2 3.83Å; Q195-V198 PolarHBondContact O-N 2.99Å; R196-V198 VanDerWaalsContact C-N 3.33Å; R196-V198 PolarHBondContact O-N 3.18Å; V198-L200 PolarHBondContact O-N 2.81Å; V198-R201 PolarHBondContact O-N 3.45Å; V198-Q202 PolarHBondContact O-N 3.42Å
199	C	98.4	Very high	95.1	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-55.6	-51.6	175	171.5	0	0	0	0	111.6	C189 Q195 R196 R201 Q202 L203	C189-C199 HydrophobicContact CB-CB 3.94Å; C189-C199 WeakPolarHBondContact CB-SG 3.38Å; C189-C199 WeakPolarHBondContact SG-CA 3.49Å; C189-C199 WeakPolarHBondContact SG-CB 3.18Å; C189-C199 CovalentContact SG-SG 2.03Å; C189-C199 PolarHBondContact SG-SG 2.6Å; Q195-C199 PolarHBondContact O-N 3.26Å; Q195-C199 VanDerWaalsContact O-N 3.07Å; R196-C199 WeakPolarHBondContact O-CB 3.37Å; R196-C199 PolarHBondContact O-N 2.85Å; C199-R201 VanDerWaalsContact C-N 3.34Å; C199-R201 PolarHBondContact O-N 3.29Å; C199-Q202 PolarHBondContact O-N 3.24Å; C199-Q202 VanDerWaalsContact O-N 3.16Å; C199-L203 WeakPolarHBondContact O-CG 3.38Å; C199-L203 PolarHBondContact O-N 2.96Å
200	L	98.3	Very high	95	Very high	18 Å²	18	62.3 Å²	62.3	9%	0.094	32%	0.323	C	S	.	.	H	α-helix	trans	-58.9	-41.6	178.1	-71.4	177.6	0	0	0	112.5	R196 V198 Q202 L203 L204 A243 G300	R196-L200 HydrophobicContact CG-CD1 3.9Å; R196-L200 HydrophobicContact CG-CG 4.19Å; R196-L200 WeakPolarHBondContact O-CB 3.5Å; R196-L200 VanDerWaalsContact O-CG 3.28Å; R196-L200 WeakPolarHBondContact O-CG 3.32Å; R196-L200 PolarHBondContact O-N 3.3Å; V198-L200 PolarHBondContact O-N 2.81Å; L200-Q202 PolarHBondContact O-N 3.44Å; L200-L203 HydrophobicContact CD2-CD1 4.48Å; L200-L203 PolarHBondContact O-N 3.35Å; L200-L204 WeakPolarHBondContact O-CG 3.21Å; L200-L204 PolarHBondContact O-N 3.3Å; L200-A243 HydrophobicContact CD2-CB 4.16Å; L200-G300 WeakPolarHBondContact CB-O 3.4Å; L200-G300 WeakPolarHBondContact O-CA 3.48Å
201	R	97.4	Very high	94.9	Very high	160 Å²	160	60.7 Å²	60.7	60%	0.604	31%	0.314	S	S	*	.	H	α-helix	trans	-63.8	-38.6	176.4	-175	176	-70.6	144.2	-1.6	112.7	H197 V198 C199 T205	H197-R201 WeakPolarHBondContact O-CB 3.37Å; H197-R201 PolarHBondContact O-N 2.85Å; V198-R201 PolarHBondContact O-N 3.45Å; C199-R201 VanDerWaalsContact C-N 3.34Å; C199-R201 PolarHBondContact O-N 3.29Å; R201-T205 WeakPolarHBondContact O-CB 3.38Å; R201-T205 PolarHBondContact O-N 2.91Å; R201-T205 PolarHBondContact O-OG1 3.33Å
202	Q	98.3	Very high	95.1	Very high	60 Å²	60	61.4 Å²	61.4	28%	0.28	30%	0.303	S	S	.	.	H	α-helix	trans	-71.9	-36.7	175.7	-67.4	-63.9	-10.9	0	0	112.1	A188 V198 C199 L200 T205 F206	A188-Q202 HydrophobicContact CB-CB 4.18Å; A188-Q202 HydrophobicContact CB-CG 3.68Å; V198-Q202 PolarHBondContact O-N 3.42Å; C199-Q202 PolarHBondContact O-N 3.24Å; C199-Q202 VanDerWaalsContact O-N 3.16Å; L200-Q202 PolarHBondContact O-N 3.44Å; Q202-T205 WeakPolarHBondContact O-CB 3.19Å; Q202-T205 PolarHBondContact O-N 2.91Å; Q202-F206 PolarHBondContact O-N 3.29Å
203	L	98.6	Very high	95.5	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.1	-47.7	172	-75.1	168.9	0	0	0	111.6	Y185 C199 L200 T205 F206 F207 I238 A243 I299	Y185-L203 HydrophobicContact CD2-CD2 3.65Å; Y185-L203 HydrophobicContact CD2-CG 4.45Å; Y185-L203 HydrophobicContact CE2-CD2 4.03Å; Y185-L203 HydrophobicContact CG-CD2 3.95Å; C199-L203 WeakPolarHBondContact O-CG 3.38Å; C199-L203 PolarHBondContact O-N 2.96Å; L200-L203 HydrophobicContact CD2-CD1 4.48Å; L200-L203 PolarHBondContact O-N 3.35Å; L203-T205 VanDerWaalsContact C-N 3.26Å; L203-T205 PolarHBondContact O-N 3.14Å; L203-F206 PolarHBondContact O-N 3.41Å; L203-F206 VanDerWaalsContact O-N 3.14Å; L203-F207 HydrophobicContact CD2-CE2 4.25Å; L203-F207 WeakPolarHBondContact O-CD2 3.49Å; L203-F207 PolarHBondContact O-N 2.83Å; L203-I238 HydrophobicContact CD1-CB 4.48Å; L203-I238 HydrophobicContact CD2-CB 4.29Å; L203-I238 HydrophobicContact CD2-CG2 4.46Å; L203-A243 HydrophobicContact CD1-CB 3.84Å; L203-I299 HydrophobicContact CB-CG2 4.46Å
204	L	96.6	Very high	95.8	Very high	29 Å²	29	48.4 Å²	48.4	15%	0.152	23%	0.233	C	C	.	.	H	α-helix	trans	-53.4	-47.5	172.6	-77.8	169.8	0	0	0	110.7	L200 F206 E208 L263 I299 G300 T301	L200-L204 WeakPolarHBondContact O-CG 3.21Å; L200-L204 PolarHBondContact O-N 3.3Å; L204-F206 VanDerWaalsContact C-N 3.34Å; L204-F206 PolarHBondContact O-N 3.14Å; L204-E208 WeakPolarHBondContact O-CB 3.25Å; L204-E208 PolarHBondContact O-N 3.14Å; L204-L263 HydrophobicContact CD1-CD2 4.11Å; L204-L263 HydrophobicContact CD2-CD2 4.43Å; L204-I299 WeakPolarHBondContact CD2-O 3.47Å; L204-G300 VanDerWaalsContact CD1-O 3.3Å; L204-G300 WeakPolarHBondContact CD1-O 3.41Å; L204-G300 WeakPolarHBondContact CG-O 3.31Å; L204-T301 HydrophobicContact CD2-CG2 3.89Å
205	T	96.4	Very high	95.9	Very high	37 Å²	37	47 Å²	47	23%	0.227	22%	0.223	C	C	.	.	H	α-helix	trans	-61.8	-40.4	179.8	-58.9	0	0	0	0	112.1	L181 R201 Q202 L203 K209	L181-T205 HydrophobicContact CD2-CG2 4.12Å; R201-T205 WeakPolarHBondContact O-CB 3.38Å; R201-T205 PolarHBondContact O-N 2.91Å; R201-T205 PolarHBondContact O-OG1 3.33Å; Q202-T205 WeakPolarHBondContact O-CB 3.19Å; Q202-T205 PolarHBondContact O-N 2.91Å; L203-T205 VanDerWaalsContact C-N 3.26Å; L203-T205 PolarHBondContact O-N 3.14Å; T205-K209 HydrophobicContact CG2-CD 3.85Å; T205-K209 HydrophobicContact CG2-CG 4.44Å; T205-K209 VanDerWaalsContact O-CB 3.29Å; T205-K209 WeakPolarHBondContact O-CB 3.46Å; T205-K209 WeakPolarHBondContact O-CG 3.45Å; T205-K209 PolarHBondContact O-N 3.39Å
206	F	98.3	Very high	95.9	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.9	-58.2	176.8	175.3	-92.2	0	0	0	111.5	L181 R182 Y185 Q202 L203 L204 E208 K209 A210 A215 L218	L181-F206 HydrophobicContact CB-CD2 3.64Å; L181-F206 HydrophobicContact CB-CE2 4.34Å; R182-F206 HydrophobicContact CB-CD2 4.43Å; R182-F206 HydrophobicContact CB-CE2 4.01Å; Y185-F206 HydrophobicContact CD1-CB 3.79Å; Y185-F206 HydrophobicContact CD1-CD1 4.47Å; Y185-F206 AromaticContact CD1-CD2 3.78Å; Y185-F206 HydrophobicContact CD1-CD2 3.78Å; Y185-F206 AromaticContact CD1-CG 3.75Å; Y185-F206 HydrophobicContact CD1-CG 3.75Å; Y185-F206 HydrophobicContact CE1-CB 4.28Å; Y185-F206 HydrophobicContact CE1-CD1 4.11Å; Y185-F206 AromaticContact CE1-CD2 3.62Å; Y185-F206 HydrophobicContact CE1-CD2 3.62Å; Y185-F206 HydrophobicContact CE1-CE1 4.42Å; Y185-F206 AromaticContact CE1-CE2 3.97Å; Y185-F206 HydrophobicContact CE1-CE2 3.97Å; Y185-F206 AromaticContact CE1-CG 3.73Å; Y185-F206 HydrophobicContact CE1-CG 3.73Å; Y185-F206 HydrophobicContact CE1-CZ 4.37Å; Q202-F206 PolarHBondContact O-N 3.29Å; L203-F206 PolarHBondContact O-N 3.41Å; L203-F206 VanDerWaalsContact O-N 3.14Å; L204-F206 VanDerWaalsContact C-N 3.34Å; L204-F206 PolarHBondContact O-N 3.14Å; F206-E208 PolarHBondContact O-N 2.87Å; F206-K209 PolarHBondContact O-N 3.33Å; F206-A210 HydrophobicContact CE2-CB 4.29Å; F206-A210 HydrophobicContact CZ-CB 4.31Å; F206-A210 WeakPolarHBondContact O-CB 3.11Å; F206-A210 PolarHBondContact O-N 3.23Å; F206-A215 HydrophobicContact CE1-CB 4.35Å; F206-L218 HydrophobicContact CE1-CD2 3.93Å; F206-L218 HydrophobicContact CE2-CD2 4.34Å; F206-L218 HydrophobicContact CZ-CD2 3.49Å; F206-L218 VanDerWaalsContact CZ-CD2 3.49Å
207	F	96.6	Very high	95.9	Very high	16 Å²	16	37.1 Å²	37.1	7%	0.07	18%	0.181	C	C	.	.	H	α-helix	trans	-67.6	-23.4	-176.2	-74.7	-74.9	0	0	0	112.8	L203 A215 L219 I238 L296 I299	L203-F207 HydrophobicContact CD2-CE2 4.25Å; L203-F207 WeakPolarHBondContact O-CD2 3.49Å; L203-F207 PolarHBondContact O-N 2.83Å; F207-A215 HydrophobicContact CD1-CB 4.03Å; F207-A215 HydrophobicContact CE1-CB 4.34Å; F207-L219 HydrophobicContact CE1-CB 4.19Å; F207-L219 HydrophobicContact CE1-CD2 4.2Å; F207-L219 HydrophobicContact CZ-CB 4.43Å; F207-L219 HydrophobicContact CZ-CD1 4.3Å; F207-L219 HydrophobicContact CZ-CD2 4.46Å; F207-I238 HydrophobicContact CE2-CG2 4.23Å; F207-I238 HydrophobicContact CZ-CG2 4.32Å; F207-L296 HydrophobicContact CD1-CB 4.39Å; F207-L296 HydrophobicContact CD1-CD2 4.03Å; F207-L296 HydrophobicContact CD1-CG 4.14Å; F207-L296 HydrophobicContact CE1-CD2 4.28Å; F207-L296 HydrophobicContact CE1-CG 4.33Å; F207-I299 HydrophobicContact CD1-CD1 4.35Å; F207-I299 HydrophobicContact CD2-CB 3.83Å; F207-I299 HydrophobicContact CD2-CD1 4.31Å; F207-I299 HydrophobicContact CD2-CG2 3.59Å; F207-I299 HydrophobicContact CE1-CD1 4Å; F207-I299 HydrophobicContact CE2-CB 4Å; F207-I299 HydrophobicContact CE2-CD1 3.98Å; F207-I299 HydrophobicContact CE2-CG2 3.39Å; F207-I299 HydrophobicContact CG-CB 4.4Å; F207-I299 HydrophobicContact CZ-CD1 3.8Å; F207-I299 HydrophobicContact CZ-CG2 4.25Å
208	E	91.9	Very high	96	Very high	39 Å²	39	32.3 Å²	32.3	18%	0.182	16%	0.159	C	C	.	.	H	α-helix	trans	-79.8	-43.9	173.4	-172.1	167.3	152.3	0	0	113	R109 Q113 L204 F206 R267	R109-E208 WeakPolarHBondContact CA-OE1 3.44Å; R109-E208 WeakPolarHBondContact CD-O 3.35Å; R109-E208 HydrophobicContact CG-CG 3.72Å; R109-E208 PolarHBondContact NE-O 2.94Å; R109-E208 PolarHBondContact NH2-O 3.01Å; Q113-E208 PolarHBondContact OE1-OE1 3Å; L204-E208 WeakPolarHBondContact O-CB 3.25Å; L204-E208 PolarHBondContact O-N 3.14Å; F206-E208 PolarHBondContact O-N 2.87Å; E208-R267 IonicContact OE2-NH2 2.76Å; E208-R267 PolarHBondContact OE2-NH2 2.03Å
209	K	93.4	Very high	96	Very high	116 Å²	116	30.2 Å²	30.2	50%	0.504	15%	0.146	S	C	.	.	H	α-helix	trans	-97.1	-21.7	-170.5	-64.2	-174.7	-178.7	175.3	0	114.7	K177 L181 T205 F206	K177-K209 WeakPolarHBondContact CE-O 3.45Å; K177-K209 PolarHBondContact NZ-O 3.02Å; L181-K209 HydrophobicContact CD1-CB 3.86Å; L181-K209 HydrophobicContact CD2-CB 4.3Å; T205-K209 HydrophobicContact CG2-CD 3.85Å; T205-K209 HydrophobicContact CG2-CG 4.44Å; T205-K209 VanDerWaalsContact O-CB 3.29Å; T205-K209 WeakPolarHBondContact O-CB 3.46Å; T205-K209 WeakPolarHBondContact O-CG 3.45Å; T205-K209 PolarHBondContact O-N 3.39Å; F206-K209 PolarHBondContact O-N 3.33Å
210	A	94.4	Very high	96	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.008	15%	0.146	C	C	.	.	S	Bend	trans	-65.4	151.7	175.5	0	0	0	0	0	110.8	R109 L181 F206 A215	R109-A210 PolarHBondContact NH2-O 3.48Å; L181-A210 HydrophobicContact CD1-CB 4.2Å; F206-A210 HydrophobicContact CE2-CB 4.29Å; F206-A210 HydrophobicContact CZ-CB 4.31Å; F206-A210 WeakPolarHBondContact O-CB 3.11Å; F206-A210 PolarHBondContact O-N 3.23Å; A210-A215 HydrophobicContact CB-CB 4.29Å
211	A	93.1	Very high	95.9	Very high	46 Å²	46	29.4 Å²	29.4	38%	0.38	14%	0.142	S	C	.	.			trans	-66.9	137.1	171.4	0	0	0	0	0	109.2	P213 H214 A215	A211-P213 VanDerWaalsContact C-CD 3.46Å; A211-P213 VanDerWaalsContact C-N 3.32Å; A211-H214 PolarHBondContact O-N 3.38Å; A211-A215 PolarHBondContact O-N 2.91Å; A211-A215 VanDerWaalsContact O-N 3.14Å
212	E	92.1	Very high	95.9	Very high	70 Å²	70	22.3 Å²	22.3	33%	0.327	12%	0.117	S	C	.	.	H	α-helix	trans	-51.6	-41.9	-175	178.6	176.7	175.6	0	0	113.6	H214 A215 Q216 R293	E212-H214 VanDerWaalsContact C-N 3.34Å; E212-H214 PolarHBondContact O-N 3.35Å; E212-A215 PolarHBondContact O-N 3.5Å; E212-Q216 HydrophobicContact CG-CG 4.11Å; E212-Q216 WeakPolarHBondContact O-CB 3.48Å; E212-Q216 WeakPolarHBondContact O-CG 3.17Å; E212-Q216 PolarHBondContact O-N 2.99Å; E212-Q216 PolarHBondContact OE1-NE2 3.28Å; E212-R293 WeakPolarHBondContact OE1-CG 3.33Å; E212-R293 IonicContact OE1-NE 3.03Å
213	P	93.4	Very high	95.7	Very high	14 Å²	14	21.2 Å²	21.2	9%	0.091	12%	0.115	C	C	.	.	H	α-helix	trans	-56.3	-42.4	175.1	-29.8	38.3	0	0	0	114.8	W148 M150 A211 G217	W148-P213 HydrophobicContact CD2-CB 4.02Å; W148-P213 HydrophobicContact CD2-CG 4.19Å; W148-P213 HydrophobicContact CG-CB 4.31Å; W148-P213 HydrophobicContact CG-CG 4.01Å; W148-P213 HydrophobicContact CH2-CB 4.44Å; W148-P213 HydrophobicContact CZ2-CB 3.75Å; M150-P213 HydrophobicContact CB-CB 4.26Å; M150-P213 HydrophobicContact SD-CB 3.74Å; A211-P213 VanDerWaalsContact C-CD 3.46Å; A211-P213 VanDerWaalsContact C-N 3.32Å; P213-G217 PolarHBondContact O-N 2.95Å
214	H	95.1	Very high	95.3	Very high	15 Å²	15	23.5 Å²	23.5	7%	0.069	13%	0.134	C	C	.	.	H	α-helix	trans	-73.3	-41.4	-178.9	-61.7	91.2	0	0	0	111.4	C178 A211 E212 L218	C178-H214 HydrophobicContact CB-CB 4.39Å; C178-H214 VanDerWaalsContact SG-CB 3.57Å; A211-H214 PolarHBondContact O-N 3.38Å; E212-H214 VanDerWaalsContact C-N 3.34Å; E212-H214 PolarHBondContact O-N 3.35Å; H214-L218 VanDerWaalsContact O-CB 3.23Å; H214-L218 WeakPolarHBondContact O-CB 3.3Å; H214-L218 PolarHBondContact O-N 3.34Å
215	A	96.4	Very high	94.6	Very high	3 Å²	3	27.2 Å²	27.2	3%	0.025	16%	0.16	C	C	.	.	H	α-helix	trans	-66.8	-45.9	179.1	0	0	0	0	0	112	F206 F207 A210 A211 E212 L219 L296	F206-A215 HydrophobicContact CE1-CB 4.35Å; F207-A215 HydrophobicContact CD1-CB 4.03Å; F207-A215 HydrophobicContact CE1-CB 4.34Å; A210-A215 HydrophobicContact CB-CB 4.29Å; A211-A215 PolarHBondContact O-N 2.91Å; A211-A215 VanDerWaalsContact O-N 3.14Å; E212-A215 PolarHBondContact O-N 3.5Å; A215-L219 WeakPolarHBondContact O-CB 3.2Å; A215-L219 PolarHBondContact O-N 3.39Å; A215-L296 HydrophobicContact CB-CD2 4.19Å
216	Q	96.6	Very high	94.3	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-65.1	-44.3	175.7	-74.5	-179.7	-1.2	0	0	111.4	E212 L218 L219 L220 L296 H355	E212-Q216 HydrophobicContact CG-CG 4.11Å; E212-Q216 WeakPolarHBondContact O-CB 3.48Å; E212-Q216 WeakPolarHBondContact O-CG 3.17Å; E212-Q216 PolarHBondContact O-N 2.99Å; E212-Q216 PolarHBondContact OE1-NE2 3.28Å; Q216-L218 PolarHBondContact O-N 3.12Å; Q216-L219 PolarHBondContact O-N 2.78Å; Q216-L220 WeakPolarHBondContact O-CA 3.27Å; Q216-L220 VanDerWaalsContact O-CB 3.3Å; Q216-L220 WeakPolarHBondContact O-CB 3.37Å; Q216-L220 PolarHBondContact O-N 3.2Å; Q216-L296 HydrophobicContact CG-CD2 3.77Å; Q216-H355 PolarHBondContact O-CE1 3.45Å
217	G	95.6	Very high	94.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.9	-43.5	178.3	0	0	0	0	0	112.9	F168 P213 C221	F168-G217 WeakPolarHBondContact CB-O 3.36Å; F168-G217 WeakPolarHBondContact CD2-O 3.27Å; F168-G217 VanDerWaalsContact CG-O 3.25Å; F168-G217 WeakPolarHBondContact CG-O 3.46Å; P213-G217 PolarHBondContact O-N 2.95Å; G217-C221 WeakPolarHBondContact O-CB 3.32Å
218	L	96.9	Very high	93.9	Very high	7 Å²	7	42.1 Å²	42.1	4%	0.037	23%	0.227	C	C	.	.	H	α-helix	trans	-66.4	-38	-179.6	-173.9	67.9	0	0	0	112.9	A169 F206 H214 Q216 T237	A169-L218 HydrophobicContact CB-CD1 3.81Å; F206-L218 HydrophobicContact CE1-CD2 3.93Å; F206-L218 HydrophobicContact CE2-CD2 4.34Å; F206-L218 HydrophobicContact CZ-CD2 3.49Å; F206-L218 VanDerWaalsContact CZ-CD2 3.49Å; H214-L218 VanDerWaalsContact O-CB 3.23Å; H214-L218 WeakPolarHBondContact O-CB 3.3Å; H214-L218 PolarHBondContact O-N 3.34Å; Q216-L218 PolarHBondContact O-N 3.12Å; L218-T237 HydrophobicContact CD2-CG2 4.22Å; L218-T237 HydrophobicContact CG-CG2 3.85Å; L218-T237 PolarHBondContact O-OG1 3.25Å
219	L	98.3	Very high	94.1	Very high	3 Å²	3	42.2 Å²	42.2	2%	0.016	24%	0.238	C	C	.	.	H	α-helix	trans	-89.8	-44.7	-176.7	-175.2	75.1	0	0	0	113.1	F207 A215 Q216 C221 R234 T237 I238 Y295 L296 I299 F307	F207-L219 HydrophobicContact CE1-CB 4.19Å; F207-L219 HydrophobicContact CE1-CD2 4.2Å; F207-L219 HydrophobicContact CZ-CB 4.43Å; F207-L219 HydrophobicContact CZ-CD1 4.3Å; F207-L219 HydrophobicContact CZ-CD2 4.46Å; A215-L219 WeakPolarHBondContact O-CB 3.2Å; A215-L219 PolarHBondContact O-N 3.39Å; Q216-L219 PolarHBondContact O-N 2.78Å; L219-C221 PolarHBondContact O-N 2.96Å; L219-R234 WeakPolarHBondContact O-CG 3.48Å; L219-T237 HydrophobicContact CD1-CG2 4.22Å; L219-I238 HydrophobicContact CD1-CG2 3.93Å; L219-Y295 HydrophobicContact CD2-CE1 4.22Å; L219-L296 HydrophobicContact CD2-CD1 3.77Å; L219-L296 HydrophobicContact CD2-CG 3.82Å; L219-I299 HydrophobicContact CD1-CD1 4.06Å; L219-I299 HydrophobicContact CD2-CD1 3.25Å; L219-I299 HydrophobicContact CG-CD1 4.28Å; L219-F307 WeakPolarHBondContact O-CE2 3.47Å
220	L	97.8	Very high	94.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.214	C	C	.	.	S	Bend	trans	-103.4	44.1	-171.6	-52.5	178.2	0	0	0	110.9	Q216 L292 Y295 L296 F307 I348 K351 M352 H355	Q216-L220 WeakPolarHBondContact O-CA 3.27Å; Q216-L220 VanDerWaalsContact O-CB 3.3Å; Q216-L220 WeakPolarHBondContact O-CB 3.37Å; Q216-L220 PolarHBondContact O-N 3.2Å; L220-L292 HydrophobicContact CD1-CD1 4.43Å; L220-L292 HydrophobicContact CD1-CD2 3.87Å; L220-Y295 HydrophobicContact CD2-CE1 4.17Å; L220-L296 HydrophobicContact CD1-CD1 3.98Å; L220-L296 HydrophobicContact CG-CD1 4.39Å; L220-F307 HydrophobicContact CD2-CZ 4.19Å; L220-I348 HydrophobicContact CD2-CG1 4.39Å; L220-I348 HydrophobicContact CD2-CG2 4.49Å; L220-K351 HydrophobicContact CB-CG 4.33Å; L220-K351 HydrophobicContact CD1-CG 4.06Å; L220-M352 WeakPolarHBondContact O-CG 3.3Å; L220-H355 PolarHBondContact O-ND1 3.11Å
221	C	96.9	Very high	94.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.214	C	C	.	.			trans	-77.4	136.2	176.9	50.5	0	0	0	0	111.4	C165 F168 G217 L219 R234 M352	C165-C221 VanDerWaalsContact CA-SG 3.52Å; C165-C221 HydrophobicContact CB-CB 3.75Å; C165-C221 WeakPolarHBondContact CB-SG 3.48Å; C165-C221 WeakPolarHBondContact SG-CB 3.13Å; C165-C221 CovalentContact SG-SG 2.01Å; C165-C221 PolarHBondContact SG-SG 3.34Å; F168-C221 HydrophobicContact CD2-CB 3.83Å; F168-C221 HydrophobicContact CE2-CB 4.41Å; G217-C221 WeakPolarHBondContact O-CB 3.32Å; L219-C221 PolarHBondContact O-N 2.96Å; C221-R234 VanDerWaalsContact O-CD 3.28Å; C221-R234 WeakPolarHBondContact O-CD 3.34Å; C221-R234 PolarHBondContact O-NH1 3.3Å; C221-R234 VanDerWaalsContact O-NH1 3.14Å; C221-M352 WeakPolarHBondContact O-CE 3.45Å
222	P	96.3	Very high	94.6	Very high	12 Å²	12	38.9 Å²	38.9	8%	0.078	22%	0.216	C	C	.	.			trans	-71.9	150.5	174.6	29.9	-34.8	0	0	0	111.1	L164 C230 M352 H355 S356	L164-P222 HydrophobicContact CB-CG 4.2Å; L164-P222 HydrophobicContact CD1-CB 4.41Å; L164-P222 HydrophobicContact CD1-CG 3.57Å; P222-C230 PolarHBondContact O-SG 2.81Å; P222-M352 HydrophobicContact CB-CB 4.12Å; P222-M352 HydrophobicContact CB-CG 4.42Å; P222-H355 HydrophobicContact CG-CB 4.14Å; P222-S356 WeakPolarHBondContact CB-OG 3.49Å; P222-S356 WeakPolarHBondContact CG-OG 3.22Å
223	C	95.3	Very high	94.9	Very high	36 Å²	36	40.4 Å²	40.4	24%	0.243	22%	0.219	C	C	.	.			trans	-138.6	149.6	173.7	-62	0	0	0	0	109.2	C165 C230 G231	C165-C223 PolarHBondContact SG-SG 2.8Å; C223-C230 WeakPolarHBondContact CA-SG 3.23Å; C223-C230 HydrophobicContact CB-CB 3.65Å; C223-C230 WeakPolarHBondContact CB-SG 3.47Å; C223-C230 WeakPolarHBondContact SG-CB 3.36Å; C223-C230 PolarHBondContact SG-O 2.99Å; C223-C230 CovalentContact SG-SG 2.04Å; C223-C230 PolarHBondContact SG-SG 3.45Å; C223-G231 PolarHBondContact SG-N 3.12Å; C223-G231 VanDerWaalsContact SG-N 3.39Å
224	A	88.9	Confident	95.1	Very high	49 Å²	49	40 Å²	40	41%	0.405	22%	0.215	S	C	.	.			trans	-70.6	146.9	168.8	0	0	0	0	0	109.9	N226 D227	A224-N226 VanDerWaalsContact CB-OD1 3.23Å; A224-N226 WeakPolarHBondContact CB-OD1 3.32Å; A224-N226 PolarHBondContact O-N 2.91Å; A224-N226 VanDerWaalsContact O-N 3.16Å; A224-D227 HydrophobicContact CB-CB 4.1Å; A224-D227 PolarHBondContact O-N 3.2Å
225	P	82.9	Confident	95.2	Very high	107 Å²	107	43.1 Å²	43.1	70%	0.695	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-27.9	-177.6	-24.5	33.7	0	0	0	114.5
226	N	89.9	Confident	95.3	Very high	141 Å²	141	46.1 Å²	46.1	75%	0.754	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-13.3	176.9	59.2	-15.6	0	0	0	113.4	A224 R228	A224-N226 VanDerWaalsContact CB-OD1 3.23Å; A224-N226 WeakPolarHBondContact CB-OD1 3.32Å; A224-N226 PolarHBondContact O-N 2.91Å; A224-N226 VanDerWaalsContact O-N 3.16Å; N226-R228 PolarHBondContact O-N 2.99Å; N226-R228 VanDerWaalsContact O-N 3.13Å
227	D	93.2	Very high	95.3	Very high	57 Å²	57	46.9 Å²	46.9	31%	0.305	25%	0.247	S	C	.	.			trans	-87.9	78.7	179.1	-172.5	-6.7	0	0	0	110.9	A224 G229 C230 G231	A224-D227 HydrophobicContact CB-CB 4.1Å; A224-D227 PolarHBondContact O-N 3.2Å; D227-G229 PolarHBondContact O-N 3.45Å; D227-G229 PolarHBondContact OD1-N 2.98Å; D227-C230 HydrophobicContact CB-CB 4.13Å; D227-C230 PolarHBondContact O-N 3.13Å; D227-C230 PolarHBondContact OD1-N 2.58Å; D227-C230 VanDerWaalsContact OD2-CB 3.22Å; D227-C230 WeakPolarHBondContact OD2-CB 3.24Å; D227-G231 PolarHBondContact O-N 3.09Å
228	R	94.1	Very high	95.5	Very high	168 Å²	168	47 Å²	47	63%	0.634	25%	0.247	S	C	*	.	H	α-helix	trans	-61.9	-29.9	177.6	-67.7	-173.6	174	-174.5	-1.1	112.7	N226 G231 E232 V311	N226-R228 PolarHBondContact O-N 2.99Å; N226-R228 VanDerWaalsContact O-N 3.13Å; R228-G231 PolarHBondContact O-N 2.88Å; R228-E232 VanDerWaalsContact O-CB 3.26Å; R228-E232 WeakPolarHBondContact O-CB 3.33Å; R228-E232 PolarHBondContact O-N 3.44Å; R228-V311 HydrophobicContact CG-CG1 4.3Å
229	G	96.1	Very high	95.5	Very high	41 Å²	41	47.7 Å²	47.7	42%	0.423	25%	0.254	S	S	.	.	H	α-helix	trans	-67.2	-43.2	179.6	0	0	0	0	0	111.9	D227 E232 R233	D227-G229 PolarHBondContact O-N 3.45Å; D227-G229 PolarHBondContact OD1-N 2.98Å; G229-E232 PolarHBondContact O-N 3.02Å; G229-R233 WeakPolarHBondContact O-CB 3.36Å; G229-R233 PolarHBondContact O-N 3.47Å
230	C	96.9	Very high	95.4	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.007	26%	0.258	C	S	.	.	H	α-helix	trans	-61.3	-48.7	173	-179.6	0	0	0	0	111.8	D163 C165 P222 C223 D227 E232 R233 R234	D163-C230 HydrophobicContact CB-CB 3.79Å; C165-C230 PolarHBondContact SG-SG 2.98Å; P222-C230 PolarHBondContact O-SG 2.81Å; C223-C230 WeakPolarHBondContact CA-SG 3.23Å; C223-C230 HydrophobicContact CB-CB 3.65Å; C223-C230 WeakPolarHBondContact CB-SG 3.47Å; C223-C230 WeakPolarHBondContact SG-CB 3.36Å; C223-C230 PolarHBondContact SG-O 2.99Å; C223-C230 CovalentContact SG-SG 2.04Å; C223-C230 PolarHBondContact SG-SG 3.45Å; D227-C230 HydrophobicContact CB-CB 4.13Å; D227-C230 PolarHBondContact O-N 3.13Å; D227-C230 PolarHBondContact OD1-N 2.58Å; D227-C230 VanDerWaalsContact OD2-CB 3.22Å; D227-C230 WeakPolarHBondContact OD2-CB 3.24Å; C230-E232 VanDerWaalsContact C-N 3.33Å; C230-E232 PolarHBondContact O-N 3.06Å; C230-R233 WeakPolarHBondContact O-CB 3.3Å; C230-R233 PolarHBondContact O-N 2.84Å; C230-R234 PolarHBondContact O-N 3.4Å
231	G	97.3	Very high	95.3	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-66.1	-34.8	-179.5	0	0	0	0	0	113.2	C223 D227 R228 R234 R235 N310	C223-G231 PolarHBondContact SG-N 3.12Å; C223-G231 VanDerWaalsContact SG-N 3.39Å; D227-G231 PolarHBondContact O-N 3.09Å; R228-G231 PolarHBondContact O-N 2.88Å; G231-R234 PolarHBondContact O-N 3.44Å; G231-R235 WeakPolarHBondContact O-CB 3.42Å; G231-R235 PolarHBondContact O-N 3.12Å; G231-N310 WeakPolarHBondContact CA-O 3.49Å
232	E	97.2	Very high	95.3	Very high	92 Å²	92	54.3 Å²	54.3	43%	0.43	30%	0.301	S	S	.	.	H	α-helix	trans	-66.6	-42.8	172.5	-179.9	168.2	-158.8	0	0	111.8	R228 G229 C230 R234 R235 N236 N310	R228-E232 VanDerWaalsContact O-CB 3.26Å; R228-E232 WeakPolarHBondContact O-CB 3.33Å; R228-E232 PolarHBondContact O-N 3.44Å; G229-E232 PolarHBondContact O-N 3.02Å; C230-E232 VanDerWaalsContact C-N 3.33Å; C230-E232 PolarHBondContact O-N 3.06Å; E232-R234 VanDerWaalsContact C-N 3.3Å; E232-R234 PolarHBondContact O-N 3.36Å; E232-R235 PolarHBondContact O-N 2.98Å; E232-N236 VanDerWaalsContact CG-ND2 3.33Å; E232-N236 WeakPolarHBondContact CG-ND2 3.4Å; E232-N236 WeakPolarHBondContact O-CB 3.42Å; E232-N236 PolarHBondContact O-N 2.84Å; E232-N236 PolarHBondContact O-ND2 3.41Å; E232-N310 HydrophobicContact CB-CB 4.34Å
233	R	97.3	Very high	95.4	Very high	102 Å²	102	53.8 Å²	53.8	39%	0.385	30%	0.297	S	S	.	.	H	α-helix	trans	-56.7	-46.4	173	-177	-176.3	-62.2	-72.5	-0.5	110.8	D163 C165 G229 C230 N236 T237	D163-R233 IonicContact OD1-NE 2.91Å; D163-R233 IonicContact OD2-NE 3.34Å; D163-R233 PolarHBondContact OD2-NE 2.87Å; C165-R233 HydrophobicContact CB-CG 4.25Å; G229-R233 WeakPolarHBondContact O-CB 3.36Å; G229-R233 PolarHBondContact O-N 3.47Å; C230-R233 WeakPolarHBondContact O-CB 3.3Å; C230-R233 PolarHBondContact O-N 2.84Å; R233-N236 CarbonylContact O-C 3.6Å; R233-N236 PolarHBondContact O-N 3.17Å; R233-T237 PolarHBondContact O-N 3.22Å; R233-T237 VanDerWaalsContact O-N 3.1Å; R233-T237 PolarHBondContact O-OG1 3.37Å
234	R	97.9	Very high	95.5	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.015	29%	0.292	C	S	.	.	H	α-helix	trans	-59.2	-47.7	177	-174	175.4	68	-146.3	-3.3	112.3	L219 C221 C230 G231 E232 N236 T237 F307 N312	L219-R234 WeakPolarHBondContact O-CG 3.48Å; C221-R234 VanDerWaalsContact O-CD 3.28Å; C221-R234 WeakPolarHBondContact O-CD 3.34Å; C221-R234 PolarHBondContact O-NH1 3.3Å; C221-R234 VanDerWaalsContact O-NH1 3.14Å; C230-R234 PolarHBondContact O-N 3.4Å; G231-R234 PolarHBondContact O-N 3.44Å; E232-R234 VanDerWaalsContact C-N 3.3Å; E232-R234 PolarHBondContact O-N 3.36Å; R234-N236 VanDerWaalsContact C-N 3.28Å; R234-N236 PolarHBondContact O-N 2.81Å; R234-T237 WeakPolarHBondContact O-CB 3.48Å; R234-T237 PolarHBondContact O-N 3.17Å; R234-T237 PolarHBondContact O-OG1 2.88Å; R234-F307 HydrophobicContact CG-CD2 3.72Å; R234-F307 HydrophobicContact CG-CE2 3.46Å; R234-F307 VanDerWaalsContact CG-CE2 3.46Å; R234-F307 HydrophobicContact CG-CG 4.45Å; R234-F307 HydrophobicContact CG-CZ 4Å; R234-N312 PolarHBondContact NH2-O 3.1Å
235	R	97.5	Very high	95.6	Very high	82 Å²	82	52.2 Å²	52.2	31%	0.309	28%	0.281	S	S	.	.	H	α-helix	trans	-62.8	-35.3	178	-169.9	-177.4	75.1	89.6	3	112.4	G231 E232 N306 F307	G231-R235 WeakPolarHBondContact O-CB 3.42Å; G231-R235 PolarHBondContact O-N 3.12Å; E232-R235 PolarHBondContact O-N 2.98Å; R235-N306 PolarHBondContact O-ND2 2.88Å; R235-N306 PolarHBondContact O-OD1 3.47Å; R235-F307 HydrophobicContact CB-CB 4.48Å; R235-F307 HydrophobicContact CG-CB 4.44Å; R235-F307 WeakPolarHBondContact CG-O 3.48Å
236	N	97.5	Very high	96	Very high	66 Å²	66	53.6 Å²	53.6	35%	0.353	29%	0.29	S	S	.	.	H	α-helix	trans	-86.1	-2	-178.6	-71.9	-32.4	0	0	0	114	E232 R233 R234 I238 A239	E232-N236 VanDerWaalsContact CG-ND2 3.33Å; E232-N236 WeakPolarHBondContact CG-ND2 3.4Å; E232-N236 WeakPolarHBondContact O-CB 3.42Å; E232-N236 PolarHBondContact O-N 2.84Å; E232-N236 PolarHBondContact O-ND2 3.41Å; R233-N236 CarbonylContact O-C 3.6Å; R233-N236 PolarHBondContact O-N 3.17Å; R234-N236 VanDerWaalsContact C-N 3.28Å; R234-N236 PolarHBondContact O-N 2.81Å; N236-I238 PolarHBondContact O-N 3.23Å; N236-I238 VanDerWaalsContact O-N 3.13Å; N236-A239 PolarHBondContact O-N 3.27Å
237	T	98.4	Very high	96.2	Very high	17 Å²	17	52.5 Å²	52.5	10%	0.104	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-35.9	-179.4	-68.7	0	0	0	0	113.5	Y185 L218 L219 R233 R234	Y185-T237 WeakPolarHBondContact CE2-O 3.3Å; Y185-T237 PolarHBondContact OH-O 2.86Å; L218-T237 HydrophobicContact CD2-CG2 4.22Å; L218-T237 HydrophobicContact CG-CG2 3.85Å; L218-T237 PolarHBondContact O-OG1 3.25Å; L219-T237 HydrophobicContact CD1-CG2 4.22Å; R233-T237 PolarHBondContact O-N 3.22Å; R233-T237 VanDerWaalsContact O-N 3.1Å; R233-T237 PolarHBondContact O-OG1 3.37Å; R234-T237 WeakPolarHBondContact O-CB 3.48Å; R234-T237 PolarHBondContact O-N 3.17Å; R234-T237 PolarHBondContact O-OG1 2.88Å
238	I	98.2	Very high	96.3	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.005	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	13.1	-178.5	66	168.1	0	0	0	113.6	L203 F207 L219 N236 A243 I299 T304 N306	L203-I238 HydrophobicContact CD1-CB 4.48Å; L203-I238 HydrophobicContact CD2-CB 4.29Å; L203-I238 HydrophobicContact CD2-CG2 4.46Å; F207-I238 HydrophobicContact CE2-CG2 4.23Å; F207-I238 HydrophobicContact CZ-CG2 4.32Å; L219-I238 HydrophobicContact CD1-CG2 3.93Å; N236-I238 PolarHBondContact O-N 3.23Å; N236-I238 VanDerWaalsContact O-N 3.13Å; I238-A243 WeakPolarHBondContact O-CB 3.11Å; I238-I299 HydrophobicContact CG2-CG2 3.85Å; I238-T304 HydrophobicContact CD1-CG2 3.7Å; I238-N306 HydrophobicContact CD1-CB 3.94Å
239	A	97.6	Very high	96.4	Very high	22 Å²	22	45.9 Å²	45.9	18%	0.182	27%	0.273	C	S	.	.			trans	50.1	63	-177.4	0	0	0	0	0	113.2	C189 N236 S241 C242 A243	C189-A239 HydrophobicContact CB-CB 3.55Å; N236-A239 PolarHBondContact O-N 3.27Å; A239-S241 PolarHBondContact O-N 2.95Å; A239-S241 VanDerWaalsContact O-N 3.09Å; A239-C242 PolarHBondContact O-N 3.35Å; A239-A243 PolarHBondContact O-N 2.92Å
240	P	97.1	Very high	96.5	Very high	14 Å²	14	45.5 Å²	45.5	9%	0.091	26%	0.262	C	S	.	.	H	α-helix	trans	-60.5	-26.3	-170.7	24.2	-34.4	0	0	0	114	C242 L244	P240-C242 PolarHBondContact O-N 3.27Å; P240-L244 HydrophobicContact CB-CD1 3.65Å; P240-L244 HydrophobicContact CB-CG 4.04Å; P240-L244 WeakPolarHBondContact O-CB 3.27Å; P240-L244 PolarHBondContact O-N 2.94Å; P240-L244 VanDerWaalsContact O-N 3.1Å
241	S	95.3	Very high	96.5	Very high	117 Å²	117	45.4 Å²	45.4	82%	0.818	26%	0.261	S	S	*	.	H	α-helix	trans	-61.3	-23	176.2	52	0	0	0	0	114.1	A239	A239-S241 PolarHBondContact O-N 2.95Å; A239-S241 VanDerWaalsContact O-N 3.09Å
242	C	97.1	Very high	96.4	Very high	12 Å²	12	45.7 Å²	45.7	8%	0.081	26%	0.263	C	S	.	.	H	α-helix	trans	-113	-39.3	174	-178.1	0	0	0	0	112.9	C194 R196 A239 P240	C194-C242 HydrophobicContact CB-CB 3.7Å; C194-C242 WeakPolarHBondContact CB-SG 3.03Å; C194-C242 WeakPolarHBondContact SG-CB 3.43Å; C194-C242 CovalentContact SG-SG 2.01Å; C194-C242 PolarHBondContact SG-SG 3.13Å; R196-C242 WeakPolarHBondContact CD-O 3.29Å; R196-C242 VanDerWaalsContact CG-O 3.25Å; R196-C242 WeakPolarHBondContact CG-O 3.07Å; A239-C242 PolarHBondContact O-N 3.35Å; P240-C242 PolarHBondContact O-N 3.27Å
243	A	97.4	Very high	96.3	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-70.5	-36.9	-175.5	0	0	0	0	0	112.8	R196 L200 L203 I238 A239	R196-A243 PolarHBondContact NE-O 2.78Å; L200-A243 HydrophobicContact CD2-CB 4.16Å; L203-A243 HydrophobicContact CD1-CB 3.84Å; I238-A243 WeakPolarHBondContact O-CB 3.11Å; A239-A243 PolarHBondContact O-N 2.92Å
244	L	96.8	Very high	96.1	Very high	27 Å²	27	40.8 Å²	40.8	14%	0.141	24%	0.244	C	C	.	.	S	Bend	trans	-89.1	152.1	-179.4	-56.2	-179.5	0	0	0	111	P240 T304 N306	P240-L244 HydrophobicContact CB-CD1 3.65Å; P240-L244 HydrophobicContact CB-CG 4.04Å; P240-L244 WeakPolarHBondContact O-CB 3.27Å; P240-L244 PolarHBondContact O-N 2.94Å; P240-L244 VanDerWaalsContact O-N 3.1Å; L244-T304 HydrophobicContact CD2-CG2 4.13Å; L244-N306 HydrophobicContact CD1-CB 4.15Å
245	P	92.9	Very high	96	Very high	26 Å²	26	42.9 Å²	42.9	17%	0.169	25%	0.252	C	S	.	.			trans	-58.9	139.6	173	-21.3	33.7	0	0	0	111.3	V247	P245-V247 VanDerWaalsContact C-N 3.26Å; P245-V247 WeakPolarHBondContact CB-O 3.46Å; P245-V247 PolarHBondContact O-N 3.27Å
246	P	90	Very high	95.7	Very high	135 Å²	135	42.8 Å²	42.8	88%	0.877	25%	0.252	S	S	*	.	S	Bend	trans	-67.9	-28.9	177.2	27.3	-34.4	0	0	0	112.4
247	V	94.1	Very high	95.4	Very high	118 Å²	118	44.3 Å²	44.3	72%	0.715	26%	0.26	S	S	*	.	S	Bend	trans	-118.9	128	173.7	-179.3	0	0	0	0	107.5	P245 P249	P245-V247 VanDerWaalsContact C-N 3.26Å; P245-V247 WeakPolarHBondContact CB-O 3.46Å; P245-V247 PolarHBondContact O-N 3.27Å; V247-P249 VanDerWaalsContact O-CD 3.23Å; V247-P249 WeakPolarHBondContact O-CD 3.29Å
248	A	95.4	Very high	95.2	Very high	44 Å²	44	43.5 Å²	43.5	36%	0.364	26%	0.255	S	S	.	.			trans	-67.8	114	179.7	0	0	0	0	0	110.3	T320	A248-T320 HydrophobicContact CB-CG2 3.91Å
249	P	96.4	Very high	94.7	Very high	42 Å²	42	46.9 Å²	46.9	27%	0.273	27%	0.27	S	S	.	.			trans	-75.9	178.1	176.5	34.7	-36.7	0	0	0	111.3	V247 L254 S318 C319 T320	V247-P249 VanDerWaalsContact O-CD 3.23Å; V247-P249 WeakPolarHBondContact O-CD 3.29Å; P249-L254 HydrophobicContact CG-CD1 4.4Å; P249-S318 WeakPolarHBondContact CD-O 3.45Å; P249-C319 HydrophobicContact CG-CB 4.4Å; P249-C319 CarbonylContact O-C 3.53Å; P249-C319 VanDerWaalsContact O-CA 3.27Å; P249-C319 WeakPolarHBondContact O-CA 3.33Å; P249-C319 VanDerWaalsContact O-CB 3.28Å; P249-C319 WeakPolarHBondContact O-CB 3.33Å; P249-T320 PolarHBondContact O-N 3.4Å
250	N	97.4	Very high	94.3	Very high	33 Å²	33	50.3 Å²	50.3	18%	0.176	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-66	135.5	167.2	-173.5	-78.1	0	0	0	110.6	L252 E253 L254 T320 R322 S324	N250-L252 VanDerWaalsContact C-N 3.31Å; N250-L252 PolarHBondContact O-N 3.42Å; N250-L252 VanDerWaalsContact OD1-CB 3.3Å; N250-L252 WeakPolarHBondContact OD1-CB 3.34Å; N250-L252 PolarHBondContact OD1-N 2.96Å; N250-E253 HydrophobicContact CB-CB 4.25Å; N250-E253 WeakPolarHBondContact O-CB 3.45Å; N250-E253 PolarHBondContact O-N 3.28Å; N250-L254 PolarHBondContact O-N 3.3Å; N250-L254 VanDerWaalsContact O-N 3.07Å; N250-T320 VanDerWaalsContact CA-O 3.24Å; N250-T320 WeakPolarHBondContact CA-O 3.02Å; N250-R322 PolarHBondContact ND2-O 3.33Å; N250-S324 PolarHBondContact ND2-OG 3.1Å
251	C	97.4	Very high	93.9	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-64.8	-32.1	-177.4	-62.9	0	0	0	0	113.7	E253 L254 R255 C319 T320 L334 E335	C251-E253 VanDerWaalsContact C-N 3.32Å; C251-L254 PolarHBondContact O-N 2.95Å; C251-R255 PolarHBondContact O-N 2.92Å; C251-C319 WeakPolarHBondContact CA-SG 3.25Å; C251-C319 HydrophobicContact CB-CB 3.9Å; C251-C319 WeakPolarHBondContact CB-SG 3.42Å; C251-C319 VanDerWaalsContact SG-C 3.52Å; C251-C319 WeakPolarHBondContact SG-CB 3.34Å; C251-C319 CovalentContact SG-SG 2.02Å; C251-C319 PolarHBondContact SG-SG 3.38Å; C251-T320 PolarHBondContact N-O 3.18Å; C251-T320 VanDerWaalsContact N-O 3.13Å; C251-L334 HydrophobicContact CB-CD2 3.98Å; C251-E335 HydrophobicContact CB-CG 4.33Å; C251-E335 WeakPolarHBondContact SG-CG 3.44Å; C251-E335 PolarHBondContact SG-OE1 2.69Å
252	L	95.5	Very high	93.7	Very high	6 Å²	6	49.3 Å²	49.3	3%	0.031	28%	0.279	C	S	.	.	H	α-helix	trans	-68.5	-34.9	176.1	-58.9	178.3	0	0	0	111.4	N250 R255 R256 L327 E330 C331 L334	N250-L252 VanDerWaalsContact C-N 3.31Å; N250-L252 PolarHBondContact O-N 3.42Å; N250-L252 VanDerWaalsContact OD1-CB 3.3Å; N250-L252 WeakPolarHBondContact OD1-CB 3.34Å; N250-L252 PolarHBondContact OD1-N 2.96Å; L252-R255 WeakPolarHBondContact O-CB 3.49Å; L252-R255 PolarHBondContact O-N 2.97Å; L252-R256 WeakPolarHBondContact O-CG 3.27Å; L252-R256 PolarHBondContact O-N 3.5Å; L252-L327 HydrophobicContact CD1-CB 3.46Å; L252-L327 VanDerWaalsContact CD1-CB 3.46Å; L252-L327 HydrophobicContact CD1-CD1 4.01Å; L252-L327 HydrophobicContact CD1-CG 4.4Å; L252-E330 HydrophobicContact CD2-CG 4.36Å; L252-C331 HydrophobicContact CD1-CB 3.99Å; L252-C331 HydrophobicContact CD2-CB 4.08Å; L252-C331 HydrophobicContact CG-CB 3.81Å; L252-L334 HydrophobicContact CD2-CD2 4.29Å
253	E	94.3	Very high	93.5	Very high	81 Å²	81	50.1 Å²	50.1	38%	0.379	28%	0.282	S	S	.	.	H	α-helix	trans	-67.5	-40.4	173.7	-171.7	56.5	-153	0	0	111.3	N250 C251 R255 R256 L257	N250-E253 HydrophobicContact CB-CB 4.25Å; N250-E253 WeakPolarHBondContact O-CB 3.45Å; N250-E253 PolarHBondContact O-N 3.28Å; C251-E253 VanDerWaalsContact C-N 3.32Å; E253-R255 VanDerWaalsContact C-N 3.29Å; E253-R255 PolarHBondContact O-N 2.94Å; E253-R256 WeakPolarHBondContact O-CB 3.49Å; E253-R256 PolarHBondContact O-N 2.69Å; E253-R256 WeakPolarHBondContact OE2-CD 3.28Å; E253-R256 IonicContact OE2-NH1 2.81Å; E253-R256 PolarHBondContact OE2-NH1 3.45Å; E253-R256 VanDerWaalsContact OE2-NH1 3.09Å; E253-L257 PolarHBondContact O-N 3.23Å
254	L	94.4	Very high	93.3	Very high	9 Å²	9	50.2 Å²	50.2	5%	0.047	28%	0.282	C	S	.	.	H	α-helix	trans	-62.2	-38.3	173.8	-165.6	65	0	0	0	112	P249 N250 C251 L257 C258 A302 M303 C319	P249-L254 HydrophobicContact CG-CD1 4.4Å; N250-L254 PolarHBondContact O-N 3.3Å; N250-L254 VanDerWaalsContact O-N 3.07Å; C251-L254 PolarHBondContact O-N 2.95Å; L254-L257 PolarHBondContact O-N 3.32Å; L254-C258 PolarHBondContact O-N 3.44Å; L254-A302 HydrophobicContact CD1-CB 4.42Å; L254-A302 WeakPolarHBondContact CD1-O 3.44Å; L254-M303 HydrophobicContact CD2-CG 4.14Å; L254-M303 HydrophobicContact CG-CG 3.87Å; L254-C319 HydrophobicContact CD2-CB 4.21Å
255	R	94.4	Very high	93.2	Very high	48 Å²	48	50.1 Å²	50.1	18%	0.181	28%	0.28	C	S	.	.	H	α-helix	trans	-64.5	-41.7	173.7	-173	-179.3	63.9	174.7	6.8	111.8	C251 L252 E253 C258 F259 L268 M303 E330 L334	C251-R255 PolarHBondContact O-N 2.92Å; L252-R255 WeakPolarHBondContact O-CB 3.49Å; L252-R255 PolarHBondContact O-N 2.97Å; E253-R255 VanDerWaalsContact C-N 3.29Å; E253-R255 PolarHBondContact O-N 2.94Å; R255-C258 WeakPolarHBondContact O-CB 3.48Å; R255-C258 PolarHBondContact O-N 2.82Å; R255-F259 HydrophobicContact CG-CD2 4.03Å; R255-F259 HydrophobicContact CG-CE1 4.48Å; R255-F259 HydrophobicContact CG-CE2 3.63Å; R255-F259 HydrophobicContact CG-CZ 3.9Å; R255-F259 WeakPolarHBondContact O-CG 3.34Å; R255-F259 PolarHBondContact O-N 3.4Å; R255-L268 HydrophobicContact CG-CD2 4.18Å; R255-M303 HydrophobicContact CB-CE 4.36Å; R255-M303 HydrophobicContact CB-SD 4.25Å; R255-M303 HydrophobicContact CG-SD 4.44Å; R255-E330 IonicContact CZ-OE1 3.5Å; R255-E330 IonicContact NH1-OE1 3.29Å; R255-E330 PolarHBondContact NH1-OE1 2.04Å; R255-E330 IonicContact NH2-OE1 3.16Å; R255-E330 PolarHBondContact NH2-OE1 2.85Å; R255-E330 IonicContact NH2-OE2 2.65Å; R255-L334 HydrophobicContact CB-CD2 3.97Å; R255-L334 HydrophobicContact CG-CD2 4.47Å
256	R	91.3	Very high	93.2	Very high	81 Å²	81	48.9 Å²	48.9	31%	0.306	27%	0.272	S	S	.	.	H	α-helix	trans	-59	-49	174.6	-74	174.2	-179.5	152.9	-1.7	111.7	L252 E253 C258 F259 S260	L252-R256 WeakPolarHBondContact O-CG 3.27Å; L252-R256 PolarHBondContact O-N 3.5Å; E253-R256 WeakPolarHBondContact O-CB 3.49Å; E253-R256 PolarHBondContact O-N 2.69Å; E253-R256 WeakPolarHBondContact OE2-CD 3.28Å; E253-R256 IonicContact OE2-NH1 2.81Å; E253-R256 PolarHBondContact OE2-NH1 3.45Å; E253-R256 VanDerWaalsContact OE2-NH1 3.09Å; R256-C258 PolarHBondContact O-N 3.46Å; R256-F259 PolarHBondContact O-N 3.26Å; R256-F259 VanDerWaalsContact O-N 3.09Å; R256-S260 PolarHBondContact O-N 3.11Å; R256-S260 VanDerWaalsContact O-N 3.08Å; R256-S260 PolarHBondContact O-OG 2.85Å
257	L	92.2	Very high	93.4	Very high	98 Å²	98	42.9 Å²	42.9	51%	0.513	23%	0.232	S	C	.	.	H	α-helix	trans	-57.4	-38.5	175.3	-70.7	171.5	0	0	0	112.2	E253 L254	E253-L257 PolarHBondContact O-N 3.23Å; L254-L257 PolarHBondContact O-N 3.32Å
258	C	93.4	Very high	93.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-67.2	-40.7	175.9	-172	0	0	0	0	112.6	L254 R255 R256 S260 D261 C264 R265 M303	L254-C258 PolarHBondContact O-N 3.44Å; R255-C258 WeakPolarHBondContact O-CB 3.48Å; R255-C258 PolarHBondContact O-N 2.82Å; R256-C258 PolarHBondContact O-N 3.46Å; C258-S260 VanDerWaalsContact C-N 3.29Å; C258-S260 PolarHBondContact O-N 3.38Å; C258-D261 PolarHBondContact O-N 3.13Å; C258-C264 WeakPolarHBondContact CA-SG 3.46Å; C258-C264 HydrophobicContact CB-CB 4.04Å; C258-C264 WeakPolarHBondContact CB-SG 3.42Å; C258-C264 WeakPolarHBondContact O-CB 3.02Å; C258-C264 WeakPolarHBondContact SG-CB 3.2Å; C258-C264 PolarHBondContact SG-O 3.44Å; C258-C264 VanDerWaalsContact SG-O 3.37Å; C258-C264 CovalentContact SG-SG 2.03Å; C258-C264 PolarHBondContact SG-SG 2.04Å; C258-R265 PolarHBondContact O-N 3.02Å; C258-R265 VanDerWaalsContact O-N 3.13Å; C258-M303 HydrophobicContact CB-CG 3.83Å; C258-M303 HydrophobicContact CB-SD 3.52Å; C258-M303 VanDerWaalsContact CB-SD 3.52Å
259	F	89.1	Confident	93.3	Very high	72 Å²	72	35.3 Å²	35.3	32%	0.316	18%	0.181	S	C	.	.	H	α-helix	trans	-68.9	-25.6	178.7	-72.6	-23.5	0	0	0	113.9	R255 R256 D261 R265 L268	R255-F259 HydrophobicContact CG-CD2 4.03Å; R255-F259 HydrophobicContact CG-CE1 4.48Å; R255-F259 HydrophobicContact CG-CE2 3.63Å; R255-F259 HydrophobicContact CG-CZ 3.9Å; R255-F259 WeakPolarHBondContact O-CG 3.34Å; R255-F259 PolarHBondContact O-N 3.4Å; R256-F259 PolarHBondContact O-N 3.26Å; R256-F259 VanDerWaalsContact O-N 3.09Å; F259-D261 VanDerWaalsContact C-N 3.29Å; F259-R265 HydrophobicContact CD1-CB 4.17Å; F259-R265 HydrophobicContact CD1-CG 3.75Å; F259-R265 HydrophobicContact CE1-CG 4.25Å; F259-L268 HydrophobicContact CD1-CD2 4.33Å; F259-L268 HydrophobicContact CE1-CD2 3.66Å; F259-L268 HydrophobicContact CZ-CD2 4.14Å
260	S	88.3	Confident	93.1	Very high	93 Å²	93	33.4 Å²	33.4	65%	0.65	17%	0.169	S	C	*	.	H	α-helix	trans	-70.2	-23.1	171.8	-57	0	0	0	0	113.5	R256 C258	R256-S260 PolarHBondContact O-N 3.11Å; R256-S260 VanDerWaalsContact O-N 3.08Å; R256-S260 PolarHBondContact O-OG 2.85Å; C258-S260 VanDerWaalsContact C-N 3.29Å; C258-S260 PolarHBondContact O-N 3.38Å
261	D	89.8	Confident	92.9	Very high	73 Å²	73	31.9 Å²	31.9	39%	0.39	16%	0.161	S	C	.	.	S	Bend	trans	-99.1	114.7	176.3	175.9	-115.6	0	0	0	110.7	C258 F259 L263 C264 R265	C258-D261 PolarHBondContact O-N 3.13Å; F259-D261 VanDerWaalsContact C-N 3.29Å; D261-L263 PolarHBondContact O-N 2.66Å; D261-L263 VanDerWaalsContact O-N 3.08Å; D261-L263 WeakPolarHBondContact OD1-CB 3.41Å; D261-L263 PolarHBondContact OD1-N 3.2Å; D261-C264 HydrophobicContact CB-CB 3.97Å; D261-C264 PolarHBondContact O-N 3.08Å; D261-C264 VanDerWaalsContact O-N 3.12Å; D261-C264 VanDerWaalsContact OD1-CB 3.29Å; D261-C264 WeakPolarHBondContact OD1-CB 3.43Å; D261-C264 PolarHBondContact OD1-N 3.17Å; D261-R265 WeakPolarHBondContact O-CB 3.44Å; D261-R265 PolarHBondContact O-N 3.12Å
262	P	89.9	Confident	92.8	Very high	37 Å²	37	34.9 Å²	34.9	24%	0.24	18%	0.175	C	C	.	.	H	α-helix	trans	-55.1	-33.9	-177.7	-28.2	35.4	0	0	0	113.1	L117 W121 S266	L117-P262 HydrophobicContact CB-CB 4.27Å; W121-P262 PolarHBondContact NE1-O 3.36Å; P262-S266 VanDerWaalsContact O-CB 3.3Å; P262-S266 WeakPolarHBondContact O-CB 3.48Å; P262-S266 PolarHBondContact O-N 2.89Å; P262-S266 VanDerWaalsContact O-N 3.1Å; P262-S266 PolarHBondContact O-OG 2.93Å
263	L	92.3	Very high	92.5	Very high	30 Å²	30	37.1 Å²	37.1	16%	0.157	19%	0.189	C	C	.	.	H	α-helix	trans	-69.8	-51.5	178.1	180	64.1	0	0	0	111.1	L117 L204 D261 S266 R267	L117-L263 HydrophobicContact CD1-CB 4.47Å; L117-L263 HydrophobicContact CD1-CD1 3.98Å; L204-L263 HydrophobicContact CD1-CD2 4.11Å; L204-L263 HydrophobicContact CD2-CD2 4.43Å; D261-L263 PolarHBondContact O-N 2.66Å; D261-L263 VanDerWaalsContact O-N 3.08Å; D261-L263 WeakPolarHBondContact OD1-CB 3.41Å; D261-L263 PolarHBondContact OD1-N 3.2Å; L263-S266 WeakPolarHBondContact O-CB 3.06Å; L263-S266 PolarHBondContact O-N 3.4Å; L263-R267 HydrophobicContact CD1-CG 4.37Å; L263-R267 VanDerWaalsContact O-CG 3.3Å; L263-R267 WeakPolarHBondContact O-CG 3.1Å; L263-R267 PolarHBondContact O-N 2.99Å
264	C	95	Very high	92.4	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.007	17%	0.172	C	C	.	.	H	α-helix	trans	-60	-48.9	179	-169.5	0	0	0	0	111.2	C258 D261 S266 R267 L268 T301	C258-C264 WeakPolarHBondContact CA-SG 3.46Å; C258-C264 HydrophobicContact CB-CB 4.04Å; C258-C264 WeakPolarHBondContact CB-SG 3.42Å; C258-C264 WeakPolarHBondContact O-CB 3.02Å; C258-C264 WeakPolarHBondContact SG-CB 3.2Å; C258-C264 PolarHBondContact SG-O 3.44Å; C258-C264 VanDerWaalsContact SG-O 3.37Å; C258-C264 CovalentContact SG-SG 2.03Å; C258-C264 PolarHBondContact SG-SG 2.04Å; D261-C264 HydrophobicContact CB-CB 3.97Å; D261-C264 PolarHBondContact O-N 3.08Å; D261-C264 VanDerWaalsContact O-N 3.12Å; D261-C264 VanDerWaalsContact OD1-CB 3.29Å; D261-C264 WeakPolarHBondContact OD1-CB 3.43Å; D261-C264 PolarHBondContact OD1-N 3.17Å; C264-S266 VanDerWaalsContact C-N 3.26Å; C264-S266 PolarHBondContact O-N 2.98Å; C264-R267 PolarHBondContact O-N 3.41Å; C264-L268 PolarHBondContact O-N 3.48Å; C264-T301 HydrophobicContact CB-CG2 4.37Å; C264-T301 VanDerWaalsContact SG-CB 3.52Å
265	R	92.9	Very high	92.4	Very high	26 Å²	26	33.1 Å²	33.1	10%	0.098	17%	0.17	C	C	.	.	H	α-helix	trans	-50.1	-49.8	173.8	-176.2	173.6	-176.9	-168.4	-0.4	111.3	W121 D135 C258 F259 D261 R267 L268 V269	W121-R265 HydrophobicContact CD2-CG 4.4Å; W121-R265 VanDerWaalsContact CE3-NH1 3.31Å; W121-R265 HydrophobicContact CH2-CG 4.06Å; W121-R265 HydrophobicContact CZ2-CB 4.46Å; W121-R265 HydrophobicContact CZ2-CG 3.67Å; W121-R265 VanDerWaalsContact CZ3-NH2 3.33Å; D135-R265 VanDerWaalsContact CG-NH2 3.32Å; D135-R265 IonicContact OD1-NH2 2.79Å; D135-R265 PolarHBondContact OD1-NH2 2.75Å; D135-R265 VanDerWaalsContact OD1-NH2 3.08Å; D135-R265 IonicContact OD2-CZ 3.09Å; D135-R265 IonicContact OD2-NE 3.08Å; D135-R265 PolarHBondContact OD2-NE 3.21Å; D135-R265 IonicContact OD2-NH2 3.81Å; D135-R265 PolarHBondContact OD2-NH2 2.78Å; C258-R265 PolarHBondContact O-N 3.02Å; C258-R265 VanDerWaalsContact O-N 3.13Å; F259-R265 HydrophobicContact CD1-CB 4.17Å; F259-R265 HydrophobicContact CD1-CG 3.75Å; F259-R265 HydrophobicContact CE1-CG 4.25Å; D261-R265 WeakPolarHBondContact O-CB 3.44Å; D261-R265 PolarHBondContact O-N 3.12Å; R265-R267 PolarHBondContact O-N 3.06Å; R265-L268 PolarHBondContact O-N 3.35Å; R265-V269 WeakPolarHBondContact O-CG2 3.48Å; R265-V269 PolarHBondContact O-N 3.26Å
266	S	92.9	Very high	92.4	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.4	-43.8	178.6	-55.7	0	0	0	0	112.8	L117 W121 P138 P262 L263 C264 L268 D270	L117-S266 VanDerWaalsContact CD2-OG 3.31Å; L117-S266 WeakPolarHBondContact CD2-OG 3.37Å; W121-S266 PolarHBondContact NE1-OG 3.18Å; P138-S266 VanDerWaalsContact CG-CB 3.49Å; P138-S266 WeakPolarHBondContact CG-OG 2.99Å; P262-S266 VanDerWaalsContact O-CB 3.3Å; P262-S266 WeakPolarHBondContact O-CB 3.48Å; P262-S266 PolarHBondContact O-N 2.89Å; P262-S266 VanDerWaalsContact O-N 3.1Å; P262-S266 PolarHBondContact O-OG 2.93Å; L263-S266 WeakPolarHBondContact O-CB 3.06Å; L263-S266 PolarHBondContact O-N 3.4Å; C264-S266 VanDerWaalsContact C-N 3.26Å; C264-S266 PolarHBondContact O-N 2.98Å; S266-L268 VanDerWaalsContact C-N 3.35Å; S266-D270 WeakPolarHBondContact O-CB 3.39Å; S266-D270 PolarHBondContact O-N 3.45Å
267	R	94.6	Very high	92.5	Very high	9 Å²	9	33.2 Å²	33.2	3%	0.034	18%	0.179	C	C	.	.	H	α-helix	trans	-68.7	-34.8	179.8	-62.7	-66.6	-179.7	93	-0	111.8	E208 L263 C264 R265 F271 G297 L298 T301	E208-R267 IonicContact OE2-NH2 2.76Å; E208-R267 PolarHBondContact OE2-NH2 2.03Å; L263-R267 HydrophobicContact CD1-CG 4.37Å; L263-R267 VanDerWaalsContact O-CG 3.3Å; L263-R267 WeakPolarHBondContact O-CG 3.1Å; L263-R267 PolarHBondContact O-N 2.99Å; C264-R267 PolarHBondContact O-N 3.41Å; R265-R267 PolarHBondContact O-N 3.06Å; R267-F271 WeakPolarHBondContact O-CB 3.47Å; R267-F271 PolarHBondContact O-N 3.48Å; R267-G297 VanDerWaalsContact CD-O 3.32Å; R267-G297 WeakPolarHBondContact CD-O 3.38Å; R267-G297 VanDerWaalsContact CG-O 3.28Å; R267-G297 WeakPolarHBondContact CG-O 3.47Å; R267-G297 PolarHBondContact NH1-O 3.44Å; R267-L298 HydrophobicContact CB-CD2 3.97Å; R267-T301 HydrophobicContact CB-CG2 4.39Å; R267-T301 HydrophobicContact CG-CG2 4.28Å
268	L	94.7	Very high	92.5	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-68.4	-49	176.7	-177.3	63.2	0	0	0	112.1	R255 F259 C264 R265 S266 D270 F271 Q272 L298 M303 F338	R255-L268 HydrophobicContact CG-CD2 4.18Å; F259-L268 HydrophobicContact CD1-CD2 4.33Å; F259-L268 HydrophobicContact CE1-CD2 3.66Å; F259-L268 HydrophobicContact CZ-CD2 4.14Å; C264-L268 PolarHBondContact O-N 3.48Å; R265-L268 PolarHBondContact O-N 3.35Å; S266-L268 VanDerWaalsContact C-N 3.35Å; L268-D270 PolarHBondContact O-N 2.67Å; L268-F271 WeakPolarHBondContact O-CB 3.28Å; L268-F271 PolarHBondContact O-N 2.92Å; L268-F271 VanDerWaalsContact O-N 3.13Å; L268-Q272 WeakPolarHBondContact O-CG 3.26Å; L268-Q272 PolarHBondContact O-N 3.14Å; L268-L298 HydrophobicContact CB-CD2 4.36Å; L268-L298 HydrophobicContact CD1-CD2 4.49Å; L268-M303 HydrophobicContact CD1-CE 3.91Å; L268-M303 HydrophobicContact CD1-SD 4.08Å; L268-M303 HydrophobicContact CD2-CE 4.05Å; L268-M303 HydrophobicContact CD2-SD 3.55Å; L268-M303 VanDerWaalsContact CD2-SD 3.55Å; L268-M303 HydrophobicContact CG-SD 4.36Å; L268-F338 HydrophobicContact CD1-CZ 4.27Å
269	V	92.6	Very high	92.2	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-61.9	-38	177.3	172.6	0	0	0	0	110.8	W121 D135 R265 F271 Q272 T273	W121-V269 HydrophobicContact CH2-CB 4.42Å; W121-V269 HydrophobicContact CH2-CG2 3.96Å; W121-V269 HydrophobicContact CZ2-CG2 4.38Å; D135-V269 HydrophobicContact CB-CG1 3.96Å; D135-V269 HydrophobicContact CB-CG2 3.76Å; D135-V269 WeakPolarHBondContact O-CG1 3.35Å; R265-V269 WeakPolarHBondContact O-CG2 3.48Å; R265-V269 PolarHBondContact O-N 3.26Å; V269-F271 VanDerWaalsContact C-N 3.35Å; V269-F271 PolarHBondContact O-N 2.92Å; V269-Q272 PolarHBondContact O-N 3.01Å; V269-T273 WeakPolarHBondContact O-CB 3.32Å; V269-T273 PolarHBondContact O-N 3.4Å; V269-T273 PolarHBondContact O-OG1 2.92Å
270	D	92	Very high	92.1	Very high	3 Å²	3	41 Å²	41	2%	0.016	22%	0.221	C	C	.	.	H	α-helix	trans	-64.2	-38.7	176	-160.5	14.6	0	0	0	112.5	R108 S137 Y139 S266 L268 H274	R108-D270 IonicContact CZ-OD2 3.65Å; R108-D270 VanDerWaalsContact CZ-OD2 3.29Å; R108-D270 IonicContact NE-OD2 3.34Å; R108-D270 PolarHBondContact NE-OD2 3.2Å; R108-D270 IonicContact NH2-OD2 3.79Å; R108-D270 PolarHBondContact NH2-OD2 3.45Å; S137-D270 WeakPolarHBondContact OG-CB 3.17Å; S137-D270 VanDerWaalsContact OG-CG 3.28Å; S137-D270 PolarHBondContact OG-OD1 3.22Å; Y139-D270 HydrophobicContact CD2-CB 4.39Å; S266-D270 WeakPolarHBondContact O-CB 3.39Å; S266-D270 PolarHBondContact O-N 3.45Å; L268-D270 PolarHBondContact O-N 2.67Å; D270-H274 WeakPolarHBondContact O-CB 3.21Å; D270-H274 PolarHBondContact O-N 3.04Å; D270-H274 PolarHBondContact O-ND1 3.03Å; D270-H274 IonicContact OD1-CE1 3.93Å; D270-H274 PolarHBondContact OD1-CE1 2.82Å; D270-H274 IonicContact OD1-ND1 3.43Å; D270-H274 PolarHBondContact OD1-ND1 3.17Å
271	F	94.9	Very high	92	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-66.8	-45.4	172.2	174	-109	0	0	0	112	R267 L268 V269 T273 H274 C275 A294 Y295 L298 F337 F338 L344	R267-F271 WeakPolarHBondContact O-CB 3.47Å; R267-F271 PolarHBondContact O-N 3.48Å; L268-F271 WeakPolarHBondContact O-CB 3.28Å; L268-F271 PolarHBondContact O-N 2.92Å; L268-F271 VanDerWaalsContact O-N 3.13Å; V269-F271 VanDerWaalsContact C-N 3.35Å; V269-F271 PolarHBondContact O-N 2.92Å; F271-T273 VanDerWaalsContact C-N 3.27Å; F271-T273 PolarHBondContact O-N 3.41Å; F271-H274 PolarHBondContact O-N 2.04Å; F271-C275 HydrophobicContact CD2-CB 3.85Å; F271-C275 WeakPolarHBondContact CD2-SG 3.1Å; F271-C275 HydrophobicContact CE2-CB 3.65Å; F271-C275 WeakPolarHBondContact CE2-SG 3.07Å; F271-C275 HydrophobicContact CZ-CB 4.22Å; F271-C275 WeakPolarHBondContact O-CA 3.48Å; F271-C275 VanDerWaalsContact O-CB 3.23Å; F271-C275 WeakPolarHBondContact O-CB 3.09Å; F271-C275 PolarHBondContact O-N 2.99Å; F271-A294 HydrophobicContact CB-CB 4.2Å; F271-Y295 HydrophobicContact CE2-CD2 4.05Å; F271-L298 HydrophobicContact CB-CD1 3.91Å; F271-L298 HydrophobicContact CB-CG 4.34Å; F271-L298 HydrophobicContact CD1-CD1 3.83Å; F271-L298 HydrophobicContact CD2-CD1 4.11Å; F271-L298 HydrophobicContact CE1-CD1 4.36Å; F271-L298 HydrophobicContact CG-CD1 3.69Å; F271-F337 HydrophobicContact CD1-CD1 4.07Å; F271-F337 AromaticContact CD1-CE1 3.85Å; F271-F337 HydrophobicContact CD1-CE1 3.85Å; F271-F337 AromaticContact CE1-CD1 3.51Å; F271-F337 HydrophobicContact CE1-CD1 3.51Å; F271-F337 AromaticContact CE1-CE1 3.62Å; F271-F337 HydrophobicContact CE1-CE1 3.62Å; F271-F337 HydrophobicContact CZ-CD1 4.29Å; F271-F337 HydrophobicContact CZ-CE1 4.29Å; F271-F338 AromaticContact CD1-CE1 3.97Å; F271-F338 HydrophobicContact CD1-CE1 3.97Å; F271-F338 AromaticContact CD1-CZ 3.89Å; F271-F338 HydrophobicContact CD1-CZ 3.89Å; F271-F338 AromaticContact CE1-CD1 3.79Å; F271-F338 HydrophobicContact CE1-CD1 3.79Å; F271-F338 HydrophobicContact CE1-CD2 4.45Å; F271-F338 AromaticContact CE1-CE1 3.36Å; F271-F338 HydrophobicContact CE1-CE1 3.36Å; F271-F338 HydrophobicContact CE1-CE2 4.07Å; F271-F338 HydrophobicContact CE1-CG 4.33Å; F271-F338 AromaticContact CE1-CZ 3.51Å; F271-F338 HydrophobicContact CE1-CZ 3.51Å; F271-F338 AromaticContact CZ-CD1 3.9Å; F271-F338 HydrophobicContact CZ-CD1 3.9Å; F271-F338 AromaticContact CZ-CE1 3.81Å; F271-F338 HydrophobicContact CZ-CE1 3.81Å; F271-F338 HydrophobicContact CZ-CZ 4.4Å; F271-L344 HydrophobicContact CE2-CD1 4.29Å; F271-L344 HydrophobicContact CE2-CD2 4.09Å; F271-L344 HydrophobicContact CZ-CD2 3.96Å
272	Q	93.4	Very high	91.9	Very high	63 Å²	63	40.3 Å²	40.3	29%	0.294	21%	0.21	S	C	.	.	H	α-helix	trans	-60.5	-37.1	176.2	-72.2	172.8	-36.5	0	0	112.3	L268 V269 H276 F337	L268-Q272 WeakPolarHBondContact O-CG 3.26Å; L268-Q272 PolarHBondContact O-N 3.14Å; V269-Q272 PolarHBondContact O-N 3.01Å; Q272-H276 WeakPolarHBondContact O-CB 3.43Å; Q272-H276 PolarHBondContact O-N 3.49Å; Q272-F337 HydrophobicContact CB-CE1 4.33Å; Q272-F337 HydrophobicContact CB-CZ 4.43Å; Q272-F337 HydrophobicContact CG-CD1 4.45Å; Q272-F337 HydrophobicContact CG-CE1 3.96Å; Q272-F337 HydrophobicContact CG-CZ 4.42Å
273	T	90.4	Very high	92	Very high	53 Å²	53	42 Å²	42	33%	0.325	22%	0.219	S	C	.	.	H	α-helix	trans	-68.7	-54.1	177.4	-57.3	0	0	0	0	111.3	V269 F271	V269-T273 WeakPolarHBondContact O-CB 3.32Å; V269-T273 PolarHBondContact O-N 3.4Å; V269-T273 PolarHBondContact O-OG1 2.92Å; F271-T273 VanDerWaalsContact C-N 3.27Å; F271-T273 PolarHBondContact O-N 3.41Å
274	H	91.8	Very high	91.9	Very high	6 Å²	6	41 Å²	41	3%	0.028	22%	0.215	C	C	.	.	H	α-helix	trans	-85.3	-26.3	-168.2	-68.9	95.7	0	0	0	114	D141 D270 F271 T286 R290 A294	D141-H274 IonicContact OD1-CE1 3.38Å; D141-H274 IonicContact OD1-NE2 3.5Å; D141-H274 PolarHBondContact OD1-NE2 2.02Å; D141-H274 IonicContact OD2-NE2 2.79Å; D270-H274 WeakPolarHBondContact O-CB 3.21Å; D270-H274 PolarHBondContact O-N 3.04Å; D270-H274 PolarHBondContact O-ND1 3.03Å; D270-H274 IonicContact OD1-CE1 3.93Å; D270-H274 PolarHBondContact OD1-CE1 2.82Å; D270-H274 IonicContact OD1-ND1 3.43Å; D270-H274 PolarHBondContact OD1-ND1 3.17Å; F271-H274 PolarHBondContact O-N 2.04Å; H274-T286 WeakPolarHBondContact CA-OG1 3.28Å; H274-T286 PolarHBondContact CD2-OG1 3.34Å; H274-T286 PolarHBondContact O-OG1 2.9Å; H274-R290 HydrophobicContact CB-CB 4.21Å; H274-R290 VanDerWaalsContact CD2-CB 3.42Å; H274-R290 WeakPolarHBondContact CD2-CB 3.4Å; H274-A294 HydrophobicContact CB-CB 4.31Å
275	C	95.3	Very high	91.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	14.4	178.3	-59.6	0	0	0	0	113.1	F271 P277 C291 N341	F271-C275 HydrophobicContact CD2-CB 3.85Å; F271-C275 WeakPolarHBondContact CD2-SG 3.1Å; F271-C275 HydrophobicContact CE2-CB 3.65Å; F271-C275 WeakPolarHBondContact CE2-SG 3.07Å; F271-C275 HydrophobicContact CZ-CB 4.22Å; F271-C275 WeakPolarHBondContact O-CA 3.48Å; F271-C275 VanDerWaalsContact O-CB 3.23Å; F271-C275 WeakPolarHBondContact O-CB 3.09Å; F271-C275 PolarHBondContact O-N 2.99Å; C275-P277 WeakPolarHBondContact O-CD 3.23Å; C275-C291 VanDerWaalsContact CA-SG 3.6Å; C275-C291 HydrophobicContact CB-CB 4.07Å; C275-C291 WeakPolarHBondContact CB-SG 3.44Å; C275-C291 WeakPolarHBondContact SG-CA 3.44Å; C275-C291 WeakPolarHBondContact SG-CB 3.39Å; C275-C291 PolarHBondContact SG-O 3.26Å; C275-C291 CovalentContact SG-SG 2.04Å; C275-C291 PolarHBondContact SG-SG 2.01Å; C275-N341 PolarHBondContact O-ND2 3.38Å
276	H	93.6	Very high	91.4	Very high	92 Å²	92	44.4 Å²	44.4	43%	0.426	24%	0.243	S	C	.	.			trans	-60	125.8	172.6	-165.3	78.8	0	0	0	109.7	Q272 M278 A285 F337	Q272-H276 WeakPolarHBondContact O-CB 3.43Å; Q272-H276 PolarHBondContact O-N 3.49Å; H276-M278 PolarHBondContact O-N 2.96Å; H276-A285 HydrophobicContact CB-CB 3.91Å; H276-A285 PolarHBondContact O-N 2.97Å; H276-F337 AromaticContact ND1-CE2 3.96Å
277	P	92.8	Very high	91.2	Very high	39 Å²	39	49 Å²	49	25%	0.253	27%	0.265	S	S	.	.	B	Isolated β-bridge	trans	-75.7	118.3	177.1	30.5	-31.9	0	0	0	109.4	C275 P342 C343	C275-P277 WeakPolarHBondContact O-CD 3.23Å; P277-P342 HydrophobicContact CB-CG 3.77Å; P277-C343 HydrophobicContact CB-CB 4.48Å
278	M	91.8	Very high	91.1	Very high	120 Å²	120	51.9 Å²	51.9	59%	0.591	28%	0.279	S	S	*	.	S	Bend	trans	-82.7	-26.6	176.6	-67.6	-60	-62.4	0	0	112.5	H276 T283 A285	H276-M278 PolarHBondContact O-N 2.96Å; M278-T283 HydrophobicContact CB-CG2 4.33Å; M278-T283 PolarHBondContact N-O 3.14Å; M278-A285 VanDerWaalsContact CG-CA 3.41Å; M278-A285 HydrophobicContact CG-CB 3.97Å; M278-A285 HydrophobicContact SD-CB 3.78Å
279	D	88.2	Confident	90.9	Very high	54 Å²	54	53.8 Å²	53.8	29%	0.289	29%	0.292	S	S	.	.	S	Bend	trans	-148	172.7	178.7	62.8	29.9	0	0	0	110.9	L281 G282 T283 P342	D279-L281 PolarHBondContact O-N 3.41Å; D279-L281 WeakPolarHBondContact OD1-CA 3.49Å; D279-L281 PolarHBondContact OD1-N 2.95Å; D279-G282 PolarHBondContact OD1-N 3.19Å; D279-T283 VanDerWaalsContact CG-CB 3.46Å; D279-T283 WeakPolarHBondContact OD1-CB 3.48Å; D279-T283 PolarHBondContact OD1-N 3.45Å; D279-T283 PolarHBondContact OD1-OG1 3.2Å; D279-T283 WeakPolarHBondContact OD2-CB 3.37Å; D279-T283 PolarHBondContact OD2-OG1 3.44Å; D279-P342 VanDerWaalsContact O-CG 3.32Å; D279-P342 WeakPolarHBondContact O-CG 3.5Å
280	I	86.4	Confident	90.9	Very high	160 Å²	160	55.5 Å²	55.5	82%	0.821	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-10.3	174.6	61.4	169.9	0	0	0	113.2
281	L	87.1	Confident	91	Very high	147 Å²	147	55.3 Å²	55.3	77%	0.77	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-13.2	-175.9	-62.8	175.7	0	0	0	112.7	D279	D279-L281 PolarHBondContact O-N 3.41Å; D279-L281 WeakPolarHBondContact OD1-CA 3.49Å; D279-L281 PolarHBondContact OD1-N 2.95Å
282	G	87.8	Confident	91.1	Very high	5 Å²	5	55.5 Å²	55.5	5%	0.052	30%	0.298	C	S	.	.			trans	106	16.2	177.5	0	0	0	0	0	114.4	D279 C284	D279-G282 PolarHBondContact OD1-N 3.19Å; G282-C284 PolarHBondContact O-N 3.23Å
283	T	90.7	Very high	91.2	Very high	71 Å²	71	55.8 Å²	55.8	44%	0.436	30%	0.297	S	S	.	.			trans	-71.5	124.4	172.1	-54.7	0	0	0	0	110	M278 D279	M278-T283 HydrophobicContact CB-CG2 4.33Å; M278-T283 PolarHBondContact N-O 3.14Å; D279-T283 VanDerWaalsContact CG-CB 3.46Å; D279-T283 WeakPolarHBondContact OD1-CB 3.48Å; D279-T283 PolarHBondContact OD1-N 3.45Å; D279-T283 PolarHBondContact OD1-OG1 3.2Å; D279-T283 WeakPolarHBondContact OD2-CB 3.37Å; D279-T283 PolarHBondContact OD2-OG1 3.44Å
284	C	91.3	Very high	91.4	Very high	10 Å²	10	53.2 Å²	53.2	7%	0.068	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-83.2	151.4	173.1	-60.7	0	0	0	0	110.7	G282 T286 C343	G282-C284 PolarHBondContact O-N 3.23Å; C284-T286 WeakPolarHBondContact CB-O 3.39Å; C284-T286 PolarHBondContact O-N 3.48Å; C284-T286 VanDerWaalsContact O-N 3.14Å; C284-C343 WeakPolarHBondContact CA-SG 3.24Å; C284-C343 HydrophobicContact CB-CB 3.97Å; C284-C343 WeakPolarHBondContact CB-SG 3.34Å; C284-C343 WeakPolarHBondContact SG-CB 3.22Å; C284-C343 CovalentContact SG-SG 2.03Å; C284-C343 PolarHBondContact SG-SG 3.48Å
285	A	88.2	Confident	91.7	Very high	46 Å²	46	53 Å²	53	38%	0.38	28%	0.28	S	S	.	.	S	Bend	trans	-59	-24.3	173.6	0	0	0	0	0	113.6	H276 M278	H276-A285 HydrophobicContact CB-CB 3.91Å; H276-A285 PolarHBondContact O-N 2.97Å; M278-A285 VanDerWaalsContact CG-CA 3.41Å; M278-A285 HydrophobicContact CG-CB 3.97Å; M278-A285 HydrophobicContact SD-CB 3.78Å
286	T	88.2	Confident	91.8	Very high	52 Å²	52	53.7 Å²	53.7	32%	0.319	28%	0.284	S	S	.	.	S	Bend	trans	-131.2	-149.2	176.7	65.1	0	0	0	0	109.8	H274 C284	H274-T286 WeakPolarHBondContact CA-OG1 3.28Å; H274-T286 PolarHBondContact CD2-OG1 3.34Å; H274-T286 PolarHBondContact O-OG1 2.9Å; C284-T286 WeakPolarHBondContact CB-O 3.39Å; C284-T286 PolarHBondContact O-N 3.48Å; C284-T286 VanDerWaalsContact O-N 3.14Å
287	E	89.8	Confident	91.9	Very high	96 Å²	96	49.5 Å²	49.5	45%	0.449	27%	0.265	S	S	.	.			trans	-79.1	140.4	174	-63.5	170	-154.7	0	0	112.2	S289 R290 C291	E287-S289 PolarHBondContact O-N 3.14Å; E287-S289 VanDerWaalsContact O-N 3.08Å; E287-S289 PolarHBondContact OE2-OG 3.34Å; E287-R290 HydrophobicContact CB-CG 4.15Å; E287-R290 WeakPolarHBondContact O-CB 3.3Å; E287-R290 PolarHBondContact O-N 2.89Å; E287-R290 IonicContact OE1-NE 3.02Å; E287-R290 IonicContact OE1-NH2 2.69Å; E287-R290 IonicContact OE2-NE 3.17Å; E287-C291 PolarHBondContact O-N 3.25Å; E287-C291 VanDerWaalsContact O-N 3.12Å
288	Q	92	Very high	92.2	Very high	71 Å²	71	47.6 Å²	47.6	33%	0.332	25%	0.253	S	S	.	.	H	α-helix	trans	-52.5	-33.4	170	-68.2	179.8	-6.4	0	0	112.5	R290 C291 L292 A347	Q288-R290 VanDerWaalsContact C-N 3.29Å; Q288-R290 PolarHBondContact O-N 3.43Å; Q288-C291 PolarHBondContact O-N 3.39Å; Q288-L292 WeakPolarHBondContact O-CG 3.43Å; Q288-L292 PolarHBondContact O-N 3.48Å; Q288-A347 HydrophobicContact CB-CB 3.9Å; Q288-A347 HydrophobicContact CG-CB 4.08Å
289	S	91.4	Very high	92.5	Very high	40 Å²	40	42 Å²	42	28%	0.28	23%	0.225	S	C	.	.	H	α-helix	trans	-60.8	-37.7	176.7	87.4	0	0	0	0	112.5	E287 R293	E287-S289 PolarHBondContact O-N 3.14Å; E287-S289 VanDerWaalsContact O-N 3.08Å; E287-S289 PolarHBondContact OE2-OG 3.34Å; S289-R293 WeakPolarHBondContact O-CG 3.41Å; S289-R293 PolarHBondContact O-N 2.77Å; S289-R293 PolarHBondContact O-NE 3.26Å; S289-R293 PolarHBondContact OG-NH2 3Å
290	R	91.4	Very high	92.9	Very high	37 Å²	37	39.6 Å²	39.6	14%	0.14	21%	0.213	C	C	.	.	H	α-helix	trans	-77.3	-39.7	179.1	-63.9	177.9	-175.5	-148.8	4.6	110.8	D141 H274 E287 Q288 L292 R293 A294	D141-R290 VanDerWaalsContact CB-NH1 3.34Å; D141-R290 IonicContact OD1-NH1 3.84Å; D141-R290 PolarHBondContact OD1-NH1 3.23Å; D141-R290 VanDerWaalsContact OD1-NH1 3.17Å; D141-R290 IonicContact OD2-NH1 3.63Å; D141-R290 PolarHBondContact OD2-NH1 3.47Å; H274-R290 HydrophobicContact CB-CB 4.21Å; H274-R290 VanDerWaalsContact CD2-CB 3.42Å; H274-R290 WeakPolarHBondContact CD2-CB 3.4Å; E287-R290 HydrophobicContact CB-CG 4.15Å; E287-R290 WeakPolarHBondContact O-CB 3.3Å; E287-R290 PolarHBondContact O-N 2.89Å; E287-R290 IonicContact OE1-NE 3.02Å; E287-R290 IonicContact OE1-NH2 2.69Å; E287-R290 IonicContact OE2-NE 3.17Å; Q288-R290 VanDerWaalsContact C-N 3.29Å; Q288-R290 PolarHBondContact O-N 3.43Å; R290-L292 VanDerWaalsContact C-N 3.33Å; R290-L292 PolarHBondContact O-N 2.78Å; R290-R293 CarbonylContact O-C 3.59Å; R290-R293 WeakPolarHBondContact O-CB 3.5Å; R290-R293 PolarHBondContact O-N 2.75Å; R290-R293 VanDerWaalsContact O-N 3.13Å; R290-A294 PolarHBondContact O-N 2.91Å
291	C	95.3	Very high	93.4	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-54.8	-49	172.2	173.6	0	0	0	0	111.3	C275 E287 Q288 R293 A294 Y295	C275-C291 VanDerWaalsContact CA-SG 3.6Å; C275-C291 HydrophobicContact CB-CB 4.07Å; C275-C291 WeakPolarHBondContact CB-SG 3.44Å; C275-C291 WeakPolarHBondContact SG-CA 3.44Å; C275-C291 WeakPolarHBondContact SG-CB 3.39Å; C275-C291 PolarHBondContact SG-O 3.26Å; C275-C291 CovalentContact SG-SG 2.04Å; C275-C291 PolarHBondContact SG-SG 2.01Å; E287-C291 PolarHBondContact O-N 3.25Å; E287-C291 VanDerWaalsContact O-N 3.12Å; Q288-C291 PolarHBondContact O-N 3.39Å; C291-R293 VanDerWaalsContact C-N 3.34Å; C291-R293 PolarHBondContact O-N 3.32Å; C291-A294 PolarHBondContact O-N 3.45Å; C291-A294 VanDerWaalsContact O-N 3.11Å; C291-Y295 WeakPolarHBondContact O-CB 3.26Å; C291-Y295 PolarHBondContact O-N 3.39Å
292	L	96.3	Very high	93.8	Very high	3 Å²	3	26.7 Å²	26.7	2%	0.016	15%	0.151	C	C	.	.	H	α-helix	trans	-62.6	-39.1	176.9	-65.3	176.6	0	0	0	112.7	L220 Q288 R290 A294 Y295 L296 A347 I348 K351	L220-L292 HydrophobicContact CD1-CD1 4.43Å; L220-L292 HydrophobicContact CD1-CD2 3.87Å; Q288-L292 WeakPolarHBondContact O-CG 3.43Å; Q288-L292 PolarHBondContact O-N 3.48Å; R290-L292 VanDerWaalsContact C-N 3.33Å; R290-L292 PolarHBondContact O-N 2.78Å; L292-A294 VanDerWaalsContact C-N 3.3Å; L292-A294 PolarHBondContact O-N 3.42Å; L292-Y295 PolarHBondContact O-N 2.86Å; L292-L296 VanDerWaalsContact O-CD1 3.27Å; L292-L296 WeakPolarHBondContact O-CD1 3.33Å; L292-L296 PolarHBondContact O-N 2.93Å; L292-A347 HydrophobicContact CD2-CB 3.96Å; L292-A347 HydrophobicContact CG-CB 4.07Å; L292-I348 HydrophobicContact CD2-CG1 3.93Å; L292-K351 HydrophobicContact CD1-CB 3.68Å; L292-K351 HydrophobicContact CD1-CD 4.42Å; L292-K351 HydrophobicContact CD1-CG 3.98Å
293	R	94.6	Very high	94.3	Very high	69 Å²	69	26.5 Å²	26.5	26%	0.26	15%	0.149	S	C	.	.	H	α-helix	trans	-63.7	-34.7	174.5	-79.2	-178.3	-87	150.1	-12.1	112.4	R108 E212 S289 R290 C291 G297	R108-R293 PolarHBondContact NH1-O 2.76Å; R108-R293 PolarHBondContact NH2-O 2.8Å; E212-R293 WeakPolarHBondContact OE1-CG 3.33Å; E212-R293 IonicContact OE1-NE 3.03Å; S289-R293 WeakPolarHBondContact O-CG 3.41Å; S289-R293 PolarHBondContact O-N 2.77Å; S289-R293 PolarHBondContact O-NE 3.26Å; S289-R293 PolarHBondContact OG-NH2 3Å; R290-R293 CarbonylContact O-C 3.59Å; R290-R293 WeakPolarHBondContact O-CB 3.5Å; R290-R293 PolarHBondContact O-N 2.75Å; R290-R293 VanDerWaalsContact O-N 3.13Å; C291-R293 VanDerWaalsContact C-N 3.34Å; C291-R293 PolarHBondContact O-N 3.32Å; R293-G297 PolarHBondContact O-N 3.3Å
294	A	95.1	Very high	94.7	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-74.2	-44	175.7	0	0	0	0	0	111.6	F271 H274 R290 C291 L292 G297 L298	F271-A294 HydrophobicContact CB-CB 4.2Å; H274-A294 HydrophobicContact CB-CB 4.31Å; R290-A294 PolarHBondContact O-N 2.91Å; C291-A294 PolarHBondContact O-N 3.45Å; C291-A294 VanDerWaalsContact O-N 3.11Å; L292-A294 VanDerWaalsContact C-N 3.3Å; L292-A294 PolarHBondContact O-N 3.42Å; A294-G297 VanDerWaalsContact O-CA 3.3Å; A294-G297 WeakPolarHBondContact O-CA 3.25Å; A294-G297 PolarHBondContact O-N 2.94Å; A294-L298 PolarHBondContact O-N 2.93Å
295	Y	98	Very high	95	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.008	13%	0.127	C	C	.	.	H	α-helix	trans	-57.3	-51.1	174.8	174.4	-106.2	0	0	0	112.5	L219 L220 F271 C291 L292 G297 L298 P305 V315 L344 I348	L219-Y295 HydrophobicContact CD2-CE1 4.22Å; L220-Y295 HydrophobicContact CD2-CE1 4.17Å; F271-Y295 HydrophobicContact CE2-CD2 4.05Å; C291-Y295 WeakPolarHBondContact O-CB 3.26Å; C291-Y295 PolarHBondContact O-N 3.39Å; L292-Y295 PolarHBondContact O-N 2.86Å; Y295-G297 PolarHBondContact O-N 3.5Å; Y295-L298 WeakPolarHBondContact O-CB 3.41Å; Y295-L298 PolarHBondContact O-N 3.37Å; Y295-L298 VanDerWaalsContact O-N 3.12Å; Y295-P305 HydrophobicContact CD2-CG 3.99Å; Y295-P305 HydrophobicContact CE2-CB 3.76Å; Y295-P305 HydrophobicContact CE2-CG 3.33Å; Y295-V315 HydrophobicContact CE2-CG2 4.27Å; Y295-V315 WeakPolarHBondContact OH-CG1 2.99Å; Y295-L344 HydrophobicContact CD1-CD1 4.49Å; Y295-L344 HydrophobicContact CD2-CD1 3.95Å; Y295-L344 HydrophobicContact CD2-CD2 4.02Å; Y295-L344 HydrophobicContact CE2-CD2 4.2Å; Y295-L344 HydrophobicContact CG-CD1 3.9Å; Y295-I348 HydrophobicContact CE1-CD1 4.5Å
296	L	97.6	Very high	95.5	Very high	14 Å²	14	21.2 Å²	21.2	7%	0.073	11%	0.111	C	C	.	.	H	α-helix	trans	-60.9	-27.4	173.8	-91.3	68.7	0	0	0	112	F207 A215 Q216 L219 L220 L292 L298 I299	F207-L296 HydrophobicContact CD1-CB 4.39Å; F207-L296 HydrophobicContact CD1-CD2 4.03Å; F207-L296 HydrophobicContact CD1-CG 4.14Å; F207-L296 HydrophobicContact CE1-CD2 4.28Å; F207-L296 HydrophobicContact CE1-CG 4.33Å; A215-L296 HydrophobicContact CB-CD2 4.19Å; Q216-L296 HydrophobicContact CG-CD2 3.77Å; L219-L296 HydrophobicContact CD2-CD1 3.77Å; L219-L296 HydrophobicContact CD2-CG 3.82Å; L220-L296 HydrophobicContact CD1-CD1 3.98Å; L220-L296 HydrophobicContact CG-CD1 4.39Å; L292-L296 VanDerWaalsContact O-CD1 3.27Å; L292-L296 WeakPolarHBondContact O-CD1 3.33Å; L292-L296 PolarHBondContact O-N 2.93Å; L296-L298 PolarHBondContact O-N 2.9Å; L296-I299 HydrophobicContact CG-CD1 4.5Å; L296-I299 PolarHBondContact O-N 3.08Å
297	G	96.1	Very high	95.9	Very high	3 Å²	3	19 Å²	19	3%	0.031	10%	0.097	C	C	.	.	H	α-helix	trans	-67.2	-19.2	178.2	0	0	0	0	0	114.1	R267 R293 A294 Y295	R267-G297 VanDerWaalsContact CD-O 3.32Å; R267-G297 WeakPolarHBondContact CD-O 3.38Å; R267-G297 VanDerWaalsContact CG-O 3.28Å; R267-G297 WeakPolarHBondContact CG-O 3.47Å; R267-G297 PolarHBondContact NH1-O 3.44Å; R293-G297 PolarHBondContact O-N 3.3Å; A294-G297 VanDerWaalsContact O-CA 3.3Å; A294-G297 WeakPolarHBondContact O-CA 3.25Å; A294-G297 PolarHBondContact O-N 2.94Å; Y295-G297 PolarHBondContact O-N 3.5Å
298	L	98.1	Very high	96.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-17.7	176.2	-68.3	173.2	0	0	0	113.2	R267 L268 F271 A294 Y295 L296 G300 T301 T304 P305 F338	R267-L298 HydrophobicContact CB-CD2 3.97Å; L268-L298 HydrophobicContact CB-CD2 4.36Å; L268-L298 HydrophobicContact CD1-CD2 4.49Å; F271-L298 HydrophobicContact CB-CD1 3.91Å; F271-L298 HydrophobicContact CB-CG 4.34Å; F271-L298 HydrophobicContact CD1-CD1 3.83Å; F271-L298 HydrophobicContact CD2-CD1 4.11Å; F271-L298 HydrophobicContact CE1-CD1 4.36Å; F271-L298 HydrophobicContact CG-CD1 3.69Å; A294-L298 PolarHBondContact O-N 2.93Å; Y295-L298 WeakPolarHBondContact O-CB 3.41Å; Y295-L298 PolarHBondContact O-N 3.37Å; Y295-L298 VanDerWaalsContact O-N 3.12Å; L296-L298 PolarHBondContact O-N 2.9Å; L298-G300 PolarHBondContact O-N 2.94Å; L298-T301 WeakPolarHBondContact O-CB 3.1Å; L298-T301 WeakPolarHBondContact O-CG2 3.42Å; L298-T301 PolarHBondContact O-N 3.44Å; L298-T301 PolarHBondContact O-OG1 2.8Å; L298-T304 PolarHBondContact O-OG1 2.76Å; L298-P305 HydrophobicContact CB-CG 4.37Å; L298-F338 HydrophobicContact CD1-CE1 3.62Å; L298-F338 HydrophobicContact CD1-CZ 3.99Å
299	I	98.5	Very high	96.2	Very high	2 Å²	2	17 Å²	17	1%	0.01	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	127.4	-175.2	-57.8	169.5	0	0	0	110.4	L203 L204 F207 L219 I238 L296 T301 T304	L203-I299 HydrophobicContact CB-CG2 4.46Å; L204-I299 WeakPolarHBondContact CD2-O 3.47Å; F207-I299 HydrophobicContact CD1-CD1 4.35Å; F207-I299 HydrophobicContact CD2-CB 3.83Å; F207-I299 HydrophobicContact CD2-CD1 4.31Å; F207-I299 HydrophobicContact CD2-CG2 3.59Å; F207-I299 HydrophobicContact CE1-CD1 4Å; F207-I299 HydrophobicContact CE2-CB 4Å; F207-I299 HydrophobicContact CE2-CD1 3.98Å; F207-I299 HydrophobicContact CE2-CG2 3.39Å; F207-I299 HydrophobicContact CG-CB 4.4Å; F207-I299 HydrophobicContact CZ-CD1 3.8Å; F207-I299 HydrophobicContact CZ-CG2 4.25Å; L219-I299 HydrophobicContact CD1-CD1 4.06Å; L219-I299 HydrophobicContact CD2-CD1 3.25Å; L219-I299 HydrophobicContact CG-CD1 4.28Å; I238-I299 HydrophobicContact CG2-CG2 3.85Å; L296-I299 HydrophobicContact CG-CD1 4.5Å; L296-I299 PolarHBondContact O-N 3.08Å; I299-T301 VanDerWaalsContact C-N 3.34Å; I299-T304 HydrophobicContact CG2-CG2 4.23Å
300	G	97.5	Very high	96.2	Very high	4 Å²	4	17.5 Å²	17.5	4%	0.041	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.3	0.7	-173.7	0	0	0	0	0	113.5	L200 L204 L298 T304	L200-G300 WeakPolarHBondContact CB-O 3.4Å; L200-G300 WeakPolarHBondContact O-CA 3.48Å; L204-G300 VanDerWaalsContact CD1-O 3.3Å; L204-G300 WeakPolarHBondContact CD1-O 3.41Å; L204-G300 WeakPolarHBondContact CG-O 3.31Å; L298-G300 PolarHBondContact O-N 2.94Å; G300-T304 PolarHBondContact N-OG1 3.47Å
301	T	97.6	Very high	96.2	Very high	6 Å²	6	18.8 Å²	18.8	4%	0.037	11%	0.109	C	C	.	.	S	Bend	trans	-89.6	176.8	167.2	75.5	0	0	0	0	111.2	L204 C264 R267 L298 I299 M303 T304	L204-T301 HydrophobicContact CD2-CG2 3.89Å; C264-T301 HydrophobicContact CB-CG2 4.37Å; C264-T301 VanDerWaalsContact SG-CB 3.52Å; R267-T301 HydrophobicContact CB-CG2 4.39Å; R267-T301 HydrophobicContact CG-CG2 4.28Å; L298-T301 WeakPolarHBondContact O-CB 3.1Å; L298-T301 WeakPolarHBondContact O-CG2 3.42Å; L298-T301 PolarHBondContact O-N 3.44Å; L298-T301 PolarHBondContact O-OG1 2.8Å; I299-T301 VanDerWaalsContact C-N 3.34Å; T301-M303 PolarHBondContact O-N 3.38Å; T301-M303 PolarHBondContact OG1-N 2.84Å; T301-T304 PolarHBondContact N-OG1 2.93Å; T301-T304 PolarHBondContact O-N 2.89Å; T301-T304 PolarHBondContact O-OG1 3.38Å
302	A	95.4	Very high	96.1	Very high	30 Å²	30	22.3 Å²	22.3	25%	0.248	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-37.9	173.5	0	0	0	0	0	112.1	L254 T304	L254-A302 HydrophobicContact CD1-CB 4.42Å; L254-A302 WeakPolarHBondContact CD1-O 3.44Å; A302-T304 VanDerWaalsContact C-N 3.34Å; A302-T304 PolarHBondContact O-N 2.62Å
303	M	97.2	Very high	96.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	50.9	179.5	-67.5	178.8	77	0	0	111.8	L254 R255 C258 L268 T301 P305 L317 L334 F338	L254-M303 HydrophobicContact CD2-CG 4.14Å; L254-M303 HydrophobicContact CG-CG 3.87Å; R255-M303 HydrophobicContact CB-CE 4.36Å; R255-M303 HydrophobicContact CB-SD 4.25Å; R255-M303 HydrophobicContact CG-SD 4.44Å; C258-M303 HydrophobicContact CB-CG 3.83Å; C258-M303 HydrophobicContact CB-SD 3.52Å; C258-M303 VanDerWaalsContact CB-SD 3.52Å; L268-M303 HydrophobicContact CD1-CE 3.91Å; L268-M303 HydrophobicContact CD1-SD 4.08Å; L268-M303 HydrophobicContact CD2-CE 4.05Å; L268-M303 HydrophobicContact CD2-SD 3.55Å; L268-M303 VanDerWaalsContact CD2-SD 3.55Å; L268-M303 HydrophobicContact CG-SD 4.36Å; T301-M303 PolarHBondContact O-N 3.38Å; T301-M303 PolarHBondContact OG1-N 2.84Å; M303-P305 WeakPolarHBondContact O-CD 3.37Å; M303-L317 HydrophobicContact CB-CD2 4.04Å; M303-L317 HydrophobicContact CE-CD1 3.56Å; M303-L317 WeakPolarHBondContact O-CD2 3.18Å; M303-L334 HydrophobicContact CE-CD1 4.01Å; M303-L334 HydrophobicContact CE-CD2 4.37Å; M303-F338 HydrophobicContact CE-CE2 4.35Å; M303-F338 HydrophobicContact CE-CZ 4.49Å
304	T	98.3	Very high	96.1	Very high	5 Å²	5	23.6 Å²	23.6	3%	0.031	15%	0.145	C	C	.	.			trans	-71	114.5	176.8	-68.5	0	0	0	0	110.5	I238 L244 L298 I299 G300 T301 A302	I238-T304 HydrophobicContact CD1-CG2 3.7Å; L244-T304 HydrophobicContact CD2-CG2 4.13Å; L298-T304 PolarHBondContact O-OG1 2.76Å; I299-T304 HydrophobicContact CG2-CG2 4.23Å; G300-T304 PolarHBondContact N-OG1 3.47Å; T301-T304 PolarHBondContact N-OG1 2.93Å; T301-T304 PolarHBondContact O-N 2.89Å; T301-T304 PolarHBondContact O-OG1 3.38Å; A302-T304 VanDerWaalsContact C-N 3.34Å; A302-T304 PolarHBondContact O-N 2.62Å
305	P	98.2	Very high	96.3	Very high	1 Å²	1	23.9 Å²	23.9	1%	0.006	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	158.6	173.8	34.2	-34.9	0	0	0	111.1	Y295 L298 M303 A316 L317 F338	Y295-P305 HydrophobicContact CD2-CG 3.99Å; Y295-P305 HydrophobicContact CE2-CB 3.76Å; Y295-P305 HydrophobicContact CE2-CG 3.33Å; L298-P305 HydrophobicContact CB-CG 4.37Å; M303-P305 WeakPolarHBondContact O-CD 3.37Å; P305-A316 WeakPolarHBondContact CA-O 3.36Å; P305-L317 HydrophobicContact CB-CD2 4.29Å; P305-F338 HydrophobicContact CB-CD1 4.18Å; P305-F338 HydrophobicContact CB-CE1 4.4Å
306	N	98.5	Very high	96.3	Very high	10 Å²	10	25 Å²	25	5%	0.053	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	167.1	170.2	-160.4	12	0	0	0	111.7	R235 I238 L244 V308 V315 A316	R235-N306 PolarHBondContact O-ND2 2.88Å; R235-N306 PolarHBondContact O-OD1 3.47Å; I238-N306 HydrophobicContact CD1-CB 3.94Å; L244-N306 HydrophobicContact CD1-CB 4.15Å; N306-V308 PolarHBondContact O-N 3.45Å; N306-V315 VanDerWaalsContact O-CA 3.3Å; N306-V315 WeakPolarHBondContact O-CA 3.22Å; N306-A316 PolarHBondContact N-O 3.29Å; N306-A316 PolarHBondContact O-N 2.87Å
307	F	98.1	Very high	96.3	Very high	5 Å²	5	25.2 Å²	25.2	2%	0.022	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	129.2	167.1	-65.4	-81.8	0	0	0	110.3	L219 L220 R234 R235 S314 V315 M352	L219-F307 WeakPolarHBondContact O-CE2 3.47Å; L220-F307 HydrophobicContact CD2-CZ 4.19Å; R234-F307 HydrophobicContact CG-CD2 3.72Å; R234-F307 HydrophobicContact CG-CE2 3.46Å; R234-F307 VanDerWaalsContact CG-CE2 3.46Å; R234-F307 HydrophobicContact CG-CG 4.45Å; R234-F307 HydrophobicContact CG-CZ 4Å; R235-F307 HydrophobicContact CB-CB 4.48Å; R235-F307 HydrophobicContact CG-CB 4.44Å; R235-F307 WeakPolarHBondContact CG-O 3.48Å; F307-S314 WeakPolarHBondContact CA-O 3.36Å; F307-V315 HydrophobicContact CD1-CG1 3.73Å; F307-V315 HydrophobicContact CE1-CG1 3.78Å; F307-V315 HydrophobicContact CG-CG1 4.3Å; F307-V315 HydrophobicContact CZ-CG1 4.37Å; F307-M352 HydrophobicContact CE1-CE 4.06Å; F307-M352 HydrophobicContact CZ-CE 3.95Å
308	V	95.3	Very high	96.3	Very high	94 Å²	94	26.7 Å²	26.7	57%	0.57	17%	0.168	S	C	*	.	S	Bend	trans	-75.1	-39.3	-179.1	-178.5	0	0	0	0	110.7	N306 S314 A316	N306-V308 PolarHBondContact O-N 3.45Å; V308-S314 PolarHBondContact N-O 2.99Å; V308-A316 HydrophobicContact CG2-CB 3.55Å
309	S	91.6	Very high	96.3	Very high	32 Å²	32	27.4 Å²	27.4	22%	0.224	17%	0.173	C	C	.	.			trans	-124.4	159.7	-174.1	-177.3	0	0	0	0	112.1	V311	S309-V311 VanDerWaalsContact OG-CG2 3.28Å; S309-V311 WeakPolarHBondContact OG-CG2 3.47Å; S309-V311 PolarHBondContact OG-N 3.01Å
310	N	92.3	Very high	96.2	Very high	50 Å²	50	30 Å²	30	27%	0.267	19%	0.189	S	C	.	.	S	Bend	trans	-91.6	2.8	173.7	62.2	-9	0	0	0	113.4	G231 E232	G231-N310 WeakPolarHBondContact CA-O 3.49Å; E232-N310 HydrophobicContact CB-CB 4.34Å
311	V	91.4	Very high	96.2	Very high	64 Å²	64	30.3 Å²	30.3	39%	0.388	19%	0.19	S	C	.	.	S	Bend	trans	-110.4	-32.4	178	-63.9	0	0	0	0	114	R228 S309	R228-V311 HydrophobicContact CG-CG1 4.3Å; S309-V311 VanDerWaalsContact OG-CG2 3.28Å; S309-V311 WeakPolarHBondContact OG-CG2 3.47Å; S309-V311 PolarHBondContact OG-N 3.01Å
312	N	92.9	Very high	96.2	Very high	74 Å²	74	40.3 Å²	40.3	40%	0.396	23%	0.227	S	C	.	.	S	Bend	trans	-115.6	177.7	-177.7	71.9	21.9	0	0	0	111	R234 S314	R234-N312 PolarHBondContact NH2-O 3.1Å; N312-S314 PolarHBondContact ND2-OG 3.44Å; N312-S314 WeakPolarHBondContact OD1-CB 3.43Å; N312-S314 PolarHBondContact OD1-N 3.38Å; N312-S314 VanDerWaalsContact OD1-N 3.08Å; N312-S314 PolarHBondContact OD1-OG 2.96Å
313	T	95.1	Very high	96.2	Very high	53 Å²	53	42.4 Å²	42.4	33%	0.325	25%	0.252	S	S	.	.			trans	-103.1	19.8	-179.8	57.6	0	0	0	0	112.5	M352	T313-M352 HydrophobicContact CG2-CE 3.87Å; T313-M352 HydrophobicContact CG2-SD 3.5Å; T313-M352 WeakPolarHBondContact CG2-SD 3.46Å
314	S	95.8	Very high	96	Very high	46 Å²	46	43.1 Å²	43.1	32%	0.322	26%	0.257	S	S	.	.			trans	-67.9	134.5	177.2	65	0	0	0	0	110.5	F307 V308 N312	F307-S314 WeakPolarHBondContact CA-O 3.36Å; V308-S314 PolarHBondContact N-O 2.99Å; N312-S314 PolarHBondContact ND2-OG 3.44Å; N312-S314 WeakPolarHBondContact OD1-CB 3.43Å; N312-S314 PolarHBondContact OD1-N 3.38Å; N312-S314 VanDerWaalsContact OD1-N 3.08Å; N312-S314 PolarHBondContact OD1-OG 2.96Å
315	V	98.1	Very high	95.9	Very high	7 Å²	7	45.6 Å²	45.6	4%	0.042	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	142.8	-178.4	-61	0	0	0	0	109.5	Y295 N306 F307 F338 S339 L344 I348	Y295-V315 HydrophobicContact CE2-CG2 4.27Å; Y295-V315 WeakPolarHBondContact OH-CG1 2.99Å; N306-V315 VanDerWaalsContact O-CA 3.3Å; N306-V315 WeakPolarHBondContact O-CA 3.22Å; F307-V315 HydrophobicContact CD1-CG1 3.73Å; F307-V315 HydrophobicContact CE1-CG1 3.78Å; F307-V315 HydrophobicContact CG-CG1 4.3Å; F307-V315 HydrophobicContact CZ-CG1 4.37Å; V315-F338 CarbonylContact O-C 3.56Å; V315-S339 VanDerWaalsContact O-CA 3.32Å; V315-S339 WeakPolarHBondContact O-CA 3.33Å; V315-L344 HydrophobicContact CG2-CD2 3.71Å; V315-I348 HydrophobicContact CG1-CD1 4.16Å; V315-I348 HydrophobicContact CG2-CD1 4.28Å
316	A	97.9	Very high	95.7	Very high	25 Å²	25	53.8 Å²	53.8	21%	0.207	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	168.2	176.6	0	0	0	0	0	110.5	P305 N306 V308	P305-A316 WeakPolarHBondContact CA-O 3.36Å; N306-A316 PolarHBondContact N-O 3.29Å; N306-A316 PolarHBondContact O-N 2.87Å; V308-A316 HydrophobicContact CG2-CB 3.55Å
317	L	97.7	Very high	95.5	Very high	18 Å²	18	55.9 Å²	55.9	9%	0.094	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	156.8	164.6	-64.9	176.3	0	0	0	110.3	M303 P305 C319 F338	M303-L317 HydrophobicContact CB-CD2 4.04Å; M303-L317 HydrophobicContact CE-CD1 3.56Å; M303-L317 WeakPolarHBondContact O-CD2 3.18Å; P305-L317 HydrophobicContact CB-CD2 4.29Å; L317-C319 VanDerWaalsContact C-N 3.33Å; L317-C319 VanDerWaalsContact CB-SG 3.54Å; L317-C319 PolarHBondContact O-N 3.5Å; L317-F338 HydrophobicContact CD1-CD2 3.82Å; L317-F338 HydrophobicContact CD1-CE2 3.56Å; L317-F338 HydrophobicContact CD1-CZ 4.03Å; L317-F338 HydrophobicContact CD2-CD1 4.34Å; L317-F338 HydrophobicContact CD2-CE1 4.04Å; L317-F338 HydrophobicContact CD2-CE2 4.35Å; L317-F338 HydrophobicContact CD2-CZ 4.04Å; L317-F338 HydrophobicContact CG-CD1 4.27Å; L317-F338 HydrophobicContact CG-CD2 3.88Å; L317-F338 HydrophobicContact CG-CE1 4.29Å; L317-F338 HydrophobicContact CG-CE2 3.93Å; L317-F338 HydrophobicContact CG-CG 4.07Å; L317-F338 HydrophobicContact CG-CZ 4.13Å
318	S	96.9	Very high	95.4	Very high	35 Å²	35	58.9 Å²	58.9	25%	0.245	35%	0.352	C	S	.	.	S	Bend	trans	-89.5	73.4	170.4	-170.8	0	0	0	0	109.7	P249	P249-S318 WeakPolarHBondContact CD-O 3.45Å
319	C	97.5	Very high	95.4	Very high	15 Å²	15	60.8 Å²	60.8	10%	0.101	36%	0.355	C	S	.	.			trans	-152.6	174.4	177.6	61.3	0	0	0	0	109.8	P249 C251 L254 L317	P249-C319 HydrophobicContact CG-CB 4.4Å; P249-C319 CarbonylContact O-C 3.53Å; P249-C319 VanDerWaalsContact O-CA 3.27Å; P249-C319 WeakPolarHBondContact O-CA 3.33Å; P249-C319 VanDerWaalsContact O-CB 3.28Å; P249-C319 WeakPolarHBondContact O-CB 3.33Å; C251-C319 WeakPolarHBondContact CA-SG 3.25Å; C251-C319 HydrophobicContact CB-CB 3.9Å; C251-C319 WeakPolarHBondContact CB-SG 3.42Å; C251-C319 VanDerWaalsContact SG-C 3.52Å; C251-C319 WeakPolarHBondContact SG-CB 3.34Å; C251-C319 CovalentContact SG-SG 2.02Å; C251-C319 PolarHBondContact SG-SG 3.38Å; L254-C319 HydrophobicContact CD2-CB 4.21Å; L317-C319 VanDerWaalsContact C-N 3.33Å; L317-C319 VanDerWaalsContact CB-SG 3.54Å; L317-C319 PolarHBondContact O-N 3.5Å
320	T	97.5	Very high	95.5	Very high	56 Å²	56	62.5 Å²	62.5	34%	0.344	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-136.7	157.6	174.1	71.9	0	0	0	0	110.8	A248 P249 N250 C251 R322 E335	A248-T320 HydrophobicContact CB-CG2 3.91Å; P249-T320 PolarHBondContact O-N 3.4Å; N250-T320 VanDerWaalsContact CA-O 3.24Å; N250-T320 WeakPolarHBondContact CA-O 3.02Å; C251-T320 PolarHBondContact N-O 3.18Å; C251-T320 VanDerWaalsContact N-O 3.13Å; T320-R322 PolarHBondContact O-N 3.46Å; T320-R322 PolarHBondContact OG1-N 3.1Å; T320-E335 WeakPolarHBondContact CA-OE1 3.22Å
321	C	97.8	Very high	95.7	Very high	10 Å²	10	60.1 Å²	60.1	7%	0.068	35%	0.346	C	S	.	.			trans	-85.5	17.7	167.9	-66.2	0	0	0	0	114.8	G323 S324 Q328 C331 E332 E335	C321-G323 PolarHBondContact O-N 2.97Å; C321-S324 PolarHBondContact O-OG 2.97Å; C321-Q328 PolarHBondContact O-OE1 3.13Å; C321-C331 WeakPolarHBondContact CA-SG 3.48Å; C321-C331 HydrophobicContact CB-CB 3.77Å; C321-C331 WeakPolarHBondContact CB-SG 3.43Å; C321-C331 WeakPolarHBondContact SG-CB 3.33Å; C321-C331 PolarHBondContact SG-O 3.41Å; C321-C331 CovalentContact SG-SG 2.03Å; C321-C331 PolarHBondContact SG-SG 3.31Å; C321-E332 HydrophobicContact CB-CG 4.39Å; C321-E332 PolarHBondContact SG-N 2.98Å; C321-E335 PolarHBondContact N-OE1 3.48Å; C321-E335 PolarHBondContact SG-OE1 3.09Å
322	R	96.5	Very high	96	Very high	216 Å²	216	61.9 Å²	61.9	82%	0.815	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	133.5	172.7	-173.8	178.9	-74	-152.3	-2	109.8	N250 T320	N250-R322 PolarHBondContact ND2-O 3.33Å; T320-R322 PolarHBondContact O-N 3.46Å; T320-R322 PolarHBondContact OG1-N 3.1Å
323	G	94.8	Very high	96.1	Very high	75 Å²	75	64 Å²	64	77%	0.773	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	18.2	176.6	0	0	0	0	0	114.8	C321 G325	C321-G323 PolarHBondContact O-N 2.97Å; G323-G325 VanDerWaalsContact C-N 3.34Å
324	S	94.9	Very high	96.1	Very high	14 Å²	14	62 Å²	62	10%	0.098	35%	0.345	C	S	.	.			trans	-76.2	-18.8	178	-54.7	0	0	0	0	113.8	N250 C321 N326 L327	N250-S324 PolarHBondContact ND2-OG 3.1Å; C321-S324 PolarHBondContact O-OG 2.97Å; S324-N326 PolarHBondContact O-N 3.43Å; S324-L327 PolarHBondContact O-N 2.76Å; S324-L327 VanDerWaalsContact O-N 3.11Å
325	G	95.3	Very high	96.2	Very high	57 Å²	57	62.6 Å²	62.6	59%	0.588	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	60	-126.5	-179.8	0	0	0	0	0	111.8	G323 L327 Q328	G323-G325 VanDerWaalsContact C-N 3.34Å; G325-L327 PolarHBondContact O-N 3.03Å; G325-Q328 PolarHBondContact O-N 3.12Å
326	N	94.8	Very high	96.1	Very high	173 Å²	173	63 Å²	63	93%	0.925	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-67.4	-14.7	179.1	-65.2	-10.9	0	0	0	113.7	S324 Q328	S324-N326 PolarHBondContact O-N 3.43Å; N326-Q328 VanDerWaalsContact C-N 3.33Å
327	L	93.3	Very high	96	Very high	54 Å²	54	63.6 Å²	63.6	28%	0.283	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-96.8	22.7	178.8	-56.1	177.8	0	0	0	112.3	L252 S324 G325 E329 E330 C331	L252-L327 HydrophobicContact CD1-CB 3.46Å; L252-L327 VanDerWaalsContact CD1-CB 3.46Å; L252-L327 HydrophobicContact CD1-CD1 4.01Å; L252-L327 HydrophobicContact CD1-CG 4.4Å; S324-L327 PolarHBondContact O-N 2.76Å; S324-L327 VanDerWaalsContact O-N 3.11Å; G325-L327 PolarHBondContact O-N 3.03Å; L327-E329 PolarHBondContact O-N 3.46Å; L327-E330 PolarHBondContact O-N 3.01Å; L327-C331 WeakPolarHBondContact O-CB 3.46Å; L327-C331 PolarHBondContact O-N 3.33Å
328	Q	96.4	Very high	96	Very high	69 Å²	69	62.8 Å²	62.8	32%	0.322	34%	0.343	S	S	.	.	H	α-helix	trans	-57.1	-50	-180	-174.4	65.4	29.6	0	0	111.9	C321 G325 N326 E330 C331 E332	C321-Q328 PolarHBondContact O-OE1 3.13Å; G325-Q328 PolarHBondContact O-N 3.12Å; N326-Q328 VanDerWaalsContact C-N 3.33Å; Q328-E330 PolarHBondContact O-N 3.29Å; Q328-C331 WeakPolarHBondContact O-CB 3.37Å; Q328-C331 PolarHBondContact O-N 2.94Å; Q328-E332 WeakPolarHBondContact CG-OE1 2.98Å; Q328-E332 PolarHBondContact NE2-OE1 3.37Å; Q328-E332 WeakPolarHBondContact O-CG 3.07Å; Q328-E332 PolarHBondContact O-N 2.96Å
329	E	95.4	Very high	95.9	Very high	133 Å²	133	63.2 Å²	63.2	62%	0.621	35%	0.345	S	S	*	.	H	α-helix	trans	-63.2	-43.4	-179.1	-171.3	-175.7	170.2	0	0	111.6	L327 C331 E332 Q333	L327-E329 PolarHBondContact O-N 3.46Å; E329-C331 VanDerWaalsContact C-N 3.25Å; E329-C331 PolarHBondContact O-N 3.42Å; E329-E332 PolarHBondContact O-N 3.16Å; E329-Q333 WeakPolarHBondContact O-CB 3.4Å; E329-Q333 VanDerWaalsContact O-CG 3.27Å; E329-Q333 WeakPolarHBondContact O-CG 3.44Å; E329-Q333 PolarHBondContact O-N 2.87Å; E329-Q333 PolarHBondContact OE1-NE2 3.28Å
330	E	94	Very high	95.9	Very high	68 Å²	68	69.9 Å²	69.9	32%	0.318	38%	0.375	S	S	.	.	H	α-helix	trans	-60.8	-38.1	176.9	-167.9	-171.3	174.5	0	0	111.6	L252 R255 L327 Q328 L334	L252-E330 HydrophobicContact CD2-CG 4.36Å; R255-E330 IonicContact CZ-OE1 3.5Å; R255-E330 IonicContact NH1-OE1 3.29Å; R255-E330 PolarHBondContact NH1-OE1 2.04Å; R255-E330 IonicContact NH2-OE1 3.16Å; R255-E330 PolarHBondContact NH2-OE1 2.85Å; R255-E330 IonicContact NH2-OE2 2.65Å; L327-E330 PolarHBondContact O-N 3.01Å; Q328-E330 PolarHBondContact O-N 3.29Å; E330-L334 PolarHBondContact O-N 2.86Å
331	C	96.7	Very high	95.8	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-66.6	-45.3	175.4	-174.4	0	0	0	0	112	L252 C321 L327 Q328 E329 Q333 L334 E335	L252-C331 HydrophobicContact CD1-CB 3.99Å; L252-C331 HydrophobicContact CD2-CB 4.08Å; L252-C331 HydrophobicContact CG-CB 3.81Å; C321-C331 WeakPolarHBondContact CA-SG 3.48Å; C321-C331 HydrophobicContact CB-CB 3.77Å; C321-C331 WeakPolarHBondContact CB-SG 3.43Å; C321-C331 WeakPolarHBondContact SG-CB 3.33Å; C321-C331 PolarHBondContact SG-O 3.41Å; C321-C331 CovalentContact SG-SG 2.03Å; C321-C331 PolarHBondContact SG-SG 3.31Å; L327-C331 WeakPolarHBondContact O-CB 3.46Å; L327-C331 PolarHBondContact O-N 3.33Å; Q328-C331 WeakPolarHBondContact O-CB 3.37Å; Q328-C331 PolarHBondContact O-N 2.94Å; E329-C331 VanDerWaalsContact C-N 3.25Å; E329-C331 PolarHBondContact O-N 3.42Å; C331-Q333 VanDerWaalsContact C-N 3.32Å; C331-Q333 PolarHBondContact O-N 3.47Å; C331-L334 WeakPolarHBondContact O-CB 3.42Å; C331-L334 PolarHBondContact O-N 3.14Å; C331-L334 VanDerWaalsContact O-N 3.12Å; C331-E335 PolarHBondContact O-N 2.81Å
332	E	97.3	Very high	95.8	Very high	102 Å²	102	68.5 Å²	68.5	48%	0.477	37%	0.367	S	S	.	.	H	α-helix	trans	-65.9	-36.3	179.4	-73.2	172.7	-175.6	0	0	111.8	C321 Q328 E329 L334 E335 G336	C321-E332 HydrophobicContact CB-CG 4.39Å; C321-E332 PolarHBondContact SG-N 2.98Å; Q328-E332 WeakPolarHBondContact CG-OE1 2.98Å; Q328-E332 PolarHBondContact NE2-OE1 3.37Å; Q328-E332 WeakPolarHBondContact O-CG 3.07Å; Q328-E332 PolarHBondContact O-N 2.96Å; E329-E332 PolarHBondContact O-N 3.16Å; E332-L334 VanDerWaalsContact C-N 3.34Å; E332-E335 PolarHBondContact O-N 3.3Å; E332-G336 PolarHBondContact O-N 3.1Å
333	Q	95.4	Very high	95.8	Very high	118 Å²	118	58.2 Å²	58.2	55%	0.551	33%	0.328	S	S	*	.	H	α-helix	trans	-61.5	-43.1	170.5	-72	175.5	8.7	0	0	111.2	E329 C331 G336 F337	E329-Q333 WeakPolarHBondContact O-CB 3.4Å; E329-Q333 VanDerWaalsContact O-CG 3.27Å; E329-Q333 WeakPolarHBondContact O-CG 3.44Å; E329-Q333 PolarHBondContact O-N 2.87Å; E329-Q333 PolarHBondContact OE1-NE2 3.28Å; C331-Q333 VanDerWaalsContact C-N 3.32Å; C331-Q333 PolarHBondContact O-N 3.47Å; Q333-G336 PolarHBondContact O-N 2.78Å; Q333-F337 WeakPolarHBondContact O-CB 3.5Å; Q333-F337 PolarHBondContact O-N 3.08Å
334	L	95.2	Very high	96	Very high	11 Å²	11	54.7 Å²	54.7	6%	0.058	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-46.9	175.5	175.8	64.2	0	0	0	112.1	C251 L252 R255 M303 E330 C331 E332 F337 F338	C251-L334 HydrophobicContact CB-CD2 3.98Å; L252-L334 HydrophobicContact CD2-CD2 4.29Å; R255-L334 HydrophobicContact CB-CD2 3.97Å; R255-L334 HydrophobicContact CG-CD2 4.47Å; M303-L334 HydrophobicContact CE-CD1 4.01Å; M303-L334 HydrophobicContact CE-CD2 4.37Å; E330-L334 PolarHBondContact O-N 2.86Å; C331-L334 WeakPolarHBondContact O-CB 3.42Å; C331-L334 PolarHBondContact O-N 3.14Å; C331-L334 VanDerWaalsContact O-N 3.12Å; E332-L334 VanDerWaalsContact C-N 3.34Å; L334-F337 PolarHBondContact O-N 3.35Å; L334-F338 HydrophobicContact CD1-CE2 4.33Å; L334-F338 WeakPolarHBondContact O-CD2 3.41Å
335	E	96.4	Very high	96.1	Very high	58 Å²	58	57.5 Å²	57.5	27%	0.271	31%	0.308	S	S	.	.	H	α-helix	trans	-60.9	-47.7	175.5	-76.4	-174.1	172.5	0	0	111.3	C251 T320 C321 C331 E332 F337 F338 S339	C251-E335 HydrophobicContact CB-CG 4.33Å; C251-E335 WeakPolarHBondContact SG-CG 3.44Å; C251-E335 PolarHBondContact SG-OE1 2.69Å; T320-E335 WeakPolarHBondContact CA-OE1 3.22Å; C321-E335 PolarHBondContact N-OE1 3.48Å; C321-E335 PolarHBondContact SG-OE1 3.09Å; C331-E335 PolarHBondContact O-N 2.81Å; E332-E335 PolarHBondContact O-N 3.3Å; E335-F337 PolarHBondContact O-N 3.47Å; E335-F338 PolarHBondContact O-N 3.05Å; E335-S339 PolarHBondContact O-N 3.38Å; E335-S339 PolarHBondContact O-OG 3.03Å
336	G	96.3	Very high	96.2	Very high	16 Å²	16	57.9 Å²	57.9	17%	0.165	29%	0.294	C	S	.	.	H	α-helix	trans	-60.5	-30.6	179.6	0	0	0	0	0	113.4	E332 Q333 F338 S339 H340 N341	E332-G336 PolarHBondContact O-N 3.1Å; Q333-G336 PolarHBondContact O-N 2.78Å; G336-F338 PolarHBondContact O-N 3.03Å; G336-F338 VanDerWaalsContact O-N 3.12Å; G336-S339 PolarHBondContact O-N 3.28Å; G336-H340 CarbonylContact O-C 3.27Å; G336-H340 VanDerWaalsContact O-C 3.27Å; G336-H340 WeakPolarHBondContact O-CA 3.33Å; G336-H340 PolarHBondContact O-N 2.92Å; G336-N341 PolarHBondContact O-N 3.21Å
337	F	95.9	Very high	96.3	Very high	37 Å²	37	49.7 Å²	49.7	16%	0.162	25%	0.251	C	S	.	.	H	α-helix	trans	-63.7	-16.8	175.1	-157.8	-98.3	0	0	0	113.4	F271 Q272 H276 Q333 L334 E335 N341	F271-F337 HydrophobicContact CD1-CD1 4.07Å; F271-F337 AromaticContact CD1-CE1 3.85Å; F271-F337 HydrophobicContact CD1-CE1 3.85Å; F271-F337 AromaticContact CE1-CD1 3.51Å; F271-F337 HydrophobicContact CE1-CD1 3.51Å; F271-F337 AromaticContact CE1-CE1 3.62Å; F271-F337 HydrophobicContact CE1-CE1 3.62Å; F271-F337 HydrophobicContact CZ-CD1 4.29Å; F271-F337 HydrophobicContact CZ-CE1 4.29Å; Q272-F337 HydrophobicContact CB-CE1 4.33Å; Q272-F337 HydrophobicContact CB-CZ 4.43Å; Q272-F337 HydrophobicContact CG-CD1 4.45Å; Q272-F337 HydrophobicContact CG-CE1 3.96Å; Q272-F337 HydrophobicContact CG-CZ 4.42Å; H276-F337 AromaticContact ND1-CE2 3.96Å; Q333-F337 WeakPolarHBondContact O-CB 3.5Å; Q333-F337 PolarHBondContact O-N 3.08Å; L334-F337 PolarHBondContact O-N 3.35Å; E335-F337 PolarHBondContact O-N 3.47Å; F337-N341 VanDerWaalsContact O-CB 3.24Å; F337-N341 WeakPolarHBondContact O-CB 3.39Å; F337-N341 PolarHBondContact O-ND2 2.63Å; F337-N341 VanDerWaalsContact O-ND2 3.09Å
338	F	97.1	Very high	96.5	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.009	24%	0.238	C	C	.	.	H	α-helix	trans	-102.1	-50.9	169.9	-67.6	-92.5	0	0	0	112.2	L268 F271 L298 M303 P305 V315 L317 L334 E335 G336	L268-F338 HydrophobicContact CD1-CZ 4.27Å; F271-F338 AromaticContact CD1-CE1 3.97Å; F271-F338 HydrophobicContact CD1-CE1 3.97Å; F271-F338 AromaticContact CD1-CZ 3.89Å; F271-F338 HydrophobicContact CD1-CZ 3.89Å; F271-F338 AromaticContact CE1-CD1 3.79Å; F271-F338 HydrophobicContact CE1-CD1 3.79Å; F271-F338 HydrophobicContact CE1-CD2 4.45Å; F271-F338 AromaticContact CE1-CE1 3.36Å; F271-F338 HydrophobicContact CE1-CE1 3.36Å; F271-F338 HydrophobicContact CE1-CE2 4.07Å; F271-F338 HydrophobicContact CE1-CG 4.33Å; F271-F338 AromaticContact CE1-CZ 3.51Å; F271-F338 HydrophobicContact CE1-CZ 3.51Å; F271-F338 AromaticContact CZ-CD1 3.9Å; F271-F338 HydrophobicContact CZ-CD1 3.9Å; F271-F338 AromaticContact CZ-CE1 3.81Å; F271-F338 HydrophobicContact CZ-CE1 3.81Å; F271-F338 HydrophobicContact CZ-CZ 4.4Å; L298-F338 HydrophobicContact CD1-CE1 3.62Å; L298-F338 HydrophobicContact CD1-CZ 3.99Å; M303-F338 HydrophobicContact CE-CE2 4.35Å; M303-F338 HydrophobicContact CE-CZ 4.49Å; P305-F338 HydrophobicContact CB-CD1 4.18Å; P305-F338 HydrophobicContact CB-CE1 4.4Å; V315-F338 CarbonylContact O-C 3.56Å; L317-F338 HydrophobicContact CD1-CD2 3.82Å; L317-F338 HydrophobicContact CD1-CE2 3.56Å; L317-F338 HydrophobicContact CD1-CZ 4.03Å; L317-F338 HydrophobicContact CD2-CD1 4.34Å; L317-F338 HydrophobicContact CD2-CE1 4.04Å; L317-F338 HydrophobicContact CD2-CE2 4.35Å; L317-F338 HydrophobicContact CD2-CZ 4.04Å; L317-F338 HydrophobicContact CG-CD1 4.27Å; L317-F338 HydrophobicContact CG-CD2 3.88Å; L317-F338 HydrophobicContact CG-CE1 4.29Å; L317-F338 HydrophobicContact CG-CE2 3.93Å; L317-F338 HydrophobicContact CG-CG 4.07Å; L317-F338 HydrophobicContact CG-CZ 4.13Å; L334-F338 HydrophobicContact CD1-CE2 4.33Å; L334-F338 WeakPolarHBondContact O-CD2 3.41Å; E335-F338 PolarHBondContact O-N 3.05Å; G336-F338 PolarHBondContact O-N 3.03Å; G336-F338 VanDerWaalsContact O-N 3.12Å
339	S	96.4	Very high	96.5	Very high	43 Å²	43	45.3 Å²	45.3	30%	0.301	23%	0.234	S	C	.	.	H	α-helix	trans	-85.3	-22.8	-169	65.2	0	0	0	0	114.7	V315 E335 G336	V315-S339 VanDerWaalsContact O-CA 3.32Å; V315-S339 WeakPolarHBondContact O-CA 3.33Å; E335-S339 PolarHBondContact O-N 3.38Å; E335-S339 PolarHBondContact O-OG 3.03Å; G336-S339 PolarHBondContact O-N 3.28Å
340	H	95.9	Very high	96.6	Very high	155 Å²	155	40 Å²	40	72%	0.718	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-126.8	30.2	-175.9	-58.6	109.5	0	0	0	111.8	G336 P342	G336-H340 CarbonylContact O-C 3.27Å; G336-H340 VanDerWaalsContact O-C 3.27Å; G336-H340 WeakPolarHBondContact O-CA 3.33Å; G336-H340 PolarHBondContact O-N 2.92Å; H340-P342 VanDerWaalsContact O-CD 3.3Å; H340-P342 WeakPolarHBondContact O-CD 3.37Å
341	N	96.9	Very high	96.7	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.011	21%	0.205	C	C	.	.			trans	-92.8	109.4	-179.5	-175.1	-34.4	0	0	0	110.8	C275 G336 F337 C343 L344 T345	C275-N341 PolarHBondContact O-ND2 3.38Å; G336-N341 PolarHBondContact O-N 3.21Å; F337-N341 VanDerWaalsContact O-CB 3.24Å; F337-N341 WeakPolarHBondContact O-CB 3.39Å; F337-N341 PolarHBondContact O-ND2 2.63Å; F337-N341 VanDerWaalsContact O-ND2 3.09Å; N341-C343 PolarHBondContact O-N 3.27Å; N341-C343 WeakPolarHBondContact OD1-CB 3.42Å; N341-C343 PolarHBondContact OD1-N 2.9Å; N341-L344 HydrophobicContact CB-CB 3.97Å; N341-L344 PolarHBondContact O-N 3.28Å; N341-L344 PolarHBondContact OD1-N 3.18Å; N341-T345 WeakPolarHBondContact O-CB 3.32Å; N341-T345 PolarHBondContact O-N 3.01Å; N341-T345 PolarHBondContact O-OG1 2.87Å
342	P	96.8	Very high	96.7	Very high	36 Å²	36	39.2 Å²	39.2	23%	0.234	21%	0.209	C	C	.	.	H	α-helix	trans	-66.8	-36.1	-177.1	27.7	-35.8	0	0	0	112.2	P277 D279 H340 T345 E346	P277-P342 HydrophobicContact CB-CG 3.77Å; D279-P342 VanDerWaalsContact O-CG 3.32Å; D279-P342 WeakPolarHBondContact O-CG 3.5Å; H340-P342 VanDerWaalsContact O-CD 3.3Å; H340-P342 WeakPolarHBondContact O-CD 3.37Å; P342-T345 PolarHBondContact O-N 3.11Å; P342-E346 WeakPolarHBondContact O-CB 3.23Å; P342-E346 PolarHBondContact O-N 3.04Å
343	C	97.5	Very high	96.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.4	-49.7	175.2	153.8	0	0	0	0	111.5	P277 C284 N341 T345 E346 A347	P277-C343 HydrophobicContact CB-CB 4.48Å; C284-C343 WeakPolarHBondContact CA-SG 3.24Å; C284-C343 HydrophobicContact CB-CB 3.97Å; C284-C343 WeakPolarHBondContact CB-SG 3.34Å; C284-C343 WeakPolarHBondContact SG-CB 3.22Å; C284-C343 CovalentContact SG-SG 2.03Å; C284-C343 PolarHBondContact SG-SG 3.48Å; N341-C343 PolarHBondContact O-N 3.27Å; N341-C343 WeakPolarHBondContact OD1-CB 3.42Å; N341-C343 PolarHBondContact OD1-N 2.9Å; C343-T345 VanDerWaalsContact C-N 3.34Å; C343-T345 PolarHBondContact O-N 3.4Å; C343-E346 PolarHBondContact O-N 3.42Å; C343-A347 VanDerWaalsContact O-CB 3.25Å; C343-A347 WeakPolarHBondContact O-CB 3.44Å; C343-A347 PolarHBondContact O-N 3.35Å
344	L	97.8	Very high	96.5	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.8	-42.8	179.2	179.5	61.3	0	0	0	111.3	F271 Y295 V315 N341 A347 I348	F271-L344 HydrophobicContact CE2-CD1 4.29Å; F271-L344 HydrophobicContact CE2-CD2 4.09Å; F271-L344 HydrophobicContact CZ-CD2 3.96Å; Y295-L344 HydrophobicContact CD1-CD1 4.49Å; Y295-L344 HydrophobicContact CD2-CD1 3.95Å; Y295-L344 HydrophobicContact CD2-CD2 4.02Å; Y295-L344 HydrophobicContact CE2-CD2 4.2Å; Y295-L344 HydrophobicContact CG-CD1 3.9Å; V315-L344 HydrophobicContact CG2-CD2 3.71Å; N341-L344 HydrophobicContact CB-CB 3.97Å; N341-L344 PolarHBondContact O-N 3.28Å; N341-L344 PolarHBondContact OD1-N 3.18Å; L344-A347 PolarHBondContact O-N 3.37Å; L344-I348 HydrophobicContact CD1-CD1 3.88Å; L344-I348 HydrophobicContact CD1-CG1 4.12Å; L344-I348 HydrophobicContact CG-CD1 3.9Å; L344-I348 HydrophobicContact CG-CG1 4.48Å; L344-I348 WeakPolarHBondContact O-CG1 3.46Å; L344-I348 PolarHBondContact O-N 3.02Å
345	T	97.3	Very high	96.4	Very high	73 Å²	73	37.5 Å²	37.5	45%	0.448	19%	0.194	S	C	.	.	H	α-helix	trans	-60.3	-48.9	179.6	-58.9	0	0	0	0	110.8	N341 P342 C343 I348 A349	N341-T345 WeakPolarHBondContact O-CB 3.32Å; N341-T345 PolarHBondContact O-N 3.01Å; N341-T345 PolarHBondContact O-OG1 2.87Å; P342-T345 PolarHBondContact O-N 3.11Å; C343-T345 VanDerWaalsContact C-N 3.34Å; C343-T345 PolarHBondContact O-N 3.4Å; T345-I348 PolarHBondContact O-N 3.3Å; T345-A349 WeakPolarHBondContact O-CB 3.45Å; T345-A349 PolarHBondContact O-N 3.38Å
346	E	97.3	Very high	96.2	Very high	66 Å²	66	36.3 Å²	36.3	31%	0.308	19%	0.192	S	C	.	.	H	α-helix	trans	-68.2	-38	179.2	-178.2	52.6	-151.5	0	0	111.9	P342 C343 I348 A349 A350 R353	P342-E346 WeakPolarHBondContact O-CB 3.23Å; P342-E346 PolarHBondContact O-N 3.04Å; C343-E346 PolarHBondContact O-N 3.42Å; E346-I348 PolarHBondContact O-N 3.44Å; E346-A349 PolarHBondContact O-N 3.44Å; E346-A350 VanDerWaalsContact O-CB 3.26Å; E346-A350 WeakPolarHBondContact O-CB 3.41Å; E346-A350 PolarHBondContact O-N 3Å; E346-R353 IonicContact OE1-CZ 3.94Å; E346-R353 IonicContact OE1-NH1 3.2Å; E346-R353 PolarHBondContact OE1-NH1 3.21Å; E346-R353 IonicContact OE1-NH2 2.98Å; E346-R353 PolarHBondContact OE1-NH2 3.06Å; E346-R353 IonicContact OE2-NH2 2.58Å; E346-R353 PolarHBondContact OE2-NH2 2.89Å
347	A	97.3	Very high	95.8	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-62.5	-43.7	175.6	0	0	0	0	0	112.3	Q288 L292 C343 L344 K351	Q288-A347 HydrophobicContact CB-CB 3.9Å; Q288-A347 HydrophobicContact CG-CB 4.08Å; L292-A347 HydrophobicContact CD2-CB 3.96Å; L292-A347 HydrophobicContact CG-CB 4.07Å; C343-A347 VanDerWaalsContact O-CB 3.25Å; C343-A347 WeakPolarHBondContact O-CB 3.44Å; C343-A347 PolarHBondContact O-N 3.35Å; L344-A347 PolarHBondContact O-N 3.37Å; A347-K351 WeakPolarHBondContact O-CB 3.43Å; A347-K351 PolarHBondContact O-N 3.07Å
348	I	97.9	Very high	95.4	Very high	3 Å²	3	41 Å²	41	2%	0.015	21%	0.211	C	C	.	.	H	α-helix	trans	-64.5	-45.4	174.9	-69	171.7	0	0	0	110	L220 L292 Y295 V315 L344 T345 E346 K351 M352	L220-I348 HydrophobicContact CD2-CG1 4.39Å; L220-I348 HydrophobicContact CD2-CG2 4.49Å; L292-I348 HydrophobicContact CD2-CG1 3.93Å; Y295-I348 HydrophobicContact CE1-CD1 4.5Å; V315-I348 HydrophobicContact CG1-CD1 4.16Å; V315-I348 HydrophobicContact CG2-CD1 4.28Å; L344-I348 HydrophobicContact CD1-CD1 3.88Å; L344-I348 HydrophobicContact CD1-CG1 4.12Å; L344-I348 HydrophobicContact CG-CD1 3.9Å; L344-I348 HydrophobicContact CG-CG1 4.48Å; L344-I348 WeakPolarHBondContact O-CG1 3.46Å; L344-I348 PolarHBondContact O-N 3.02Å; T345-I348 PolarHBondContact O-N 3.3Å; E346-I348 PolarHBondContact O-N 3.44Å; I348-K351 PolarHBondContact O-N 3.45Å; I348-M352 HydrophobicContact CG2-CE 3.77Å; I348-M352 HydrophobicContact CG2-CG 4.39Å; I348-M352 HydrophobicContact CG2-SD 4.1Å; I348-M352 WeakPolarHBondContact O-CB 3.46Å; I348-M352 WeakPolarHBondContact O-CG 3.12Å; I348-M352 PolarHBondContact O-N 2.83Å
349	A	96.6	Very high	94.5	Very high	28 Å²	28	42.1 Å²	42.1	23%	0.231	22%	0.216	C	C	.	.	H	α-helix	trans	-62	-45.2	179.7	0	0	0	0	0	112	T345 E346 K351 M352 R353	T345-A349 WeakPolarHBondContact O-CB 3.45Å; T345-A349 PolarHBondContact O-N 3.38Å; E346-A349 PolarHBondContact O-N 3.44Å; A349-K351 VanDerWaalsContact C-N 3.35Å; A349-K351 PolarHBondContact O-N 3.4Å; A349-M352 PolarHBondContact O-N 3.07Å; A349-R353 WeakPolarHBondContact O-CG 3.49Å; A349-R353 PolarHBondContact O-N 3.21Å
350	A	96.1	Very high	93.4	Very high	22 Å²	22	48.3 Å²	48.3	18%	0.182	23%	0.234	C	C	.	.	H	α-helix	trans	-61.2	-42.7	176.1	0	0	0	0	0	111.9	E346 R353 F354	E346-A350 VanDerWaalsContact O-CB 3.26Å; E346-A350 WeakPolarHBondContact O-CB 3.41Å; E346-A350 PolarHBondContact O-N 3Å; A350-R353 PolarHBondContact O-N 3.28Å; A350-F354 PolarHBondContact O-N 3.04Å
351	K	96.1	Very high	91.4	Very high	36 Å²	36	46.7 Å²	46.7	16%	0.157	23%	0.227	C	C	.	.	H	α-helix	trans	-64.3	-42.5	175.2	-175	57.6	53	162.2	0	112.3	L220 L292 A347 I348 A349 F354 H355	L220-K351 HydrophobicContact CB-CG 4.33Å; L220-K351 HydrophobicContact CD1-CG 4.06Å; L292-K351 HydrophobicContact CD1-CB 3.68Å; L292-K351 HydrophobicContact CD1-CD 4.42Å; L292-K351 HydrophobicContact CD1-CG 3.98Å; A347-K351 WeakPolarHBondContact O-CB 3.43Å; A347-K351 PolarHBondContact O-N 3.07Å; I348-K351 PolarHBondContact O-N 3.45Å; A349-K351 VanDerWaalsContact C-N 3.35Å; A349-K351 PolarHBondContact O-N 3.4Å; K351-F354 HydrophobicContact CD-CD1 4.47Å; K351-F354 WeakPolarHBondContact O-CB 3.43Å; K351-F354 PolarHBondContact O-N 2.96Å; K351-H355 WeakPolarHBondContact CD-NE2 3.28Å; K351-H355 WeakPolarHBondContact O-CB 3.22Å; K351-H355 VanDerWaalsContact O-CG 3.24Å; K351-H355 PolarHBondContact O-N 3.01Å
352	M	96.4	Very high	88.8	Confident	15 Å²	15	53.2 Å²	53.2	7%	0.074	26%	0.261	C	S	.	.	H	α-helix	trans	-65.2	-39.3	176.5	-77.4	-172.8	-179.1	0	0	112.2	L220 C221 P222 F307 T313 I348 A349 H355 S356	L220-M352 WeakPolarHBondContact O-CG 3.3Å; C221-M352 WeakPolarHBondContact O-CE 3.45Å; P222-M352 HydrophobicContact CB-CB 4.12Å; P222-M352 HydrophobicContact CB-CG 4.42Å; F307-M352 HydrophobicContact CE1-CE 4.06Å; F307-M352 HydrophobicContact CZ-CE 3.95Å; T313-M352 HydrophobicContact CG2-CE 3.87Å; T313-M352 HydrophobicContact CG2-SD 3.5Å; T313-M352 WeakPolarHBondContact CG2-SD 3.46Å; I348-M352 HydrophobicContact CG2-CE 3.77Å; I348-M352 HydrophobicContact CG2-CG 4.39Å; I348-M352 HydrophobicContact CG2-SD 4.1Å; I348-M352 WeakPolarHBondContact O-CB 3.46Å; I348-M352 WeakPolarHBondContact O-CG 3.12Å; I348-M352 PolarHBondContact O-N 2.83Å; A349-M352 PolarHBondContact O-N 3.07Å; M352-H355 PolarHBondContact O-N 3Å; M352-S356 PolarHBondContact O-N 3.14Å; M352-S356 PolarHBondContact O-OG 2.92Å
353	R	95.6	Very high	85.7	Confident	121 Å²	121	62.5 Å²	62.5	46%	0.457	29%	0.292	S	S	.	.	H	α-helix	trans	-59.3	-48	172.2	-77.7	179	-110.1	124	-3.5	111.6	E346 A349 A350 H355 S356 Q357	E346-R353 IonicContact OE1-CZ 3.94Å; E346-R353 IonicContact OE1-NH1 3.2Å; E346-R353 PolarHBondContact OE1-NH1 3.21Å; E346-R353 IonicContact OE1-NH2 2.98Å; E346-R353 PolarHBondContact OE1-NH2 3.06Å; E346-R353 IonicContact OE2-NH2 2.58Å; E346-R353 PolarHBondContact OE2-NH2 2.89Å; A349-R353 WeakPolarHBondContact O-CG 3.49Å; A349-R353 PolarHBondContact O-N 3.21Å; A350-R353 PolarHBondContact O-N 3.28Å; R353-H355 VanDerWaalsContact C-N 3.34Å; R353-H355 PolarHBondContact O-N 3.3Å; R353-S356 PolarHBondContact O-N 3.22Å; R353-Q357 WeakPolarHBondContact O-CG 3.49Å; R353-Q357 PolarHBondContact O-N 2.55Å; R353-Q357 VanDerWaalsContact O-N 3.11Å
354	F	93.6	Very high	82.8	Confident	74 Å²	74	68.4 Å²	68.4	33%	0.325	33%	0.33	S	S	.	.	H	α-helix	trans	-59	-46.1	174.5	174.7	-100.2	0	0	0	111.4	W148 A350 K351 S356 Q357 L358	W148-F354 AromaticContact CD2-CE1 3.64Å; W148-F354 HydrophobicContact CD2-CE1 3.64Å; W148-F354 HydrophobicContact CD2-CZ 4.01Å; W148-F354 AromaticContact CE2-CE1 3.87Å; W148-F354 AromaticContact CE3-CE1 3.77Å; W148-F354 HydrophobicContact CE3-CE1 3.77Å; W148-F354 AromaticContact CE3-CZ 3.83Å; W148-F354 HydrophobicContact CE3-CZ 3.83Å; W148-F354 HydrophobicContact CG-CE1 4.09Å; W148-F354 HydrophobicContact CG-CZ 4.37Å; W148-F354 HydrophobicContact CH2-CE1 4.47Å; W148-F354 HydrophobicContact CZ2-CE1 4.3Å; W148-F354 HydrophobicContact CZ3-CE1 4.2Å; W148-F354 HydrophobicContact CZ3-CZ 4.42Å; A350-F354 PolarHBondContact O-N 3.04Å; K351-F354 HydrophobicContact CD-CD1 4.47Å; K351-F354 WeakPolarHBondContact O-CB 3.43Å; K351-F354 PolarHBondContact O-N 2.96Å; F354-S356 VanDerWaalsContact C-N 3.32Å; F354-S356 PolarHBondContact O-N 3.23Å; F354-Q357 PolarHBondContact O-N 2.99Å; F354-L358 HydrophobicContact CD1-CD1 4.19Å; F354-L358 HydrophobicContact CE1-CD1 3.75Å; F354-L358 HydrophobicContact CE1-CD2 4.23Å; F354-L358 HydrophobicContact CE1-CG 4.15Å; F354-L358 HydrophobicContact CE2-CD2 4.4Å; F354-L358 HydrophobicContact CZ-CD1 4.28Å; F354-L358 HydrophobicContact CZ-CD2 3.9Å; F354-L358 HydrophobicContact CZ-CG 4.26Å; F354-L358 WeakPolarHBondContact O-CG 3.38Å; F354-L358 PolarHBondContact O-N 3.23Å
355	H	93.1	Very high	79.8	Confident	0 Å²	0	76 Å²	76	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-60.6	-37.4	177.2	-75	168.8	0	0	0	113.5	F168 Q216 L220 P222 K351 M352 R353 F359	F168-H355 HydrophobicContact CE2-CB 3.74Å; F168-H355 AromaticContact CE2-CG 3.91Å; F168-H355 HydrophobicContact CZ-CB 3.55Å; F168-H355 AromaticContact CZ-CD2 3.65Å; F168-H355 AromaticContact CZ-CG 3.44Å; F168-H355 VanDerWaalsContact CZ-CG 3.44Å; F168-H355 AromaticContact CZ-ND1 3.95Å; Q216-H355 PolarHBondContact O-CE1 3.45Å; L220-H355 PolarHBondContact O-ND1 3.11Å; P222-H355 HydrophobicContact CG-CB 4.14Å; K351-H355 WeakPolarHBondContact CD-NE2 3.28Å; K351-H355 WeakPolarHBondContact O-CB 3.22Å; K351-H355 VanDerWaalsContact O-CG 3.24Å; K351-H355 PolarHBondContact O-N 3.01Å; M352-H355 PolarHBondContact O-N 3Å; R353-H355 VanDerWaalsContact C-N 3.34Å; R353-H355 PolarHBondContact O-N 3.3Å; H355-F359 WeakPolarHBondContact O-CD2 3.33Å
356	S	91.8	Very high	76.9	Confident	32 Å²	32	76.6 Å²	76.6	22%	0.224	37%	0.371	C	S	.	.	H	α-helix	trans	-62.1	-50.8	172.7	-65.1	0	0	0	0	110.7	P222 M352 R353 F354 L358 F359 Y360	P222-S356 WeakPolarHBondContact CB-OG 3.49Å; P222-S356 WeakPolarHBondContact CG-OG 3.22Å; M352-S356 PolarHBondContact O-N 3.14Å; M352-S356 PolarHBondContact O-OG 2.92Å; R353-S356 PolarHBondContact O-N 3.22Å; F354-S356 VanDerWaalsContact C-N 3.32Å; F354-S356 PolarHBondContact O-N 3.23Å; S356-L358 PolarHBondContact O-N 3.12Å; S356-L358 VanDerWaalsContact O-N 3.14Å; S356-F359 PolarHBondContact O-N 3.31Å; S356-F359 VanDerWaalsContact O-N 3.11Å; S356-Y360 WeakPolarHBondContact O-CD2 3.07Å
357	Q	89.6	Confident	74.1	Confident	121 Å²	121	79.9 Å²	79.9	57%	0.565	40%	0.395	S	S	*	.	H	α-helix	trans	-56.7	-32.9	-176.7	-71.2	170.8	-13.7	0	0	113.3	R353 F354 F359 Y360	R353-Q357 WeakPolarHBondContact O-CG 3.49Å; R353-Q357 PolarHBondContact O-N 2.55Å; R353-Q357 VanDerWaalsContact O-N 3.11Å; F354-Q357 PolarHBondContact O-N 2.99Å; Q357-F359 PolarHBondContact O-N 3.16Å; Q357-Y360 PolarHBondContact O-N 3.16Å
358	L	85.4	Confident	71.2	Confident	30 Å²	30	88.7 Å²	88.7	16%	0.157	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-28.6	178.9	-69.7	171.8	0	0	0	114.6	W148 L152 F354 S356	W148-L358 HydrophobicContact CE3-CD1 4.24Å; W148-L358 HydrophobicContact CE3-CD2 4.37Å; W148-L358 HydrophobicContact CH2-CD1 3.13Å; W148-L358 HydrophobicContact CH2-CD2 4.43Å; W148-L358 HydrophobicContact CH2-CG 4.39Å; W148-L358 HydrophobicContact CZ2-CD1 3.85Å; W148-L358 HydrophobicContact CZ3-CD1 3.34Å; W148-L358 HydrophobicContact CZ3-CD2 3.77Å; W148-L358 HydrophobicContact CZ3-CG 4.21Å; L152-L358 HydrophobicContact CD1-CD2 4.38Å; F354-L358 HydrophobicContact CD1-CD1 4.19Å; F354-L358 HydrophobicContact CE1-CD1 3.75Å; F354-L358 HydrophobicContact CE1-CD2 4.23Å; F354-L358 HydrophobicContact CE1-CG 4.15Å; F354-L358 HydrophobicContact CE2-CD2 4.4Å; F354-L358 HydrophobicContact CZ-CD1 4.28Å; F354-L358 HydrophobicContact CZ-CD2 3.9Å; F354-L358 HydrophobicContact CZ-CG 4.26Å; F354-L358 WeakPolarHBondContact O-CG 3.38Å; F354-L358 PolarHBondContact O-N 3.23Å; S356-L358 PolarHBondContact O-N 3.12Å; S356-L358 VanDerWaalsContact O-N 3.14Å
359	F	79.5	Confident	68	Low	27 Å²	27	92.7 Å²	92.7	12%	0.118	47%	0.467	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-3.6	-177	-65.7	-88.5	0	0	0	113.8	L152 L155 L158 L164 K167 F168 L171 H355 S356 Q357	L152-F359 HydrophobicContact CD2-CE1 4.27Å; L152-F359 HydrophobicContact CD2-CZ 4.37Å; L155-F359 HydrophobicContact CD1-CD1 4.17Å; L155-F359 HydrophobicContact CD1-CE1 3.68Å; L155-F359 HydrophobicContact CD2-CD1 3.68Å; L155-F359 HydrophobicContact CD2-CE1 4.08Å; L155-F359 HydrophobicContact CG-CD1 4.06Å; L155-F359 HydrophobicContact CG-CE1 4.05Å; L158-F359 HydrophobicContact CD1-CE1 4.41Å; L164-F359 HydrophobicContact CD2-CB 3.92Å; L164-F359 HydrophobicContact CD2-CD2 3.82Å; L164-F359 HydrophobicContact CD2-CE2 4.5Å; L164-F359 HydrophobicContact CD2-CG 3.87Å; K167-F359 HydrophobicContact CB-CD1 4.4Å; K167-F359 HydrophobicContact CB-CE1 3.7Å; K167-F359 HydrophobicContact CB-CZ 3.95Å; K167-F359 HydrophobicContact CD-CD1 3.8Å; K167-F359 HydrophobicContact CD-CE1 3.96Å; K167-F359 HydrophobicContact CD-CG 4.49Å; K167-F359 HydrophobicContact CG-CE1 4.42Å; F168-F359 HydrophobicContact CD1-CE2 4.44Å; F168-F359 HydrophobicContact CD1-CZ 4.38Å; F168-F359 HydrophobicContact CD2-CE2 4.11Å; F168-F359 HydrophobicContact CD2-CZ 4.44Å; F168-F359 AromaticContact CE1-CE2 3.95Å; F168-F359 HydrophobicContact CE1-CE2 3.95Å; F168-F359 HydrophobicContact CE1-CZ 4.23Å; F168-F359 HydrophobicContact CE2-CD2 4.45Å; F168-F359 AromaticContact CE2-CE2 3.55Å; F168-F359 HydrophobicContact CE2-CE2 3.55Å; F168-F359 HydrophobicContact CE2-CZ 4.27Å; F168-F359 HydrophobicContact CG-CZ 4.49Å; F168-F359 HydrophobicContact CZ-CD2 4.48Å; F168-F359 AromaticContact CZ-CE2 3.48Å; F168-F359 HydrophobicContact CZ-CE2 3.48Å; F168-F359 VanDerWaalsContact CZ-CE2 3.48Å; F168-F359 HydrophobicContact CZ-CZ 4.19Å; L171-F359 HydrophobicContact CD1-CE1 4.13Å; L171-F359 HydrophobicContact CD1-CZ 3.76Å; H355-F359 WeakPolarHBondContact O-CD2 3.33Å; S356-F359 PolarHBondContact O-N 3.31Å; S356-F359 VanDerWaalsContact O-N 3.11Å; Q357-F359 PolarHBondContact O-N 3.16Å
360	Y	72.8	Confident	64.9	Low	172 Å²	172	97.9 Å²	97.9	68%	0.675	50%	0.496	S	S	*	.	S	Bend	trans	-104	3.7	178.5	-69.1	-71.2	0	0	0	113.1	S356 Q357 D362	S356-Y360 WeakPolarHBondContact O-CD2 3.07Å; Q357-Y360 PolarHBondContact O-N 3.16Å; Y360-D362 VanDerWaalsContact C-N 3.26Å; Y360-D362 PolarHBondContact O-N 3.12Å; Y360-D362 VanDerWaalsContact O-N 3.12Å
361	Q	54.8	Low	61.7	Low	122 Å²	122	105.3 Å²	105.3	57%	0.57	53%	0.529	S	S	*	.			trans	-81.3	35.2	-178.3	-81	-164.3	-4.6	0	0	115.7	W363	Q361-W363 VanDerWaalsContact C-N 3.31Å; Q361-W363 PolarHBondContact O-N 3.3Å
362	D	42.3	Very low	58.5	Low	138 Å²	138	107.7 Å²	107.7	74%	0.738	56%	0.556	S	S	*	*			trans	-91.4	56.9	163.7	-84.8	-25.2	0	0	0	110.9	Y360	Y360-D362 VanDerWaalsContact C-N 3.26Å; Y360-D362 PolarHBondContact O-N 3.12Å; Y360-D362 VanDerWaalsContact O-N 3.12Å
363	W	30.2	Very low	55.2	Low	231 Å²	231	116.1 Å²	116.1	88%	0.875	59%	0.594	S	S	*	*	S	Bend	trans	-162.8	150	158.8	-82.2	-55.6	0	0	0	109.2	Q361	Q361-W363 VanDerWaalsContact C-N 3.31Å; Q361-W363 PolarHBondContact O-N 3.3Å
364	P	38.5	Very low	52	Low	124 Å²	124	119 Å²	119	81%	0.805	61%	0.613	S	S	*	*			trans	-64.3	141.3	-146.4	26.6	-33.7	0	0	0	113.7
365	H	33.5	Very low	48.8	Very low	160 Å²	160	122.5 Å²	122.5	74%	0.741	64%	0.635	S	S	*	*			trans	-43.4	130.5	-174.9	-57.8	-50	0	0	0	114.8
366	P	36.4	Very low	45.8	Very low	86 Å²	86	130 Å²	130	56%	0.558	67%	0.67	S	S	*	*			trans	-87.9	111.5	143	18	-1.2	0	0	0	107.8	F368	P366-F368 HydrophobicContact CB-CD2 4.23Å; P366-F368 HydrophobicContact CB-CE2 3.91Å; P366-F368 HydrophobicContact CG-CD2 4.43Å; P366-F368 HydrophobicContact CG-CE2 3.96Å; P366-F368 PolarHBondContact O-N 3.01Å
367	T	39.5	Very low	42.7	Very low	135 Å²	135	135.4 Å²	135.4	83%	0.828	70%	0.697	S	S	*	*			trans	-56	99.8	160.7	30.9	0	0	0	0	109.3	A369	T367-A369 PolarHBondContact O-N 3Å
368	F	35.6	Very low	39.7	Very low	185 Å²	185	140.8 Å²	140.8	81%	0.811	71%	0.712	S	S	*	*			trans	-83.7	91	163.2	-79.1	-79.8	0	0	0	108.6	P366 V370	P366-F368 HydrophobicContact CB-CD2 4.23Å; P366-F368 HydrophobicContact CB-CE2 3.91Å; P366-F368 HydrophobicContact CG-CD2 4.43Å; P366-F368 HydrophobicContact CG-CE2 3.96Å; P366-F368 PolarHBondContact O-N 3.01Å; F368-V370 PolarHBondContact O-N 2.91Å
369	A	31.6	Very low	37	Very low	87 Å²	87	143.8 Å²	143.8	72%	0.719	74%	0.74	S	S	*	*			trans	-68.2	114.5	158.5	0	0	0	0	0	107.6	T367 M371	T367-A369 PolarHBondContact O-N 3Å; A369-M371 PolarHBondContact O-N 3.4Å; A369-M371 VanDerWaalsContact O-N 3.11Å
370	V	31.1	Very low	34.5	Very low	138 Å²	138	151 Å²	151	84%	0.836	78%	0.78	S	S	*	*			trans	-65	109.1	166.2	174.1	0	0	0	0	106.6	F368 A372	F368-V370 PolarHBondContact O-N 2.91Å; V370-A372 PolarHBondContact O-N 3.48Å; V370-A372 VanDerWaalsContact O-N 3.12Å
371	M	28.4	Very low	32.3	Very low	177 Å²	177	154.3 Å²	154.3	87%	0.872	79%	0.791	S	S	*	*			trans	-61.4	112.3	168.6	-81.5	-163	-83.6	0	0	108.4	A369 H373	A369-M371 PolarHBondContact O-N 3.4Å; A369-M371 VanDerWaalsContact O-N 3.11Å; M371-H373 PolarHBondContact O-N 3.03Å
372	A	28.2	Very low	30.8	Very low	87 Å²	87	153.6 Å²	153.6	72%	0.719	80%	0.8	S	S	*	*			trans	-65.5	118.2	160.9	0	0	0	0	0	107.5	V370 Q374	V370-A372 PolarHBondContact O-N 3.48Å; V370-A372 VanDerWaalsContact O-N 3.12Å; A372-Q374 PolarHBondContact O-N 3.12Å
373	H	28.3	Very low	30.1	Very low	192 Å²	192	155.9 Å²	155.9	89%	0.889	81%	0.806	S	S	*	*			trans	-60.3	100.4	163.9	-100	-55	0	0	0	108.2	M371 N375	M371-H373 PolarHBondContact O-N 3.03Å; H373-N375 PolarHBondContact O-N 3.37Å
374	Q	28.5	Very low	30.1	Very low	180 Å²	180	150.9 Å²	150.9	84%	0.841	80%	0.803	S	S	*	*			trans	-71.3	106.4	162.4	-86.1	-175.7	-23.9	0	0	107.7	A372 E376	A372-Q374 PolarHBondContact O-N 3.12Å; Q374-E376 PolarHBondContact O-N 2.96Å; Q374-E376 VanDerWaalsContact O-N 3.16Å
375	N	26.9	Very low	29.4	Very low	148 Å²	148	157.5 Å²	157.5	79%	0.791	81%	0.812	S	S	*	*			trans	-65.8	103.5	160	-111.3	-7.2	0	0	0	107.6	H373 N377	H373-N375 PolarHBondContact O-N 3.37Å; N375-N377 PolarHBondContact O-N 3.36Å; N375-N377 VanDerWaalsContact O-N 3.16Å
376	E	28.6	Very low	29.1	Very low	159 Å²	159	154.5 Å²	154.5	74%	0.743	82%	0.815	S	S	*	*			trans	-65.7	105.9	162.1	-89	-155.8	135	0	0	108.7	Q374	Q374-E376 PolarHBondContact O-N 2.96Å; Q374-E376 VanDerWaalsContact O-N 3.16Å
377	N	26.5	Very low	28.9	Very low	145 Å²	145	155.8 Å²	155.8	78%	0.775	82%	0.823	S	S	*	*			trans	-113.2	100.4	154.8	-85.3	-34.8	0	0	0	107.8	N375 A379	N375-N377 PolarHBondContact O-N 3.36Å; N375-N377 VanDerWaalsContact O-N 3.16Å; N377-A379 PolarHBondContact O-N 3.11Å; N377-A379 VanDerWaalsContact O-N 3.12Å
378	R	27.8	Very low	28.3	Very low	234 Å²	234	154.1 Å²	154.1	88%	0.883	82%	0.817	S	S	*	*			trans	-59.9	106.5	164.3	-87.1	177.8	173.8	165.9	-1	108.8
379	A	27.8	Very low	28	Very low	92 Å²	92	151.7 Å²	151.7	76%	0.76	81%	0.812	S	S	*	*			trans	-116.3	99.3	159.7	0	0	0	0	0	108.4	N377 R381	N377-A379 PolarHBondContact O-N 3.11Å; N377-A379 VanDerWaalsContact O-N 3.12Å; A379-R381 PolarHBondContact O-N 3.25Å
380	L	28.3	Very low	27.9	Very low	180 Å²	180	156.2 Å²	156.2	94%	0.942	82%	0.815	S	S	*	*			trans	-51.8	115.4	171	-170.4	73.1	0	0	0	110
381	R	25.3	Very low	27.8	Very low	240 Å²	240	154.7 Å²	154.7	91%	0.906	81%	0.811	S	S	*	*			trans	-128.5	101.6	163.8	-165.9	174.1	-99.7	-168.9	-5.2	109.2	A379	A379-R381 PolarHBondContact O-N 3.25Å
382	S	23.5	Very low	27.8	Very low	108 Å²	108	151.5 Å²	151.5	76%	0.755	81%	0.805	S	S	*	*			trans	-57.9	133.5	173.5	48.1	0	0	0	0	112.3
383	Q	27.5	Very low	28	Very low	186 Å²	186	154.2 Å²	154.2	87%	0.869	81%	0.813	S	S	*	*			trans	-120.3	144.4	155	-82.5	-151	-36	0	0	110.4
384	P	30.6	Very low	28.3	Very low	125 Å²	125	152.4 Å²	152.4	81%	0.812	81%	0.809	S	S	*	*			trans	-90	151.7	-171.3	4	17.2	0	0	0	112.7
385	W	24	Very low	29.1	Very low	263 Å²	263	149.5 Å²	149.5	100%	0.996	81%	0.806	S	S	*	*			trans	-53.8	145.4	175.7	-76.1	-23.1	0	0	0	115.6
386	A	26.7	Very low	29.4	Very low	97 Å²	97	149 Å²	149	80%	0.802	80%	0.802	S	S	*	*			trans	-137.1	133.2	144	0	0	0	0	0	108.8
387	P	31.7	Very low	29.9	Very low	114 Å²	114	148.4 Å²	148.4	74%	0.74	80%	0.803	S	S	*	*			trans	-95.9	152.1	-168.4	36.8	-33.6	0	0	0	113.4
388	S	28.5	Very low	30.2	Very low	99 Å²	99	147.7 Å²	147.7	69%	0.692	80%	0.798	S	S	*	*			trans	45.2	138.1	145.8	60.9	0	0	0	0	120
389	L	29.1	Very low	30.4	Very low	134 Å²	134	142.9 Å²	142.9	70%	0.702	79%	0.789	S	S	*	*				178.4	134.2	116.2	-94.6	-177.7	0	0	0	112.6
390	F	28.1	Very low	30.6	Very low	182 Å²	182	146.2 Å²	146.2	80%	0.798	79%	0.794	S	S	*	*			trans	66.2	142.7	152.8	-65.7	-62.1	0	0	0	118.7
391	S	29	Very low	31	Very low	107 Å²	107	141.4 Å²	141.4	75%	0.748	78%	0.775	S	S	*	*			cis	-161	151.7	10.9	-165.3	0	0	0	0	109.9
392	C	28.4	Very low	31.5	Very low	110 Å²	110	137.4 Å²	137.4	74%	0.743	77%	0.771	S	S	*	*			trans	-55.6	153.5	171.8	-63.3	0	0	0	0	114.1
393	T	32.4	Very low	32.2	Very low	144 Å²	144	148 Å²	148	88%	0.883	79%	0.794	S	S	*	*				-169.8	113.8	119.4	23.4	0	0	0	0	110.5
394	L	34.8	Very low	32.4	Very low	153 Å²	153	146.1 Å²	146.1	80%	0.801	79%	0.79	S	S	*	*			trans	-98.5	149.7	155.9	-113.8	148.6	0	0	0	106.2
395	P	46	Very low	32.5	Very low	119 Å²	119	147.2 Å²	147.2	77%	0.773	79%	0.789	S	S	*	*				-144.7	128	105.5	31.3	-13.1	0	0	0	114.9
396	L	32.9	Very low	33	Very low	138 Å²	138	140.7 Å²	140.7	72%	0.723	78%	0.778	S	S	*	*				41.9	147.5	116	-123.3	117.7	0	0	0	122.3
397	I	38.9	Very low	33.3	Very low	146 Å²	146	143.3 Å²	143.3	75%	0.749	78%	0.776	S	S	*	*			trans	100.8	130.5	158.5	-56.4	167.4	0	0	0	113.7
398	L	33.2	Very low	33.4	Very low	130 Å²	130	145.1 Å²	145.1	68%	0.681	78%	0.779	S	S	*	*			cis	-179.4	152.1	-19.7	-112.2	155.9	0	0	0	104.7
399	L	31.9	Very low	33.8	Very low	134 Å²	134	148.2 Å²	148.2	70%	0.702	78%	0.784	S	S	*	*			trans	62.5	113.6	147.6	-75.9	156.9	0	0	0	119.5
400	L	32.5	Very low	34.1	Very low	162 Å²	162	149.2 Å²	149.2	85%	0.848	79%	0.79	S	S	*	*				-177.9	138	91.1	-103.6	141.7	0	0	0	112.2
401	S	35.5	Very low	34.6	Very low	79 Å²	79	146.7 Å²	146.7	55%	0.552	79%	0.79	S	S	*	*			trans	-77	158	178.2	45.5	0	0	0	0	114
402	L	36.6	Very low	35	Very low	156 Å²	156	150 Å²	150	82%	0.817	79%	0.793	S	S	*	*			trans	75.2	116	155.8	-62	139.6	0	0	0	115.7
403	W	37.3	Very low	35.6	Very low	329 Å²	329	153.6 Å²	153.6	100%	1.246	80%	0.798	S	S	*	*				-150.9	0	91.4	-93.7	31.4	0	0	0	109.4

Retrieved 403 of 403 residues in 2107.1 ms (Link to these results)

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