G4LWS6_SCHMA Loading...

Protein FRA10AC1 homolog

AlphaFold DB , UniProt , Accession G4LWS6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 339 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.1	Very low	48	Very low	238 Å²	238	170.1 Å²	170.1	100%	1.172	82%	0.815	S	S	*	*				0	141.6	0	-78.4	159.3	163.1	0	0	106.8
2	F	44.6	Very low	47.3	Very low	211 Å²	211	171.2 Å²	171.2	93%	0.925	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-75.3	128.8	-171.8	-84.5	-92.5	0	0	0	111.7
3	E	45.9	Very low	47.3	Very low	186 Å²	186	163.9 Å²	163.9	87%	0.869	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-78.8	116.4	167.3	-69.7	166	115	0	0	108.5	R5	E3-R5 PolarHBondContact O-N 3.01Å
4	S	54.1	Low	46.8	Very low	122 Å²	122	165.4 Å²	165.4	85%	0.853	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-81.7	116.8	-179.5	-67.9	0	0	0	0	110.8
5	R	50.4	Low	46.6	Very low	216 Å²	216	162.5 Å²	162.5	82%	0.815	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-59.5	151.9	-177.8	-91.3	-178.3	158.9	110.5	-3.2	115.9	E3	E3-R5 PolarHBondContact O-N 3.01Å
6	D	47.5	Very low	46	Very low	125 Å²	125	158.8 Å²	158.8	67%	0.668	79%	0.793	S	S	*	*			trans	46	100	132.7	-43.5	-25.8	0	0	0	118
7	Y	50.7	Low	45.8	Very low	214 Å²	214	154.4 Å²	154.4	84%	0.839	78%	0.781	S	S	*	*			trans	-118.5	85	157.5	-169	-99.6	0	0	0	109.8
8	I	47.1	Very low	45.7	Very low	131 Å²	131	152.3 Å²	152.3	67%	0.672	77%	0.772	S	S	*	*			trans	-87.6	115.9	168	-66.7	173.4	0	0	0	106.7	D10	I8-D10 WeakPolarHBondContact CG2-OD1 3.3Å; I8-D10 PolarHBondContact O-N 2.94Å
9	S	49.3	Very low	45.9	Very low	87 Å²	87	151.6 Å²	151.6	61%	0.608	77%	0.769	S	S	*	*			trans	-93.9	78.7	179.2	63.5	0	0	0	0	110.7	Y11	S9-Y11 VanDerWaalsContact C-N 3.26Å; S9-Y11 PolarHBondContact O-N 3.02Å
10	D	43	Very low	45.9	Very low	140 Å²	140	151 Å²	151	75%	0.749	77%	0.768	S	S	*	*			trans	-69.4	84.4	172.2	-63.3	-41	0	0	0	109.6	I8	I8-D10 WeakPolarHBondContact CG2-OD1 3.3Å; I8-D10 PolarHBondContact O-N 2.94Å
11	Y	47.8	Very low	45.9	Very low	201 Å²	201	153.9 Å²	153.9	79%	0.788	77%	0.769	S	S	*	*			trans	-117.2	57.5	177.2	-146.8	-100.1	0	0	0	111.2	S9 S13	S9-Y11 VanDerWaalsContact C-N 3.26Å; S9-Y11 PolarHBondContact O-N 3.02Å; Y11-S13 PolarHBondContact O-N 3.16Å; Y11-S13 PolarHBondContact O-OG 3.35Å
12	E	40	Very low	45.8	Very low	183 Å²	183	145.9 Å²	145.9	86%	0.855	75%	0.748	S	S	*	*			trans	-56.6	99.8	166.2	-67.6	-161.7	123.3	0	0	109	E14	E12-E14 PolarHBondContact O-N 3.21Å
13	S	47.4	Very low	45.9	Very low	77 Å²	77	139.3 Å²	139.3	54%	0.538	73%	0.728	S	S	.	*			trans	-79.4	89.8	-176.9	-62	0	0	0	0	109.1	Y11 T15	Y11-S13 PolarHBondContact O-N 3.16Å; Y11-S13 PolarHBondContact O-OG 3.35Å; S13-T15 PolarHBondContact O-N 3.39Å
14	E	39.9	Very low	45.7	Very low	184 Å²	184	139.6 Å²	139.6	86%	0.86	73%	0.73	S	S	*	*			trans	-66.9	56.5	178.7	-65.4	-165.9	114	0	0	113.6	E12 S16	E12-E14 PolarHBondContact O-N 3.21Å; E14-S16 PolarHBondContact O-N 3.01Å
15	T	44.1	Very low	45.2	Very low	123 Å²	123	139.4 Å²	139.4	76%	0.755	72%	0.718	S	S	*	*			trans	-88.4	40.7	172.9	53.4	0	0	0	0	112	S13 S17	S13-T15 PolarHBondContact O-N 3.39Å; T15-S17 PolarHBondContact O-N 2.98Å
16	S	37.9	Very low	44.7	Very low	102 Å²	102	131.9 Å²	131.9	71%	0.713	70%	0.698	S	S	*	*			trans	-73.5	64.2	167.7	-76.7	0	0	0	0	111.2	E14 N18	E14-S16 PolarHBondContact O-N 3.01Å; S16-N18 PolarHBondContact O-N 2.93Å; S16-N18 PolarHBondContact O-ND2 3.3Å
17	S	42	Very low	44.9	Very low	84 Å²	84	134.5 Å²	134.5	59%	0.587	71%	0.706	S	S	*	*			trans	-64.6	94.7	169	52	0	0	0	0	109.3	T15 I19	T15-S17 PolarHBondContact O-N 2.98Å; S17-I19 PolarHBondContact O-N 2.82Å
18	N	43.1	Very low	45	Very low	118 Å²	118	128.5 Å²	128.5	63%	0.631	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	39.8	-175.1	-89.7	-91.5	0	0	0	113.7	S16 R21	S16-N18 PolarHBondContact O-N 2.93Å; S16-N18 PolarHBondContact O-ND2 3.3Å; N18-R21 PolarHBondContact OD1-NH1 3.3Å
19	I	49.5	Very low	45.3	Very low	138 Å²	138	127.9 Å²	127.9	71%	0.708	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	-30.1	-176.1	-76.6	170.4	0	0	0	112	S17 R21	S17-I19 PolarHBondContact O-N 2.82Å; I19-R21 VanDerWaalsContact C-N 3.26Å; I19-R21 PolarHBondContact O-N 2.88Å
20	D	46.4	Very low	45.4	Very low	139 Å²	139	128.5 Å²	128.5	74%	0.743	69%	0.689	S	S	*	*			trans	-85.6	52.3	-178.2	-67.8	-45.1	0	0	0	113.8
21	R	45.6	Very low	45.9	Very low	212 Å²	212	126.8 Å²	126.8	80%	0.8	69%	0.686	S	S	*	*	S	Bend	trans	-118.5	85.9	167	-83	-171.9	170.8	127.3	-3.6	110.5	N18 I19	N18-R21 PolarHBondContact OD1-NH1 3.3Å; I19-R21 VanDerWaalsContact C-N 3.26Å; I19-R21 PolarHBondContact O-N 2.88Å
22	G	45.8	Very low	46	Very low	71 Å²	71	123 Å²	123	73%	0.732	69%	0.685	S	S	*	*	S	Bend	trans	168.7	-26.4	171.5	0	0	0	0	0	116	E24	G22-E24 VanDerWaalsContact C-N 3.27Å; G22-E24 PolarHBondContact O-N 2.79Å
23	S	46.6	Very low	46.5	Very low	72 Å²	72	116.6 Å²	116.6	50%	0.503	66%	0.661	S	S	.	*			trans	-81.3	64.7	-179	-64.4	0	0	0	0	113.5	I25	S23-I25 PolarHBondContact O-N 2.97Å
24	E	41.3	Very low	46.8	Very low	193 Å²	193	122.2 Å²	122.2	90%	0.902	68%	0.676	S	S	*	*			trans	-69.8	80.8	158.2	-71.2	-164.6	144.3	0	0	109.4	G22 S26	G22-E24 VanDerWaalsContact C-N 3.27Å; G22-E24 PolarHBondContact O-N 2.79Å; E24-S26 PolarHBondContact O-N 3.11Å
25	I	43.7	Very low	47.5	Very low	118 Å²	118	117.2 Å²	117.2	61%	0.605	66%	0.655	S	S	*	*			trans	-65.8	112.3	164.1	-64.6	173.2	0	0	0	106.5	S23 Q27 I30	S23-I25 PolarHBondContact O-N 2.97Å; I25-Q27 PolarHBondContact O-N 2.87Å; I25-I30 HydrophobicContact CG2-CD1 4.04Å; I25-I30 HydrophobicContact CG2-CG1 3.8Å
26	S	41	Very low	48.1	Very low	57 Å²	57	117.5 Å²	117.5	40%	0.399	65%	0.646	S	S	.	*			trans	-60.3	136.2	175.3	-178.7	0	0	0	0	109.7	E24 S28 D29	E24-S26 PolarHBondContact O-N 3.11Å; S26-S28 WeakPolarHBondContact CB-OG 3.4Å; S26-S28 PolarHBondContact O-N 3.26Å; S26-S28 PolarHBondContact OG-N 2.81Å; S26-S28 PolarHBondContact OG-OG 3.36Å; S26-D29 PolarHBondContact O-N 3.07Å
27	Q	51.2	Low	49	Very low	180 Å²	180	118.1 Å²	118.1	84%	0.841	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-11.8	177.1	-69.3	-174.4	-5.3	0	0	113.1	I25 D29	I25-Q27 PolarHBondContact O-N 2.87Å; Q27-D29 VanDerWaalsContact C-N 3.34Å
28	S	52.4	Low	49.6	Very low	89 Å²	89	116.9 Å²	116.9	62%	0.622	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-28.2	169.8	51.4	0	0	0	0	114.1	S26	S26-S28 WeakPolarHBondContact CB-OG 3.4Å; S26-S28 PolarHBondContact O-N 3.26Å; S26-S28 PolarHBondContact OG-N 2.81Å; S26-S28 PolarHBondContact OG-OG 3.36Å
29	D	53.1	Low	50.2	Low	118 Å²	118	117.6 Å²	117.6	63%	0.631	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.2	-12.3	-163	-53.9	-10.7	0	0	0	111.7	S26 Q27	S26-D29 PolarHBondContact O-N 3.07Å; Q27-D29 VanDerWaalsContact C-N 3.34Å
30	I	52.7	Low	50.7	Low	99 Å²	99	116.7 Å²	116.7	51%	0.508	61%	0.611	S	S	.	*	S	Bend	trans	-82.7	115.7	170.7	-53.8	173.9	0	0	0	107.3	I25	I25-I30 HydrophobicContact CG2-CD1 4.04Å; I25-I30 HydrophobicContact CG2-CG1 3.8Å
31	P	53.1	Low	51.2	Low	105 Å²	105	118.5 Å²	118.5	68%	0.682	61%	0.612	S	S	*	*			trans	-59.5	132.9	176.6	24.8	-33.2	0	0	0	109.3	S33	P31-S33 PolarHBondContact O-N 3.25Å
32	P	49.1	Very low	51.7	Low	120 Å²	120	112.5 Å²	112.5	78%	0.779	60%	0.6	S	S	*	*			trans	-61.2	112.1	-172.1	23.6	-33.8	0	0	0	109.7	K34	P32-K34 PolarHBondContact O-N 3.18Å
33	S	51.1	Low	52.5	Low	49 Å²	49	114.7 Å²	114.7	34%	0.343	60%	0.599	S	S	.	*			trans	-59.9	134.2	-175.6	-174.2	0	0	0	0	110.3	P31 D35 W39	P31-S33 PolarHBondContact O-N 3.25Å; S33-D35 PolarHBondContact O-N 3.35Å; S33-W39 WeakPolarHBondContact OG-CH2 3.26Å; S33-W39 WeakPolarHBondContact OG-CZ2 3.3Å
34	K	52.3	Low	53.2	Low	196 Å²	196	121.4 Å²	121.4	85%	0.852	61%	0.614	S	S	*	*	S	Bend	trans	-61.1	-32.2	-167.4	-65.3	172.6	-177.4	171.5	0	111.7	P32 K36	P32-K34 PolarHBondContact O-N 3.18Å; K34-K36 PolarHBondContact O-N 3.2Å
35	D	54.9	Low	54.2	Low	78 Å²	78	116.4 Å²	116.4	42%	0.417	60%	0.598	S	S	.	*			trans	-93.4	65.6	-173.3	-53.2	-54.5	0	0	0	112	S33 E37 L38 W39	S33-D35 PolarHBondContact O-N 3.35Å; D35-E37 PolarHBondContact O-N 2.69Å; D35-L38 HydrophobicContact CB-CD1 3.85Å; D35-L38 HydrophobicContact CB-CG 4.15Å; D35-L38 PolarHBondContact O-N 3.46Å; D35-W39 HydrophobicContact CB-CZ2 4.45Å; D35-W39 VanDerWaalsContact O-CE2 3.31Å; D35-W39 WeakPolarHBondContact O-CZ2 3.48Å; D35-W39 PolarHBondContact O-NE1 3.03Å
36	K	57.4	Low	55	Low	130 Å²	130	122.2 Å²	122.2	57%	0.565	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-45.2	-33.5	177.9	-70.6	-172	171.9	-165	0	114.4	K34 L38 W39 E40	K34-K36 PolarHBondContact O-N 3.2Å; K36-L38 PolarHBondContact O-N 2.79Å; K36-L38 VanDerWaalsContact O-N 3.12Å; K36-W39 VanDerWaalsContact O-CD1 3.32Å; K36-W39 PolarHBondContact O-N 3.28Å; K36-E40 WeakPolarHBondContact O-CB 3.38Å; K36-E40 PolarHBondContact O-N 3.28Å
37	E	57.6	Low	55.9	Low	115 Å²	115	127.8 Å²	127.8	54%	0.537	63%	0.629	S	S	.	*	G	3₁₀ helix	trans	-64	-10.6	-178.6	-54.7	-170.9	164.9	0	0	115	D35 N66	D35-E37 PolarHBondContact O-N 2.69Å; E37-N66 WeakPolarHBondContact CB-ND2 3.02Å; E37-N66 PolarHBondContact O-ND2 3.09Å
38	L	54.5	Low	56.3	Low	58 Å²	58	124.3 Å²	124.3	30%	0.304	62%	0.623	S	S	.	*	G	3₁₀ helix	trans	-84.9	-30.6	179.6	-66.5	176.6	0	0	0	113.9	D35 K36	D35-L38 HydrophobicContact CB-CD1 3.85Å; D35-L38 HydrophobicContact CB-CG 4.15Å; D35-L38 PolarHBondContact O-N 3.46Å; K36-L38 PolarHBondContact O-N 2.79Å; K36-L38 VanDerWaalsContact O-N 3.12Å
39	W	55.6	Low	56.6	Low	133 Å²	133	124 Å²	124	50%	0.504	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-113.6	-30.7	-175.1	13	77.2	0	0	0	113.6	S33 D35 K36 K41	S33-W39 WeakPolarHBondContact OG-CH2 3.26Å; S33-W39 WeakPolarHBondContact OG-CZ2 3.3Å; D35-W39 HydrophobicContact CB-CZ2 4.45Å; D35-W39 VanDerWaalsContact O-CE2 3.31Å; D35-W39 WeakPolarHBondContact O-CZ2 3.48Å; D35-W39 PolarHBondContact O-NE1 3.03Å; K36-W39 VanDerWaalsContact O-CD1 3.32Å; K36-W39 PolarHBondContact O-N 3.28Å; W39-K41 PolarHBondContact O-N 3.4Å
40	E	58.6	Low	56.8	Low	119 Å²	119	129.8 Å²	129.8	56%	0.556	64%	0.64	S	S	*	*	S	Bend	trans	-64.7	128.3	178.1	-71.5	-176.1	-168.5	0	0	110.8	K36	K36-E40 WeakPolarHBondContact O-CB 3.38Å; K36-E40 PolarHBondContact O-N 3.28Å
41	K	57.6	Low	57.5	Low	176 Å²	176	127.4 Å²	127.4	77%	0.765	64%	0.64	S	S	*	*			trans	-62.4	129.6	173.8	-68.5	179.8	-178.9	175.8	0	108.2	W39 V43	W39-K41 PolarHBondContact O-N 3.4Å; K41-V43 PolarHBondContact O-N 2.97Å
42	P	56.7	Low	58.6	Low	86 Å²	86	127.8 Å²	127.8	56%	0.558	64%	0.636	S	S	*	*			trans	-68.5	92.7	-171.4	25.7	-34.7	0	0	0	112.2	R44 R63	P42-R44 PolarHBondContact O-N 2.97Å; P42-R63 HydrophobicContact CB-CG 4.2Å
43	V	61.9	Low	60	Low	117 Å²	117	126.5 Å²	126.5	71%	0.709	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-66.8	126.3	174	-176.9	0	0	0	0	109	K41 R63	K41-V43 PolarHBondContact O-N 2.97Å; V43-R63 PolarHBondContact O-NH2 2.84Å
44	R	61.3	Low	61.5	Low	214 Å²	214	132 Å²	132	81%	0.808	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-81.2	122.4	166.2	-63.3	-174	-176.7	-134.1	2.1	107.7	P42	P42-R44 PolarHBondContact O-N 2.97Å
45	P	61.6	Low	63	Low	87 Å²	87	125.5 Å²	125.5	57%	0.565	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-63.9	141.7	174.3	29.1	-34.7	0	0	0	109.2	F47	P45-F47 PolarHBondContact O-N 2.97Å
46	R	61.2	Low	64.1	Low	241 Å²	241	125.4 Å²	125.4	91%	0.909	63%	0.629	S	S	*	*	S	Bend	trans	-65.8	-20.3	-178.3	-62.6	-170.9	-169.8	-173.1	4.8	113.3
47	F	60.2	Low	65.3	Low	173 Å²	173	124.1 Å²	124.1	76%	0.759	63%	0.628	S	S	*	*	S	Bend	trans	-129.9	129.4	174.6	-59.5	-77.3	0	0	0	108.3	P45 A49	P45-F47 PolarHBondContact O-N 2.97Å; F47-A49 PolarHBondContact O-N 3.25Å
48	P	59.2	Low	66.6	Low	108 Å²	108	122.4 Å²	122.4	70%	0.701	62%	0.622	S	S	*	*			trans	-62.6	126	169.9	-19.9	32.6	0	0	0	109.8	Y50	P48-Y50 PolarHBondContact O-N 3.07Å
49	A	58.4	Low	67.9	Low	83 Å²	83	122.1 Å²	122.1	69%	0.686	63%	0.628	S	S	*	*			trans	-70.6	124.8	168.7	0	0	0	0	0	108.7	F47 G51	F47-A49 PolarHBondContact O-N 3.25Å; A49-G51 PolarHBondContact O-N 3.49Å
50	Y	58.5	Low	69.1	Low	239 Å²	239	121.5 Å²	121.5	94%	0.937	63%	0.631	S	S	*	*			trans	-72.2	73.7	172.7	-81.2	-94	0	0	0	110.2	P48	P48-Y50 PolarHBondContact O-N 3.07Å
51	G	66.3	Low	70.3	Confident	48 Å²	48	120.5 Å²	120.5	50%	0.495	63%	0.63	S	S	.	*			trans	-96.4	178.9	175.4	0	0	0	0	0	113	A49 S53	A49-G51 PolarHBondContact O-N 3.49Å; G51-S53 PolarHBondContact O-N 3.44Å
52	N	76.6	Confident	71.5	Confident	113 Å²	113	116 Å²	116	60%	0.604	61%	0.61	S	S	*	*			trans	-56.7	123.3	171.2	-179.5	-20.6	0	0	0	110	K54 A55 I56	N52-K54 PolarHBondContact O-N 3.35Å; N52-K54 VanDerWaalsContact O-N 3.11Å; N52-K54 PolarHBondContact OD1-N 2.85Å; N52-K54 VanDerWaalsContact OD1-N 3.1Å; N52-A55 WeakPolarHBondContact O-CB 3.41Å; N52-A55 PolarHBondContact O-N 3.16Å; N52-I56 PolarHBondContact O-N 2.78Å
53	S	77.9	Confident	72.5	Confident	94 Å²	94	116.9 Å²	116.9	66%	0.657	60%	0.602	S	S	*	*	H	α-helix	trans	-55.4	-32.6	-175.5	55.1	0	0	0	0	113.4	G51 A55 I56 L57	G51-S53 PolarHBondContact O-N 3.44Å; S53-A55 VanDerWaalsContact C-N 3.33Å; S53-A55 PolarHBondContact O-N 2.93Å; S53-I56 PolarHBondContact O-N 2.92Å; S53-L57 PolarHBondContact O-N 2.88Å
54	K	84.2	Confident	73.5	Confident	165 Å²	165	114 Å²	114	72%	0.717	59%	0.591	S	S	*	*	H	α-helix	trans	-63.1	-37.3	174.9	-177.1	174	178.9	178.4	0	112.6	N52 D58	N52-K54 PolarHBondContact O-N 3.35Å; N52-K54 VanDerWaalsContact O-N 3.11Å; N52-K54 PolarHBondContact OD1-N 2.85Å; N52-K54 VanDerWaalsContact OD1-N 3.1Å; K54-D58 WeakPolarHBondContact O-CB 3.26Å; K54-D58 PolarHBondContact O-N 2.9Å
55	A	82	Confident	74.5	Confident	58 Å²	58	111.2 Å²	111.2	48%	0.479	58%	0.581	S	S	.	*	H	α-helix	trans	-74.4	-33.1	178.5	0	0	0	0	0	112.1	N52 S53 A59	N52-A55 WeakPolarHBondContact O-CB 3.41Å; N52-A55 PolarHBondContact O-N 3.16Å; S53-A55 VanDerWaalsContact C-N 3.33Å; S53-A55 PolarHBondContact O-N 2.93Å; A55-A59 WeakPolarHBondContact O-CB 3.35Å; A55-A59 PolarHBondContact O-N 3.47Å; A55-A59 VanDerWaalsContact O-N 3.07Å
56	I	78.8	Confident	75.3	Confident	76 Å²	76	108.3 Å²	108.3	39%	0.39	56%	0.561	S	S	.	*	H	α-helix	trans	-64.8	-49.1	173.3	-58.9	175.2	0	0	0	109.7	N52 S53 D58 A59 E60	N52-I56 PolarHBondContact O-N 2.78Å; S53-I56 PolarHBondContact O-N 2.92Å; I56-D58 PolarHBondContact O-N 2.83Å; I56-A59 PolarHBondContact O-N 2.96Å; I56-E60 PolarHBondContact O-N 3.18Å
57	L	83.6	Confident	76.3	Confident	104 Å²	104	100.4 Å²	100.4	55%	0.545	54%	0.543	S	S	.	.	H	α-helix	trans	-59.7	-43.5	178.1	-170	76.4	0	0	0	112.6	S53 E60 N61	S53-L57 PolarHBondContact O-N 2.88Å; L57-E60 PolarHBondContact O-N 2.88Å; L57-N61 WeakPolarHBondContact O-CB 3.17Å; L57-N61 VanDerWaalsContact O-CG 3.3Å; L57-N61 PolarHBondContact O-N 2.86Å; L57-N61 PolarHBondContact O-ND2 2.89Å
58	D	84.3	Confident	77.4	Confident	78 Å²	78	96.8 Å²	96.8	42%	0.417	54%	0.535	S	S	.	.	H	α-helix	trans	-61.8	-43.7	176.6	-179.7	58.6	0	0	0	112	K54 I56 N61 K62	K54-D58 WeakPolarHBondContact O-CB 3.26Å; K54-D58 PolarHBondContact O-N 2.9Å; I56-D58 PolarHBondContact O-N 2.83Å; D58-N61 PolarHBondContact O-N 3.18Å; D58-K62 WeakPolarHBondContact O-CB 3.17Å; D58-K62 WeakPolarHBondContact O-CG 3.23Å; D58-K62 PolarHBondContact O-N 3.19Å; D58-K62 IonicContact OD1-NZ 3.89Å; D58-K62 VanDerWaalsContact OD2-CE 3.29Å; D58-K62 WeakPolarHBondContact OD2-CE 3.28Å; D58-K62 IonicContact OD2-NZ 3Å; D58-K62 PolarHBondContact OD2-NZ 3Å
59	A	82.3	Confident	78.6	Confident	52 Å²	52	94 Å²	94	43%	0.43	51%	0.514	S	S	.	.	H	α-helix	trans	-66.3	-36.5	176.2	0	0	0	0	0	113.2	A55 I56 R63	A55-A59 WeakPolarHBondContact O-CB 3.35Å; A55-A59 PolarHBondContact O-N 3.47Å; A55-A59 VanDerWaalsContact O-N 3.07Å; I56-A59 PolarHBondContact O-N 2.96Å; A59-R63 WeakPolarHBondContact O-CB 3.5Å; A59-R63 PolarHBondContact O-N 3.4Å
60	E	80.1	Confident	79.7	Confident	121 Å²	121	96 Å²	96	57%	0.565	50%	0.503	S	S	*	.	H	α-helix	trans	-69.6	-41.1	174.6	-70.4	-163.9	134.9	0	0	112.2	I56 L57 R63 A64	I56-E60 PolarHBondContact O-N 3.18Å; L57-E60 PolarHBondContact O-N 2.88Å; E60-R63 PolarHBondContact O-N 3.45Å; E60-A64 PolarHBondContact O-N 3.02Å
61	N	84.8	Confident	80.8	Confident	98 Å²	98	90.4 Å²	90.4	52%	0.524	49%	0.485	S	S	.	.	H	α-helix	trans	-60.8	-46.9	173.9	-76	-27.1	0	0	0	111.8	L57 D58 R63 A64 Y65	L57-N61 WeakPolarHBondContact O-CB 3.17Å; L57-N61 VanDerWaalsContact O-CG 3.3Å; L57-N61 PolarHBondContact O-N 2.86Å; L57-N61 PolarHBondContact O-ND2 2.89Å; D58-N61 PolarHBondContact O-N 3.18Å; N61-R63 PolarHBondContact O-N 3.39Å; N61-A64 PolarHBondContact O-N 2.94Å; N61-Y65 WeakPolarHBondContact O-CB 3.48Å; N61-Y65 PolarHBondContact O-N 2.66Å
62	K	81.1	Confident	81.7	Confident	82 Å²	82	92.3 Å²	92.3	36%	0.357	48%	0.481	S	S	.	.	H	α-helix	trans	-58.3	-44.9	174.4	-75.6	166.6	175.9	169.5	0	112.1	D58 A64 Y65 N66	D58-K62 WeakPolarHBondContact O-CB 3.17Å; D58-K62 WeakPolarHBondContact O-CG 3.23Å; D58-K62 PolarHBondContact O-N 3.19Å; D58-K62 IonicContact OD1-NZ 3.89Å; D58-K62 VanDerWaalsContact OD2-CE 3.29Å; D58-K62 WeakPolarHBondContact OD2-CE 3.28Å; D58-K62 IonicContact OD2-NZ 3Å; D58-K62 PolarHBondContact OD2-NZ 3Å; K62-A64 PolarHBondContact O-N 3.28Å; K62-Y65 PolarHBondContact O-N 3.25Å; K62-N66 WeakPolarHBondContact O-CB 3.48Å; K62-N66 VanDerWaalsContact O-CG 3.24Å; K62-N66 PolarHBondContact O-N 3.23Å; K62-N66 PolarHBondContact O-OD1 3.05Å
63	R	79	Confident	82.2	Confident	104 Å²	104	88.6 Å²	88.6	39%	0.392	46%	0.461	S	S	.	.	H	α-helix	trans	-60.5	-42.9	176.1	176.2	173.4	-73.2	179.4	-11.1	112.5	P42 V43 A59 E60 N61 S67	P42-R63 HydrophobicContact CB-CG 4.2Å; V43-R63 PolarHBondContact O-NH2 2.84Å; A59-R63 WeakPolarHBondContact O-CB 3.5Å; A59-R63 PolarHBondContact O-N 3.4Å; E60-R63 PolarHBondContact O-N 3.45Å; N61-R63 PolarHBondContact O-N 3.39Å; R63-S67 VanDerWaalsContact O-CB 3.3Å; R63-S67 WeakPolarHBondContact O-CB 3.42Å; R63-S67 PolarHBondContact O-N 2.72Å
64	A	82.8	Confident	82.5	Confident	56 Å²	56	88.8 Å²	88.8	46%	0.463	45%	0.454	S	S	.	.	H	α-helix	trans	-66.7	-41.8	176.7	0	0	0	0	0	112.1	E60 N61 K62 S67 T68	E60-A64 PolarHBondContact O-N 3.02Å; N61-A64 PolarHBondContact O-N 2.94Å; K62-A64 PolarHBondContact O-N 3.28Å; A64-S67 PolarHBondContact O-N 2.91Å; A64-T68 PolarHBondContact O-N 2.92Å; A64-T68 PolarHBondContact O-OG1 2.97Å
65	Y	80.9	Confident	82.6	Confident	155 Å²	155	86.2 Å²	86.2	61%	0.608	45%	0.449	S	S	*	.	H	α-helix	trans	-62.8	-51.4	176.6	-176.7	-109.3	0	0	0	111.9	N61 K62 S67 T68 I69	N61-Y65 WeakPolarHBondContact O-CB 3.48Å; N61-Y65 PolarHBondContact O-N 2.66Å; K62-Y65 PolarHBondContact O-N 3.25Å; Y65-S67 VanDerWaalsContact C-N 3.3Å; Y65-S67 PolarHBondContact O-N 2.75Å; Y65-T68 WeakPolarHBondContact O-CA 3.31Å; Y65-T68 WeakPolarHBondContact O-CB 3.44Å; Y65-T68 PolarHBondContact O-N 2.94Å; Y65-I69 HydrophobicContact CD1-CD1 3.84Å; Y65-I69 HydrophobicContact CE1-CD1 3.35Å; Y65-I69 HydrophobicContact CE1-CG1 4.42Å; Y65-I69 HydrophobicContact CE2-CD1 4.31Å; Y65-I69 PolarHBondContact O-N 2.91Å
66	N	80.3	Confident	82.9	Confident	27 Å²	27	85.4 Å²	85.4	14%	0.144	44%	0.436	C	S	.	.	H	α-helix	trans	-63.9	-35.6	178.7	-65.2	2.1	0	0	0	111.7	E37 K62 T68 I69 R70	E37-N66 WeakPolarHBondContact CB-ND2 3.02Å; E37-N66 PolarHBondContact O-ND2 3.09Å; K62-N66 WeakPolarHBondContact O-CB 3.48Å; K62-N66 VanDerWaalsContact O-CG 3.24Å; K62-N66 PolarHBondContact O-N 3.23Å; K62-N66 PolarHBondContact O-OD1 3.05Å; N66-T68 VanDerWaalsContact C-N 3.33Å; N66-T68 PolarHBondContact O-N 2.87Å; N66-I69 PolarHBondContact O-N 3.04Å; N66-R70 VanDerWaalsContact O-CB 3.24Å; N66-R70 WeakPolarHBondContact O-CB 3.41Å; N66-R70 PolarHBondContact O-N 2.88Å
67	S	80.6	Confident	83.5	Confident	75 Å²	75	87 Å²	87	52%	0.524	45%	0.445	S	S	.	.	H	α-helix	trans	-62.7	-39.5	172.3	-168.7	0	0	0	0	112.1	R63 A64 Y65 H71	R63-S67 VanDerWaalsContact O-CB 3.3Å; R63-S67 WeakPolarHBondContact O-CB 3.42Å; R63-S67 PolarHBondContact O-N 2.72Å; A64-S67 PolarHBondContact O-N 2.91Å; Y65-S67 VanDerWaalsContact C-N 3.3Å; Y65-S67 PolarHBondContact O-N 2.75Å; S67-H71 WeakPolarHBondContact O-CB 3.33Å; S67-H71 PolarHBondContact O-N 2.86Å
68	T	83.6	Confident	83.8	Confident	96 Å²	96	84.7 Å²	84.7	59%	0.589	44%	0.441	S	S	*	.	H	α-helix	trans	-68	-46	177.3	-55.6	0	0	0	0	111.5	A64 Y65 N66 R70 H71 H72	A64-T68 PolarHBondContact O-N 2.92Å; A64-T68 PolarHBondContact O-OG1 2.97Å; Y65-T68 WeakPolarHBondContact O-CA 3.31Å; Y65-T68 WeakPolarHBondContact O-CB 3.44Å; Y65-T68 PolarHBondContact O-N 2.94Å; N66-T68 VanDerWaalsContact C-N 3.33Å; N66-T68 PolarHBondContact O-N 2.87Å; T68-R70 VanDerWaalsContact C-N 3.35Å; T68-R70 PolarHBondContact O-N 3.18Å; T68-H71 PolarHBondContact O-N 3.43Å; T68-H72 PolarHBondContact O-N 2.71Å
69	I	84.2	Confident	84.1	Confident	51 Å²	51	88 Å²	88	26%	0.262	45%	0.452	S	S	.	.	H	α-helix	trans	-58.1	-47.7	173.8	-72.1	177.1	0	0	0	110.6	Y65 N66 H71 H72 L73	Y65-I69 HydrophobicContact CD1-CD1 3.84Å; Y65-I69 HydrophobicContact CE1-CD1 3.35Å; Y65-I69 HydrophobicContact CE1-CG1 4.42Å; Y65-I69 HydrophobicContact CE2-CD1 4.31Å; Y65-I69 PolarHBondContact O-N 2.91Å; N66-I69 PolarHBondContact O-N 3.04Å; I69-H71 PolarHBondContact O-N 2.92Å; I69-H72 PolarHBondContact O-N 2.58Å; I69-L73 HydrophobicContact CG2-CD1 3.75Å; I69-L73 HydrophobicContact CG2-CG 4.24Å; I69-L73 WeakPolarHBondContact O-CB 3.42Å; I69-L73 WeakPolarHBondContact O-CG 3.29Å; I69-L73 PolarHBondContact O-N 2.85Å
70	R	81.2	Confident	84.6	Confident	123 Å²	123	90 Å²	90	46%	0.464	45%	0.453	S	S	.	.	H	α-helix	trans	-60	-44.9	-179.9	-175.6	-178.5	-179.8	87.3	10.7	111.9	N66 T68 L73 L74	N66-R70 VanDerWaalsContact O-CB 3.24Å; N66-R70 WeakPolarHBondContact O-CB 3.41Å; N66-R70 PolarHBondContact O-N 2.88Å; T68-R70 VanDerWaalsContact C-N 3.35Å; T68-R70 PolarHBondContact O-N 3.18Å; R70-L73 PolarHBondContact O-N 2.82Å; R70-L74 HydrophobicContact CG-CD1 4.01Å; R70-L74 WeakPolarHBondContact O-CB 3.42Å; R70-L74 VanDerWaalsContact O-CG 3.28Å; R70-L74 WeakPolarHBondContact O-CG 3.24Å; R70-L74 PolarHBondContact O-N 3.35Å
71	H	81.7	Confident	85.2	Confident	122 Å²	122	88.9 Å²	88.9	57%	0.565	44%	0.443	S	S	*	.	H	α-helix	trans	-62.6	-46.6	177.3	-174.6	-112.8	0	0	0	111.3	S67 T68 I69 L73 L74 N75	S67-H71 WeakPolarHBondContact O-CB 3.33Å; S67-H71 PolarHBondContact O-N 2.86Å; T68-H71 PolarHBondContact O-N 3.43Å; I69-H71 PolarHBondContact O-N 2.92Å; H71-L73 PolarHBondContact O-N 3.35Å; H71-L74 PolarHBondContact O-N 3.36Å; H71-N75 PolarHBondContact CE1-ND2 3.2Å; H71-N75 PolarHBondContact O-N 3.29Å; H71-N75 PolarHBondContact O-OD1 3.47Å
72	H	86.2	Confident	85.5	Confident	89 Å²	89	89.3 Å²	89.3	41%	0.412	44%	0.442	S	S	.	.	H	α-helix	trans	-61.3	-41.6	175.8	170.4	39.7	0	0	0	112.8	T68 I69 L74 N75 L76 K84	T68-H72 PolarHBondContact O-N 2.71Å; I69-H72 PolarHBondContact O-N 2.58Å; H72-L74 VanDerWaalsContact C-N 3.33Å; H72-L74 PolarHBondContact O-N 3.41Å; H72-N75 PolarHBondContact O-N 3.4Å; H72-L76 PolarHBondContact O-N 3.47Å; H72-K84 PolarHBondContact CD2-NZ 3.25Å; H72-K84 VanDerWaalsContact CD2-NZ 3.31Å; H72-K84 PolarHBondContact NE2-NZ 3.23Å
73	L	86.4	Confident	86	Confident	34 Å²	34	92.1 Å²	92.1	18%	0.178	45%	0.454	C	S	.	.	H	α-helix	trans	-66.1	-31.1	175.6	-75.8	173.8	0	0	0	113.3	I69 R70 H71 R81 K84 L85	I69-L73 HydrophobicContact CG2-CD1 3.75Å; I69-L73 HydrophobicContact CG2-CG 4.24Å; I69-L73 WeakPolarHBondContact O-CB 3.42Å; I69-L73 WeakPolarHBondContact O-CG 3.29Å; I69-L73 PolarHBondContact O-N 2.85Å; R70-L73 PolarHBondContact O-N 2.82Å; H71-L73 PolarHBondContact O-N 3.35Å; L73-R81 HydrophobicContact CD2-CG 4.46Å; L73-R81 WeakPolarHBondContact O-CD 3.29Å; L73-R81 WeakPolarHBondContact O-CG 3.2Å; L73-K84 HydrophobicContact CD2-CD 3.98Å; L73-L85 HydrophobicContact CD1-CD2 4.49Å
74	L	84.4	Confident	86.6	Confident	99 Å²	99	90.3 Å²	90.3	52%	0.518	45%	0.449	S	S	.	.	H	α-helix	trans	-77.9	-25.7	176.8	-71.6	170.5	0	0	0	112.9	R70 H71 H72	R70-L74 HydrophobicContact CG-CD1 4.01Å; R70-L74 WeakPolarHBondContact O-CB 3.42Å; R70-L74 VanDerWaalsContact O-CG 3.28Å; R70-L74 WeakPolarHBondContact O-CG 3.24Å; R70-L74 PolarHBondContact O-N 3.35Å; H71-L74 PolarHBondContact O-N 3.36Å; H72-L74 VanDerWaalsContact C-N 3.33Å; H72-L74 PolarHBondContact O-N 3.41Å
75	N	86.3	Confident	86.9	Confident	111 Å²	111	91.9 Å²	91.9	59%	0.594	45%	0.449	S	S	*	.	H	α-helix	trans	-85.8	-8	179.9	-65.4	3.5	0	0	0	113.8	H71 H72	H71-N75 PolarHBondContact CE1-ND2 3.2Å; H71-N75 PolarHBondContact O-N 3.29Å; H71-N75 PolarHBondContact O-OD1 3.47Å; H72-N75 PolarHBondContact O-N 3.4Å
76	L	88.6	Confident	87.4	Confident	41 Å²	41	85.3 Å²	85.3	22%	0.215	43%	0.425	C	S	.	.	S	Bend	trans	-81.3	148.5	172.5	-72.6	172.9	0	0	0	111.1	H72 E80 R81 K84	H72-L76 PolarHBondContact O-N 3.47Å; L76-E80 HydrophobicContact CB-CB 4.17Å; L76-E80 HydrophobicContact CD2-CB 4.28Å; L76-R81 HydrophobicContact CB-CB 4.16Å; L76-K84 HydrophobicContact CD1-CD 4.07Å
77	N	90.8	Very high	87.9	Confident	108 Å²	108	87.9 Å²	87.9	58%	0.578	44%	0.439	S	S	*	.			trans	-59.5	150.8	171.7	-171.1	-8.1	0	0	0	110	F79 E80 R81	N77-F79 PolarHBondContact O-N 3.08Å; N77-F79 VanDerWaalsContact O-N 3.14Å; N77-E80 HydrophobicContact CB-CB 4.44Å; N77-E80 HydrophobicContact CB-CG 4.05Å; N77-E80 VanDerWaalsContact CB-OE2 3.3Å; N77-E80 WeakPolarHBondContact CB-OE2 3.34Å; N77-E80 PolarHBondContact N-OE2 3.05Å; N77-E80 PolarHBondContact O-N 2.7Å; N77-R81 WeakPolarHBondContact O-CB 3.38Å; N77-R81 PolarHBondContact O-N 3.24Å
78	A	89.6	Confident	88.4	Confident	57 Å²	57	86.2 Å²	86.2	47%	0.471	42%	0.424	S	S	.	.	H	α-helix	trans	-52.9	-40.3	-176.3	0	0	0	0	0	112.8	H82	A78-H82 WeakPolarHBondContact O-CB 3.21Å; A78-H82 PolarHBondContact O-N 2.64Å
79	F	91.5	Very high	88.6	Confident	146 Å²	146	85.9 Å²	85.9	64%	0.64	41%	0.413	S	S	*	.	H	α-helix	trans	-66.4	-43.8	174.8	177.2	-101.5	0	0	0	113.2	N77 H82 K83	N77-F79 PolarHBondContact O-N 3.08Å; N77-F79 VanDerWaalsContact O-N 3.14Å; F79-H82 PolarHBondContact O-N 3.31Å; F79-K83 WeakPolarHBondContact O-CB 3.25Å; F79-K83 PolarHBondContact O-N 2.76Å
80	E	92.6	Very high	88.9	Confident	96 Å²	96	85.5 Å²	85.5	45%	0.449	41%	0.411	S	S	.	.	H	α-helix	trans	-67.3	-42.6	179	-62.3	175.3	135.7	0	0	111.5	L76 N77 K83 K84	L76-E80 HydrophobicContact CB-CB 4.17Å; L76-E80 HydrophobicContact CD2-CB 4.28Å; N77-E80 HydrophobicContact CB-CB 4.44Å; N77-E80 HydrophobicContact CB-CG 4.05Å; N77-E80 VanDerWaalsContact CB-OE2 3.3Å; N77-E80 WeakPolarHBondContact CB-OE2 3.34Å; N77-E80 PolarHBondContact N-OE2 3.05Å; N77-E80 PolarHBondContact O-N 2.7Å; E80-K83 PolarHBondContact O-N 2.98Å; E80-K84 WeakPolarHBondContact O-CB 3.44Å; E80-K84 PolarHBondContact O-N 3.08Å
81	R	92.4	Very high	89.2	Confident	96 Å²	96	85.2 Å²	85.2	36%	0.362	42%	0.415	S	S	.	.	H	α-helix	trans	-59.4	-46.4	173.9	-173.6	-179.2	72.2	-153.8	1.3	110.9	L73 L76 N77 K84 L85	L73-R81 HydrophobicContact CD2-CG 4.46Å; L73-R81 WeakPolarHBondContact O-CD 3.29Å; L73-R81 WeakPolarHBondContact O-CG 3.2Å; L76-R81 HydrophobicContact CB-CB 4.16Å; N77-R81 WeakPolarHBondContact O-CB 3.38Å; N77-R81 PolarHBondContact O-N 3.24Å; R81-K84 PolarHBondContact O-N 3.02Å; R81-L85 HydrophobicContact CG-CD1 4.16Å; R81-L85 WeakPolarHBondContact O-CB 3.5Å; R81-L85 VanDerWaalsContact O-CG 3.25Å; R81-L85 WeakPolarHBondContact O-CG 3.34Å; R81-L85 PolarHBondContact O-N 2.64Å
82	H	91.3	Very high	89.5	Confident	108 Å²	108	87.1 Å²	87.1	50%	0.5	42%	0.418	S	S	.	.	H	α-helix	trans	-61.3	-51.7	174.2	174.8	-106.7	0	0	0	111.7	A78 F79 K84 L85 V86	A78-H82 WeakPolarHBondContact O-CB 3.21Å; A78-H82 PolarHBondContact O-N 2.64Å; F79-H82 PolarHBondContact O-N 3.31Å; H82-K84 VanDerWaalsContact C-N 3.26Å; H82-K84 PolarHBondContact O-N 2.86Å; H82-L85 PolarHBondContact O-N 2.73Å; H82-L85 VanDerWaalsContact O-N 3.13Å; H82-V86 WeakPolarHBondContact NE2-CG2 3.4Å; H82-V86 WeakPolarHBondContact O-CG2 3.32Å; H82-V86 PolarHBondContact O-N 2.87Å
83	K	92.5	Very high	89.3	Confident	141 Å²	141	88.6 Å²	88.6	61%	0.613	42%	0.421	S	S	*	.	H	α-helix	trans	-55	-41.6	178.2	-178	-179.5	177.7	-177.2	0	112.1	F79 E80 N87	F79-K83 WeakPolarHBondContact O-CB 3.25Å; F79-K83 PolarHBondContact O-N 2.76Å; E80-K83 PolarHBondContact O-N 2.98Å; K83-N87 WeakPolarHBondContact O-CB 3.33Å; K83-N87 PolarHBondContact O-N 3.35Å
84	K	90.9	Very high	89.1	Confident	66 Å²	66	90.3 Å²	90.3	29%	0.287	45%	0.447	S	S	.	.	H	α-helix	trans	-65.6	-49.9	175.7	-176.2	173.2	-179	-175.3	0	111.8	H72 L73 L76 E80 R81 H82 V86 N87 D88	H72-K84 PolarHBondContact CD2-NZ 3.25Å; H72-K84 VanDerWaalsContact CD2-NZ 3.31Å; H72-K84 PolarHBondContact NE2-NZ 3.23Å; L73-K84 HydrophobicContact CD2-CD 3.98Å; L76-K84 HydrophobicContact CD1-CD 4.07Å; E80-K84 WeakPolarHBondContact O-CB 3.44Å; E80-K84 PolarHBondContact O-N 3.08Å; R81-K84 PolarHBondContact O-N 3.02Å; H82-K84 VanDerWaalsContact C-N 3.26Å; H82-K84 PolarHBondContact O-N 2.86Å; K84-V86 VanDerWaalsContact C-N 3.31Å; K84-V86 PolarHBondContact O-N 2.89Å; K84-N87 PolarHBondContact O-N 3.13Å; K84-N87 VanDerWaalsContact O-N 3.16Å; K84-D88 WeakPolarHBondContact CG-OD2 3.33Å; K84-D88 WeakPolarHBondContact O-CB 3.36Å; K84-D88 PolarHBondContact O-N 3.19Å
85	L	90.1	Very high	88.9	Confident	89 Å²	89	86.2 Å²	86.2	47%	0.466	43%	0.429	S	S	.	.	H	α-helix	trans	-60.8	-38.6	178.9	-70.5	168.5	0	0	0	112.6	L73 R81 H82 Y89	L73-L85 HydrophobicContact CD1-CD2 4.49Å; R81-L85 HydrophobicContact CG-CD1 4.16Å; R81-L85 WeakPolarHBondContact O-CB 3.5Å; R81-L85 VanDerWaalsContact O-CG 3.25Å; R81-L85 WeakPolarHBondContact O-CG 3.34Å; R81-L85 PolarHBondContact O-N 2.64Å; H82-L85 PolarHBondContact O-N 2.73Å; H82-L85 VanDerWaalsContact O-N 3.13Å; L85-Y89 VanDerWaalsContact O-CB 3.3Å; L85-Y89 WeakPolarHBondContact O-CB 3.36Å; L85-Y89 PolarHBondContact O-N 2.97Å
86	V	90.7	Very high	88.9	Confident	17 Å²	17	83.4 Å²	83.4	10%	0.103	42%	0.418	C	S	.	.	H	α-helix	trans	-64.1	-46.5	173.5	170.9	0	0	0	0	111.1	H82 K84 Y89 L90 W97 F100	H82-V86 WeakPolarHBondContact NE2-CG2 3.4Å; H82-V86 WeakPolarHBondContact O-CG2 3.32Å; H82-V86 PolarHBondContact O-N 2.87Å; K84-V86 VanDerWaalsContact C-N 3.31Å; K84-V86 PolarHBondContact O-N 2.89Å; V86-Y89 PolarHBondContact O-N 3.34Å; V86-L90 HydrophobicContact CG1-CD1 3.85Å; V86-L90 WeakPolarHBondContact O-CD1 3.39Å; V86-L90 VanDerWaalsContact O-CG 3.24Å; V86-L90 WeakPolarHBondContact O-CG 3.27Å; V86-L90 PolarHBondContact O-N 3.14Å; V86-W97 HydrophobicContact CG1-CH2 3.93Å; V86-W97 HydrophobicContact CG1-CZ3 4Å; V86-F100 HydrophobicContact CB-CZ 4.21Å; V86-F100 HydrophobicContact CG1-CE2 3.97Å; V86-F100 HydrophobicContact CG1-CZ 3.88Å; V86-F100 HydrophobicContact CG2-CE1 3.84Å; V86-F100 HydrophobicContact CG2-CZ 3.91Å
87	N	90.9	Very high	88.7	Confident	81 Å²	81	90 Å²	90	43%	0.433	44%	0.44	S	S	.	.	H	α-helix	trans	-60.1	-48.4	175.8	-178.1	92.2	0	0	0	111.7	K83 K84 Y89 L90 Q91	K83-N87 WeakPolarHBondContact O-CB 3.33Å; K83-N87 PolarHBondContact O-N 3.35Å; K84-N87 PolarHBondContact O-N 3.13Å; K84-N87 VanDerWaalsContact O-N 3.16Å; N87-Y89 VanDerWaalsContact C-N 3.3Å; N87-Y89 PolarHBondContact O-N 2.84Å; N87-L90 PolarHBondContact O-N 3.5Å; N87-Q91 PolarHBondContact ND2-OE1 3.29Å; N87-Q91 VanDerWaalsContact ND2-OE1 3.13Å; N87-Q91 WeakPolarHBondContact O-CB 3.44Å; N87-Q91 PolarHBondContact O-N 2.85Å
88	D	89.9	Confident	88.3	Confident	39 Å²	39	92 Å²	92	21%	0.209	44%	0.444	C	S	.	.	H	α-helix	trans	-63.7	-36.8	-178.4	-65.6	-14.5	0	0	0	110.9	K84 Y92 Y93	K84-D88 WeakPolarHBondContact CG-OD2 3.33Å; K84-D88 WeakPolarHBondContact O-CB 3.36Å; K84-D88 PolarHBondContact O-N 3.19Å; D88-Y92 HydrophobicContact CB-CD2 4.11Å; D88-Y92 HydrophobicContact CB-CE2 4.43Å; D88-Y92 WeakPolarHBondContact O-CB 3.41Å; D88-Y92 WeakPolarHBondContact O-CD2 3.36Å; D88-Y92 PolarHBondContact O-N 3.47Å; D88-Y93 WeakPolarHBondContact O-CD2 3.35Å
89	Y	88.8	Confident	88	Confident	90 Å²	90	93.7 Å²	93.7	35%	0.353	45%	0.445	S	S	.	.	H	α-helix	trans	-62.5	-50.6	173	-178.3	-109.9	0	0	0	112.9	L85 V86 N87 Q91 Y93 G95 D99 F100	L85-Y89 VanDerWaalsContact O-CB 3.3Å; L85-Y89 WeakPolarHBondContact O-CB 3.36Å; L85-Y89 PolarHBondContact O-N 2.97Å; V86-Y89 PolarHBondContact O-N 3.34Å; N87-Y89 VanDerWaalsContact C-N 3.3Å; N87-Y89 PolarHBondContact O-N 2.84Å; Y89-Q91 VanDerWaalsContact C-N 3.33Å; Y89-Q91 PolarHBondContact O-N 2.9Å; Y89-Y93 HydrophobicContact CD2-CG 4.48Å; Y89-Y93 WeakPolarHBondContact O-CB 3.44Å; Y89-Y93 PolarHBondContact O-N 3.5Å; Y89-G95 VanDerWaalsContact CE1-CA 3.46Å; Y89-G95 PolarHBondContact O-N 3.43Å; Y89-D99 HydrophobicContact CE1-CB 4.16Å; Y89-D99 PolarHBondContact OH-OD2 3.02Å; Y89-F100 AromaticContact CD1-CE2 3.81Å; Y89-F100 HydrophobicContact CD1-CE2 3.81Å; Y89-F100 AromaticContact CD1-CZ 3.51Å; Y89-F100 HydrophobicContact CD1-CZ 3.51Å; Y89-F100 HydrophobicContact CE1-CE2 4.2Å; Y89-F100 HydrophobicContact CE1-CZ 4.09Å; Y89-F100 HydrophobicContact CG-CZ 4.33Å
90	L	89.7	Confident	87.6	Confident	42 Å²	42	91 Å²	91	22%	0.22	43%	0.433	C	S	.	.	H	α-helix	trans	-63.3	-38.5	178.1	-66.6	166.6	0	0	0	111.8	V86 N87 G95 W97 F100	V86-L90 HydrophobicContact CG1-CD1 3.85Å; V86-L90 WeakPolarHBondContact O-CD1 3.39Å; V86-L90 VanDerWaalsContact O-CG 3.24Å; V86-L90 WeakPolarHBondContact O-CG 3.27Å; V86-L90 PolarHBondContact O-N 3.14Å; N87-L90 PolarHBondContact O-N 3.5Å; L90-G95 WeakPolarHBondContact CD2-O 3.17Å; L90-W97 HydrophobicContact CD1-CD2 4.17Å; L90-W97 HydrophobicContact CD1-CH2 3.84Å; L90-W97 HydrophobicContact CD1-CZ2 3.37Å; L90-W97 HydrophobicContact CD1-CZ3 4.39Å; L90-W97 HydrophobicContact CD2-CD2 4.38Å; L90-W97 HydrophobicContact CD2-CG 4.41Å; L90-F100 HydrophobicContact CD2-CE2 4.15Å; L90-F100 HydrophobicContact CG-CE2 4.33Å
91	Q	88.1	Confident	87.2	Confident	118 Å²	118	93.5 Å²	93.5	55%	0.551	45%	0.445	S	S	*	.	H	α-helix	trans	-82.9	-43.6	-173	-176.2	172.6	-4.4	0	0	113.9	N87 Y89	N87-Q91 PolarHBondContact ND2-OE1 3.29Å; N87-Q91 VanDerWaalsContact ND2-OE1 3.13Å; N87-Q91 WeakPolarHBondContact O-CB 3.44Å; N87-Q91 PolarHBondContact O-N 2.85Å; Y89-Q91 VanDerWaalsContact C-N 3.33Å; Y89-Q91 PolarHBondContact O-N 2.9Å
92	Y	87.3	Confident	86.9	Confident	161 Å²	161	94.8 Å²	94.8	63%	0.631	45%	0.449	S	S	*	.	H	α-helix	trans	-103.4	-29.2	-171.3	-61	-71.2	0	0	0	114.1	D88	D88-Y92 HydrophobicContact CB-CD2 4.11Å; D88-Y92 HydrophobicContact CB-CE2 4.43Å; D88-Y92 WeakPolarHBondContact O-CB 3.41Å; D88-Y92 WeakPolarHBondContact O-CD2 3.36Å; D88-Y92 PolarHBondContact O-N 3.47Å
93	Y	82.5	Confident	86.6	Confident	120 Å²	120	93.9 Å²	93.9	47%	0.471	45%	0.449	S	S	.	.	S	Bend	trans	-102.2	-1.8	-174.6	-58.9	-95.4	0	0	0	113	D88 Y89 G95	D88-Y93 WeakPolarHBondContact O-CD2 3.35Å; Y89-Y93 HydrophobicContact CD2-CG 4.48Å; Y89-Y93 WeakPolarHBondContact O-CB 3.44Å; Y89-Y93 PolarHBondContact O-N 3.5Å; Y93-G95 VanDerWaalsContact C-N 3.3Å
94	G	81.9	Confident	86.4	Confident	70 Å²	70	91.7 Å²	91.7	72%	0.722	45%	0.447	S	S	*	.			trans	72.3	21.4	180	0	0	0	0	0	114
95	G	81	Confident	86.2	Confident	14 Å²	14	93.1 Å²	93.1	14%	0.144	47%	0.465	C	S	.	.			trans	-61.4	154	-179.4	0	0	0	0	0	113.5	Y89 L90 Y93	Y89-G95 VanDerWaalsContact CE1-CA 3.46Å; Y89-G95 PolarHBondContact O-N 3.43Å; L90-G95 WeakPolarHBondContact CD2-O 3.17Å; Y93-G95 VanDerWaalsContact C-N 3.3Å
96	S	86	Confident	86	Confident	52 Å²	52	97 Å²	97	36%	0.364	48%	0.478	S	S	.	.			trans	-107.2	151.1	176.4	-160.8	0	0	0	0	111.5	K98 D99	S96-K98 PolarHBondContact O-N 3.38Å; S96-K98 VanDerWaalsContact O-N 3.1Å; S96-D99 PolarHBondContact N-OD2 3.43Å; S96-D99 WeakPolarHBondContact O-CB 3.44Å; S96-D99 PolarHBondContact O-N 2.94Å
97	W	84	Confident	86	Confident	180 Å²	180	99.5 Å²	99.5	68%	0.682	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-60.4	-17.1	166.8	-73.7	107	0	0	0	113.4	V86 L90 D99 F100	V86-W97 HydrophobicContact CG1-CH2 3.93Å; V86-W97 HydrophobicContact CG1-CZ3 4Å; L90-W97 HydrophobicContact CD1-CD2 4.17Å; L90-W97 HydrophobicContact CD1-CH2 3.84Å; L90-W97 HydrophobicContact CD1-CZ2 3.37Å; L90-W97 HydrophobicContact CD1-CZ3 4.39Å; L90-W97 HydrophobicContact CD2-CD2 4.38Å; L90-W97 HydrophobicContact CD2-CG 4.41Å; W97-D99 VanDerWaalsContact C-N 3.31Å; W97-F100 HydrophobicContact CE3-CD2 4.14Å
98	K	83.8	Confident	85.9	Confident	150 Å²	150	101.7 Å²	101.7	65%	0.652	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-66	-31.4	171.4	-65.6	178.8	178.7	180	0	112.9	S96 F100 Q101	S96-K98 PolarHBondContact O-N 3.38Å; S96-K98 VanDerWaalsContact O-N 3.1Å; K98-F100 PolarHBondContact O-N 2.83Å; K98-Q101 VanDerWaalsContact O-CB 3.3Å; K98-Q101 WeakPolarHBondContact O-CB 3.17Å; K98-Q101 WeakPolarHBondContact O-CG 3.19Å; K98-Q101 PolarHBondContact O-N 2.77Å
99	D	82.6	Confident	86.1	Confident	92 Å²	92	103.1 Å²	103.1	49%	0.492	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-72.7	-17.2	-173.6	-47.3	-23.9	0	0	0	111.5	Y89 S96 W97	Y89-D99 HydrophobicContact CE1-CB 4.16Å; Y89-D99 PolarHBondContact OH-OD2 3.02Å; S96-D99 PolarHBondContact N-OD2 3.43Å; S96-D99 WeakPolarHBondContact O-CB 3.44Å; S96-D99 PolarHBondContact O-N 2.94Å; W97-D99 VanDerWaalsContact C-N 3.31Å
100	F	83.3	Confident	86.3	Confident	88 Å²	88	103.4 Å²	103.4	39%	0.386	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-92.7	1.8	172.5	-58.6	-73.5	0	0	0	113.7	V86 Y89 L90 W97 K98 R102	V86-F100 HydrophobicContact CB-CZ 4.21Å; V86-F100 HydrophobicContact CG1-CE2 3.97Å; V86-F100 HydrophobicContact CG1-CZ 3.88Å; V86-F100 HydrophobicContact CG2-CE1 3.84Å; V86-F100 HydrophobicContact CG2-CZ 3.91Å; Y89-F100 AromaticContact CD1-CE2 3.81Å; Y89-F100 HydrophobicContact CD1-CE2 3.81Å; Y89-F100 AromaticContact CD1-CZ 3.51Å; Y89-F100 HydrophobicContact CD1-CZ 3.51Å; Y89-F100 HydrophobicContact CE1-CE2 4.2Å; Y89-F100 HydrophobicContact CE1-CZ 4.09Å; Y89-F100 HydrophobicContact CG-CZ 4.33Å; L90-F100 HydrophobicContact CD2-CE2 4.15Å; L90-F100 HydrophobicContact CG-CE2 4.33Å; W97-F100 HydrophobicContact CE3-CD2 4.14Å; K98-F100 PolarHBondContact O-N 2.83Å; F100-R102 PolarHBondContact O-N 2.79Å
101	Q	84.3	Confident	86.5	Confident	149 Å²	149	106.8 Å²	106.8	70%	0.696	53%	0.532	S	S	*	.			trans	-77.8	106.7	176.6	-64.3	-174.9	-54.3	0	0	109.7	K98 D103	K98-Q101 VanDerWaalsContact O-CB 3.3Å; K98-Q101 WeakPolarHBondContact O-CB 3.17Å; K98-Q101 WeakPolarHBondContact O-CG 3.19Å; K98-Q101 PolarHBondContact O-N 2.77Å; Q101-D103 PolarHBondContact O-N 2.69Å
102	R	84.9	Confident	86.8	Confident	123 Å²	123	103.4 Å²	103.4	46%	0.464	52%	0.518	S	S	.	.			trans	-60	131.6	176.2	-170	171.5	82.1	80.1	-10.5	110.2	F100 T104 D107	F100-R102 PolarHBondContact O-N 2.79Å; R102-T104 PolarHBondContact O-N 2.81Å; R102-D107 IonicContact CZ-OD1 3.74Å; R102-D107 VanDerWaalsContact CZ-OD1 3.31Å; R102-D107 IonicContact CZ-OD2 2.67Å; R102-D107 IonicContact NH1-OD1 3.57Å; R102-D107 PolarHBondContact NH1-OD1 2.96Å; R102-D107 IonicContact NH1-OD2 3.5Å; R102-D107 PolarHBondContact NH1-OD2 3.46Å; R102-D107 IonicContact NH2-OD1 2.76Å; R102-D107 PolarHBondContact NH2-OD1 2.95Å; R102-D107 IonicContact NH2-OD2 3.05Å; R102-D107 PolarHBondContact NH2-OD2 3.14Å
103	D	85.9	Confident	87.1	Confident	90 Å²	90	96.3 Å²	96.3	48%	0.481	49%	0.491	S	S	.	.			trans	-62.8	114.5	168.7	175.4	20.7	0	0	0	109.8	Q101 S105	Q101-D103 PolarHBondContact O-N 2.69Å; D103-S105 VanDerWaalsContact CG-OG 3.24Å; D103-S105 WeakPolarHBondContact OD1-CB 3.26Å; D103-S105 PolarHBondContact OD1-N 3.43Å; D103-S105 PolarHBondContact OD1-OG 3.28Å; D103-S105 PolarHBondContact OD2-OG 3.38Å; D103-S105 VanDerWaalsContact OD2-OG 3.1Å
104	T	88.3	Confident	87.6	Confident	95 Å²	95	92.1 Å²	92.1	58%	0.583	48%	0.476	S	S	*	.			trans	-96.7	-0.2	177.7	56.5	0	0	0	0	113	R102 K106 D107	R102-T104 PolarHBondContact O-N 2.81Å; T104-K106 PolarHBondContact O-N 3.12Å; T104-K106 VanDerWaalsContact O-N 3.08Å; T104-D107 WeakPolarHBondContact CA-OD2 3.43Å; T104-D107 WeakPolarHBondContact CB-OD2 3.42Å; T104-D107 WeakPolarHBondContact CG2-OD2 3.38Å; T104-D107 WeakPolarHBondContact O-CB 3.4Å; T104-D107 PolarHBondContact O-N 3.29Å
105	S	86.8	Confident	88.1	Confident	95 Å²	95	95.8 Å²	95.8	66%	0.664	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-18.9	-174.6	67.4	0	0	0	0	114.5	D103	D103-S105 VanDerWaalsContact CG-OG 3.24Å; D103-S105 WeakPolarHBondContact OD1-CB 3.26Å; D103-S105 PolarHBondContact OD1-N 3.43Å; D103-S105 PolarHBondContact OD1-OG 3.28Å; D103-S105 PolarHBondContact OD2-OG 3.38Å; D103-S105 VanDerWaalsContact OD2-OG 3.1Å
106	K	86.3	Confident	88.6	Confident	170 Å²	170	100.1 Å²	100.1	74%	0.739	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	-2	179.3	-59.6	174	-170.4	166.3	0	113.4	T104 K108	T104-K106 PolarHBondContact O-N 3.12Å; T104-K106 VanDerWaalsContact O-N 3.08Å; K106-K108 PolarHBondContact O-N 2.94Å
107	D	89	Confident	88.8	Confident	71 Å²	71	99.7 Å²	99.7	38%	0.38	48%	0.481	S	S	.	.			trans	-72.4	113.7	-177.9	-69.3	-22.1	0	0	0	110.5	R102 T104	R102-D107 IonicContact CZ-OD1 3.74Å; R102-D107 VanDerWaalsContact CZ-OD1 3.31Å; R102-D107 IonicContact CZ-OD2 2.67Å; R102-D107 IonicContact NH1-OD1 3.57Å; R102-D107 PolarHBondContact NH1-OD1 2.96Å; R102-D107 IonicContact NH1-OD2 3.5Å; R102-D107 PolarHBondContact NH1-OD2 3.46Å; R102-D107 IonicContact NH2-OD1 2.76Å; R102-D107 PolarHBondContact NH2-OD1 2.95Å; R102-D107 IonicContact NH2-OD2 3.05Å; R102-D107 PolarHBondContact NH2-OD2 3.14Å; T104-D107 WeakPolarHBondContact CA-OD2 3.43Å; T104-D107 WeakPolarHBondContact CB-OD2 3.42Å; T104-D107 WeakPolarHBondContact CG2-OD2 3.38Å; T104-D107 WeakPolarHBondContact O-CB 3.4Å; T104-D107 PolarHBondContact O-N 3.29Å
108	K	89.7	Confident	89.1	Confident	127 Å²	127	92.9 Å²	92.9	55%	0.552	47%	0.467	S	S	*	.			trans	-92	123.9	169.4	-59.8	-156.5	-175.9	-150.3	0	109.8	K106 V113 E116	K106-K108 PolarHBondContact O-N 2.94Å; K108-V113 HydrophobicContact CB-CG2 4.2Å; K108-E116 IonicContact NZ-OE1 2.91Å; K108-E116 PolarHBondContact NZ-OE1 2.96Å; K108-E116 IonicContact NZ-OE2 2.72Å; K108-E116 PolarHBondContact NZ-OE2 2.97Å
109	T	93.2	Very high	89.4	Confident	68 Å²	68	87.4 Å²	87.4	42%	0.417	44%	0.442	S	S	.	.			trans	-82	156.8	168	77.1	0	0	0	0	110.4	I111 D112 V113	T109-I111 PolarHBondContact O-N 3.33Å; T109-I111 PolarHBondContact OG1-N 2.92Å; T109-D112 WeakPolarHBondContact CB-OD2 3.26Å; T109-D112 PolarHBondContact N-OD2 3.12Å; T109-D112 WeakPolarHBondContact O-CA 3.3Å; T109-D112 WeakPolarHBondContact O-CB 3.41Å; T109-D112 PolarHBondContact O-N 3.24Å; T109-D112 PolarHBondContact OG1-N 2.99Å; T109-D112 PolarHBondContact OG1-OD2 3.34Å; T109-V113 PolarHBondContact O-N 3.47Å
110	D	93.3	Very high	89.7	Confident	97 Å²	97	84.2 Å²	84.2	52%	0.519	42%	0.424	S	S	.	.	H	α-helix	trans	-47.5	-36.7	170.8	-66.7	24.2	0	0	0	112.4	D112 V113 I114 L135	D110-D112 VanDerWaalsContact C-N 3.33Å; D110-D112 PolarHBondContact O-N 3.18Å; D110-V113 PolarHBondContact O-N 2.62Å; D110-I114 WeakPolarHBondContact O-CB 3.26Å; D110-I114 WeakPolarHBondContact O-CD1 3.44Å; D110-I114 WeakPolarHBondContact O-CG1 3.45Å; D110-I114 PolarHBondContact O-N 3.47Å; D110-L135 HydrophobicContact CB-CD2 4.17Å
111	I	93.3	Very high	90.1	Very high	112 Å²	112	83 Å²	83	57%	0.574	42%	0.421	S	S	*	.	H	α-helix	trans	-67	-36.7	179.9	-50.7	176.8	0	0	0	110.5	T109 K115	T109-I111 PolarHBondContact O-N 3.33Å; T109-I111 PolarHBondContact OG1-N 2.92Å; I111-K115 WeakPolarHBondContact O-CG 3.27Å; I111-K115 PolarHBondContact O-N 3.37Å
112	D	94.6	Very high	90.3	Very high	48 Å²	48	77.3 Å²	77.3	26%	0.257	39%	0.393	S	S	.	.	H	α-helix	trans	-75.8	-38.7	177.9	-55.7	-55.8	0	0	0	111.6	T109 D110 I114 K115 E116	T109-D112 WeakPolarHBondContact CB-OD2 3.26Å; T109-D112 PolarHBondContact N-OD2 3.12Å; T109-D112 WeakPolarHBondContact O-CA 3.3Å; T109-D112 WeakPolarHBondContact O-CB 3.41Å; T109-D112 PolarHBondContact O-N 3.24Å; T109-D112 PolarHBondContact OG1-N 2.99Å; T109-D112 PolarHBondContact OG1-OD2 3.34Å; D110-D112 VanDerWaalsContact C-N 3.33Å; D110-D112 PolarHBondContact O-N 3.18Å; D112-I114 VanDerWaalsContact C-N 3.27Å; D112-I114 PolarHBondContact O-N 3.33Å; D112-K115 WeakPolarHBondContact O-CB 3.15Å; D112-K115 PolarHBondContact O-N 2.92Å; D112-K115 VanDerWaalsContact O-N 3.08Å; D112-K115 IonicContact OD1-NZ 3.42Å; D112-K115 PolarHBondContact OD1-NZ 3Å; D112-E116 WeakPolarHBondContact O-CG 3.39Å; D112-E116 PolarHBondContact O-N 2.72Å
113	V	93.8	Very high	90.2	Very high	11 Å²	11	73.7 Å²	73.7	7%	0.067	39%	0.387	C	S	.	.	H	α-helix	trans	-58.7	-41.1	170.6	-179.5	0	0	0	0	110.8	K108 T109 D110 E116 H117 W131 S132 L135	K108-V113 HydrophobicContact CB-CG2 4.2Å; T109-V113 PolarHBondContact O-N 3.47Å; D110-V113 PolarHBondContact O-N 2.62Å; V113-E116 PolarHBondContact O-N 3.4Å; V113-H117 WeakPolarHBondContact O-CB 3.33Å; V113-H117 PolarHBondContact O-N 2.88Å; V113-W131 HydrophobicContact CG1-CZ3 4.2Å; V113-S132 VanDerWaalsContact CG1-CB 3.47Å; V113-L135 HydrophobicContact CB-CD2 4.26Å; V113-L135 HydrophobicContact CG1-CD2 4.11Å
114	I	93.6	Very high	89.9	Confident	32 Å²	32	78.8 Å²	78.8	16%	0.164	41%	0.407	C	S	.	.	H	α-helix	trans	-67.9	-32.7	174.8	-69.6	164.2	0	0	0	112.2	D110 D112 G118 L135 Y139	D110-I114 WeakPolarHBondContact O-CB 3.26Å; D110-I114 WeakPolarHBondContact O-CD1 3.44Å; D110-I114 WeakPolarHBondContact O-CG1 3.45Å; D110-I114 PolarHBondContact O-N 3.47Å; D112-I114 VanDerWaalsContact C-N 3.27Å; D112-I114 PolarHBondContact O-N 3.33Å; I114-G118 WeakPolarHBondContact O-CA 3.28Å; I114-G118 PolarHBondContact O-N 3.24Å; I114-L135 HydrophobicContact CD1-CD1 4.49Å; I114-L135 HydrophobicContact CD1-CD2 4.44Å; I114-L135 HydrophobicContact CD1-CG 4.13Å; I114-L135 HydrophobicContact CG1-CD2 4.22Å; I114-L135 HydrophobicContact CG1-CG 3.97Å; I114-Y139 HydrophobicContact CD1-CD2 4.19Å; I114-Y139 HydrophobicContact CD1-CG 4.15Å; I114-Y139 HydrophobicContact CG2-CD1 3.59Å; I114-Y139 HydrophobicContact CG2-CD2 4.47Å; I114-Y139 HydrophobicContact CG2-CE1 3.95Å; I114-Y139 HydrophobicContact CG2-CG 3.87Å
115	K	91.8	Very high	89.3	Confident	147 Å²	147	82.5 Å²	82.5	64%	0.639	42%	0.418	S	S	*	.	H	α-helix	trans	-68	-40.1	172	-69.7	166.4	-160.5	158	0	112.3	I111 D112	I111-K115 WeakPolarHBondContact O-CG 3.27Å; I111-K115 PolarHBondContact O-N 3.37Å; D112-K115 WeakPolarHBondContact O-CB 3.15Å; D112-K115 PolarHBondContact O-N 2.92Å; D112-K115 VanDerWaalsContact O-N 3.08Å; D112-K115 IonicContact OD1-NZ 3.42Å; D112-K115 PolarHBondContact OD1-NZ 3Å
116	E	91.7	Very high	88.8	Confident	105 Å²	105	79.1 Å²	79.1	49%	0.491	39%	0.393	S	S	.	.	H	α-helix	trans	-73.4	-44	-177.4	-73.1	177.5	172.4	0	0	112.6	K108 D112 V113	K108-E116 IonicContact NZ-OE1 2.91Å; K108-E116 PolarHBondContact NZ-OE1 2.96Å; K108-E116 IonicContact NZ-OE2 2.72Å; K108-E116 PolarHBondContact NZ-OE2 2.97Å; D112-E116 WeakPolarHBondContact O-CG 3.39Å; D112-E116 PolarHBondContact O-N 2.72Å; V113-E116 PolarHBondContact O-N 3.4Å
117	H	91.2	Very high	88.4	Confident	43 Å²	43	78.5 Å²	78.5	20%	0.199	39%	0.392	C	S	.	.	H	α-helix	trans	-98.5	-13.2	-174.7	-73.9	-100.5	0	0	0	114.3	V113 S132 D133 A136 R203	V113-H117 WeakPolarHBondContact O-CB 3.33Å; V113-H117 PolarHBondContact O-N 2.88Å; H117-S132 WeakPolarHBondContact CD2-CB 3.17Å; H117-S132 VanDerWaalsContact CG-CB 3.49Å; H117-S132 VanDerWaalsContact NE2-CB 3.34Å; H117-S132 WeakPolarHBondContact NE2-CB 3.43Å; H117-D133 IonicContact CE1-OD1 3.58Å; H117-D133 IonicContact CG-OD1 2.71Å; H117-D133 IonicContact ND1-OD1 3.6Å; H117-D133 PolarHBondContact ND1-OD1 3.29Å; H117-D133 IonicContact ND1-OD2 3.31Å; H117-A136 HydrophobicContact CB-CB 3.92Å; H117-R203 PolarHBondContact O-NH2 3.06Å
118	G	89.7	Confident	88.1	Confident	37 Å²	37	76.1 Å²	76.1	38%	0.381	38%	0.383	S	S	.	.			trans	-58.3	134.6	-177.1	0	0	0	0	0	113.9	I114	I114-G118 WeakPolarHBondContact O-CA 3.28Å; I114-G118 PolarHBondContact O-N 3.24Å
119	R	89.7	Confident	88	Confident	35 Å²	35	75.1 Å²	75.1	13%	0.132	39%	0.387	C	S	.	.			trans	-115.2	149.3	175.5	-57.3	-176.8	-175.4	-129.6	23.8	111.1	L121 W122 D126 E202	R119-L121 WeakPolarHBondContact CB-O 3.43Å; R119-W122 HydrophobicContact CB-CD2 4.39Å; R119-W122 HydrophobicContact CB-CG 4.46Å; R119-W122 HydrophobicContact CB-CZ2 4.37Å; R119-W122 HydrophobicContact CG-CD2 4.41Å; R119-W122 HydrophobicContact CG-CH2 4.44Å; R119-W122 HydrophobicContact CG-CZ2 4.06Å; R119-D126 IonicContact CZ-OD1 2.69Å; R119-D126 IonicContact CZ-OD2 3.72Å; R119-D126 IonicContact NH1-OD1 3.52Å; R119-D126 PolarHBondContact NH1-OD1 3.33Å; R119-D126 IonicContact NH1-OD2 2.77Å; R119-D126 PolarHBondContact NH1-OD2 3.22Å; R119-D126 VanDerWaalsContact NH2-CG 3.33Å; R119-D126 IonicContact NH2-OD1 2.72Å; R119-D126 PolarHBondContact NH2-OD1 3.2Å; R119-E202 WeakPolarHBondContact CA-OE1 3.5Å; R119-E202 WeakPolarHBondContact CB-OE1 3.18Å
120	F	89.9	Confident	87.9	Confident	25 Å²	25	74.2 Å²	74.2	11%	0.11	38%	0.384	C	S	.	.	S	Bend	trans	-75.8	-39.4	176.9	-174	-102.8	0	0	0	111.6	W140 W164 F198 Y200 E202 A209 V211	F120-W140 PolarHBondContact O-NE1 3.08Å; F120-W164 HydrophobicContact CD1-CZ2 4.48Å; F120-W164 AromaticContact CD2-NE1 3.8Å; F120-W164 AromaticContact CE1-CZ2 3.67Å; F120-W164 HydrophobicContact CE1-CZ2 3.67Å; F120-W164 HydrophobicContact CE2-CD2 4.46Å; F120-W164 AromaticContact CE2-CE2 3.84Å; F120-W164 HydrophobicContact CE2-CZ2 4.25Å; F120-W164 AromaticContact CE2-NE1 3.57Å; F120-W164 HydrophobicContact CZ-CD2 4.41Å; F120-W164 AromaticContact CZ-CE2 3.6Å; F120-W164 HydrophobicContact CZ-CH2 4.28Å; F120-W164 AromaticContact CZ-CZ2 3.52Å; F120-W164 HydrophobicContact CZ-CZ2 3.52Å; F120-W164 AromaticContact CZ-NE1 3.75Å; F120-W164 PolarHBondContact O-NE1 2.64Å; F120-F198 HydrophobicContact CD1-CD1 4.04Å; F120-F198 HydrophobicContact CD1-CE1 4.16Å; F120-F198 HydrophobicContact CD2-CD1 4.49Å; F120-F198 AromaticContact CD2-CE1 3.96Å; F120-F198 HydrophobicContact CD2-CE1 3.96Å; F120-F198 AromaticContact CE1-CD1 3.69Å; F120-F198 HydrophobicContact CE1-CD1 3.69Å; F120-F198 HydrophobicContact CE1-CE1 4.12Å; F120-F198 HydrophobicContact CE2-CD1 4.16Å; F120-F198 AromaticContact CE2-CE1 3.9Å; F120-F198 HydrophobicContact CE2-CE1 3.9Å; F120-F198 HydrophobicContact CG-CD1 4.44Å; F120-F198 HydrophobicContact CG-CE1 4.1Å; F120-F198 AromaticContact CZ-CD1 3.76Å; F120-F198 HydrophobicContact CZ-CD1 3.76Å; F120-F198 AromaticContact CZ-CE1 3.99Å; F120-F198 HydrophobicContact CZ-CE1 3.99Å; F120-Y200 HydrophobicContact CB-CD2 4.25Å; F120-Y200 HydrophobicContact CB-CE1 4.47Å; F120-Y200 HydrophobicContact CB-CE2 3.69Å; F120-Y200 HydrophobicContact CD1-CD1 4.42Å; F120-Y200 AromaticContact CD1-CE1 3.83Å; F120-Y200 HydrophobicContact CD1-CE1 3.83Å; F120-Y200 AromaticContact CD1-CZ 3.9Å; F120-Y200 HydrophobicContact CG-CE1 4.45Å; F120-Y200 HydrophobicContact CG-CE2 4.46Å; F120-E202 PolarHBondContact N-OE1 3.12Å; F120-A209 HydrophobicContact CD1-CB 4.24Å; F120-A209 HydrophobicContact CE1-CB 3.88Å; F120-V211 HydrophobicContact CE1-CG2 4.01Å; F120-V211 HydrophobicContact CZ-CG2 3.97Å
121	L	90.4	Very high	87.8	Confident	64 Å²	64	77.5 Å²	77.5	34%	0.335	39%	0.389	S	S	.	.	S	Bend	trans	-131.1	143.8	168.3	-65.8	174.5	0	0	0	108.3	R119 W140 W164 A209	R119-L121 WeakPolarHBondContact CB-O 3.43Å; L121-W140 HydrophobicContact CD2-CZ2 4.46Å; L121-W164 HydrophobicContact CD2-CZ2 4.09Å; L121-A209 HydrophobicContact CD1-CB 3.82Å
122	W	88.9	Confident	87.8	Confident	29 Å²	29	73.2 Å²	73.2	11%	0.11	37%	0.37	C	S	.	.			trans	-100.8	127.8	168.9	-69.5	73.9	0	0	0	108.3	R119 D126 D133 A136 K137 W140	R119-W122 HydrophobicContact CB-CD2 4.39Å; R119-W122 HydrophobicContact CB-CG 4.46Å; R119-W122 HydrophobicContact CB-CZ2 4.37Å; R119-W122 HydrophobicContact CG-CD2 4.41Å; R119-W122 HydrophobicContact CG-CH2 4.44Å; R119-W122 HydrophobicContact CG-CZ2 4.06Å; W122-D126 HydrophobicContact CE3-CB 4.03Å; W122-D133 HydrophobicContact CH2-CB 4.06Å; W122-D133 VanDerWaalsContact CH2-O 3.26Å; W122-D133 WeakPolarHBondContact CH2-O 3.28Å; W122-D133 HydrophobicContact CZ3-CB 4.46Å; W122-A136 HydrophobicContact CH2-CB 4.38Å; W122-A136 HydrophobicContact CZ2-CB 3.9Å; W122-K137 HydrophobicContact CD2-CB 4.33Å; W122-K137 HydrophobicContact CD2-CG 4.42Å; W122-K137 HydrophobicContact CE3-CB 4.39Å; W122-K137 HydrophobicContact CE3-CD 4.4Å; W122-K137 HydrophobicContact CH2-CB 4.01Å; W122-K137 HydrophobicContact CZ2-CB 3.91Å; W122-K137 HydrophobicContact CZ3-CB 4.24Å; W122-W140 AromaticContact CD1-CD1 3.65Å; W122-W140 AromaticContact CD1-CD2 3.45Å; W122-W140 VanDerWaalsContact CD1-CD2 3.45Å; W122-W140 AromaticContact CD1-CE2 3.8Å; W122-W140 AromaticContact CD1-CE3 3.94Å; W122-W140 AromaticContact CD1-CG 3.38Å; W122-W140 AromaticContact CD1-NE1 3.89Å; W122-W140 HydrophobicContact CG-CD2 4.43Å; W122-W140 AromaticContact NE1-CD1 3.88Å; W122-W140 AromaticContact NE1-CG 3.53Å
123	S	83.2	Confident	87.7	Confident	47 Å²	47	71.8 Å²	71.8	33%	0.329	36%	0.362	S	S	.	.			trans	-71.5	161.8	166.3	-168.2	0	0	0	0	110	E125 D126	S123-E125 PolarHBondContact O-N 2.85Å; S123-E125 PolarHBondContact OG-N 2.71Å; S123-E125 PolarHBondContact OG-OE2 2.85Å; S123-E125 VanDerWaalsContact OG-OE2 3.05Å; S123-D126 WeakPolarHBondContact CB-OD2 3.37Å; S123-D126 PolarHBondContact N-OD2 3.14Å; S123-D126 VanDerWaalsContact N-OD2 3.08Å; S123-D126 PolarHBondContact O-N 3.28Å
124	E	78.7	Confident	87.7	Confident	196 Å²	196	78.4 Å²	78.4	92%	0.916	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-29.8	166.4	-171.2	165.9	-167	0	0	110.9	D126	E124-D126 VanDerWaalsContact C-N 3.26Å; E124-D126 PolarHBondContact O-N 3.11Å
125	E	76	Confident	87.7	Confident	173 Å²	173	78.5 Å²	78.5	81%	0.808	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-17.7	174.5	-57	161.6	143.8	0	0	113.5	S123 E127	S123-E125 PolarHBondContact O-N 2.85Å; S123-E125 PolarHBondContact OG-N 2.71Å; S123-E125 PolarHBondContact OG-OE2 2.85Å; S123-E125 VanDerWaalsContact OG-OE2 3.05Å; E125-E127 VanDerWaalsContact C-N 3.3Å; E125-E127 PolarHBondContact O-N 2.81Å
126	D	77.4	Confident	87.8	Confident	25 Å²	25	71.5 Å²	71.5	13%	0.134	36%	0.356	C	S	.	.			trans	-85.2	66.9	-175	-77.4	-49	0	0	0	111.6	R119 W122 S123 E124 A128 R207	R119-D126 IonicContact CZ-OD1 2.69Å; R119-D126 IonicContact CZ-OD2 3.72Å; R119-D126 IonicContact NH1-OD1 3.52Å; R119-D126 PolarHBondContact NH1-OD1 3.33Å; R119-D126 IonicContact NH1-OD2 2.77Å; R119-D126 PolarHBondContact NH1-OD2 3.22Å; R119-D126 VanDerWaalsContact NH2-CG 3.33Å; R119-D126 IonicContact NH2-OD1 2.72Å; R119-D126 PolarHBondContact NH2-OD1 3.2Å; W122-D126 HydrophobicContact CE3-CB 4.03Å; S123-D126 WeakPolarHBondContact CB-OD2 3.37Å; S123-D126 PolarHBondContact N-OD2 3.14Å; S123-D126 VanDerWaalsContact N-OD2 3.08Å; S123-D126 PolarHBondContact O-N 3.28Å; E124-D126 VanDerWaalsContact C-N 3.26Å; E124-D126 PolarHBondContact O-N 3.11Å; D126-A128 PolarHBondContact O-N 3.13Å; D126-R207 IonicContact OD2-NH1 3.9Å
127	E	77	Confident	87.9	Confident	156 Å²	156	70 Å²	70	73%	0.729	35%	0.348	S	S	*	.			trans	-58.6	133.3	176.5	-72.1	-163.6	177	0	0	112.4	E125 T129	E125-E127 VanDerWaalsContact C-N 3.3Å; E125-E127 PolarHBondContact O-N 2.81Å; E127-T129 VanDerWaalsContact C-N 3.27Å; E127-T129 PolarHBondContact O-N 3.39Å
128	A	83.7	Confident	88	Confident	22 Å²	22	75.2 Å²	75.2	18%	0.182	37%	0.37	C	S	.	.			trans	-82.7	68.6	-177	0	0	0	0	0	111.3	D126 D133 R134 K137	D126-A128 PolarHBondContact O-N 3.13Å; A128-D133 HydrophobicContact CB-CB 4.3Å; A128-R134 HydrophobicContact CB-CB 4.46Å; A128-R134 HydrophobicContact CB-CG 3.69Å; A128-R134 WeakPolarHBondContact O-CG 3.48Å; A128-R134 PolarHBondContact O-NE 3.3Å; A128-K137 HydrophobicContact CB-CD 4.15Å
129	T	86	Confident	88.2	Confident	105 Å²	105	78.4 Å²	78.4	64%	0.644	37%	0.371	S	S	*	.			trans	-63.8	-50.1	-174.7	-50.8	0	0	0	0	112.2	E127 R134	E127-T129 VanDerWaalsContact C-N 3.27Å; E127-T129 PolarHBondContact O-N 3.39Å; T129-R134 PolarHBondContact O-NH2 2.99Å
130	S	91	Very high	88.4	Confident	50 Å²	50	79 Å²	79	35%	0.35	37%	0.374	S	S	.	.	S	Bend	trans	-78.2	152.1	179	-171.2	0	0	0	0	112.6	S132 D133 R134	S130-S132 PolarHBondContact O-N 3.15Å; S130-S132 PolarHBondContact OG-N 2.82Å; S130-D133 WeakPolarHBondContact CB-OD2 3.46Å; S130-D133 PolarHBondContact O-N 3.22Å; S130-D133 VanDerWaalsContact O-N 3.15Å; S130-R134 WeakPolarHBondContact O-CG 3.44Å; S130-R134 PolarHBondContact O-N 3.42Å
131	W	92.5	Very high	88.5	Confident	165 Å²	165	83 Å²	83	63%	0.625	39%	0.393	S	S	*	.	H	α-helix	trans	-53.9	-39.6	167.7	176.6	90	0	0	0	111.8	V113 R134 L135	V113-W131 HydrophobicContact CG1-CZ3 4.2Å; W131-R134 WeakPolarHBondContact O-CB 3.29Å; W131-R134 PolarHBondContact O-N 2.84Å; W131-L135 HydrophobicContact CH2-CD2 3.78Å; W131-L135 HydrophobicContact CZ2-CD2 4.36Å; W131-L135 HydrophobicContact CZ3-CD2 4.05Å; W131-L135 PolarHBondContact O-N 3.43Å
132	S	93	Very high	88.7	Confident	23 Å²	23	85.6 Å²	85.6	16%	0.161	40%	0.401	C	S	.	.	H	α-helix	trans	-62.4	-42.7	176.7	-52.2	0	0	0	0	112.9	V113 H117 S130 R134 L135 A136	V113-S132 VanDerWaalsContact CG1-CB 3.47Å; H117-S132 WeakPolarHBondContact CD2-CB 3.17Å; H117-S132 VanDerWaalsContact CG-CB 3.49Å; H117-S132 VanDerWaalsContact NE2-CB 3.34Å; H117-S132 WeakPolarHBondContact NE2-CB 3.43Å; S130-S132 PolarHBondContact O-N 3.15Å; S130-S132 PolarHBondContact OG-N 2.82Å; S132-R134 VanDerWaalsContact C-N 3.34Å; S132-L135 PolarHBondContact O-N 3.41Å; S132-A136 WeakPolarHBondContact O-CB 3.29Å; S132-A136 PolarHBondContact O-N 3.16Å
133	D	92.5	Very high	88.9	Confident	17 Å²	17	85.3 Å²	85.3	9%	0.091	40%	0.401	C	S	.	.	H	α-helix	trans	-68.2	-35	176.4	-61.3	-60.2	0	0	0	110.7	H117 W122 A128 S130 A136 K137 R203	H117-D133 IonicContact CE1-OD1 3.58Å; H117-D133 IonicContact CG-OD1 2.71Å; H117-D133 IonicContact ND1-OD1 3.6Å; H117-D133 PolarHBondContact ND1-OD1 3.29Å; H117-D133 IonicContact ND1-OD2 3.31Å; W122-D133 HydrophobicContact CH2-CB 4.06Å; W122-D133 VanDerWaalsContact CH2-O 3.26Å; W122-D133 WeakPolarHBondContact CH2-O 3.28Å; W122-D133 HydrophobicContact CZ3-CB 4.46Å; A128-D133 HydrophobicContact CB-CB 4.3Å; S130-D133 WeakPolarHBondContact CB-OD2 3.46Å; S130-D133 PolarHBondContact O-N 3.22Å; S130-D133 VanDerWaalsContact O-N 3.15Å; D133-A136 PolarHBondContact O-N 2.93Å; D133-K137 VanDerWaalsContact O-CB 3.32Å; D133-K137 WeakPolarHBondContact O-CB 3.02Å; D133-K137 PolarHBondContact O-N 3.44Å; D133-R203 IonicContact OD1-CZ 3.67Å; D133-R203 IonicContact OD1-NH1 2.66Å; D133-R203 IonicContact OD1-NH2 2.67Å; D133-R203 PolarHBondContact OD1-NH2 3.04Å
134	R	93.5	Very high	89.4	Confident	150 Å²	150	86 Å²	86	57%	0.566	40%	0.399	S	S	*	.	H	α-helix	trans	-66.4	-40.9	174.2	-64.5	171.2	-159.1	-177.7	8.4	112.2	A128 T129 S130 W131 S132 K137 K138	A128-R134 HydrophobicContact CB-CB 4.46Å; A128-R134 HydrophobicContact CB-CG 3.69Å; A128-R134 WeakPolarHBondContact O-CG 3.48Å; A128-R134 PolarHBondContact O-NE 3.3Å; T129-R134 PolarHBondContact O-NH2 2.99Å; S130-R134 WeakPolarHBondContact O-CG 3.44Å; S130-R134 PolarHBondContact O-N 3.42Å; W131-R134 WeakPolarHBondContact O-CB 3.29Å; W131-R134 PolarHBondContact O-N 2.84Å; S132-R134 VanDerWaalsContact C-N 3.34Å; R134-K137 PolarHBondContact O-N 3.39Å; R134-K138 WeakPolarHBondContact O-CB 3.5Å; R134-K138 PolarHBondContact O-N 2.98Å
135	L	94.2	Very high	90.1	Very high	34 Å²	34	80 Å²	80	18%	0.178	37%	0.37	C	S	.	.	H	α-helix	trans	-62.8	-45.5	174.2	-179.7	63	0	0	0	110.9	D110 V113 I114 W131 S132 K138 Y139	D110-L135 HydrophobicContact CB-CD2 4.17Å; V113-L135 HydrophobicContact CB-CD2 4.26Å; V113-L135 HydrophobicContact CG1-CD2 4.11Å; I114-L135 HydrophobicContact CD1-CD1 4.49Å; I114-L135 HydrophobicContact CD1-CD2 4.44Å; I114-L135 HydrophobicContact CD1-CG 4.13Å; I114-L135 HydrophobicContact CG1-CD2 4.22Å; I114-L135 HydrophobicContact CG1-CG 3.97Å; W131-L135 HydrophobicContact CH2-CD2 3.78Å; W131-L135 HydrophobicContact CZ2-CD2 4.36Å; W131-L135 HydrophobicContact CZ3-CD2 4.05Å; W131-L135 PolarHBondContact O-N 3.43Å; S132-L135 PolarHBondContact O-N 3.41Å; L135-K138 PolarHBondContact O-N 3.42Å; L135-Y139 PolarHBondContact O-N 2.99Å
136	A	93.8	Very high	90.9	Very high	1 Å²	1	75.9 Å²	75.9	1%	0.008	35%	0.35	C	S	.	.	H	α-helix	trans	-64.2	-38.8	176.1	0	0	0	0	0	112.9	H117 W122 S132 D133 Y139 W140	H117-A136 HydrophobicContact CB-CB 3.92Å; W122-A136 HydrophobicContact CH2-CB 4.38Å; W122-A136 HydrophobicContact CZ2-CB 3.9Å; S132-A136 WeakPolarHBondContact O-CB 3.29Å; S132-A136 PolarHBondContact O-N 3.16Å; D133-A136 PolarHBondContact O-N 2.93Å; A136-Y139 PolarHBondContact O-N 2.97Å; A136-W140 PolarHBondContact O-N 3.43Å
137	K	93.1	Very high	91.7	Very high	74 Å²	74	77.1 Å²	77.1	32%	0.322	35%	0.354	S	S	.	.	H	α-helix	trans	-65	-48.1	174.5	-178.6	168.5	178.1	169.3	0	111.5	W122 A128 D133 R134 Y139 W140 E141	W122-K137 HydrophobicContact CD2-CB 4.33Å; W122-K137 HydrophobicContact CD2-CG 4.42Å; W122-K137 HydrophobicContact CE3-CB 4.39Å; W122-K137 HydrophobicContact CE3-CD 4.4Å; W122-K137 HydrophobicContact CH2-CB 4.01Å; W122-K137 HydrophobicContact CZ2-CB 3.91Å; W122-K137 HydrophobicContact CZ3-CB 4.24Å; A128-K137 HydrophobicContact CB-CD 4.15Å; D133-K137 VanDerWaalsContact O-CB 3.32Å; D133-K137 WeakPolarHBondContact O-CB 3.02Å; D133-K137 PolarHBondContact O-N 3.44Å; R134-K137 PolarHBondContact O-N 3.39Å; K137-Y139 VanDerWaalsContact C-N 3.26Å; K137-Y139 PolarHBondContact O-N 2.93Å; K137-W140 CarbonylContact O-C 3.57Å; K137-W140 PolarHBondContact O-N 2.93Å; K137-E141 WeakPolarHBondContact CE-OE1 3.38Å; K137-E141 HydrophobicContact CG-CG 4.46Å; K137-E141 WeakPolarHBondContact CG-OE1 3.39Å; K137-E141 WeakPolarHBondContact O-CG 3.09Å; K137-E141 PolarHBondContact O-N 3.38Å
138	K	93.6	Very high	92.5	Very high	152 Å²	152	69.7 Å²	69.7	66%	0.661	32%	0.319	S	S	*	.	H	α-helix	trans	-58.2	-36.8	174.9	-175	179.4	-179.3	-179.5	0	112.5	R134 L135 K142	R134-K138 WeakPolarHBondContact O-CB 3.5Å; R134-K138 PolarHBondContact O-N 2.98Å; L135-K138 PolarHBondContact O-N 3.42Å; K138-K142 PolarHBondContact O-N 2.95Å
139	Y	93.9	Very high	93.1	Very high	104 Å²	104	69 Å²	69	41%	0.408	31%	0.312	S	S	.	.	H	α-helix	trans	-65.9	-46.8	172.5	177.9	-100.8	0	0	0	111.8	I114 L135 A136 K137 E141 K142 L143	I114-Y139 HydrophobicContact CD1-CD2 4.19Å; I114-Y139 HydrophobicContact CD1-CG 4.15Å; I114-Y139 HydrophobicContact CG2-CD1 3.59Å; I114-Y139 HydrophobicContact CG2-CD2 4.47Å; I114-Y139 HydrophobicContact CG2-CE1 3.95Å; I114-Y139 HydrophobicContact CG2-CG 3.87Å; L135-Y139 PolarHBondContact O-N 2.99Å; A136-Y139 PolarHBondContact O-N 2.97Å; K137-Y139 VanDerWaalsContact C-N 3.26Å; K137-Y139 PolarHBondContact O-N 2.93Å; Y139-E141 VanDerWaalsContact C-N 3.32Å; Y139-E141 PolarHBondContact O-N 3.02Å; Y139-K142 PolarHBondContact O-N 3.45Å; Y139-K142 VanDerWaalsContact O-N 3.16Å; Y139-L143 HydrophobicContact CD1-CD1 4.25Å; Y139-L143 HydrophobicContact CE1-CD1 3.91Å; Y139-L143 HydrophobicContact CE1-CD2 4.11Å; Y139-L143 HydrophobicContact CE1-CG 4.26Å; Y139-L143 PolarHBondContact O-N 3.42Å
140	W	93.7	Very high	93.5	Very high	48 Å²	48	64 Å²	64	18%	0.182	28%	0.281	C	S	.	.	H	α-helix	trans	-64.1	-33.8	177.9	-179.3	97.5	0	0	0	113.3	F120 L121 W122 A136 K137 K142 L143 K145	F120-W140 PolarHBondContact O-NE1 3.08Å; L121-W140 HydrophobicContact CD2-CZ2 4.46Å; W122-W140 AromaticContact CD1-CD1 3.65Å; W122-W140 AromaticContact CD1-CD2 3.45Å; W122-W140 VanDerWaalsContact CD1-CD2 3.45Å; W122-W140 AromaticContact CD1-CE2 3.8Å; W122-W140 AromaticContact CD1-CE3 3.94Å; W122-W140 AromaticContact CD1-CG 3.38Å; W122-W140 AromaticContact CD1-NE1 3.89Å; W122-W140 HydrophobicContact CG-CD2 4.43Å; W122-W140 AromaticContact NE1-CD1 3.88Å; W122-W140 AromaticContact NE1-CG 3.53Å; A136-W140 PolarHBondContact O-N 3.43Å; K137-W140 CarbonylContact O-C 3.57Å; K137-W140 PolarHBondContact O-N 2.93Å; W140-K142 VanDerWaalsContact C-N 3.3Å; W140-K142 PolarHBondContact O-N 2.67Å; W140-L143 WeakPolarHBondContact O-CB 3.16Å; W140-L143 PolarHBondContact O-N 2.67Å; W140-L143 VanDerWaalsContact O-N 3.14Å; W140-K145 HydrophobicContact CD2-CD 4.23Å; W140-K145 VanDerWaalsContact CE3-NZ 3.28Å; W140-K145 HydrophobicContact CH2-CD 3.94Å; W140-K145 HydrophobicContact CZ2-CD 3.49Å; W140-K145 VanDerWaalsContact CZ2-CD 3.49Å; W140-K145 HydrophobicContact CZ3-CD 4.47Å; W140-K145 VanDerWaalsContact CZ3-NZ 3.25Å; W140-K145 PolarHBondContact O-NZ 3.18Å
141	E	93.2	Very high	93.7	Very high	109 Å²	109	63.8 Å²	63.8	51%	0.509	28%	0.276	S	S	.	.	H	α-helix	trans	-61	-38.3	173.4	-75.2	164.5	177.8	0	0	111.4	K137 Y139 L143	K137-E141 WeakPolarHBondContact CE-OE1 3.38Å; K137-E141 HydrophobicContact CG-CG 4.46Å; K137-E141 WeakPolarHBondContact CG-OE1 3.39Å; K137-E141 WeakPolarHBondContact O-CG 3.09Å; K137-E141 PolarHBondContact O-N 3.38Å; Y139-E141 VanDerWaalsContact C-N 3.32Å; Y139-E141 PolarHBondContact O-N 3.02Å; E141-L143 VanDerWaalsContact C-N 3.3Å; E141-L143 PolarHBondContact O-N 3.38Å
142	K	93.3	Very high	93.7	Very high	118 Å²	118	56.2 Å²	56.2	51%	0.513	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-6	174.6	-179.2	156.9	178.1	144.8	0	114.7	K138 Y139 W140 E167	K138-K142 PolarHBondContact O-N 2.95Å; Y139-K142 PolarHBondContact O-N 3.45Å; Y139-K142 VanDerWaalsContact O-N 3.16Å; W140-K142 VanDerWaalsContact C-N 3.3Å; W140-K142 PolarHBondContact O-N 2.67Å; K142-E167 WeakPolarHBondContact CE-OE2 3.42Å; K142-E167 VanDerWaalsContact NZ-CD 3.31Å; K142-E167 IonicContact NZ-OE1 2.75Å; K142-E167 PolarHBondContact NZ-OE1 3.03Å; K142-E167 IonicContact NZ-OE2 3.42Å; K142-E167 PolarHBondContact NZ-OE2 2.92Å
143	L	94.5	Very high	93.7	Very high	22 Å²	22	58.4 Å²	58.4	12%	0.115	26%	0.263	C	S	.	.	S	Bend	trans	-82.4	135.1	176.4	-64.3	175.8	0	0	0	111.8	Y139 W140 E141 K145 W164 L166	Y139-L143 HydrophobicContact CD1-CD1 4.25Å; Y139-L143 HydrophobicContact CE1-CD1 3.91Å; Y139-L143 HydrophobicContact CE1-CD2 4.11Å; Y139-L143 HydrophobicContact CE1-CG 4.26Å; Y139-L143 PolarHBondContact O-N 3.42Å; W140-L143 WeakPolarHBondContact O-CB 3.16Å; W140-L143 PolarHBondContact O-N 2.67Å; W140-L143 VanDerWaalsContact O-N 3.14Å; E141-L143 VanDerWaalsContact C-N 3.3Å; E141-L143 PolarHBondContact O-N 3.38Å; L143-K145 WeakPolarHBondContact O-CE 3.13Å; L143-W164 HydrophobicContact CB-CB 3.86Å; L143-W164 HydrophobicContact CB-CG 4.5Å; L143-W164 HydrophobicContact CD1-CB 4.11Å; L143-W164 HydrophobicContact CG-CB 4.39Å; L143-L166 HydrophobicContact CD2-CD2 3.76Å
144	F	93.3	Very high	93.6	Very high	63 Å²	63	64.6 Å²	64.6	28%	0.276	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	119.8	177.4	-68	-92.1	0	0	0	110.2	R165 E167 V170 M337	F144-R165 HydrophobicContact CB-CB 4.14Å; F144-R165 PolarHBondContact N-O 2.89Å; F144-R165 PolarHBondContact O-N 3.1Å; F144-E167 HydrophobicContact CE2-CB 3.93Å; F144-V170 HydrophobicContact CB-CG2 3.66Å; F144-V170 HydrophobicContact CD1-CG2 4.16Å; F144-V170 HydrophobicContact CD2-CG2 3.79Å; F144-V170 HydrophobicContact CG-CG2 3.59Å; F144-M337 HydrophobicContact CD1-CE 4.24Å; F144-M337 HydrophobicContact CE1-CE 3.48Å; F144-M337 VanDerWaalsContact CE1-CE 3.48Å; F144-M337 HydrophobicContact CZ-CE 3.89Å
145	K	92.5	Very high	93.6	Very high	70 Å²	70	60.1 Å²	60.1	30%	0.304	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	13.3	-160.4	-74.6	164	-66.5	-142	0	115.2	W140 L143 W164	W140-K145 HydrophobicContact CD2-CD 4.23Å; W140-K145 VanDerWaalsContact CE3-NZ 3.28Å; W140-K145 HydrophobicContact CH2-CD 3.94Å; W140-K145 HydrophobicContact CZ2-CD 3.49Å; W140-K145 VanDerWaalsContact CZ2-CD 3.49Å; W140-K145 HydrophobicContact CZ3-CD 4.47Å; W140-K145 VanDerWaalsContact CZ3-NZ 3.25Å; W140-K145 PolarHBondContact O-NZ 3.18Å; L143-K145 WeakPolarHBondContact O-CE 3.13Å; K145-W164 HydrophobicContact CB-CD2 4.33Å; K145-W164 HydrophobicContact CB-CE3 4.09Å; K145-W164 HydrophobicContact CB-CZ3 4.2Å; K145-W164 HydrophobicContact CG-CD2 3.75Å; K145-W164 HydrophobicContact CG-CE3 4.02Å; K145-W164 HydrophobicContact CG-CG 3.98Å; K145-W164 HydrophobicContact CG-CZ3 4.5Å; K145-W164 WeakPolarHBondContact O-CZ3 3.41Å
146	E	92.8	Very high	93.4	Very high	86 Å²	86	64.3 Å²	64.3	40%	0.402	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	-43.1	179.6	-51.4	166.5	110	0	0	113	R165 K212 Y333	E146-R165 IonicContact OE2-CZ 2.67Å; E146-R165 IonicContact OE2-NH2 2.65Å; E146-R165 PolarHBondContact OE2-NH2 3.07Å; E146-K212 WeakPolarHBondContact O-CB 3.32Å; E146-Y333 WeakPolarHBondContact OE1-CE2 3.48Å; E146-Y333 PolarHBondContact OE2-OH 3.12Å
147	Y	94.3	Very high	93.3	Very high	51 Å²	51	69.1 Å²	69.1	20%	0.2	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	137.8	-177.6	-63.7	-74.2	0	0	0	108.8	R165 Q176 K212 R214	Y147-R165 WeakPolarHBondContact O-CG 3.35Å; Y147-Q176 HydrophobicContact CD2-CB 4.28Å; Y147-Q176 HydrophobicContact CE2-CB 4.29Å; Y147-Q176 HydrophobicContact CE2-CG 4.08Å; Y147-K212 CarbonylContact C-O 3.4Å; Y147-K212 WeakPolarHBondContact CA-O 3.43Å; Y147-K212 HydrophobicContact CD1-CB 4.09Å; Y147-K212 HydrophobicContact CE1-CB 4.46Å; Y147-R214 HydrophobicContact CD1-CG 3.83Å; Y147-R214 HydrophobicContact CE1-CG 3.49Å; Y147-R214 VanDerWaalsContact CE1-CG 3.49Å
148	C	94.6	Very high	93	Very high	0 Å²	0	68 Å²	68	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	155.6	168.1	-88.2	0	0	0	0	112.3	R163 W164 V211 K212 I213	C148-R163 WeakPolarHBondContact CA-O 3.5Å; C148-R163 WeakPolarHBondContact CB-O 3.38Å; C148-R163 PolarHBondContact SG-O 2.81Å; C148-R163 VanDerWaalsContact SG-O 3.35Å; C148-W164 VanDerWaalsContact SG-CZ3 3.51Å; C148-V211 HydrophobicContact CB-CG1 3.42Å; C148-V211 VanDerWaalsContact CB-CG1 3.42Å; C148-V211 WeakPolarHBondContact SG-CG1 3.3Å; C148-K212 PolarHBondContact N-O 3.26Å; C148-I213 HydrophobicContact CB-CG1 4.44Å
149	L	95	Very high	92.9	Very high	6 Å²	6	66.5 Å²	66.5	3%	0.031	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	145.8	155.8	-57.3	-177.2	0	0	0	109.3	M162 R163 R165 E169 K174 G180 V182	L149-M162 WeakPolarHBondContact O-CA 3.45Å; L149-R163 PolarHBondContact N-O 3.08Å; L149-R163 PolarHBondContact O-N 3.32Å; L149-R165 HydrophobicContact CD2-CG 4.32Å; L149-R165 HydrophobicContact CG-CG 4.09Å; L149-E169 HydrophobicContact CD1-CB 4.48Å; L149-E169 VanDerWaalsContact CD1-CD 3.5Å; L149-E169 VanDerWaalsContact CD1-OE1 3.29Å; L149-E169 WeakPolarHBondContact CD1-OE1 3.35Å; L149-K174 HydrophobicContact CD2-CB 4.15Å; L149-G180 CarbonylContact C-O 3.58Å; L149-G180 VanDerWaalsContact CA-O 3.3Å; L149-G180 WeakPolarHBondContact CA-O 3.34Å; L149-V182 HydrophobicContact CB-CG2 4.02Å
150	I	95.1	Very high	92.8	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	142.8	-175.7	-173.3	168.7	0	0	0	110.3	L152 F160 G161 M162 G180 N181 V182 I213 L215 L223	I150-L152 HydrophobicContact CD1-CD2 3.59Å; I150-L152 HydrophobicContact CD1-CG 4.46Å; I150-L152 HydrophobicContact CG1-CD2 3.93Å; I150-L152 HydrophobicContact CG1-CG 4.36Å; I150-L152 HydrophobicContact CG2-CD2 4.39Å; I150-L152 HydrophobicContact CG2-CG 4.19Å; I150-F160 HydrophobicContact CD1-CB 4.15Å; I150-F160 HydrophobicContact CD1-CD1 4.32Å; I150-F160 HydrophobicContact CD1-CG 4.37Å; I150-F160 HydrophobicContact CG1-CB 4.36Å; I150-G161 CarbonylContact C-O 3.51Å; I150-G161 WeakPolarHBondContact CA-O 3.34Å; I150-G161 WeakPolarHBondContact CG1-O 3.36Å; I150-M162 HydrophobicContact CB-CG 4.43Å; I150-M162 HydrophobicContact CD1-CE 4.05Å; I150-M162 HydrophobicContact CD1-CG 4.45Å; I150-M162 HydrophobicContact CG1-CG 4.15Å; I150-G180 PolarHBondContact N-O 2.72Å; I150-N181 HydrophobicContact CG2-CB 4.29Å; I150-N181 CarbonylContact O-C 3.58Å; I150-N181 VanDerWaalsContact O-CA 3.27Å; I150-N181 WeakPolarHBondContact O-CA 3.36Å; I150-N181 PolarHBondContact O-OD1 3.37Å; I150-V182 PolarHBondContact O-N 3.22Å; I150-I213 HydrophobicContact CB-CD1 4.32Å; I150-I213 HydrophobicContact CD1-CD1 3.94Å; I150-I213 HydrophobicContact CG2-CG2 4.01Å; I150-L215 HydrophobicContact CG2-CD2 3.82Å; I150-L223 HydrophobicContact CD1-CD1 3.66Å
151	D	95.3	Very high	92.7	Very high	47 Å²	47	62.6 Å²	62.6	25%	0.251	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	116.5	162.5	176.6	28	0	0	0	109.5	S153 G161	D151-S153 VanDerWaalsContact CG-OG 3.24Å; D151-S153 WeakPolarHBondContact OD1-CB 3.4Å; D151-S153 PolarHBondContact OD1-N 3.22Å; D151-S153 PolarHBondContact OD1-OG 2.65Å; D151-S153 WeakPolarHBondContact OD2-CB 3.48Å; D151-S153 PolarHBondContact OD2-OG 3.35Å; D151-G161 PolarHBondContact N-O 2.59Å; D151-G161 PolarHBondContact O-N 3.26Å
152	L	93	Very high	92.8	Very high	5 Å²	5	58.6 Å²	58.6	3%	0.026	28%	0.278	C	S	.	.			trans	-94.7	9.3	175.7	-62.9	177.4	0	0	0	113	I150 R154 Y155 F160 N181 L215 C219 K222 L223	I150-L152 HydrophobicContact CD1-CD2 3.59Å; I150-L152 HydrophobicContact CD1-CG 4.46Å; I150-L152 HydrophobicContact CG1-CD2 3.93Å; I150-L152 HydrophobicContact CG1-CG 4.36Å; I150-L152 HydrophobicContact CG2-CD2 4.39Å; I150-L152 HydrophobicContact CG2-CG 4.19Å; L152-R154 VanDerWaalsContact C-N 3.33Å; L152-R154 PolarHBondContact O-N 2.91Å; L152-Y155 WeakPolarHBondContact O-CB 3.21Å; L152-Y155 VanDerWaalsContact O-CD1 3.25Å; L152-Y155 WeakPolarHBondContact O-CD1 3.41Å; L152-Y155 PolarHBondContact O-N 3.41Å; L152-F160 HydrophobicContact CD2-CD1 3.57Å; L152-F160 HydrophobicContact CD2-CE1 3.66Å; L152-N181 HydrophobicContact CD1-CB 3.82Å; L152-N181 HydrophobicContact CG-CB 4.22Å; L152-N181 PolarHBondContact N-OD1 2.98Å; L152-L215 HydrophobicContact CD1-CD1 4.41Å; L152-C219 HydrophobicContact CD1-CB 3.62Å; L152-C219 WeakPolarHBondContact CD1-O 3.46Å; L152-K222 HydrophobicContact CD1-CB 4.13Å; L152-L223 HydrophobicContact CD2-CD1 4.26Å
153	S	91.9	Very high	92.8	Very high	69 Å²	69	57.7 Å²	57.7	48%	0.483	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	-48.5	-177.4	63.1	0	0	0	0	113.8	D151	D151-S153 VanDerWaalsContact CG-OG 3.24Å; D151-S153 WeakPolarHBondContact OD1-CB 3.4Å; D151-S153 PolarHBondContact OD1-N 3.22Å; D151-S153 PolarHBondContact OD1-OG 2.65Å; D151-S153 WeakPolarHBondContact OD2-CB 3.48Å; D151-S153 PolarHBondContact OD2-OG 3.35Å
154	R	92.1	Very high	92.8	Very high	147 Å²	147	57.9 Å²	57.9	56%	0.555	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	28.5	-175.2	-72.7	172.8	-74.7	-162.6	-1.8	113.8	L152 K156 E157 K159	L152-R154 VanDerWaalsContact C-N 3.33Å; L152-R154 PolarHBondContact O-N 2.91Å; R154-K156 PolarHBondContact O-N 2.68Å; R154-E157 PolarHBondContact O-N 3.34Å; R154-K159 CarbonylContact C-O 3.42Å; R154-K159 HydrophobicContact CB-CB 4.15Å; R154-K159 PolarHBondContact O-N 3.49Å
155	Y	91.9	Very high	92.9	Very high	56 Å²	56	54.9 Å²	54.9	22%	0.22	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-53.1	-31.4	180	75.7	-81.8	0	0	0	114.5	L152 E157 N158 K222 Y225	L152-Y155 WeakPolarHBondContact O-CB 3.21Å; L152-Y155 VanDerWaalsContact O-CD1 3.25Å; L152-Y155 WeakPolarHBondContact O-CD1 3.41Å; L152-Y155 PolarHBondContact O-N 3.41Å; Y155-E157 PolarHBondContact O-N 3.06Å; Y155-N158 PolarHBondContact O-N 3.36Å; Y155-K222 HydrophobicContact CD1-CD 4.41Å; Y155-K222 HydrophobicContact CD1-CG 4.26Å; Y155-K222 HydrophobicContact CD2-CB 3.99Å; Y155-K222 HydrophobicContact CD2-CG 3.97Å; Y155-K222 HydrophobicContact CE1-CD 4.4Å; Y155-K222 HydrophobicContact CE1-CG 4.31Å; Y155-K222 HydrophobicContact CE2-CG 4.04Å; Y155-K222 HydrophobicContact CG-CB 3.97Å; Y155-K222 HydrophobicContact CG-CG 4.08Å; Y155-Y225 HydrophobicContact CD2-CD1 4.06Å; Y155-Y225 HydrophobicContact CD2-CD2 4.13Å; Y155-Y225 AromaticContact CD2-CG 3.74Å; Y155-Y225 HydrophobicContact CD2-CG 3.74Å; Y155-Y225 HydrophobicContact CE2-CD1 4.31Å; Y155-Y225 AromaticContact CE2-CD2 3.85Å; Y155-Y225 HydrophobicContact CE2-CD2 3.85Å; Y155-Y225 HydrophobicContact CE2-CE2 4.18Å; Y155-Y225 AromaticContact CE2-CG 3.93Å; Y155-Y225 HydrophobicContact CE2-CG 3.93Å
156	K	91.3	Very high	93	Very high	123 Å²	123	54.7 Å²	54.7	54%	0.535	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-62.2	-26.6	177.5	-66.1	-174.9	178.3	-178.3	0	113.8	R154 Y225 R226	R154-K156 PolarHBondContact O-N 2.68Å; K156-Y225 HydrophobicContact CB-CE1 4.15Å; K156-Y225 HydrophobicContact CG-CE1 4.1Å; K156-R226 PolarHBondContact O-NE 3.35Å; K156-R226 PolarHBondContact O-NH2 3.21Å
157	E	91.2	Very high	93.1	Very high	102 Å²	102	54.5 Å²	54.5	48%	0.477	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-93.5	2	175.8	-61.6	175.7	-119.8	0	0	112.6	R154 Y155 K159	R154-E157 PolarHBondContact O-N 3.34Å; Y155-E157 PolarHBondContact O-N 3.06Å; E157-K159 HydrophobicContact CB-CB 4.34Å; E157-K159 HydrophobicContact CB-CD 4.09Å; E157-K159 HydrophobicContact CB-CG 4Å; E157-K159 PolarHBondContact O-N 2.87Å; E157-K159 WeakPolarHBondContact OE2-CD 3.36Å; E157-K159 VanDerWaalsContact OE2-CE 3.24Å; E157-K159 WeakPolarHBondContact OE2-CE 3.44Å; E157-K159 IonicContact OE2-NZ 3.64Å; E157-K159 PolarHBondContact OE2-NZ 3.06Å
158	N	86.9	Confident	93.1	Very high	49 Å²	49	60.3 Å²	60.3	26%	0.262	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	17.3	-165.5	-63.1	-18.6	0	0	0	114.6	Y155 F160 Y227	Y155-N158 PolarHBondContact O-N 3.36Å; N158-F160 HydrophobicContact CB-CE2 4.42Å; N158-F160 VanDerWaalsContact O-CD2 3.23Å; N158-F160 WeakPolarHBondContact O-CD2 3.33Å; N158-F160 VanDerWaalsContact O-CE2 3.28Å; N158-F160 WeakPolarHBondContact O-CE2 3.44Å; N158-Y227 VanDerWaalsContact ND2-CE2 3.26Å; N158-Y227 WeakPolarHBondContact ND2-CE2 3.4Å
159	K	90.5	Very high	93.1	Very high	121 Å²	121	61.3 Å²	61.3	53%	0.526	29%	0.289	S	S	.	.			trans	-89.8	125.3	176.8	-66.4	176.8	-171.3	162.6	0	109.6	R154 E157	R154-K159 CarbonylContact C-O 3.42Å; R154-K159 HydrophobicContact CB-CB 4.15Å; R154-K159 PolarHBondContact O-N 3.49Å; E157-K159 HydrophobicContact CB-CB 4.34Å; E157-K159 HydrophobicContact CB-CD 4.09Å; E157-K159 HydrophobicContact CB-CG 4Å; E157-K159 PolarHBondContact O-N 2.87Å; E157-K159 WeakPolarHBondContact OE2-CD 3.36Å; E157-K159 VanDerWaalsContact OE2-CE 3.24Å; E157-K159 WeakPolarHBondContact OE2-CE 3.44Å; E157-K159 IonicContact OE2-NZ 3.64Å; E157-K159 PolarHBondContact OE2-NZ 3.06Å
160	F	91.8	Very high	93	Very high	33 Å²	33	61.2 Å²	61.2	15%	0.145	29%	0.289	C	S	.	.			trans	-131.8	132	-177.3	-54.4	-70.3	0	0	0	109.6	I150 L152 N158 R229	I150-F160 HydrophobicContact CD1-CB 4.15Å; I150-F160 HydrophobicContact CD1-CD1 4.32Å; I150-F160 HydrophobicContact CD1-CG 4.37Å; I150-F160 HydrophobicContact CG1-CB 4.36Å; L152-F160 HydrophobicContact CD2-CD1 3.57Å; L152-F160 HydrophobicContact CD2-CE1 3.66Å; N158-F160 HydrophobicContact CB-CE2 4.42Å; N158-F160 VanDerWaalsContact O-CD2 3.23Å; N158-F160 WeakPolarHBondContact O-CD2 3.33Å; N158-F160 VanDerWaalsContact O-CE2 3.28Å; N158-F160 WeakPolarHBondContact O-CE2 3.44Å; F160-R229 VanDerWaalsContact CE2-NH1 3.29Å
161	G	93.4	Very high	92.9	Very high	38 Å²	38	66.9 Å²	66.9	39%	0.392	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	143.6	167.6	0	0	0	0	0	110.1	I150 D151	I150-G161 CarbonylContact C-O 3.51Å; I150-G161 WeakPolarHBondContact CA-O 3.34Å; I150-G161 WeakPolarHBondContact CG1-O 3.36Å; D151-G161 PolarHBondContact N-O 2.59Å; D151-G161 PolarHBondContact O-N 3.26Å
162	M	93.7	Very high	92.8	Very high	25 Å²	25	67.4 Å²	67.4	12%	0.123	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	150.9	173.7	-61.5	-172.8	-161	0	0	110.9	L149 I150 V196 F198 V211 I213	L149-M162 WeakPolarHBondContact O-CA 3.45Å; I150-M162 HydrophobicContact CB-CG 4.43Å; I150-M162 HydrophobicContact CD1-CE 4.05Å; I150-M162 HydrophobicContact CD1-CG 4.45Å; I150-M162 HydrophobicContact CG1-CG 4.15Å; M162-V196 HydrophobicContact CE-CB 4.17Å; M162-V196 HydrophobicContact CE-CG1 3.73Å; M162-F198 HydrophobicContact CB-CD2 4.05Å; M162-F198 HydrophobicContact CB-CE2 3.9Å; M162-F198 HydrophobicContact CB-CG 4.44Å; M162-F198 HydrophobicContact CB-CZ 4.13Å; M162-F198 HydrophobicContact CE-CB 4.23Å; M162-F198 HydrophobicContact CE-CD2 3.93Å; M162-F198 HydrophobicContact CE-CG 4.43Å; M162-F198 HydrophobicContact CG-CD2 3.84Å; M162-F198 HydrophobicContact CG-CE2 4Å; M162-F198 HydrophobicContact CG-CG 4.43Å; M162-F198 HydrophobicContact SD-CB 3.85Å; M162-F198 HydrophobicContact SD-CD2 3.67Å; M162-F198 HydrophobicContact SD-CE2 4.42Å; M162-F198 HydrophobicContact SD-CG 3.85Å; M162-V211 HydrophobicContact SD-CB 4.27Å; M162-V211 HydrophobicContact SD-CG1 4Å; M162-I213 HydrophobicContact CE-CD1 3.94Å; M162-I213 HydrophobicContact SD-CD1 3.87Å
163	R	93.5	Very high	92.7	Very high	99 Å²	99	67.4 Å²	67.4	37%	0.374	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	159	168.2	63.5	170.5	-177.1	78.5	-2.9	111.6	C148 L149 E169	C148-R163 WeakPolarHBondContact CA-O 3.5Å; C148-R163 WeakPolarHBondContact CB-O 3.38Å; C148-R163 PolarHBondContact SG-O 2.81Å; C148-R163 VanDerWaalsContact SG-O 3.35Å; L149-R163 PolarHBondContact N-O 3.08Å; L149-R163 PolarHBondContact O-N 3.32Å; R163-E169 IonicContact CZ-OE1 2.76Å; R163-E169 IonicContact CZ-OE2 3.34Å; R163-E169 IonicContact NH1-OE1 3.24Å; R163-E169 IonicContact NH1-OE2 2.68Å; R163-E169 PolarHBondContact NH1-OE2 2.91Å; R163-E169 IonicContact NH2-OE1 2.92Å; R163-E169 PolarHBondContact NH2-OE1 3.18Å; R163-E169 IonicContact NH2-OE2 3.48Å; R163-E169 PolarHBondContact NH2-OE2 2.95Å
164	W	95.2	Very high	92.6	Very high	26 Å²	26	68.4 Å²	68.4	10%	0.098	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	162.4	172.6	-59	118.1	0	0	0	112.5	F120 L121 L143 K145 C148	F120-W164 HydrophobicContact CD1-CZ2 4.48Å; F120-W164 AromaticContact CD2-NE1 3.8Å; F120-W164 AromaticContact CE1-CZ2 3.67Å; F120-W164 HydrophobicContact CE1-CZ2 3.67Å; F120-W164 HydrophobicContact CE2-CD2 4.46Å; F120-W164 AromaticContact CE2-CE2 3.84Å; F120-W164 HydrophobicContact CE2-CZ2 4.25Å; F120-W164 AromaticContact CE2-NE1 3.57Å; F120-W164 HydrophobicContact CZ-CD2 4.41Å; F120-W164 AromaticContact CZ-CE2 3.6Å; F120-W164 HydrophobicContact CZ-CH2 4.28Å; F120-W164 AromaticContact CZ-CZ2 3.52Å; F120-W164 HydrophobicContact CZ-CZ2 3.52Å; F120-W164 AromaticContact CZ-NE1 3.75Å; F120-W164 PolarHBondContact O-NE1 2.64Å; L121-W164 HydrophobicContact CD2-CZ2 4.09Å; L143-W164 HydrophobicContact CB-CB 3.86Å; L143-W164 HydrophobicContact CB-CG 4.5Å; L143-W164 HydrophobicContact CD1-CB 4.11Å; L143-W164 HydrophobicContact CG-CB 4.39Å; K145-W164 HydrophobicContact CB-CD2 4.33Å; K145-W164 HydrophobicContact CB-CE3 4.09Å; K145-W164 HydrophobicContact CB-CZ3 4.2Å; K145-W164 HydrophobicContact CG-CD2 3.75Å; K145-W164 HydrophobicContact CG-CE3 4.02Å; K145-W164 HydrophobicContact CG-CG 3.98Å; K145-W164 HydrophobicContact CG-CZ3 4.5Å; K145-W164 WeakPolarHBondContact O-CZ3 3.41Å; C148-W164 VanDerWaalsContact SG-CZ3 3.51Å
165	R	95.2	Very high	92.5	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	141.2	179.1	-68.9	-170.6	-59.9	169.2	2.4	111.1	F144 E146 Y147 L149 V170 K174 Y333	F144-R165 HydrophobicContact CB-CB 4.14Å; F144-R165 PolarHBondContact N-O 2.89Å; F144-R165 PolarHBondContact O-N 3.1Å; E146-R165 IonicContact OE2-CZ 2.67Å; E146-R165 IonicContact OE2-NH2 2.65Å; E146-R165 PolarHBondContact OE2-NH2 3.07Å; Y147-R165 WeakPolarHBondContact O-CG 3.35Å; L149-R165 HydrophobicContact CD2-CG 4.32Å; L149-R165 HydrophobicContact CG-CG 4.09Å; R165-V170 HydrophobicContact CB-CG2 3.91Å; R165-K174 WeakPolarHBondContact CD-O 3.38Å; R165-K174 PolarHBondContact NH1-O 2.69Å; R165-Y333 PolarHBondContact NH2-OH 3.48Å
166	L	94.8	Very high	92.3	Very high	66 Å²	66	59.3 Å²	59.3	35%	0.346	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-85.7	154.6	164	-67.3	165.5	0	0	0	110.5	L143 K168 E169 V170	L143-L166 HydrophobicContact CD2-CD2 3.76Å; L166-K168 VanDerWaalsContact C-N 3.31Å; L166-K168 PolarHBondContact O-N 3.19Å; L166-E169 HydrophobicContact CB-CG 4.19Å; L166-E169 PolarHBondContact N-OE2 2.76Å; L166-E169 WeakPolarHBondContact O-CA 3.5Å; L166-E169 VanDerWaalsContact O-CB 3.29Å; L166-E169 WeakPolarHBondContact O-CB 3.4Å; L166-E169 PolarHBondContact O-N 3.42Å; L166-V170 PolarHBondContact O-N 3.24Å
167	E	94.7	Very high	92.3	Very high	82 Å²	82	54.2 Å²	54.2	38%	0.383	27%	0.266	S	S	.	.	H	α-helix	trans	-39.2	-53.4	171.3	-178.5	-179.3	-147.5	0	0	113.6	K142 F144 E169 V170 I171	K142-E167 WeakPolarHBondContact CE-OE2 3.42Å; K142-E167 VanDerWaalsContact NZ-CD 3.31Å; K142-E167 IonicContact NZ-OE1 2.75Å; K142-E167 PolarHBondContact NZ-OE1 3.03Å; K142-E167 IonicContact NZ-OE2 3.42Å; K142-E167 PolarHBondContact NZ-OE2 2.92Å; F144-E167 HydrophobicContact CE2-CB 3.93Å; E167-E169 PolarHBondContact O-N 3.04Å; E167-E169 VanDerWaalsContact O-N 3.12Å; E167-V170 PolarHBondContact O-N 3Å; E167-I171 HydrophobicContact CG-CD1 4.05Å; E167-I171 WeakPolarHBondContact O-CG1 3.06Å; E167-I171 PolarHBondContact O-N 2.76Å
168	K	94.9	Very high	92.3	Very high	172 Å²	172	51.7 Å²	51.7	75%	0.748	26%	0.258	S	S	*	.	H	α-helix	trans	-61.7	-20.9	178.3	-60.5	-176.3	179.4	-177	0	114.1	L166 S172	L166-K168 VanDerWaalsContact C-N 3.31Å; L166-K168 PolarHBondContact O-N 3.19Å; K168-S172 PolarHBondContact O-N 3.39Å; K168-S172 PolarHBondContact O-OG 3.01Å
169	E	93.9	Very high	92.6	Very high	22 Å²	22	49.7 Å²	49.7	10%	0.103	25%	0.247	C	C	.	.	H	α-helix	trans	-92.2	-31	-179.8	-56.9	-178.1	123.1	0	0	111.9	L149 R163 L166 E167 S172 G173 K174	L149-E169 HydrophobicContact CD1-CB 4.48Å; L149-E169 VanDerWaalsContact CD1-CD 3.5Å; L149-E169 VanDerWaalsContact CD1-OE1 3.29Å; L149-E169 WeakPolarHBondContact CD1-OE1 3.35Å; R163-E169 IonicContact CZ-OE1 2.76Å; R163-E169 IonicContact CZ-OE2 3.34Å; R163-E169 IonicContact NH1-OE1 3.24Å; R163-E169 IonicContact NH1-OE2 2.68Å; R163-E169 PolarHBondContact NH1-OE2 2.91Å; R163-E169 IonicContact NH2-OE1 2.92Å; R163-E169 PolarHBondContact NH2-OE1 3.18Å; R163-E169 IonicContact NH2-OE2 3.48Å; R163-E169 PolarHBondContact NH2-OE2 2.95Å; L166-E169 HydrophobicContact CB-CG 4.19Å; L166-E169 PolarHBondContact N-OE2 2.76Å; L166-E169 WeakPolarHBondContact O-CA 3.5Å; L166-E169 VanDerWaalsContact O-CB 3.29Å; L166-E169 WeakPolarHBondContact O-CB 3.4Å; L166-E169 PolarHBondContact O-N 3.42Å; E167-E169 PolarHBondContact O-N 3.04Å; E167-E169 VanDerWaalsContact O-N 3.12Å; E169-S172 WeakPolarHBondContact CA-OG 3.48Å; E169-S172 CarbonylContact O-C 3.53Å; E169-G173 PolarHBondContact O-N 3.44Å; E169-K174 HydrophobicContact CB-CB 4.3Å; E169-K174 HydrophobicContact CB-CD 4.27Å; E169-K174 HydrophobicContact CG-CD 4.37Å; E169-K174 WeakPolarHBondContact O-CB 3.14Å; E169-K174 PolarHBondContact O-N 2.96Å
170	V	93.7	Very high	92.7	Very high	3 Å²	3	44 Å²	44	2%	0.018	22%	0.222	C	C	.	.	H	α-helix	trans	-66.5	-48.2	167.5	-176.9	0	0	0	0	110	F144 R165 L166 E167 S172 G173 Y333 M337	F144-V170 HydrophobicContact CB-CG2 3.66Å; F144-V170 HydrophobicContact CD1-CG2 4.16Å; F144-V170 HydrophobicContact CD2-CG2 3.79Å; F144-V170 HydrophobicContact CG-CG2 3.59Å; R165-V170 HydrophobicContact CB-CG2 3.91Å; L166-V170 PolarHBondContact O-N 3.24Å; E167-V170 PolarHBondContact O-N 3Å; V170-S172 PolarHBondContact O-N 3.17Å; V170-G173 WeakPolarHBondContact O-CA 3.42Å; V170-G173 PolarHBondContact O-N 2.96Å; V170-Y333 HydrophobicContact CG1-CE1 4.17Å; V170-Y333 WeakPolarHBondContact CG1-OH 3.35Å; V170-M337 HydrophobicContact CG1-CE 3.89Å; V170-M337 HydrophobicContact CG1-SD 4.27Å
171	I	93.2	Very high	92.8	Very high	120 Å²	120	42.9 Å²	42.9	62%	0.615	22%	0.218	S	C	*	.	H	α-helix	trans	-59.6	-31.3	176.6	-65	164.9	0	0	0	111.9	E167 G173	E167-I171 HydrophobicContact CG-CD1 4.05Å; E167-I171 WeakPolarHBondContact O-CG1 3.06Å; E167-I171 PolarHBondContact O-N 2.76Å; I171-G173 VanDerWaalsContact C-N 3.34Å
172	S	91.3	Very high	92.8	Very high	57 Å²	57	45.4 Å²	45.4	40%	0.399	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	15.3	173.1	53.1	0	0	0	0	114.3	K168 E169 V170 K174	K168-S172 PolarHBondContact O-N 3.39Å; K168-S172 PolarHBondContact O-OG 3.01Å; E169-S172 WeakPolarHBondContact CA-OG 3.48Å; E169-S172 CarbonylContact O-C 3.53Å; V170-S172 PolarHBondContact O-N 3.17Å; S172-K174 PolarHBondContact O-N 2.78Å; S172-K174 VanDerWaalsContact O-N 3.11Å; S172-K174 WeakPolarHBondContact OG-CE 3.45Å
173	G	90.9	Very high	92.6	Very high	6 Å²	6	47.7 Å²	47.7	6%	0.062	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	12.5	173.1	0	0	0	0	0	115.8	E169 V170 I171 Q176 F177 T178	E169-G173 PolarHBondContact O-N 3.44Å; V170-G173 WeakPolarHBondContact O-CA 3.42Å; V170-G173 PolarHBondContact O-N 2.96Å; I171-G173 VanDerWaalsContact C-N 3.34Å; G173-Q176 PolarHBondContact O-N 2.95Å; G173-F177 PolarHBondContact O-N 3.23Å; G173-T178 PolarHBondContact O-N 2.74Å
174	K	91.5	Very high	92.3	Very high	89 Å²	89	44.5 Å²	44.5	39%	0.387	24%	0.241	S	C	.	.	B	Isolated β-bridge	trans	-67.9	138.6	-175.1	-61.8	-177.7	-177.8	-179.5	0	110.8	L149 R165 E169 S172 Q176	L149-K174 HydrophobicContact CD2-CB 4.15Å; R165-K174 WeakPolarHBondContact CD-O 3.38Å; R165-K174 PolarHBondContact NH1-O 2.69Å; E169-K174 HydrophobicContact CB-CB 4.3Å; E169-K174 HydrophobicContact CB-CD 4.27Å; E169-K174 HydrophobicContact CG-CD 4.37Å; E169-K174 WeakPolarHBondContact O-CB 3.14Å; E169-K174 PolarHBondContact O-N 2.96Å; S172-K174 PolarHBondContact O-N 2.78Å; S172-K174 VanDerWaalsContact O-N 3.11Å; S172-K174 WeakPolarHBondContact OG-CE 3.45Å; K174-Q176 PolarHBondContact O-N 3.37Å
175	G	89.5	Confident	91.7	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	-2.2	-176.2	0	0	0	0	0	115.5	T178 R214	G175-T178 WeakPolarHBondContact CA-O 3.41Å; G175-T178 PolarHBondContact N-O 2.91Å; G175-R214 WeakPolarHBondContact O-CB 3.45Å; G175-R214 WeakPolarHBondContact O-CG 3.46Å
176	Q	88.2	Confident	90.3	Very high	12 Å²	12	51.6 Å²	51.6	6%	0.056	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-131.9	-51.5	-173.9	-178.7	174.9	-10.4	0	0	112.6	Y147 G173 K174 T178 R214 Y333	Y147-Q176 HydrophobicContact CD2-CB 4.28Å; Y147-Q176 HydrophobicContact CE2-CB 4.29Å; Y147-Q176 HydrophobicContact CE2-CG 4.08Å; G173-Q176 PolarHBondContact O-N 2.95Å; K174-Q176 PolarHBondContact O-N 3.37Å; Q176-T178 PolarHBondContact N-O 3.24Å; Q176-R214 WeakPolarHBondContact O-CD 3.37Å; Q176-R214 PolarHBondContact O-NH1 3.4Å; Q176-R214 VanDerWaalsContact O-NH1 3.08Å; Q176-Y333 VanDerWaalsContact NE2-CG 3.27Å; Q176-Y333 PolarHBondContact OE1-OH 3.02Å
177	F	89.6	Confident	89	Confident	17 Å²	17	50.4 Å²	50.4	8%	0.075	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	-21.9	176	-54.7	-76	0	0	0	112.3	G173 S188 F330	G173-F177 PolarHBondContact O-N 3.23Å; F177-S188 VanDerWaalsContact O-CA 3.27Å; F177-S188 WeakPolarHBondContact O-CA 3.3Å; F177-S188 WeakPolarHBondContact O-CB 3.49Å; F177-F330 HydrophobicContact CB-CE1 4.17Å; F177-F330 HydrophobicContact CB-CZ 3.72Å; F177-F330 HydrophobicContact CD1-CD1 4.31Å; F177-F330 HydrophobicContact CD1-CD2 4.28Å; F177-F330 AromaticContact CD1-CE1 3.89Å; F177-F330 HydrophobicContact CD1-CE1 3.89Å; F177-F330 AromaticContact CD1-CE2 3.83Å; F177-F330 HydrophobicContact CD1-CE2 3.83Å; F177-F330 HydrophobicContact CD1-CG 4.5Å; F177-F330 AromaticContact CD1-CZ 3.62Å; F177-F330 HydrophobicContact CD1-CZ 3.62Å; F177-F330 AromaticContact CD2-CD1 3.82Å; F177-F330 HydrophobicContact CD2-CD1 3.82Å; F177-F330 AromaticContact CD2-CE1 3.18Å; F177-F330 HydrophobicContact CD2-CE1 3.18Å; F177-F330 AromaticContact CD2-CZ 3.63Å; F177-F330 HydrophobicContact CD2-CZ 3.63Å; F177-F330 AromaticContact CE1-CD1 3.94Å; F177-F330 HydrophobicContact CE1-CD1 3.94Å; F177-F330 HydrophobicContact CE1-CD2 4.07Å; F177-F330 AromaticContact CE1-CE1 4Å; F177-F330 HydrophobicContact CE1-CE1 4Å; F177-F330 HydrophobicContact CE1-CE2 4.1Å; F177-F330 AromaticContact CE1-CG 3.98Å; F177-F330 HydrophobicContact CE1-CG 3.98Å; F177-F330 HydrophobicContact CE1-CZ 4.06Å; F177-F330 AromaticContact CE2-CD1 3.4Å; F177-F330 HydrophobicContact CE2-CD1 3.4Å; F177-F330 VanDerWaalsContact CE2-CD1 3.4Å; F177-F330 AromaticContact CE2-CE1 3.32Å; F177-F330 HydrophobicContact CE2-CE1 3.32Å; F177-F330 HydrophobicContact CE2-CG 4.24Å; F177-F330 HydrophobicContact CE2-CZ 4.08Å; F177-F330 HydrophobicContact CG-CD1 4.24Å; F177-F330 AromaticContact CG-CE1 3.48Å; F177-F330 HydrophobicContact CG-CE1 3.48Å; F177-F330 VanDerWaalsContact CG-CE1 3.48Å; F177-F330 HydrophobicContact CG-CE2 4.07Å; F177-F330 AromaticContact CG-CZ 3.37Å; F177-F330 HydrophobicContact CG-CZ 3.37Å; F177-F330 AromaticContact CZ-CD1 3.46Å; F177-F330 HydrophobicContact CZ-CD1 3.46Å; F177-F330 VanDerWaalsContact CZ-CD1 3.46Å; F177-F330 HydrophobicContact CZ-CD2 4.38Å; F177-F330 AromaticContact CZ-CE1 3.72Å; F177-F330 HydrophobicContact CZ-CE1 3.72Å; F177-F330 AromaticContact CZ-CG 3.83Å; F177-F330 HydrophobicContact CZ-CG 3.83Å; F177-F330 HydrophobicContact CZ-CZ 4.27Å
178	T	92.1	Very high	87.7	Confident	49 Å²	49	50.1 Å²	50.1	30%	0.301	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-112.7	150.2	165.6	-71	0	0	0	0	109.8	G173 G175 Q176 G180	G173-T178 PolarHBondContact O-N 2.74Å; G175-T178 WeakPolarHBondContact CA-O 3.41Å; G175-T178 PolarHBondContact N-O 2.91Å; Q176-T178 PolarHBondContact N-O 3.24Å; T178-G180 PolarHBondContact O-N 2.99Å
179	C	93.6	Very high	86.7	Confident	7 Å²	7	48.4 Å²	48.4	5%	0.047	30%	0.299	C	S	.	.			trans	-51.4	133.7	-179.5	-174.7	0	0	0	0	112.7	N181 C184 L191 C216	C179-N181 PolarHBondContact O-N 3.1Å; C179-C184 HydrophobicContact CB-CB 4.34Å; C179-L191 HydrophobicContact CB-CD2 4.1Å; C179-C216 HydrophobicContact CB-CB 4.29Å; C179-C216 PolarHBondContact SG-N 3.4Å
180	G	93	Very high	86.3	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	33%	0.333	C	S	.	.	S	Bend	trans	-74.2	-2.6	179.8	0	0	0	0	0	115.8	L149 I150 T178 V182 R214	L149-G180 CarbonylContact C-O 3.58Å; L149-G180 VanDerWaalsContact CA-O 3.3Å; L149-G180 WeakPolarHBondContact CA-O 3.34Å; I150-G180 PolarHBondContact N-O 2.72Å; T178-G180 PolarHBondContact O-N 2.99Å; G180-V182 PolarHBondContact O-N 3.18Å; G180-R214 PolarHBondContact N-O 3.04Å
181	N	94	Very high	86.1	Confident	10 Å²	10	58.8 Å²	58.8	5%	0.053	34%	0.339	C	S	.	.	B	Isolated β-bridge	trans	-80.1	117.6	175.6	171.1	32.7	0	0	0	110.9	I150 L152 C179 A183 C184 L215 C219	I150-N181 HydrophobicContact CG2-CB 4.29Å; I150-N181 CarbonylContact O-C 3.58Å; I150-N181 VanDerWaalsContact O-CA 3.27Å; I150-N181 WeakPolarHBondContact O-CA 3.36Å; I150-N181 PolarHBondContact O-OD1 3.37Å; L152-N181 HydrophobicContact CD1-CB 3.82Å; L152-N181 HydrophobicContact CG-CB 4.22Å; L152-N181 PolarHBondContact N-OD1 2.98Å; C179-N181 PolarHBondContact O-N 3.1Å; N181-A183 PolarHBondContact O-N 3.26Å; N181-A183 VanDerWaalsContact O-N 3.14Å; N181-A183 PolarHBondContact OD1-N 2.85Å; N181-C184 HydrophobicContact CB-CB 3.99Å; N181-C184 VanDerWaalsContact O-CB 3.26Å; N181-C184 WeakPolarHBondContact O-CB 3.41Å; N181-C184 PolarHBondContact O-N 3.18Å; N181-L215 HydrophobicContact CB-CD2 4.07Å; N181-C219 HydrophobicContact CB-CB 4.3Å; N181-C219 PolarHBondContact ND2-SG 3Å; N181-C219 VanDerWaalsContact ND2-SG 3.36Å
182	V	92.1	Very high	86	Confident	91 Å²	91	58.3 Å²	58.3	55%	0.552	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-34.4	-174.6	177.8	0	0	0	0	112.8	L149 I150 G180	L149-V182 HydrophobicContact CB-CG2 4.02Å; I150-V182 PolarHBondContact O-N 3.22Å; G180-V182 PolarHBondContact O-N 3.18Å
183	A	89	Confident	86	Confident	73 Å²	73	56.9 Å²	56.9	60%	0.603	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	23.2	-179.1	0	0	0	0	0	113.7	N181	N181-A183 PolarHBondContact O-N 3.26Å; N181-A183 VanDerWaalsContact O-N 3.14Å; N181-A183 PolarHBondContact OD1-N 2.85Å
184	C	88.8	Confident	86.1	Confident	32 Å²	32	57.2 Å²	57.2	22%	0.216	32%	0.319	C	S	.	.			trans	-95.9	120.9	-179.8	-162.1	0	0	0	0	112.2	C179 N181 A186	C179-C184 HydrophobicContact CB-CB 4.34Å; N181-C184 HydrophobicContact CB-CB 3.99Å; N181-C184 VanDerWaalsContact O-CB 3.26Å; N181-C184 WeakPolarHBondContact O-CB 3.41Å; N181-C184 PolarHBondContact O-N 3.18Å; C184-A186 VanDerWaalsContact C-N 3.33Å
185	P	81	Confident	86.2	Confident	136 Å²	136	56.8 Å²	56.8	88%	0.883	32%	0.319	S	S	*	.			trans	-81.4	-10.6	172.8	33.4	-35.6	0	0	0	113.5	G187	P185-G187 PolarHBondContact O-N 3.18Å
186	A	67.4	Low	86.3	Confident	40 Å²	40	57 Å²	57	33%	0.331	32%	0.319	S	S	.	.			trans	-87	110.9	-176.7	0	0	0	0	0	111.4	C184	C184-A186 VanDerWaalsContact C-N 3.33Å
187	G	66	Low	86.5	Confident	41 Å²	41	60.4 Å²	60.4	42%	0.423	34%	0.338	S	S	.	.			trans	-75.9	152.7	173.3	0	0	0	0	0	113.1	P185 E189	P185-G187 PolarHBondContact O-N 3.18Å; G187-E189 PolarHBondContact O-N 3.32Å
188	S	68.5	Low	86.6	Confident	76 Å²	76	61 Å²	61	53%	0.531	34%	0.341	S	S	.	.	S	Bend	trans	43.5	-6.1	163.1	55.4	0	0	0	0	123.1	F177 R190	F177-S188 VanDerWaalsContact O-CA 3.27Å; F177-S188 WeakPolarHBondContact O-CA 3.3Å; F177-S188 WeakPolarHBondContact O-CB 3.49Å; S188-R190 PolarHBondContact O-N 3.21Å
189	E	74.3	Confident	86.7	Confident	135 Å²	135	62.2 Å²	62.2	63%	0.631	35%	0.348	S	S	*	.	S	Bend	trans	-74.4	114.2	-171.4	-168.8	167.5	-148.1	0	0	113.4	G187 L191	G187-E189 PolarHBondContact O-N 3.32Å; E189-L191 PolarHBondContact O-N 3.46Å
190	R	85.3	Confident	86.6	Confident	217 Å²	217	63.4 Å²	63.4	82%	0.819	35%	0.352	S	S	*	.	S	Bend	trans	30.5	65.3	172.3	-69.8	-171.2	179.8	-98.5	3.2	114.3	S188	S188-R190 PolarHBondContact O-N 3.21Å
191	L	89.9	Confident	86.5	Confident	27 Å²	27	70 Å²	70	14%	0.141	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-65	131.6	-179.6	-56.3	-178.6	0	0	0	112.3	C179 E189 R214 L215 C216	C179-L191 HydrophobicContact CB-CD2 4.1Å; E189-L191 PolarHBondContact O-N 3.46Å; L191-R214 HydrophobicContact CB-CB 4.25Å; L191-R214 HydrophobicContact CD1-CB 4.39Å; L191-L215 WeakPolarHBondContact CA-O 3.46Å; L191-C216 HydrophobicContact CD2-CB 3.92Å
192	R	90	Very high	86.2	Confident	109 Å²	109	70.3 Å²	70.3	41%	0.411	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	143.5	171.3	-69.5	170.2	178.5	-106.3	2.5	110.3	W194 R214 L215 D231	R192-W194 HydrophobicContact CB-CZ2 4.34Å; R192-W194 VanDerWaalsContact O-CD1 3.24Å; R192-W194 PolarHBondContact O-NE1 3.18Å; R192-R214 WeakPolarHBondContact O-CA 3.15Å; R192-L215 PolarHBondContact N-O 3.3Å; R192-L215 PolarHBondContact O-N 3.04Å; R192-D231 WeakPolarHBondContact CD-OD2 3.29Å; R192-D231 IonicContact CZ-OD2 2.7Å; R192-D231 IonicContact NE-OD2 2.64Å; R192-D231 IonicContact NH1-OD2 2.64Å; R192-D231 PolarHBondContact NH1-OD2 3.4Å
193	S	92.2	Very high	85.9	Confident	27 Å²	27	73.1 Å²	73.1	19%	0.189	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	127.3	179.7	-61.2	0	0	0	0	111.4	R214 V232 T233	S193-R214 PolarHBondContact OG-NE 3.36Å; S193-V232 PolarHBondContact O-N 3.34Å; S193-T233 PolarHBondContact N-OG1 3.04Å
194	W	92.7	Very high	85.8	Confident	13 Å²	13	72.1 Å²	72.1	5%	0.049	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	135.5	-176.5	-59.6	84.6	0	0	0	110.5	R192 V196 K212 I213 L223 N224 D231	R192-W194 HydrophobicContact CB-CZ2 4.34Å; R192-W194 VanDerWaalsContact O-CD1 3.24Å; R192-W194 PolarHBondContact O-NE1 3.18Å; W194-V196 HydrophobicContact CB-CG2 4.12Å; W194-K212 CarbonylContact O-C 3.4Å; W194-K212 WeakPolarHBondContact O-CA 3.41Å; W194-I213 PolarHBondContact N-O 2.75Å; W194-I213 PolarHBondContact O-N 3.38Å; W194-L223 HydrophobicContact CB-CD2 3.96Å; W194-L223 HydrophobicContact CD2-CD2 3.91Å; W194-L223 HydrophobicContact CE3-CD2 4.18Å; W194-L223 HydrophobicContact CG-CD2 3.77Å; W194-N224 WeakPolarHBondContact CH2-ND2 3.38Å; W194-N224 VanDerWaalsContact CZ3-ND2 3.26Å; W194-N224 WeakPolarHBondContact CZ3-ND2 3.49Å; W194-D231 HydrophobicContact CE3-CB 4.44Å; W194-D231 HydrophobicContact CH2-CB 3.56Å; W194-D231 HydrophobicContact CZ2-CB 4.05Å; W194-D231 HydrophobicContact CZ3-CB 3.78Å
195	E	93.6	Very high	85.9	Confident	81 Å²	81	75.8 Å²	75.8	38%	0.379	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	123.7	165.1	-75.5	177.2	171	0	0	108.5	L210 V211 K212 V232	E195-L210 HydrophobicContact CB-CD1 4.15Å; E195-L210 HydrophobicContact CB-CG 4.43Å; E195-V211 WeakPolarHBondContact CA-O 3.22Å; E195-K212 HydrophobicContact CG-CG 3.83Å; E195-K212 WeakPolarHBondContact OE1-CE 3.35Å; E195-K212 IonicContact OE1-NZ 3.75Å; E195-V232 HydrophobicContact CB-CG2 4.04Å; E195-V232 HydrophobicContact CG-CG2 4.03Å
196	V	91.1	Very high	86.5	Confident	3 Å²	3	78.4 Å²	78.4	2%	0.018	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	126.9	-171.4	-172.2	0	0	0	0	109.1	M162 W194 F198 V211 I213 L223	M162-V196 HydrophobicContact CE-CB 4.17Å; M162-V196 HydrophobicContact CE-CG1 3.73Å; W194-V196 HydrophobicContact CB-CG2 4.12Å; V196-F198 PolarHBondContact O-N 3.41Å; V196-V211 PolarHBondContact N-O 3.16Å; V196-V211 PolarHBondContact O-N 2.83Å; V196-I213 HydrophobicContact CB-CD1 4.35Å; V196-I213 HydrophobicContact CG2-CD1 4Å; V196-L223 HydrophobicContact CG2-CD1 4.4Å; V196-L223 HydrophobicContact CG2-CD2 3.97Å
197	N	92.3	Very high	87.7	Confident	85 Å²	85	79.5 Å²	79.5	46%	0.455	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	108	168.7	-176.2	12.2	0	0	0	109.1
198	F	92.8	Very high	88.9	Confident	30 Å²	30	82.5 Å²	82.5	13%	0.132	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	106.8	173.8	-178.9	-123.7	0	0	0	109.1	F120 M162 V196 Y200 N208 A209 V211	F120-F198 HydrophobicContact CD1-CD1 4.04Å; F120-F198 HydrophobicContact CD1-CE1 4.16Å; F120-F198 HydrophobicContact CD2-CD1 4.49Å; F120-F198 AromaticContact CD2-CE1 3.96Å; F120-F198 HydrophobicContact CD2-CE1 3.96Å; F120-F198 AromaticContact CE1-CD1 3.69Å; F120-F198 HydrophobicContact CE1-CD1 3.69Å; F120-F198 HydrophobicContact CE1-CE1 4.12Å; F120-F198 HydrophobicContact CE2-CD1 4.16Å; F120-F198 AromaticContact CE2-CE1 3.9Å; F120-F198 HydrophobicContact CE2-CE1 3.9Å; F120-F198 HydrophobicContact CG-CD1 4.44Å; F120-F198 HydrophobicContact CG-CE1 4.1Å; F120-F198 AromaticContact CZ-CD1 3.76Å; F120-F198 HydrophobicContact CZ-CD1 3.76Å; F120-F198 AromaticContact CZ-CE1 3.99Å; F120-F198 HydrophobicContact CZ-CE1 3.99Å; M162-F198 HydrophobicContact CB-CD2 4.05Å; M162-F198 HydrophobicContact CB-CE2 3.9Å; M162-F198 HydrophobicContact CB-CG 4.44Å; M162-F198 HydrophobicContact CB-CZ 4.13Å; M162-F198 HydrophobicContact CE-CB 4.23Å; M162-F198 HydrophobicContact CE-CD2 3.93Å; M162-F198 HydrophobicContact CE-CG 4.43Å; M162-F198 HydrophobicContact CG-CD2 3.84Å; M162-F198 HydrophobicContact CG-CE2 4Å; M162-F198 HydrophobicContact CG-CG 4.43Å; M162-F198 HydrophobicContact SD-CB 3.85Å; M162-F198 HydrophobicContact SD-CD2 3.67Å; M162-F198 HydrophobicContact SD-CE2 4.42Å; M162-F198 HydrophobicContact SD-CG 3.85Å; V196-F198 PolarHBondContact O-N 3.41Å; F198-Y200 AromaticContact CD1-CD1 3.59Å; F198-Y200 HydrophobicContact CD1-CD1 3.59Å; F198-Y200 HydrophobicContact CD1-CE1 4.25Å; F198-Y200 HydrophobicContact CD1-CG 4.19Å; F198-Y200 AromaticContact CE1-CD1 3.73Å; F198-Y200 HydrophobicContact CE1-CD1 3.73Å; F198-Y200 AromaticContact CE1-CG 3.85Å; F198-Y200 HydrophobicContact CE1-CG 3.85Å; F198-Y200 HydrophobicContact CG-CD1 4.44Å; F198-N208 WeakPolarHBondContact O-CA 3.33Å; F198-A209 PolarHBondContact N-O 3.13Å; F198-A209 PolarHBondContact O-N 2.94Å; F198-V211 HydrophobicContact CB-CG2 3.87Å
199	V	92.4	Very high	90.1	Very high	73 Å²	73	79.3 Å²	79.3	44%	0.442	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	120.6	173.9	-178.9	0	0	0	0	108	N208	V199-N208 WeakPolarHBondContact CG2-OD1 3.24Å
200	Y	92	Very high	91	Very high	32 Å²	32	78.7 Å²	78.7	13%	0.125	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	173.1	-178.5	64.5	-79.3	0	0	0	111.5	F120 F198 E202 R207 A209	F120-Y200 HydrophobicContact CB-CD2 4.25Å; F120-Y200 HydrophobicContact CB-CE1 4.47Å; F120-Y200 HydrophobicContact CB-CE2 3.69Å; F120-Y200 HydrophobicContact CD1-CD1 4.42Å; F120-Y200 AromaticContact CD1-CE1 3.83Å; F120-Y200 HydrophobicContact CD1-CE1 3.83Å; F120-Y200 AromaticContact CD1-CZ 3.9Å; F120-Y200 HydrophobicContact CG-CE1 4.45Å; F120-Y200 HydrophobicContact CG-CE2 4.46Å; F198-Y200 AromaticContact CD1-CD1 3.59Å; F198-Y200 HydrophobicContact CD1-CD1 3.59Å; F198-Y200 HydrophobicContact CD1-CE1 4.25Å; F198-Y200 HydrophobicContact CD1-CG 4.19Å; F198-Y200 AromaticContact CE1-CD1 3.73Å; F198-Y200 HydrophobicContact CE1-CD1 3.73Å; F198-Y200 AromaticContact CE1-CG 3.85Å; F198-Y200 HydrophobicContact CE1-CG 3.85Å; F198-Y200 HydrophobicContact CG-CD1 4.44Å; Y200-E202 HydrophobicContact CD2-CB 4.11Å; Y200-E202 HydrophobicContact CE2-CB 3.9Å; Y200-E202 HydrophobicContact CE2-CG 4.46Å; Y200-R207 HydrophobicContact CD1-CB 4.4Å; Y200-R207 VanDerWaalsContact CD1-O 3.31Å; Y200-R207 WeakPolarHBondContact CD1-O 3.48Å; Y200-R207 HydrophobicContact CD2-CB 4.33Å; Y200-R207 HydrophobicContact CE1-CB 3.88Å; Y200-R207 HydrophobicContact CE2-CB 3.82Å; Y200-R207 PolarHBondContact N-O 3.37Å; Y200-R207 PolarHBondContact O-N 3.14Å; Y200-A209 HydrophobicContact CE1-CB 4.05Å
201	Q	91.7	Very high	91.4	Very high	140 Å²	140	68.5 Å²	68.5	65%	0.654	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122	132.3	174.5	-163.1	177	12.3	0	0	109.4	G204 E205	Q201-G204 PolarHBondContact NE2-O 2.99Å; Q201-E205 CarbonylContact C-O 3.58Å; Q201-E205 WeakPolarHBondContact CA-O 3.5Å; Q201-E205 VanDerWaalsContact CG-O 3.29Å; Q201-E205 WeakPolarHBondContact CG-O 3.25Å
202	E	87.8	Confident	91.7	Very high	15 Å²	15	72.5 Å²	72.5	7%	0.07	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	118.7	-172.4	-173.7	164.7	-102.3	0	0	108.7	R119 F120 Y200 G204 E205 R207	R119-E202 WeakPolarHBondContact CA-OE1 3.5Å; R119-E202 WeakPolarHBondContact CB-OE1 3.18Å; F120-E202 PolarHBondContact N-OE1 3.12Å; Y200-E202 HydrophobicContact CD2-CB 4.11Å; Y200-E202 HydrophobicContact CE2-CB 3.9Å; Y200-E202 HydrophobicContact CE2-CG 4.46Å; E202-G204 PolarHBondContact O-N 2.97Å; E202-E205 PolarHBondContact N-O 3.4Å; E202-E205 PolarHBondContact O-N 3.48Å; E202-R207 WeakPolarHBondContact OE2-CD 3.34Å; E202-R207 IonicContact OE2-CZ 3.67Å; E202-R207 IonicContact OE2-NE 3.91Å; E202-R207 IonicContact OE2-NH1 2.69Å; E202-R207 PolarHBondContact OE2-NH1 2.88Å
203	R	84.5	Confident	91.8	Very high	151 Å²	151	67.3 Å²	67.3	57%	0.57	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	25.5	-174.1	-57.5	-171	-178.2	-167.4	3.1	114.9	H117 D133	H117-R203 PolarHBondContact O-NH2 3.06Å; D133-R203 IonicContact OD1-CZ 3.67Å; D133-R203 IonicContact OD1-NH1 2.66Å; D133-R203 IonicContact OD1-NH2 2.67Å; D133-R203 PolarHBondContact OD1-NH2 3.04Å
204	G	88.6	Confident	91.9	Very high	51 Å²	51	68.6 Å²	68.6	53%	0.526	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.3	-26	-178.8	0	0	0	0	0	114.4	Q201 E202	Q201-G204 PolarHBondContact NE2-O 2.99Å; E202-G204 PolarHBondContact O-N 2.97Å
205	E	90.4	Very high	91.9	Very high	109 Å²	109	68 Å²	68	51%	0.509	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	146.2	179.2	-60	-179.9	167.4	0	0	111.9	Q201 E202 R207	Q201-E205 CarbonylContact C-O 3.58Å; Q201-E205 WeakPolarHBondContact CA-O 3.5Å; Q201-E205 VanDerWaalsContact CG-O 3.29Å; Q201-E205 WeakPolarHBondContact CG-O 3.25Å; E202-E205 PolarHBondContact N-O 3.4Å; E202-E205 PolarHBondContact O-N 3.48Å; E205-R207 HydrophobicContact CB-CG 4.44Å; E205-R207 IonicContact OE2-CZ 3.89Å; E205-R207 VanDerWaalsContact OE2-CZ 3.24Å; E205-R207 IonicContact OE2-NE 3.67Å; E205-R207 PolarHBondContact OE2-NE 2.98Å; E205-R207 IonicContact OE2-NH2 2.83Å; E205-R207 PolarHBondContact OE2-NH2 2.85Å
206	R	92.5	Very high	91.9	Very high	191 Å²	191	64.2 Å²	64.2	72%	0.721	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.8	118.9	171.5	-66.8	-178.3	64.7	176.6	-1	109.6
207	R	92.2	Very high	91.8	Very high	64 Å²	64	66 Å²	66	24%	0.242	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	149.7	-177.1	-65.6	-177.1	176.9	-153.6	-14.5	110.7	D126 Y200 E202 E205	D126-R207 IonicContact OD2-NH1 3.9Å; Y200-R207 HydrophobicContact CD1-CB 4.4Å; Y200-R207 VanDerWaalsContact CD1-O 3.31Å; Y200-R207 WeakPolarHBondContact CD1-O 3.48Å; Y200-R207 HydrophobicContact CD2-CB 4.33Å; Y200-R207 HydrophobicContact CE1-CB 3.88Å; Y200-R207 HydrophobicContact CE2-CB 3.82Å; Y200-R207 PolarHBondContact N-O 3.37Å; Y200-R207 PolarHBondContact O-N 3.14Å; E202-R207 WeakPolarHBondContact OE2-CD 3.34Å; E202-R207 IonicContact OE2-CZ 3.67Å; E202-R207 IonicContact OE2-NE 3.91Å; E202-R207 IonicContact OE2-NH1 2.69Å; E202-R207 PolarHBondContact OE2-NH1 2.88Å; E205-R207 HydrophobicContact CB-CG 4.44Å; E205-R207 IonicContact OE2-CZ 3.89Å; E205-R207 VanDerWaalsContact OE2-CZ 3.24Å; E205-R207 IonicContact OE2-NE 3.67Å; E205-R207 PolarHBondContact OE2-NE 2.98Å; E205-R207 IonicContact OE2-NH2 2.83Å; E205-R207 PolarHBondContact OE2-NH2 2.85Å
208	N	93	Very high	91.8	Very high	103 Å²	103	65 Å²	65	55%	0.551	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.4	136.2	-177.4	-65.8	-13.2	0	0	0	109.3	F198 V199	F198-N208 WeakPolarHBondContact O-CA 3.33Å; V199-N208 WeakPolarHBondContact CG2-OD1 3.24Å
209	A	93.3	Very high	91.7	Very high	9 Å²	9	63.6 Å²	63.6	7%	0.074	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	135.9	174.7	0	0	0	0	0	110.9	F120 L121 F198 Y200 V211	F120-A209 HydrophobicContact CD1-CB 4.24Å; F120-A209 HydrophobicContact CE1-CB 3.88Å; L121-A209 HydrophobicContact CD1-CB 3.82Å; F198-A209 PolarHBondContact N-O 3.13Å; F198-A209 PolarHBondContact O-N 2.94Å; Y200-A209 HydrophobicContact CE1-CB 4.05Å; A209-V211 HydrophobicContact CB-CG2 4.24Å
210	L	93.3	Very high	91.7	Very high	123 Å²	123	60.7 Å²	60.7	64%	0.644	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	120.5	171	-170.2	65.9	0	0	0	109.4	E195	E195-L210 HydrophobicContact CB-CD1 4.15Å; E195-L210 HydrophobicContact CB-CG 4.43Å
211	V	93.9	Very high	91.5	Very high	2 Å²	2	65.4 Å²	65.4	1%	0.012	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	133.6	-169.3	173.5	0	0	0	0	110.7	F120 C148 M162 E195 V196 F198 A209 I213	F120-V211 HydrophobicContact CE1-CG2 4.01Å; F120-V211 HydrophobicContact CZ-CG2 3.97Å; C148-V211 HydrophobicContact CB-CG1 3.42Å; C148-V211 VanDerWaalsContact CB-CG1 3.42Å; C148-V211 WeakPolarHBondContact SG-CG1 3.3Å; M162-V211 HydrophobicContact SD-CB 4.27Å; M162-V211 HydrophobicContact SD-CG1 4Å; E195-V211 WeakPolarHBondContact CA-O 3.22Å; V196-V211 PolarHBondContact N-O 3.16Å; V196-V211 PolarHBondContact O-N 2.83Å; F198-V211 HydrophobicContact CB-CG2 3.87Å; A209-V211 HydrophobicContact CB-CG2 4.24Å; V211-I213 HydrophobicContact CG1-CD1 4.48Å; V211-I213 HydrophobicContact CG1-CG1 4.07Å
212	K	94.7	Very high	91.5	Very high	111 Å²	111	62.3 Å²	62.3	48%	0.483	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	137.7	175.6	-71.7	172.6	178.2	177.9	0	111.2	E146 Y147 C148 W194 E195	E146-K212 WeakPolarHBondContact O-CB 3.32Å; Y147-K212 CarbonylContact C-O 3.4Å; Y147-K212 WeakPolarHBondContact CA-O 3.43Å; Y147-K212 HydrophobicContact CD1-CB 4.09Å; Y147-K212 HydrophobicContact CE1-CB 4.46Å; C148-K212 PolarHBondContact N-O 3.26Å; W194-K212 CarbonylContact O-C 3.4Å; W194-K212 WeakPolarHBondContact O-CA 3.41Å; E195-K212 HydrophobicContact CG-CG 3.83Å; E195-K212 WeakPolarHBondContact OE1-CE 3.35Å; E195-K212 IonicContact OE1-NZ 3.75Å
213	I	93.8	Very high	91.6	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	133	-177.7	-44.1	177.9	0	0	0	109.4	C148 I150 M162 W194 V196 V211 L215	C148-I213 HydrophobicContact CB-CG1 4.44Å; I150-I213 HydrophobicContact CB-CD1 4.32Å; I150-I213 HydrophobicContact CD1-CD1 3.94Å; I150-I213 HydrophobicContact CG2-CG2 4.01Å; M162-I213 HydrophobicContact CE-CD1 3.94Å; M162-I213 HydrophobicContact SD-CD1 3.87Å; W194-I213 PolarHBondContact N-O 2.75Å; W194-I213 PolarHBondContact O-N 3.38Å; V196-I213 HydrophobicContact CB-CD1 4.35Å; V196-I213 HydrophobicContact CG2-CD1 4Å; V211-I213 HydrophobicContact CG1-CD1 4.48Å; V211-I213 HydrophobicContact CG1-CG1 4.07Å; I213-L215 HydrophobicContact CG2-CD1 4.43Å; I213-L215 HydrophobicContact CG2-CD2 3.95Å; I213-L215 HydrophobicContact CG2-CG 3.93Å
214	R	93.3	Very high	91.6	Very high	54 Å²	54	55.8 Å²	55.8	20%	0.204	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	130.1	168.2	-48.4	-170.7	89.7	-179.8	9.5	111.4	Y147 G175 Q176 G180 L191 R192 S193	Y147-R214 HydrophobicContact CD1-CG 3.83Å; Y147-R214 HydrophobicContact CE1-CG 3.49Å; Y147-R214 VanDerWaalsContact CE1-CG 3.49Å; G175-R214 WeakPolarHBondContact O-CB 3.45Å; G175-R214 WeakPolarHBondContact O-CG 3.46Å; Q176-R214 WeakPolarHBondContact O-CD 3.37Å; Q176-R214 PolarHBondContact O-NH1 3.4Å; Q176-R214 VanDerWaalsContact O-NH1 3.08Å; G180-R214 PolarHBondContact N-O 3.04Å; L191-R214 HydrophobicContact CB-CB 4.25Å; L191-R214 HydrophobicContact CD1-CB 4.39Å; R192-R214 WeakPolarHBondContact O-CA 3.15Å; S193-R214 PolarHBondContact OG-NE 3.36Å
215	L	92.9	Very high	91.5	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	142.5	-175.6	-64.6	178.3	0	0	0	111.9	I150 L152 N181 L191 R192 I213 C219 L223	I150-L215 HydrophobicContact CG2-CD2 3.82Å; L152-L215 HydrophobicContact CD1-CD1 4.41Å; N181-L215 HydrophobicContact CB-CD2 4.07Å; L191-L215 WeakPolarHBondContact CA-O 3.46Å; R192-L215 PolarHBondContact N-O 3.3Å; R192-L215 PolarHBondContact O-N 3.04Å; I213-L215 HydrophobicContact CG2-CD1 4.43Å; I213-L215 HydrophobicContact CG2-CD2 3.95Å; I213-L215 HydrophobicContact CG2-CG 3.93Å; L215-C219 HydrophobicContact CB-CB 4.05Å; L215-C219 HydrophobicContact CD1-CB 4.4Å; L215-C219 HydrophobicContact CD2-CB 4.09Å; L215-C219 HydrophobicContact CG-CB 4.42Å; L215-L223 HydrophobicContact CD1-CB 4.11Å; L215-L223 HydrophobicContact CD1-CD2 3.89Å; L215-L223 HydrophobicContact CD1-CG 4.4Å
216	C	92.7	Very high	90.6	Very high	2 Å²	2	61.4 Å²	61.4	1%	0.014	28%	0.28	C	S	.	.			trans	-67.4	157.9	168.1	65.1	0	0	0	0	110.7	C179 L191 C219 S220	C179-C216 HydrophobicContact CB-CB 4.29Å; C179-C216 PolarHBondContact SG-N 3.4Å; L191-C216 HydrophobicContact CD2-CB 3.92Å; C216-C219 PolarHBondContact O-N 2.95Å; C216-C219 VanDerWaalsContact SG-SG 3.66Å; C216-S220 PolarHBondContact O-N 3.25Å
217	P	90.7	Very high	89.4	Confident	41 Å²	41	59.2 Å²	59.2	27%	0.266	27%	0.273	S	S	.	.	H	α-helix	trans	-47.2	-50.1	-174.6	-28.3	35.3	0	0	0	115.9	C219 S220 E221	P217-C219 VanDerWaalsContact C-N 3.27Å; P217-C219 PolarHBondContact O-N 2.86Å; P217-S220 WeakPolarHBondContact O-CA 3.21Å; P217-S220 VanDerWaalsContact O-CB 3.29Å; P217-S220 WeakPolarHBondContact O-CB 3.28Å; P217-S220 PolarHBondContact O-N 3.4Å; P217-S220 PolarHBondContact O-OG 2.81Å; P217-E221 PolarHBondContact O-N 2.93Å
218	P	91	Very high	88	Confident	62 Å²	62	67.9 Å²	67.9	40%	0.403	31%	0.305	S	S	.	.	H	α-helix	trans	-71.8	-17	-179.1	29.3	-37.1	0	0	0	114	K222	P218-K222 WeakPolarHBondContact O-CD 3.24Å; P218-K222 WeakPolarHBondContact O-CG 3.41Å; P218-K222 PolarHBondContact O-N 2.93Å
219	C	92.1	Very high	86.7	Confident	2 Å²	2	67.1 Å²	67.1	1%	0.014	29%	0.294	C	S	.	.	H	α-helix	trans	-83.7	-31.5	168.7	-69.5	0	0	0	0	111.4	L152 N181 L215 C216 P217 E221 K222 L223	L152-C219 HydrophobicContact CD1-CB 3.62Å; L152-C219 WeakPolarHBondContact CD1-O 3.46Å; N181-C219 HydrophobicContact CB-CB 4.3Å; N181-C219 PolarHBondContact ND2-SG 3Å; N181-C219 VanDerWaalsContact ND2-SG 3.36Å; L215-C219 HydrophobicContact CB-CB 4.05Å; L215-C219 HydrophobicContact CD1-CB 4.4Å; L215-C219 HydrophobicContact CD2-CB 4.09Å; L215-C219 HydrophobicContact CG-CB 4.42Å; C216-C219 PolarHBondContact O-N 2.95Å; C216-C219 VanDerWaalsContact SG-SG 3.66Å; P217-C219 VanDerWaalsContact C-N 3.27Å; P217-C219 PolarHBondContact O-N 2.86Å; C219-E221 VanDerWaalsContact C-N 3.33Å; C219-K222 PolarHBondContact O-N 2.88Å; C219-L223 PolarHBondContact O-N 2.84Å
220	S	90.4	Very high	85.2	Confident	12 Å²	12	74.4 Å²	74.4	8%	0.084	32%	0.32	C	S	.	.	H	α-helix	trans	-64	-36.9	171.1	101.1	0	0	0	0	112	C216 P217 L223 N224	C216-S220 PolarHBondContact O-N 3.25Å; P217-S220 WeakPolarHBondContact O-CA 3.21Å; P217-S220 VanDerWaalsContact O-CB 3.29Å; P217-S220 WeakPolarHBondContact O-CB 3.28Å; P217-S220 PolarHBondContact O-N 3.4Å; P217-S220 PolarHBondContact O-OG 2.81Å; S220-L223 WeakPolarHBondContact O-CB 3.3Å; S220-L223 PolarHBondContact O-N 2.85Å; S220-N224 WeakPolarHBondContact O-CB 3.42Å; S220-N224 PolarHBondContact O-N 3.34Å; S220-N224 PolarHBondContact O-ND2 2.87Å
221	E	88.6	Confident	84	Confident	131 Å²	131	69.7 Å²	69.7	61%	0.612	30%	0.296	S	S	*	.	H	α-helix	trans	-66.1	-44.6	174.2	-72.6	166.2	-159.9	0	0	111.7	P217 C219 L223 N224 Y225	P217-E221 PolarHBondContact O-N 2.93Å; C219-E221 VanDerWaalsContact C-N 3.33Å; E221-L223 VanDerWaalsContact C-N 3.32Å; E221-L223 PolarHBondContact O-N 2.97Å; E221-N224 CarbonylContact O-C 3.55Å; E221-N224 PolarHBondContact O-N 2.86Å; E221-Y225 PolarHBondContact O-N 3.21Å; E221-Y225 VanDerWaalsContact O-N 3.09Å
222	K	91.2	Very high	82.6	Confident	75 Å²	75	73.5 Å²	73.5	33%	0.326	32%	0.319	S	S	.	.	H	α-helix	trans	-60	-39.4	174.3	-71	170.2	-171.8	177.2	0	112.4	L152 Y155 P218 C219 N224 Y225	L152-K222 HydrophobicContact CD1-CB 4.13Å; Y155-K222 HydrophobicContact CD1-CD 4.41Å; Y155-K222 HydrophobicContact CD1-CG 4.26Å; Y155-K222 HydrophobicContact CD2-CB 3.99Å; Y155-K222 HydrophobicContact CD2-CG 3.97Å; Y155-K222 HydrophobicContact CE1-CD 4.4Å; Y155-K222 HydrophobicContact CE1-CG 4.31Å; Y155-K222 HydrophobicContact CE2-CG 4.04Å; Y155-K222 HydrophobicContact CG-CB 3.97Å; Y155-K222 HydrophobicContact CG-CG 4.08Å; P218-K222 WeakPolarHBondContact O-CD 3.24Å; P218-K222 WeakPolarHBondContact O-CG 3.41Å; P218-K222 PolarHBondContact O-N 2.93Å; C219-K222 PolarHBondContact O-N 2.88Å; K222-N224 PolarHBondContact O-N 2.67Å; K222-Y225 WeakPolarHBondContact O-CB 3.46Å; K222-Y225 PolarHBondContact O-N 3.41Å
223	L	90.2	Very high	81.2	Confident	3 Å²	3	72.3 Å²	72.3	2%	0.016	32%	0.321	C	S	.	.	H	α-helix	trans	-61.6	-27.5	175	-173.2	72.1	0	0	0	112.7	I150 L152 W194 V196 L215 C219 S220 E221 R229	I150-L223 HydrophobicContact CD1-CD1 3.66Å; L152-L223 HydrophobicContact CD2-CD1 4.26Å; W194-L223 HydrophobicContact CB-CD2 3.96Å; W194-L223 HydrophobicContact CD2-CD2 3.91Å; W194-L223 HydrophobicContact CE3-CD2 4.18Å; W194-L223 HydrophobicContact CG-CD2 3.77Å; V196-L223 HydrophobicContact CG2-CD1 4.4Å; V196-L223 HydrophobicContact CG2-CD2 3.97Å; L215-L223 HydrophobicContact CD1-CB 4.11Å; L215-L223 HydrophobicContact CD1-CD2 3.89Å; L215-L223 HydrophobicContact CD1-CG 4.4Å; C219-L223 PolarHBondContact O-N 2.84Å; S220-L223 WeakPolarHBondContact O-CB 3.3Å; S220-L223 PolarHBondContact O-N 2.85Å; E221-L223 VanDerWaalsContact C-N 3.32Å; E221-L223 PolarHBondContact O-N 2.97Å; L223-R229 PolarHBondContact O-NH1 3.21Å
224	N	85.8	Confident	79.5	Confident	26 Å²	26	74.4 Å²	74.4	14%	0.139	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	10.3	-173.5	-72.3	-56.8	0	0	0	114.1	W194 S220 E221 K222 R226 Y227 R229	W194-N224 WeakPolarHBondContact CH2-ND2 3.38Å; W194-N224 VanDerWaalsContact CZ3-ND2 3.26Å; W194-N224 WeakPolarHBondContact CZ3-ND2 3.49Å; S220-N224 WeakPolarHBondContact O-CB 3.42Å; S220-N224 PolarHBondContact O-N 3.34Å; S220-N224 PolarHBondContact O-ND2 2.87Å; E221-N224 CarbonylContact O-C 3.55Å; E221-N224 PolarHBondContact O-N 2.86Å; K222-N224 PolarHBondContact O-N 2.67Å; N224-R226 VanDerWaalsContact C-N 3.32Å; N224-R226 PolarHBondContact O-N 3.13Å; N224-R226 VanDerWaalsContact O-N 3.07Å; N224-Y227 CarbonylContact C-O 3.48Å; N224-Y227 VanDerWaalsContact CA-O 3.3Å; N224-Y227 WeakPolarHBondContact CA-O 3.05Å; N224-Y227 CarbonylContact O-C 3.59Å; N224-Y227 PolarHBondContact O-N 3Å; N224-Y227 VanDerWaalsContact O-N 3.11Å; N224-Y227 VanDerWaalsContact O-O 3.14Å; N224-Y227 PolarHBondContact OD1-O 3.35Å; N224-R229 WeakPolarHBondContact OD1-CA 3.39Å; N224-R229 WeakPolarHBondContact OD1-CB 3.38Å; N224-R229 PolarHBondContact OD1-N 3.47Å
225	Y	84.9	Confident	77.5	Confident	121 Å²	121	79 Å²	79	48%	0.475	36%	0.364	S	S	.	.	S	Bend	trans	-52.7	-37	-162.5	177	-115.1	0	0	0	116.2	Y155 K156 E221 K222	Y155-Y225 HydrophobicContact CD2-CD1 4.06Å; Y155-Y225 HydrophobicContact CD2-CD2 4.13Å; Y155-Y225 AromaticContact CD2-CG 3.74Å; Y155-Y225 HydrophobicContact CD2-CG 3.74Å; Y155-Y225 HydrophobicContact CE2-CD1 4.31Å; Y155-Y225 AromaticContact CE2-CD2 3.85Å; Y155-Y225 HydrophobicContact CE2-CD2 3.85Å; Y155-Y225 HydrophobicContact CE2-CE2 4.18Å; Y155-Y225 AromaticContact CE2-CG 3.93Å; Y155-Y225 HydrophobicContact CE2-CG 3.93Å; K156-Y225 HydrophobicContact CB-CE1 4.15Å; K156-Y225 HydrophobicContact CG-CE1 4.1Å; E221-Y225 PolarHBondContact O-N 3.21Å; E221-Y225 VanDerWaalsContact O-N 3.09Å; K222-Y225 WeakPolarHBondContact O-CB 3.46Å; K222-Y225 PolarHBondContact O-N 3.41Å
226	R	73.1	Confident	75.4	Confident	157 Å²	157	87.6 Å²	87.6	59%	0.592	40%	0.404	S	S	*	.	S	Bend	trans	-109.6	-19.2	172.5	-59.8	-166.7	-170.8	-159	1.7	114.6	K156 N224	K156-R226 PolarHBondContact O-NE 3.35Å; K156-R226 PolarHBondContact O-NH2 3.21Å; N224-R226 VanDerWaalsContact C-N 3.32Å; N224-R226 PolarHBondContact O-N 3.13Å; N224-R226 VanDerWaalsContact O-N 3.07Å
227	Y	66.6	Low	73.4	Confident	145 Å²	145	95.3 Å²	95.3	57%	0.569	45%	0.445	S	S	*	.	S	Bend	trans	-142.2	123.1	-173.1	-57.7	-63.3	0	0	0	109.7	N158 N224 R229	N158-Y227 VanDerWaalsContact ND2-CE2 3.26Å; N158-Y227 WeakPolarHBondContact ND2-CE2 3.4Å; N224-Y227 CarbonylContact C-O 3.48Å; N224-Y227 VanDerWaalsContact CA-O 3.3Å; N224-Y227 WeakPolarHBondContact CA-O 3.05Å; N224-Y227 CarbonylContact O-C 3.59Å; N224-Y227 PolarHBondContact O-N 3Å; N224-Y227 VanDerWaalsContact O-N 3.11Å; N224-Y227 VanDerWaalsContact O-O 3.14Å; N224-Y227 PolarHBondContact OD1-O 3.35Å; Y227-R229 PolarHBondContact O-N 3.44Å
228	R	63	Low	71	Confident	246 Å²	246	101.2 Å²	101.2	93%	0.928	47%	0.474	S	S	*	.			trans	-70.1	92.7	173.5	-68.3	-176.7	176.2	-169.9	-1.6	110
229	R	65.1	Low	68.6	Low	86 Å²	86	103.6 Å²	103.6	33%	0.325	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-63.3	156.2	163.1	-57.1	175.1	163.8	153.7	-8.8	108.2	F160 L223 N224 Y227	F160-R229 VanDerWaalsContact CE2-NH1 3.29Å; L223-R229 PolarHBondContact O-NH1 3.21Å; N224-R229 WeakPolarHBondContact OD1-CA 3.39Å; N224-R229 WeakPolarHBondContact OD1-CB 3.38Å; N224-R229 PolarHBondContact OD1-N 3.47Å; Y227-R229 PolarHBondContact O-N 3.44Å
230	R	62.5	Low	66.3	Low	163 Å²	163	112.9 Å²	112.9	62%	0.615	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-81.1	124.7	-177.9	-67.1	179.6	-177.9	164.6	6.6	109.6	W301	R230-W301 PolarHBondContact NH2-O 3.02Å
231	D	66.8	Low	64	Low	24 Å²	24	121.8 Å²	121.8	13%	0.128	58%	0.575	C	S	.	*	B	Isolated β-bridge	trans	-69.6	128.8	166.2	-170.9	-23.8	0	0	0	108.5	R192 W194 T233 G234	R192-D231 WeakPolarHBondContact CD-OD2 3.29Å; R192-D231 IonicContact CZ-OD2 2.7Å; R192-D231 IonicContact NE-OD2 2.64Å; R192-D231 IonicContact NH1-OD2 2.64Å; R192-D231 PolarHBondContact NH1-OD2 3.4Å; W194-D231 HydrophobicContact CE3-CB 4.44Å; W194-D231 HydrophobicContact CH2-CB 3.56Å; W194-D231 HydrophobicContact CZ2-CB 4.05Å; W194-D231 HydrophobicContact CZ3-CB 3.78Å; D231-T233 WeakPolarHBondContact OD1-CA 3.44Å; D231-T233 WeakPolarHBondContact OD1-CB 3.37Å; D231-T233 PolarHBondContact OD1-N 2.81Å; D231-G234 PolarHBondContact OD1-N 3.06Å
232	V	66	Low	61.4	Low	82 Å²	82	119.4 Å²	119.4	50%	0.497	59%	0.586	S	S	.	*	S	Bend	trans	-80.8	-30	178.9	-172.9	0	0	0	0	110.5	S193 E195	S193-V232 PolarHBondContact O-N 3.34Å; E195-V232 HydrophobicContact CB-CG2 4.04Å; E195-V232 HydrophobicContact CG-CG2 4.03Å
233	T	65.5	Low	58.7	Low	85 Å²	85	123.1 Å²	123.1	52%	0.521	60%	0.604	S	S	.	*	S	Bend	trans	-79.9	-18.9	177.2	-42.9	0	0	0	0	112.4	S193 D231 K235	S193-T233 PolarHBondContact N-OG1 3.04Å; D231-T233 WeakPolarHBondContact OD1-CA 3.44Å; D231-T233 WeakPolarHBondContact OD1-CB 3.37Å; D231-T233 PolarHBondContact OD1-N 2.81Å; T233-K235 PolarHBondContact O-N 3.46Å
234	G	57.3	Low	56.3	Low	46 Å²	46	131 Å²	131	47%	0.474	65%	0.646	S	S	.	*	S	Bend	trans	-81.4	11	-165.1	0	0	0	0	0	118.8	D231	D231-G234 PolarHBondContact OD1-N 3.06Å
235	K	51.9	Low	54.1	Low	150 Å²	150	137.7 Å²	137.7	65%	0.652	68%	0.677	S	S	*	*	S	Bend	trans	-129.2	54.3	-166.6	-69.9	-167.6	172.8	-167.6	0	116.4	T233	T233-K235 PolarHBondContact O-N 3.46Å
236	Q	48.5	Very low	51.8	Low	180 Å²	180	137.3 Å²	137.3	84%	0.841	69%	0.69	S	S	*	*	S	Bend	trans	-141	-15.5	168.4	-77.6	-59.9	-37.8	0	0	116.5
237	L	50	Low	50.3	Low	164 Å²	164	136.8 Å²	136.8	86%	0.859	70%	0.698	S	S	*	*	S	Bend	trans	-105.7	-18.1	-162.3	-70.8	170.8	0	0	0	117.8
238	N	41.1	Very low	48.9	Very low	166 Å²	166	135.5 Å²	135.5	89%	0.888	71%	0.705	S	S	*	*	S	Bend	trans	-122.7	68.6	-175	-72	16.1	0	0	0	112.4
239	S	39.9	Very low	47.6	Very low	111 Å²	111	131 Å²	131	78%	0.776	70%	0.7	S	S	*	*			trans	-141.4	13.5	174.3	-163.6	0	0	0	0	114.8
240	H	43.1	Very low	46.5	Very low	198 Å²	198	135.5 Å²	135.5	92%	0.917	72%	0.724	S	S	*	*			trans	-114.4	41.2	177.3	-91.4	-76	0	0	0	112.5
241	Q	43.1	Very low	45.5	Very low	199 Å²	199	135.7 Å²	135.7	93%	0.93	73%	0.732	S	S	*	*			trans	-126.3	101.9	164.7	-75.8	-178.3	-26.7	0	0	107.1
242	G	33.4	Very low	44.2	Very low	81 Å²	81	142.9 Å²	142.9	84%	0.835	77%	0.765	S	S	*	*	S	Bend	trans	162.3	1.1	-175.1	0	0	0	0	0	117.9
243	H	36.1	Very low	42.8	Very low	152 Å²	152	144.7 Å²	144.7	70%	0.704	78%	0.776	S	S	*	*			trans	-156.6	104.9	168.2	-157.4	-70.6	0	0	0	111.6	E245	H243-E245 IonicContact CE1-OE2 2.76Å
244	D	38.7	Very low	41.4	Very low	169 Å²	169	147.3 Å²	147.3	90%	0.904	79%	0.787	S	S	*	*			trans	-157.7	126.4	155	-98.1	-37.2	0	0	0	107.8
245	E	40.2	Very low	40.5	Very low	167 Å²	167	152.9 Å²	152.9	78%	0.78	81%	0.806	S	S	*	*			trans	-95.9	131.7	-176.6	-63	165.9	87.1	0	0	110.4	H243	H243-E245 IonicContact CE1-OE2 2.76Å
246	C	36.3	Very low	39.9	Very low	112 Å²	112	152.5 Å²	152.5	76%	0.757	81%	0.811	S	S	*	*			trans	-159.8	108.5	146.6	-146.4	0	0	0	0	113.4
247	I	41	Very low	39.5	Very low	146 Å²	146	151.1 Å²	151.1	75%	0.749	81%	0.81	S	S	*	*				26	116.4	124.9	-44.2	171.9	0	0	0	114.2
248	T	36.8	Very low	39.4	Very low	119 Å²	119	148.6 Å²	148.6	73%	0.73	80%	0.797	S	S	*	*				-165.7	177.5	63.4	-28.7	0	0	0	0	111.8
249	N	36.8	Very low	39.8	Very low	152 Å²	152	148.2 Å²	148.2	81%	0.813	79%	0.787	S	S	*	*			trans	90.6	93.5	164.5	-59.1	-8.4	0	0	0	116.4
250	Q	41.8	Very low	39.8	Very low	179 Å²	179	149.8 Å²	149.8	84%	0.836	79%	0.787	S	S	*	*			trans	-73.7	-178.8	159.1	-58.7	164.7	3	0	0	110
251	Q	41.9	Very low	40	Very low	167 Å²	167	146.6 Å²	146.6	78%	0.78	78%	0.775	S	S	*	*			trans	71.1	142.5	171.9	-61.1	178	-29.1	0	0	116.5
252	E	39.9	Very low	40	Very low	176 Å²	176	145.3 Å²	145.3	82%	0.822	77%	0.769	S	S	*	*			cis	-156.2	164.7	-34.5	-135.2	152.9	-134	0	0	108.6
253	T	36.6	Very low	40.5	Very low	119 Å²	119	146.6 Å²	146.6	73%	0.73	77%	0.765	S	S	*	*			trans	-78.1	130.7	-173.1	51	0	0	0	0	113.3
254	N	34.1	Very low	40.8	Very low	141 Å²	141	144.2 Å²	144.2	75%	0.754	77%	0.766	S	S	*	*			trans	61.8	118.3	153.1	-51.9	-22.3	0	0	0	118
255	N	39.4	Very low	41.1	Very low	163 Å²	163	141.4 Å²	141.4	87%	0.872	76%	0.76	S	S	*	*				-156.7	163.8	114.5	-96.3	-40	0	0	0	110.8
256	N	38.7	Very low	41.1	Very low	141 Å²	141	139.7 Å²	139.7	75%	0.754	76%	0.76	S	S	*	*			trans	-92.4	-169.1	-176.5	-61.9	-60.7	0	0	0	111.7
257	D	41.7	Very low	41.7	Very low	152 Å²	152	139.5 Å²	139.5	81%	0.813	76%	0.76	S	S	*	*			trans	79.2	133.9	168.7	-45.9	-23.5	0	0	0	114
258	D	46.9	Very low	41.8	Very low	110 Å²	110	138.2 Å²	138.2	59%	0.588	76%	0.762	S	S	*	*			cis	-159.1	164.3	-0.7	-143.2	-25	0	0	0	113.1
259	K	49.2	Very low	42.1	Very low	159 Å²	159	137.9 Å²	137.9	69%	0.691	76%	0.764	S	S	*	*			trans	29.9	122.4	160.3	-68.6	135.2	-164.6	157.7	0	121.8
260	N	39.2	Very low	42.6	Very low	143 Å²	143	134.8 Å²	134.8	77%	0.765	75%	0.754	S	S	*	*				-164.7	113.5	110.4	-93.1	-29	0	0	0	110.3
261	I	47.9	Very low	42.7	Very low	132 Å²	132	135.5 Å²	135.5	68%	0.677	76%	0.755	S	S	*	*				75.5	108.5	94.8	-67.3	179.9	0	0	0	114.3
262	E	42.9	Very low	42.6	Very low	172 Å²	172	138.7 Å²	138.7	80%	0.804	76%	0.76	S	S	*	*			trans	26.6	139.7	136.4	-43.9	177.8	122.8	0	0	119
263	S	43.6	Very low	42.8	Very low	107 Å²	107	136.1 Å²	136.1	75%	0.748	76%	0.758	S	S	*	*			cis	-165.5	170.9	34.7	-44.7	0	0	0	0	109.1
264	S	43.2	Very low	42.8	Very low	102 Å²	102	141.7 Å²	141.7	71%	0.713	77%	0.766	S	S	*	*			cis	-176.7	151.7	-23.2	53	0	0	0	0	109.3
265	S	44.7	Very low	43.5	Very low	111 Å²	111	143.4 Å²	143.4	78%	0.776	77%	0.773	S	S	*	*			trans	60.1	156.5	169.1	77.6	0	0	0	0	117.5
266	T	39.8	Very low	43.5	Very low	130 Å²	130	142.2 Å²	142.2	80%	0.798	77%	0.767	S	S	*	*			cis	-144.2	157.1	9.6	-37.9	0	0	0	0	111.6
267	S	48.8	Very low	43.8	Very low	108 Å²	108	141.9 Å²	141.9	76%	0.755	77%	0.765	S	S	*	*			trans	-110.4	-161.5	177.5	-32.1	0	0	0	0	110.7
268	P	43.8	Very low	43.9	Very low	120 Å²	120	140.3 Å²	140.3	78%	0.779	76%	0.761	S	S	*	*			cis	-136	-156.6	-25.1	39.5	-20	0	0	0	112.9
269	S	42.6	Very low	43.8	Very low	111 Å²	111	141.6 Å²	141.6	78%	0.776	77%	0.768	S	S	*	*			trans	75.7	149.2	164.1	-115.1	0	0	0	0	116.2
270	S	47.4	Very low	43.4	Very low	87 Å²	87	140 Å²	140	61%	0.608	77%	0.767	S	S	*	*			cis	-162.7	170.1	5.2	-119.8	0	0	0	0	107.9
271	K	43.5	Very low	43.7	Very low	194 Å²	194	141.4 Å²	141.4	84%	0.843	77%	0.774	S	S	*	*			cis	-159.8	-157.4	4.4	-133.3	160.6	-162.2	176.6	0	111.1
272	R	41.3	Very low	43.3	Very low	235 Å²	235	141.3 Å²	141.3	89%	0.887	78%	0.775	S	S	*	*			trans	-141.1	176.8	169.6	-97.5	-173	-174.8	-170.8	4.1	107.5
273	P	42.8	Very low	43.4	Very low	121 Å²	121	141.1 Å²	141.1	79%	0.786	78%	0.78	S	S	*	*			cis	-149.5	-157.2	35.1	45	-21.8	0	0	0	116.9
274	R	37.8	Very low	43.1	Very low	237 Å²	237	142.3 Å²	142.3	89%	0.894	78%	0.778	S	S	*	*			trans	-90.1	165.5	169.8	-59.8	172.9	177.4	162.6	-4.5	111.4
275	I	48.3	Very low	43.2	Very low	176 Å²	176	144 Å²	144	90%	0.903	78%	0.783	S	S	*	*			trans	-130.8	161.7	159.1	-66.4	-177.4	0	0	0	107.6
276	D	39.7	Very low	42.9	Very low	139 Å²	139	147.5 Å²	147.5	74%	0.743	79%	0.785	S	S	*	*			trans	-125.8	-167.6	-158.6	-141.6	-31.8	0	0	0	112.9
277	D	44	Very low	42.7	Very low	133 Å²	133	147.3 Å²	147.3	71%	0.711	79%	0.786	S	S	*	*			trans	81.2	121	151.5	-69.6	-44.4	0	0	0	122.2
278	T	45.1	Very low	42.1	Very low	119 Å²	119	150.2 Å²	150.2	73%	0.73	79%	0.792	S	S	*	*			trans	50.6	156.1	146.4	25.4	0	0	0	0	121.4
279	D	43.8	Very low	41.6	Very low	137 Å²	137	149.7 Å²	149.7	73%	0.733	79%	0.791	S	S	*	*			cis	-147.8	-179.9	25.2	-144.4	-28.5	0	0	0	114.8
280	N	40.8	Very low	41.4	Very low	126 Å²	126	149.7 Å²	149.7	67%	0.674	79%	0.791	S	S	*	*			trans	-77.5	154.2	-173.7	-62.8	-94.2	0	0	0	113.7
281	N	46.1	Very low	40.9	Very low	172 Å²	172	155 Å²	155	92%	0.92	81%	0.806	S	S	*	*				-160.7	162.8	108.9	-108.3	-63	0	0	0	113.5
282	N	38.6	Very low	40.7	Very low	130 Å²	130	154.7 Å²	154.7	70%	0.695	81%	0.808	S	S	*	*			trans	-123.4	129.6	-166.4	171.9	30.9	0	0	0	110
283	D	45.2	Very low	40.6	Very low	168 Å²	168	153.1 Å²	153.1	90%	0.898	81%	0.807	S	S	*	*			trans	-142.6	140.8	169.9	-118.1	-38.9	0	0	0	111.3
284	N	37.5	Very low	40.4	Very low	133 Å²	133	153.4 Å²	153.4	71%	0.711	81%	0.812	S	S	*	*			trans	-135.6	102.8	-143.7	-176	1.4	0	0	0	112.8
285	V	44.6	Very low	40.8	Very low	136 Å²	136	145.6 Å²	145.6	82%	0.824	80%	0.799	S	S	*	*			trans	-132.4	126.4	178.4	-174.6	0	0	0	0	111.3
286	K	40	Very low	40.4	Very low	186 Å²	186	142.4 Å²	142.4	81%	0.809	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-60.9	135.7	-178.7	-67.8	173.8	174	175.9	0	113.6
287	P	35.5	Very low	40.5	Very low	126 Å²	126	142.7 Å²	142.7	82%	0.818	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-81.3	139	143.7	-1.8	21.1	0	0	0	109.6
288	L	35.2	Very low	40.7	Very low	168 Å²	168	141.6 Å²	141.6	88%	0.88	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-86	143.2	170.5	-158.9	71.5	0	0	0	110
289	S	33.8	Very low	40.4	Very low	110 Å²	110	139.4 Å²	139.4	77%	0.769	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-84.3	125	-170.1	53.3	0	0	0	0	114.1
290	S	38.4	Very low	40.1	Very low	111 Å²	111	137.8 Å²	137.8	78%	0.776	76%	0.762	S	S	*	*			trans	-140.9	97.8	156	61.5	0	0	0	0	108.9	E292	S290-E292 PolarHBondContact O-N 3.36Å
291	E	36.5	Very low	40.1	Very low	197 Å²	197	140.9 Å²	140.9	92%	0.921	77%	0.765	S	S	*	*			trans	-82.1	100	-177.7	-64.7	-175.5	117.4	0	0	111.3
292	E	40.4	Very low	39.4	Very low	188 Å²	188	137.9 Å²	137.9	88%	0.879	76%	0.756	S	S	*	*			trans	-112	128	162.3	-68.7	-159.8	156.3	0	0	110.9	S290 S294	S290-E292 PolarHBondContact O-N 3.36Å; E292-S294 PolarHBondContact O-N 3.45Å
293	K	38.4	Very low	39.2	Very low	202 Å²	202	137.4 Å²	137.4	88%	0.878	76%	0.761	S	S	*	*			trans	-64.7	121.5	-168.8	-71.6	166.8	177.5	167.7	0	111.3	A295	K293-A295 PolarHBondContact O-N 3.26Å
294	S	39.8	Very low	38.8	Very low	127 Å²	127	138.1 Å²	138.1	89%	0.888	76%	0.759	S	S	*	*			trans	-72.6	59.8	166.4	46.8	0	0	0	0	111.8	E292 D296	E292-S294 PolarHBondContact O-N 3.45Å; S294-D296 PolarHBondContact O-N 2.94Å
295	A	46.2	Very low	38.5	Very low	74 Å²	74	138.2 Å²	138.2	61%	0.612	77%	0.771	S	S	*	*			trans	-72.3	82.1	-176.5	0	0	0	0	0	112.6	K293 L297	K293-A295 PolarHBondContact O-N 3.26Å; A295-L297 PolarHBondContact O-N 3.48Å
296	D	39.8	Very low	38.1	Very low	109 Å²	109	134.5 Å²	134.5	58%	0.583	76%	0.76	S	S	*	*			trans	45.6	42.3	145.7	-155.2	13.4	0	0	0	118.5	S294 N298 S299	S294-D296 PolarHBondContact O-N 2.94Å; D296-N298 PolarHBondContact O-N 2.88Å; D296-S299 VanDerWaalsContact O-CB 3.3Å; D296-S299 WeakPolarHBondContact O-CB 3.32Å; D296-S299 PolarHBondContact O-N 3.47Å
297	L	41.4	Very low	38.2	Very low	145 Å²	145	134.1 Å²	134.1	76%	0.759	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-5	177.8	-66.5	175.5	0	0	0	114.8	A295	A295-L297 PolarHBondContact O-N 3.48Å
298	N	47.5	Very low	38.2	Very low	110 Å²	110	134.8 Å²	134.8	59%	0.588	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-17.3	173.7	-75.1	-25.9	0	0	0	113.3	D296 V300 W301	D296-N298 PolarHBondContact O-N 2.88Å; N298-V300 PolarHBondContact O-N 3.49Å; N298-W301 PolarHBondContact O-N 3.04Å
299	S	38.7	Very low	38.3	Very low	72 Å²	72	132.7 Å²	132.7	50%	0.503	76%	0.757	S	S	.	*	G	3₁₀ helix	trans	-58.5	-32.3	-176.6	-166.2	0	0	0	0	113.5	D296 W301 C302	D296-S299 VanDerWaalsContact O-CB 3.3Å; D296-S299 WeakPolarHBondContact O-CB 3.32Å; D296-S299 PolarHBondContact O-N 3.47Å; S299-W301 PolarHBondContact O-N 3.03Å; S299-C302 PolarHBondContact O-N 2.91Å; S299-C302 VanDerWaalsContact O-N 3.16Å
300	V	38.7	Very low	38.3	Very low	103 Å²	103	133.1 Å²	133.1	62%	0.624	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-55.7	-25.3	-178.1	-175.9	0	0	0	0	113.7	N298	N298-V300 PolarHBondContact O-N 3.49Å
301	W	39.2	Very low	38.5	Very low	192 Å²	192	137.9 Å²	137.9	73%	0.727	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-94.3	9.6	-175.2	-65.4	89.7	0	0	0	114.9	R230 N298 S299	R230-W301 PolarHBondContact NH2-O 3.02Å; N298-W301 PolarHBondContact O-N 3.04Å; S299-W301 PolarHBondContact O-N 3.03Å
302	C	32	Very low	38.4	Very low	109 Å²	109	137.8 Å²	137.8	74%	0.736	76%	0.764	S	S	*	*			trans	-104.5	36.4	175.7	-83.5	0	0	0	0	113.5	S299 Q304	S299-C302 PolarHBondContact O-N 2.91Å; S299-C302 VanDerWaalsContact O-N 3.16Å; C302-Q304 PolarHBondContact O-N 2.85Å
303	C	33.7	Very low	38.2	Very low	119 Å²	119	133.8 Å²	133.8	80%	0.804	76%	0.756	S	S	*	*			trans	-67.8	96.8	172.1	-70.1	0	0	0	0	111.7
304	Q	37.7	Very low	38	Very low	183 Å²	183	130.6 Å²	130.6	86%	0.855	75%	0.754	S	S	*	*			trans	-5	119.9	160.2	-61	169	7.1	0	0	116.5	C302 G306	C302-Q304 PolarHBondContact O-N 2.85Å; Q304-G306 PolarHBondContact O-N 3.29Å
305	S	31.9	Very low	37.7	Very low	136 Å²	136	128.8 Å²	128.8	95%	0.951	75%	0.746	S	S	*	*			trans	-71.3	89.2	163.4	52.5	0	0	0	0	110.2
306	G	36.4	Very low	37.1	Very low	58 Å²	58	130.3 Å²	130.3	60%	0.598	75%	0.749	S	S	*	*			trans	-137.3	91	-171.8	0	0	0	0	0	114.3	Q304	Q304-G306 PolarHBondContact O-N 3.29Å
307	Q	42.1	Very low	36.9	Very low	177 Å²	177	130.2 Å²	130.2	83%	0.827	76%	0.756	S	S	*	*			trans	60.6	126.2	153.5	-55.7	-175	11.6	0	0	120.1
308	N	34.8	Very low	36.8	Very low	140 Å²	140	133.3 Å²	133.3	75%	0.749	76%	0.759	S	S	*	*			trans	60	108.6	142.7	-53.2	-16	0	0	0	120.1
309	S	37.2	Very low	36.1	Very low	125 Å²	125	132.7 Å²	132.7	87%	0.874	77%	0.769	S	S	*	*				-174	125.6	112.2	-82.7	0	0	0	0	112.6
310	S	34	Very low	35.9	Very low	119 Å²	119	133.3 Å²	133.3	83%	0.832	79%	0.787	S	S	*	*			trans	-79.3	137.7	-176.3	-50.6	0	0	0	0	113.4
311	K	41.1	Very low	35.9	Very low	210 Å²	210	132.1 Å²	132.1	91%	0.913	80%	0.795	S	S	*	*			trans	-158.2	129.4	154.4	-104.5	146.8	-171.6	177.2	0	111.4
312	K	34.8	Very low	36.3	Very low	196 Å²	196	129.5 Å²	129.5	85%	0.852	80%	0.801	S	S	*	*			trans	-73.2	166.7	159.4	-52.1	176.3	-179.9	179.4	0	108
313	S	36.6	Very low	37.3	Very low	104 Å²	104	132.1 Å²	132.1	73%	0.727	81%	0.806	S	S	*	*			cis	-139.3	179.5	10.3	-52	0	0	0	0	108.2
314	T	34.9	Very low	38.8	Very low	134 Å²	134	131.5 Å²	131.5	82%	0.822	79%	0.789	S	S	*	*			cis	-146.9	162.6	11.9	-50.2	0	0	0	0	108.7
315	A	33	Very low	40.6	Very low	89 Å²	89	126.7 Å²	126.7	74%	0.736	77%	0.773	S	S	*	*			trans	-124.5	125.3	166.6	0	0	0	0	0	110.6	S317	A315-S317 PolarHBondContact O-N 3.45Å
316	T	33.2	Very low	42.5	Very low	107 Å²	107	125 Å²	125	66%	0.656	75%	0.75	S	S	*	*			trans	-83.4	106.3	171.8	-57.2	0	0	0	0	108.9	Y318	T316-Y318 HydrophobicContact CG2-CD2 4.39Å; T316-Y318 HydrophobicContact CG2-CE1 4.25Å; T316-Y318 HydrophobicContact CG2-CE2 3.78Å; T316-Y318 PolarHBondContact O-N 3.01Å
317	S	35.5	Very low	44.5	Very low	106 Å²	106	123.8 Å²	123.8	74%	0.741	74%	0.738	S	S	*	*			trans	-84.1	100.7	179.4	55.8	0	0	0	0	111.4	A315 A319	A315-S317 PolarHBondContact O-N 3.45Å; S317-A319 PolarHBondContact O-N 3.37Å; S317-A319 VanDerWaalsContact O-N 3.16Å
318	Y	39	Very low	46.3	Very low	211 Å²	211	119 Å²	119	83%	0.827	72%	0.717	S	S	*	*			trans	-75.8	96.5	164.2	-60.9	-77.9	0	0	0	108.9	T316	T316-Y318 HydrophobicContact CG2-CD2 4.39Å; T316-Y318 HydrophobicContact CG2-CE1 4.25Å; T316-Y318 HydrophobicContact CG2-CE2 3.78Å; T316-Y318 PolarHBondContact O-N 3.01Å
319	A	33.2	Very low	48.5	Very low	97 Å²	97	116.6 Å²	116.6	80%	0.802	70%	0.702	S	S	*	*			trans	-85.7	131.3	177.9	0	0	0	0	0	110.6	S317	S317-A319 PolarHBondContact O-N 3.37Å; S317-A319 VanDerWaalsContact O-N 3.16Å
320	G	34.7	Very low	50.5	Low	84 Å²	84	113.7 Å²	113.7	87%	0.866	67%	0.674	S	S	*	*			trans	94.5	101.4	-179.5	0	0	0	0	0	112.6
321	G	39	Very low	52.7	Low	78 Å²	78	113.5 Å²	113.5	80%	0.804	66%	0.663	S	S	*	*			trans	-152.5	113.3	172.7	0	0	0	0	0	109.5
322	T	47.8	Very low	54.8	Low	138 Å²	138	108.3 Å²	108.3	85%	0.847	64%	0.642	S	S	*	*			trans	-61.5	157.7	173.2	-23.5	0	0	0	0	109.9	K324	T322-K324 PolarHBondContact O-N 3.42Å
323	I	53.7	Low	56.9	Low	163 Å²	163	100.7 Å²	100.7	84%	0.836	61%	0.608	S	S	*	*			trans	-64.6	99.8	172.7	-58.4	172.2	0	0	0	108	T325	I323-T325 PolarHBondContact O-N 3.26Å
324	K	65.3	Low	59	Low	106 Å²	106	99.5 Å²	99.5	46%	0.461	59%	0.59	S	S	.	*			trans	-56.4	126.4	171	-75.7	-177.8	170.4	178.3	0	108.7	T322 D328 E332	T322-K324 PolarHBondContact O-N 3.42Å; K324-D328 HydrophobicContact CB-CB 4.13Å; K324-D328 HydrophobicContact CG-CB 4.21Å; K324-E332 IonicContact NZ-OE1 3.4Å; K324-E332 PolarHBondContact NZ-OE1 3.31Å; K324-E332 IonicContact NZ-OE2 3.98Å; K324-E332 PolarHBondContact NZ-OE2 3.26Å
325	T	74.5	Confident	61.2	Low	83 Å²	83	95.4 Å²	95.4	51%	0.509	57%	0.57	S	S	.	*			trans	-76.3	167.3	169.4	74.2	0	0	0	0	109.4	I323 G327 D328 E329	I323-T325 PolarHBondContact O-N 3.26Å; T325-G327 PolarHBondContact O-N 3.11Å; T325-G327 PolarHBondContact OG1-N 3.07Å; T325-D328 WeakPolarHBondContact CA-OD2 3.48Å; T325-D328 VanDerWaalsContact CB-OD2 3.26Å; T325-D328 WeakPolarHBondContact CB-OD2 3.46Å; T325-D328 PolarHBondContact N-OD2 3.34Å; T325-D328 PolarHBondContact O-N 2.89Å; T325-D328 VanDerWaalsContact O-N 3.13Å; T325-D328 PolarHBondContact OG1-N 3.43Å; T325-D328 PolarHBondContact OG1-OD2 3.07Å; T325-E329 PolarHBondContact O-N 3.25Å
326	Q	72.2	Confident	63.4	Low	100 Å²	100	97.3 Å²	97.3	47%	0.467	57%	0.568	S	S	.	*	H	α-helix	trans	-58.8	-29.5	174.9	-169.7	-178.2	-6.6	0	0	112.1	E329 F330	Q326-E329 PolarHBondContact O-N 2.96Å; Q326-F330 HydrophobicContact CG-CD2 4.12Å; Q326-F330 HydrophobicContact CG-CE2 3.93Å; Q326-F330 WeakPolarHBondContact O-CD2 3.33Å; Q326-F330 PolarHBondContact O-N 3.46Å; Q326-F330 VanDerWaalsContact O-N 3.12Å
327	G	77.4	Confident	65.2	Low	33 Å²	33	95.8 Å²	95.8	34%	0.34	55%	0.554	S	S	.	*	H	α-helix	trans	-66	-44.1	175.3	0	0	0	0	0	112.4	T325 E329 F330 D331	T325-G327 PolarHBondContact O-N 3.11Å; T325-G327 PolarHBondContact OG1-N 3.07Å; G327-E329 VanDerWaalsContact C-N 3.27Å; G327-E329 PolarHBondContact O-N 3.02Å; G327-F330 WeakPolarHBondContact O-CA 3.3Å; G327-F330 WeakPolarHBondContact O-CB 3.49Å; G327-F330 PolarHBondContact O-N 2.95Å; G327-D331 PolarHBondContact O-N 3.38Å
328	D	79.9	Confident	66.5	Low	75 Å²	75	97.8 Å²	97.8	40%	0.401	56%	0.556	S	S	.	*	H	α-helix	trans	-63.1	-34.8	177.4	-49.6	-71.3	0	0	0	111.6	K324 T325 E332	K324-D328 HydrophobicContact CB-CB 4.13Å; K324-D328 HydrophobicContact CG-CB 4.21Å; T325-D328 WeakPolarHBondContact CA-OD2 3.48Å; T325-D328 VanDerWaalsContact CB-OD2 3.26Å; T325-D328 WeakPolarHBondContact CB-OD2 3.46Å; T325-D328 PolarHBondContact N-OD2 3.34Å; T325-D328 PolarHBondContact O-N 2.89Å; T325-D328 VanDerWaalsContact O-N 3.13Å; T325-D328 PolarHBondContact OG1-N 3.43Å; T325-D328 PolarHBondContact OG1-OD2 3.07Å; D328-E332 VanDerWaalsContact O-CB 3.28Å; D328-E332 WeakPolarHBondContact O-CB 3.4Å; D328-E332 PolarHBondContact O-N 3.42Å; D328-E332 VanDerWaalsContact O-N 3.12Å
329	E	80.6	Confident	67.2	Low	90 Å²	90	98 Å²	98	42%	0.421	57%	0.567	S	S	.	*	H	α-helix	trans	-69.1	-28.5	171.7	-66.7	-170.4	172.8	0	0	113.5	T325 Q326 G327 Y333	T325-E329 PolarHBondContact O-N 3.25Å; Q326-E329 PolarHBondContact O-N 2.96Å; G327-E329 VanDerWaalsContact C-N 3.27Å; G327-E329 PolarHBondContact O-N 3.02Å; E329-Y333 WeakPolarHBondContact O-CB 3.32Å; E329-Y333 PolarHBondContact O-N 2.91Å
330	F	80.5	Confident	68.9	Low	65 Å²	65	98.1 Å²	98.1	29%	0.285	56%	0.555	S	S	.	*	H	α-helix	trans	-72.7	-49.2	173.5	-89.4	-73.9	0	0	0	110.8	F177 Q326 G327 Y333 F334	F177-F330 HydrophobicContact CB-CE1 4.17Å; F177-F330 HydrophobicContact CB-CZ 3.72Å; F177-F330 HydrophobicContact CD1-CD1 4.31Å; F177-F330 HydrophobicContact CD1-CD2 4.28Å; F177-F330 AromaticContact CD1-CE1 3.89Å; F177-F330 HydrophobicContact CD1-CE1 3.89Å; F177-F330 AromaticContact CD1-CE2 3.83Å; F177-F330 HydrophobicContact CD1-CE2 3.83Å; F177-F330 HydrophobicContact CD1-CG 4.5Å; F177-F330 AromaticContact CD1-CZ 3.62Å; F177-F330 HydrophobicContact CD1-CZ 3.62Å; F177-F330 AromaticContact CD2-CD1 3.82Å; F177-F330 HydrophobicContact CD2-CD1 3.82Å; F177-F330 AromaticContact CD2-CE1 3.18Å; F177-F330 HydrophobicContact CD2-CE1 3.18Å; F177-F330 AromaticContact CD2-CZ 3.63Å; F177-F330 HydrophobicContact CD2-CZ 3.63Å; F177-F330 AromaticContact CE1-CD1 3.94Å; F177-F330 HydrophobicContact CE1-CD1 3.94Å; F177-F330 HydrophobicContact CE1-CD2 4.07Å; F177-F330 AromaticContact CE1-CE1 4Å; F177-F330 HydrophobicContact CE1-CE1 4Å; F177-F330 HydrophobicContact CE1-CE2 4.1Å; F177-F330 AromaticContact CE1-CG 3.98Å; F177-F330 HydrophobicContact CE1-CG 3.98Å; F177-F330 HydrophobicContact CE1-CZ 4.06Å; F177-F330 AromaticContact CE2-CD1 3.4Å; F177-F330 HydrophobicContact CE2-CD1 3.4Å; F177-F330 VanDerWaalsContact CE2-CD1 3.4Å; F177-F330 AromaticContact CE2-CE1 3.32Å; F177-F330 HydrophobicContact CE2-CE1 3.32Å; F177-F330 HydrophobicContact CE2-CG 4.24Å; F177-F330 HydrophobicContact CE2-CZ 4.08Å; F177-F330 HydrophobicContact CG-CD1 4.24Å; F177-F330 AromaticContact CG-CE1 3.48Å; F177-F330 HydrophobicContact CG-CE1 3.48Å; F177-F330 VanDerWaalsContact CG-CE1 3.48Å; F177-F330 HydrophobicContact CG-CE2 4.07Å; F177-F330 AromaticContact CG-CZ 3.37Å; F177-F330 HydrophobicContact CG-CZ 3.37Å; F177-F330 AromaticContact CZ-CD1 3.46Å; F177-F330 HydrophobicContact CZ-CD1 3.46Å; F177-F330 VanDerWaalsContact CZ-CD1 3.46Å; F177-F330 HydrophobicContact CZ-CD2 4.38Å; F177-F330 AromaticContact CZ-CE1 3.72Å; F177-F330 HydrophobicContact CZ-CE1 3.72Å; F177-F330 AromaticContact CZ-CG 3.83Å; F177-F330 HydrophobicContact CZ-CG 3.83Å; F177-F330 HydrophobicContact CZ-CZ 4.27Å; Q326-F330 HydrophobicContact CG-CD2 4.12Å; Q326-F330 HydrophobicContact CG-CE2 3.93Å; Q326-F330 WeakPolarHBondContact O-CD2 3.33Å; Q326-F330 PolarHBondContact O-N 3.46Å; Q326-F330 VanDerWaalsContact O-N 3.12Å; G327-F330 WeakPolarHBondContact O-CA 3.3Å; G327-F330 WeakPolarHBondContact O-CB 3.49Å; G327-F330 PolarHBondContact O-N 2.95Å; F330-Y333 PolarHBondContact O-N 3.31Å; F330-F334 HydrophobicContact CD1-CE2 4.08Å; F330-F334 VanDerWaalsContact O-CD2 3.28Å; F330-F334 WeakPolarHBondContact O-CD2 3.42Å; F330-F334 PolarHBondContact O-N 3.1Å
331	D	80.8	Confident	70.7	Confident	114 Å²	114	98.8 Å²	98.8	61%	0.61	54%	0.539	S	S	*	.	H	α-helix	trans	-69	-38.7	-173.7	-69.6	-19.1	0	0	0	111.7	G327 F334 A335	G327-D331 PolarHBondContact O-N 3.38Å; D331-F334 PolarHBondContact O-N 3.23Å; D331-A335 WeakPolarHBondContact O-CB 3.38Å; D331-A335 PolarHBondContact O-N 3.31Å
332	E	84.7	Confident	72.5	Confident	101 Å²	101	99.9 Å²	99.9	47%	0.472	52%	0.524	S	S	.	.	H	α-helix	trans	-63.1	-41.9	172.5	-172.2	174.1	-121.7	0	0	111.7	K324 D328 A335 D336	K324-E332 IonicContact NZ-OE1 3.4Å; K324-E332 PolarHBondContact NZ-OE1 3.31Å; K324-E332 IonicContact NZ-OE2 3.98Å; K324-E332 PolarHBondContact NZ-OE2 3.26Å; D328-E332 VanDerWaalsContact O-CB 3.28Å; D328-E332 WeakPolarHBondContact O-CB 3.4Å; D328-E332 PolarHBondContact O-N 3.42Å; D328-E332 VanDerWaalsContact O-N 3.12Å; E332-A335 PolarHBondContact O-N 2.85Å; E332-D336 PolarHBondContact O-N 2.85Å; E332-D336 VanDerWaalsContact O-N 3.14Å
333	Y	79.3	Confident	73.9	Confident	37 Å²	37	97.7 Å²	97.7	15%	0.145	51%	0.505	C	S	.	.	H	α-helix	trans	-65	-39.8	175.5	178.6	-103.9	0	0	0	112.8	E146 R165 V170 Q176 E329 F330 M337	E146-Y333 WeakPolarHBondContact OE1-CE2 3.48Å; E146-Y333 PolarHBondContact OE2-OH 3.12Å; R165-Y333 PolarHBondContact NH2-OH 3.48Å; V170-Y333 HydrophobicContact CG1-CE1 4.17Å; V170-Y333 WeakPolarHBondContact CG1-OH 3.35Å; Q176-Y333 VanDerWaalsContact NE2-CG 3.27Å; Q176-Y333 PolarHBondContact OE1-OH 3.02Å; E329-Y333 WeakPolarHBondContact O-CB 3.32Å; E329-Y333 PolarHBondContact O-N 2.91Å; F330-Y333 PolarHBondContact O-N 3.31Å; Y333-M337 HydrophobicContact CE1-SD 4.19Å; Y333-M337 WeakPolarHBondContact O-CB 3.38Å; Y333-M337 PolarHBondContact O-N 3.45Å
334	F	79.6	Confident	75.2	Confident	78 Å²	78	93.6 Å²	93.6	34%	0.342	48%	0.484	S	S	.	.	H	α-helix	trans	-73.1	-30.1	177.2	-82.3	-63.5	0	0	0	112.8	F330 D331 M337 L338	F330-F334 HydrophobicContact CD1-CE2 4.08Å; F330-F334 VanDerWaalsContact O-CD2 3.28Å; F330-F334 WeakPolarHBondContact O-CD2 3.42Å; F330-F334 PolarHBondContact O-N 3.1Å; D331-F334 PolarHBondContact O-N 3.23Å; F334-M337 HydrophobicContact CD1-SD 4.4Å; F334-M337 HydrophobicContact CE1-SD 4.44Å; F334-M337 PolarHBondContact O-N 3.02Å; F334-L338 WeakPolarHBondContact O-CB 3.42Å; F334-L338 PolarHBondContact O-N 2.94Å
335	A	82	Confident	75.9	Confident	49 Å²	49	92.8 Å²	92.8	41%	0.405	49%	0.486	S	S	.	.	H	α-helix	trans	-64.6	-48.9	173	0	0	0	0	0	111.8	D331 E332 M337 L338	D331-A335 WeakPolarHBondContact O-CB 3.38Å; D331-A335 PolarHBondContact O-N 3.31Å; E332-A335 PolarHBondContact O-N 2.85Å; A335-M337 PolarHBondContact O-N 3.3Å; A335-L338 PolarHBondContact O-N 3.45Å; A335-L338 VanDerWaalsContact O-N 3.13Å
336	D	78.8	Confident	75.9	Confident	129 Å²	129	93.5 Å²	93.5	69%	0.69	48%	0.484	S	S	*	.	H	α-helix	trans	-66.5	-15	175.2	-88.2	10.3	0	0	0	113.3	E332	E332-D336 PolarHBondContact O-N 2.85Å; E332-D336 VanDerWaalsContact O-N 3.14Å
337	M	70.7	Confident	76.2	Confident	74 Å²	74	93 Å²	93	37%	0.365	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-8.1	175.7	-162.2	-178.1	-175.4	0	0	113.4	F144 V170 Y333 F334 A335	F144-M337 HydrophobicContact CD1-CE 4.24Å; F144-M337 HydrophobicContact CE1-CE 3.48Å; F144-M337 VanDerWaalsContact CE1-CE 3.48Å; F144-M337 HydrophobicContact CZ-CE 3.89Å; V170-M337 HydrophobicContact CG1-CE 3.89Å; V170-M337 HydrophobicContact CG1-SD 4.27Å; Y333-M337 HydrophobicContact CE1-SD 4.19Å; Y333-M337 WeakPolarHBondContact O-CB 3.38Å; Y333-M337 PolarHBondContact O-N 3.45Å; F334-M337 HydrophobicContact CD1-SD 4.4Å; F334-M337 HydrophobicContact CE1-SD 4.44Å; F334-M337 PolarHBondContact O-N 3.02Å; A335-M337 PolarHBondContact O-N 3.3Å
338	L	63.7	Low	76.1	Confident	149 Å²	149	98 Å²	98	78%	0.78	50%	0.498	S	S	*	.			trans	-116.9	2.5	-174.7	-89.2	161.5	0	0	0	114.3	F334 A335	F334-L338 WeakPolarHBondContact O-CB 3.42Å; F334-L338 PolarHBondContact O-N 2.94Å; A335-L338 PolarHBondContact O-N 3.45Å; A335-L338 VanDerWaalsContact O-N 3.13Å
339	M	53.2	Low	75.8	Confident	215 Å²	215	100.1 Å²	100.1	100%	1.059	51%	0.507	S	S	*	.			trans	-112	0	171	-67.7	-162.2	-67.9	0	0	112.1

Retrieved 339 of 339 residues in 83.1 ms (Link to these results)

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