A0A3Q0KIN3_SCHMA Loading...

DUF155 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KIN3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 415 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	29.7	Very low	28.7	Very low	242 Å²	242	147.8 Å²	147.8	100%	1.192	80%	0.804	S	S	*	*				0	98.2	0	-78.6	173.5	169.1	0	0	107.8
2	K	32.9	Very low	28.3	Very low	210 Å²	210	149.1 Å²	149.1	91%	0.913	81%	0.808	S	S	*	*			trans	-132.2	105	-172.4	-82.1	-177.5	174.8	179.2	0	111
3	T	23.9	Very low	28.1	Very low	120 Å²	120	147 Å²	147	74%	0.736	80%	0.795	S	S	*	*			trans	-48.6	139	151.8	44.9	0	0	0	0	111.1
4	F	27.7	Very low	28	Very low	196 Å²	196	145.1 Å²	145.1	86%	0.86	79%	0.794	S	S	*	*				-175.4	115.2	118.1	-105.2	-78.3	0	0	0	108.6
5	I	26.5	Very low	28.2	Very low	148 Å²	148	147.6 Å²	147.6	76%	0.759	80%	0.795	S	S	*	*			trans	-86.8	151.1	163.5	-58.5	173	0	0	0	106.2
6	T	29.7	Very low	28.3	Very low	115 Å²	115	142.3 Å²	142.3	71%	0.706	79%	0.785	S	S	*	*			trans	119.3	128	149.7	68.4	0	0	0	0	117.2
7	N	29.6	Very low	28.3	Very low	138 Å²	138	140.8 Å²	140.8	74%	0.738	79%	0.787	S	S	*	*			trans	75.9	98.8	141.6	-74.4	-10.9	0	0	0	120.9
8	S	27.9	Very low	28.5	Very low	106 Å²	106	140.2 Å²	140.2	74%	0.741	79%	0.787	S	S	*	*				42	100.5	116	64.7	0	0	0	0	117.8
9	S	32.5	Very low	28.3	Very low	103 Å²	103	143.5 Å²	143.5	72%	0.72	79%	0.786	S	S	*	*			trans	-141.3	80.7	151.1	41.8	0	0	0	0	109	I11	S9-I11 PolarHBondContact O-N 3.34Å; S9-I11 VanDerWaalsContact O-N 3.17Å
10	S	26	Very low	28.2	Very low	111 Å²	111	142.3 Å²	142.3	78%	0.776	79%	0.787	S	S	*	*			trans	-66.1	100.8	162.6	44.5	0	0	0	0	108.9	L12	S10-L12 PolarHBondContact O-N 3.27Å
11	I	29.1	Very low	28.1	Very low	137 Å²	137	144.5 Å²	144.5	70%	0.703	79%	0.785	S	S	*	*			trans	-91	98.6	172.5	-65.4	171.9	0	0	0	107.5	S9 L13	S9-I11 PolarHBondContact O-N 3.34Å; S9-I11 VanDerWaalsContact O-N 3.17Å; I11-L13 HydrophobicContact CG2-CD2 4.45Å; I11-L13 HydrophobicContact CG2-CG 4Å
12	L	24.2	Very low	27.9	Very low	163 Å²	163	138.6 Å²	138.6	85%	0.853	77%	0.767	S	S	*	*			trans	-77.7	108.4	165.3	-88	153.3	0	0	0	108	S10	S10-L12 PolarHBondContact O-N 3.27Å
13	L	26	Very low	27.7	Very low	122 Å²	122	134.9 Å²	134.9	64%	0.639	76%	0.756	S	S	*	*			trans	-96.7	112.4	167.3	-74.7	168.2	0	0	0	108.9	I11 F15	I11-L13 HydrophobicContact CG2-CD2 4.45Å; I11-L13 HydrophobicContact CG2-CG 4Å; L13-F15 HydrophobicContact CB-CD2 4Å; L13-F15 HydrophobicContact CB-CE2 4.09Å; L13-F15 HydrophobicContact CD1-CE2 4.22Å; L13-F15 HydrophobicContact CD2-CE2 3.97Å; L13-F15 HydrophobicContact CG-CE2 4.31Å; L13-F15 PolarHBondContact O-N 2.89Å
14	P	27	Very low	27.8	Very low	121 Å²	121	135 Å²	135	79%	0.786	76%	0.759	S	S	*	*			trans	-88.9	95.1	171.6	33.5	-25.2	0	0	0	107.6
15	F	30.7	Very low	27.7	Very low	182 Å²	182	131.8 Å²	131.8	80%	0.798	75%	0.749	S	S	*	*			trans	-93.3	112.3	170.3	-85	-74.6	0	0	0	110.2	L13	L13-F15 HydrophobicContact CB-CD2 4Å; L13-F15 HydrophobicContact CB-CE2 4.09Å; L13-F15 HydrophobicContact CD1-CE2 4.22Å; L13-F15 HydrophobicContact CD2-CE2 3.97Å; L13-F15 HydrophobicContact CG-CE2 4.31Å; L13-F15 PolarHBondContact O-N 2.89Å
16	G	28.9	Very low	27.4	Very low	62 Å²	62	130.3 Å²	130.3	64%	0.639	75%	0.752	S	S	*	*			trans	-65	158.9	-169.1	0	0	0	0	0	115.1	V18	G16-V18 PolarHBondContact O-N 3.37Å; G16-V18 VanDerWaalsContact O-N 3.13Å
17	S	29.2	Very low	27.2	Very low	118 Å²	118	130.5 Å²	130.5	83%	0.825	75%	0.748	S	S	*	*			trans	-48.6	107.2	168.7	51.5	0	0	0	0	112	R19	S17-R19 PolarHBondContact O-N 3.19Å; S17-R19 VanDerWaalsContact O-N 3.08Å
18	V	30.9	Very low	27	Very low	129 Å²	129	135.3 Å²	135.3	78%	0.782	76%	0.755	S	S	*	*			trans	-73.5	99.4	165.9	-179.9	0	0	0	0	107.4	G16 C20	G16-V18 PolarHBondContact O-N 3.37Å; G16-V18 VanDerWaalsContact O-N 3.13Å; V18-C20 PolarHBondContact O-N 2.89Å; V18-C20 VanDerWaalsContact O-N 3.12Å
19	R	26	Very low	27.1	Very low	204 Å²	204	135.1 Å²	135.1	77%	0.77	75%	0.75	S	S	*	*			trans	-65	101.6	165.9	-106.6	177.3	173.4	170.9	-2	107.7	S17 Y21	S17-R19 PolarHBondContact O-N 3.19Å; S17-R19 VanDerWaalsContact O-N 3.08Å; R19-Y21 PolarHBondContact O-N 2.97Å; R19-Y21 VanDerWaalsContact O-N 3.14Å
20	C	25.4	Very low	26.8	Very low	119 Å²	119	137.2 Å²	137.2	80%	0.804	75%	0.753	S	S	*	*			trans	-71.1	104.4	168.1	-70.9	0	0	0	0	108.9	V18 S22	V18-C20 PolarHBondContact O-N 2.89Å; V18-C20 VanDerWaalsContact O-N 3.12Å; C20-S22 PolarHBondContact O-N 3.48Å
21	Y	26.9	Very low	26.9	Very low	189 Å²	189	137.5 Å²	137.5	74%	0.741	76%	0.755	S	S	*	*			trans	-67.8	113.1	164.9	-74	-90.4	0	0	0	108.6	R19 I23	R19-Y21 PolarHBondContact O-N 2.97Å; R19-Y21 VanDerWaalsContact O-N 3.14Å; Y21-I23 PolarHBondContact O-N 2.97Å
22	S	24.3	Very low	26.8	Very low	118 Å²	118	136.4 Å²	136.4	83%	0.825	76%	0.755	S	S	*	*			trans	-79.9	94.8	165.3	56.5	0	0	0	0	108.5	C20	C20-S22 PolarHBondContact O-N 3.48Å
23	I	28.6	Very low	26.9	Very low	131 Å²	131	134.6 Å²	134.6	67%	0.672	75%	0.751	S	S	*	*			trans	-87.6	122	167.7	-63	171.2	0	0	0	107.2	Y21 I25	Y21-I23 PolarHBondContact O-N 2.97Å; I23-I25 PolarHBondContact O-N 3.21Å
24	P	26.5	Very low	26.9	Very low	122 Å²	122	135.9 Å²	135.9	79%	0.792	76%	0.757	S	S	*	*			trans	-74.9	100.4	179.4	30.1	-30.7	0	0	0	108.5	S26	P24-S26 PolarHBondContact O-N 2.98Å
25	I	25.3	Very low	26.7	Very low	130 Å²	130	138.4 Å²	138.4	67%	0.667	76%	0.755	S	S	*	*			trans	-82.7	103.8	171.9	-88.1	168.9	0	0	0	108	I23 I27	I23-I25 PolarHBondContact O-N 3.21Å; I25-I27 VanDerWaalsContact C-N 3.3Å; I25-I27 HydrophobicContact CG2-CB 4.34Å; I25-I27 HydrophobicContact CG2-CD1 3.25Å; I25-I27 HydrophobicContact CG2-CG1 3.36Å; I25-I27 PolarHBondContact O-N 3.4Å; I25-I27 VanDerWaalsContact O-N 3.07Å
26	S	21.6	Very low	26.3	Very low	117 Å²	117	135.7 Å²	135.7	82%	0.818	75%	0.754	S	S	*	*			trans	-76.4	79.5	170.5	61.5	0	0	0	0	109.3	P24 R28	P24-S26 PolarHBondContact O-N 2.98Å; S26-R28 PolarHBondContact O-N 2.91Å
27	I	25.7	Very low	26.1	Very low	119 Å²	119	141.8 Å²	141.8	61%	0.61	76%	0.759	S	S	*	*			trans	-82.2	99.3	170.9	-74.2	161.1	0	0	0	108.2	I25 T29	I25-I27 VanDerWaalsContact C-N 3.3Å; I25-I27 HydrophobicContact CG2-CB 4.34Å; I25-I27 HydrophobicContact CG2-CD1 3.25Å; I25-I27 HydrophobicContact CG2-CG1 3.36Å; I25-I27 PolarHBondContact O-N 3.4Å; I25-I27 VanDerWaalsContact O-N 3.07Å; I27-T29 VanDerWaalsContact C-N 3.26Å; I27-T29 HydrophobicContact CG2-CG2 3.27Å; I27-T29 PolarHBondContact O-N 3.39Å; I27-T29 VanDerWaalsContact O-N 3.1Å
28	R	23.7	Very low	26.2	Very low	238 Å²	238	139.7 Å²	139.7	90%	0.898	75%	0.745	S	S	*	*			trans	-74.4	80.7	163.5	-172.8	-172.8	-112.9	-154.1	-2.1	107.6	S26	S26-R28 PolarHBondContact O-N 2.91Å
29	T	29.9	Very low	26.3	Very low	103 Å²	103	137.6 Å²	137.6	63%	0.632	74%	0.736	S	S	*	*			trans	-100.4	112.3	169	42.5	0	0	0	0	110.2	I27	I27-T29 VanDerWaalsContact C-N 3.26Å; I27-T29 HydrophobicContact CG2-CG2 3.27Å; I27-T29 PolarHBondContact O-N 3.39Å; I27-T29 VanDerWaalsContact O-N 3.1Å
30	N	27.9	Very low	26.7	Very low	146 Å²	146	129.9 Å²	129.9	78%	0.781	71%	0.713	S	S	*	*			trans	-44.4	133.2	166.7	-69	-31.6	0	0	0	111.8	T32	N30-T32 PolarHBondContact O-N 3.49Å
31	S	26.3	Very low	27	Very low	117 Å²	117	133.2 Å²	133.2	82%	0.818	71%	0.708	S	S	*	*			trans	40.7	68.5	149.3	-170.5	0	0	0	0	116.2
32	T	28.7	Very low	27.1	Very low	115 Å²	115	131.3 Å²	131.3	71%	0.706	71%	0.71	S	S	*	*			trans	-104.2	110.2	154.2	41.2	0	0	0	0	107.9	N30 I34	N30-T32 PolarHBondContact O-N 3.49Å; T32-I34 PolarHBondContact O-N 3.47Å
33	T	25.2	Very low	27.4	Very low	124 Å²	124	129.8 Å²	129.8	76%	0.761	69%	0.692	S	S	*	*			trans	-39.3	104.9	171.7	-41.9	0	0	0	0	109.5	K35	T33-K35 PolarHBondContact O-N 3.02Å
34	I	25.5	Very low	27.5	Very low	149 Å²	149	126.1 Å²	126.1	76%	0.764	67%	0.67	S	S	*	*			trans	-65.1	95.9	168.2	-62.3	173.3	0	0	0	104.3	T32 T36	T32-I34 PolarHBondContact O-N 3.47Å; I34-T36 PolarHBondContact O-N 3.45Å
35	K	22.9	Very low	27.7	Very low	174 Å²	174	130.6 Å²	130.6	76%	0.757	67%	0.671	S	S	*	*			trans	-59.1	99.7	162.1	-75.2	-177.5	176.7	-179.8	0	104.5	T33 Y37	T33-K35 PolarHBondContact O-N 3.02Å; K35-Y37 PolarHBondContact O-N 2.94Å
36	T	23.6	Very low	28.2	Very low	126 Å²	126	131 Å²	131	77%	0.773	68%	0.675	S	S	*	*			trans	-60	90.7	168.7	46.4	0	0	0	0	105.8	I34 S38	I34-T36 PolarHBondContact O-N 3.45Å; T36-S38 PolarHBondContact O-N 3.45Å
37	Y	25.2	Very low	28.8	Very low	189 Å²	189	128 Å²	128	74%	0.741	65%	0.649	S	S	*	*			trans	-50.3	120.5	156.2	-81.8	-86.5	0	0	0	105	K35 S39	K35-Y37 PolarHBondContact O-N 2.94Å; Y37-S39 WeakPolarHBondContact O-CA 3.46Å; Y37-S39 PolarHBondContact O-N 3.47Å; Y37-S39 PolarHBondContact O-OG 2.95Å
38	S	31.2	Very low	29.1	Very low	75 Å²	75	126.9 Å²	126.9	52%	0.524	65%	0.652	S	S	.	*			trans	-48.4	95.9	167.3	165	0	0	0	0	106.3	T36 S40 R41	T36-S38 PolarHBondContact O-N 3.45Å; S38-S40 PolarHBondContact O-N 2.89Å; S38-S40 PolarHBondContact OG-OG 3.22Å; S38-R41 PolarHBondContact O-N 3.02Å
39	S	32.7	Very low	29.7	Very low	85 Å²	85	119.2 Å²	119.2	59%	0.594	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-8	-170.1	-65.1	0	0	0	0	111.1	Y37 R41	Y37-S39 WeakPolarHBondContact O-CA 3.46Å; Y37-S39 PolarHBondContact O-N 3.47Å; Y37-S39 PolarHBondContact O-OG 2.95Å; S39-R41 PolarHBondContact O-N 2.84Å
40	S	33.7	Very low	29.6	Very low	41 Å²	41	120 Å²	120	29%	0.287	63%	0.63	S	S	.	*	H	α-helix	trans	-52.4	-50.2	169	-35.6	0	0	0	0	111.1	S38 L42 I43 Y44	S38-S40 PolarHBondContact O-N 2.89Å; S38-S40 PolarHBondContact OG-OG 3.22Å; S40-L42 PolarHBondContact O-N 3.44Å; S40-I43 PolarHBondContact O-N 3.21Å; S40-Y44 WeakPolarHBondContact O-CD2 3.43Å; S40-Y44 VanDerWaalsContact O-CE2 3.31Å; S40-Y44 WeakPolarHBondContact O-CE2 3.41Å
41	R	31.2	Very low	29.5	Very low	190 Å²	190	117.1 Å²	117.1	72%	0.717	63%	0.626	S	S	*	*	H	α-helix	trans	-63.1	-34.6	-169.8	-71	-169.6	-178.6	-161.7	-2.2	115.7	S38 S39	S38-R41 PolarHBondContact O-N 3.02Å; S39-R41 PolarHBondContact O-N 2.84Å
42	L	29.4	Very low	29.5	Very low	148 Å²	148	117.3 Å²	117.3	78%	0.775	62%	0.623	S	S	*	*	H	α-helix	trans	-81.8	-22.7	-174.3	-80.2	164.4	0	0	0	113.3	S40	S40-L42 PolarHBondContact O-N 3.44Å
43	I	30.9	Very low	29.4	Very low	87 Å²	87	118.9 Å²	118.9	45%	0.446	63%	0.626	S	S	.	*	H	α-helix	trans	-81.6	-31	178.9	-58.6	174.9	0	0	0	110.5	S40 R45 T319	S40-I43 PolarHBondContact O-N 3.21Å; I43-R45 VanDerWaalsContact C-N 3.26Å; I43-R45 PolarHBondContact O-N 3.05Å; I43-R45 VanDerWaalsContact O-N 3.13Å; I43-T319 HydrophobicContact CG2-CG2 4.19Å
44	Y	30.8	Very low	29.3	Very low	53 Å²	53	122.8 Å²	122.8	21%	0.208	63%	0.633	C	S	.	*	G	3₁₀ helix	trans	-62.4	-22.3	-174.1	-77.6	-56.6	0	0	0	116	S40 N46 L323	S40-Y44 WeakPolarHBondContact O-CD2 3.43Å; S40-Y44 VanDerWaalsContact O-CE2 3.31Å; S40-Y44 WeakPolarHBondContact O-CE2 3.41Å; Y44-N46 VanDerWaalsContact C-N 3.27Å; Y44-N46 PolarHBondContact O-N 3.26Å; Y44-L323 HydrophobicContact CE1-CD2 3.52Å
45	R	31.1	Very low	29.2	Very low	216 Å²	216	123.3 Å²	123.3	82%	0.815	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-73.2	-15.3	-173.4	-154.7	175.1	168.1	145.5	0.4	114.2	I43 S48	I43-R45 VanDerWaalsContact C-N 3.26Å; I43-R45 PolarHBondContact O-N 3.05Å; I43-R45 VanDerWaalsContact O-N 3.13Å; R45-S48 PolarHBondContact O-OG 3.45Å
46	N	35.5	Very low	29.2	Very low	140 Å²	140	120.7 Å²	120.7	75%	0.749	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-104.2	6.5	-170.6	-78.2	-44.8	0	0	0	115.8	Y44 S48	Y44-N46 VanDerWaalsContact C-N 3.27Å; Y44-N46 PolarHBondContact O-N 3.26Å; N46-S48 PolarHBondContact O-N 3.42Å
47	L	33.7	Very low	29.4	Very low	54 Å²	54	121.1 Å²	121.1	28%	0.283	64%	0.636	S	S	.	*			trans	-83	5	171.7	-109.1	102.5	0	0	0	114.1	F49 T319	L47-F49 HydrophobicContact CG-CE2 4.43Å; L47-F49 PolarHBondContact O-N 3.41Å; L47-T319 HydrophobicContact CD1-CG2 3.66Å
48	S	32.6	Very low	29.5	Very low	94 Å²	94	118.2 Å²	118.2	66%	0.657	64%	0.643	S	S	*	*			trans	-70.5	81.2	163.5	33	0	0	0	0	109.2	R45 N46 T50	R45-S48 PolarHBondContact O-OG 3.45Å; N46-S48 PolarHBondContact O-N 3.42Å; S48-T50 PolarHBondContact O-N 3.49Å
49	F	35.2	Very low	29.4	Very low	78 Å²	78	119.4 Å²	119.4	34%	0.342	65%	0.651	S	S	.	*			trans	-56.4	107.2	175.3	-92.7	-91.8	0	0	0	109.7	L47 A51 T285	L47-F49 HydrophobicContact CG-CE2 4.43Å; L47-F49 PolarHBondContact O-N 3.41Å; F49-A51 PolarHBondContact O-N 2.99Å; F49-A51 VanDerWaalsContact O-N 3.14Å; F49-T285 HydrophobicContact CD1-CG2 4.01Å; F49-T285 HydrophobicContact CE1-CG2 3.64Å; F49-T285 HydrophobicContact CZ-CG2 4.09Å
50	T	29.3	Very low	28.9	Very low	119 Å²	119	121.1 Å²	121.1	73%	0.73	66%	0.663	S	S	*	*			trans	-76.8	98.6	164.1	45.6	0	0	0	0	107.6	S48 T52	S48-T50 PolarHBondContact O-N 3.49Å; T50-T52 PolarHBondContact O-N 3.06Å
51	A	25.7	Very low	28.7	Very low	85 Å²	85	124.8 Å²	124.8	70%	0.702	68%	0.684	S	S	*	*			trans	-60.2	86.9	163.7	0	0	0	0	0	108.2	F49 L53	F49-A51 PolarHBondContact O-N 2.99Å; F49-A51 VanDerWaalsContact O-N 3.14Å; A51-L53 PolarHBondContact O-N 3.29Å
52	T	26.6	Very low	28.2	Very low	121 Å²	121	121.7 Å²	121.7	74%	0.742	69%	0.692	S	S	*	*			trans	-71.7	98.4	172.2	32.5	0	0	0	0	107.1	T50 F54	T50-T52 PolarHBondContact O-N 3.06Å; T52-F54 PolarHBondContact O-N 2.96Å
53	L	25	Very low	28.2	Very low	149 Å²	149	120.9 Å²	120.9	78%	0.78	69%	0.686	S	S	*	*			trans	-41	110.6	171.5	-85.1	86.1	0	0	0	110.4	A51 Q55	A51-L53 PolarHBondContact O-N 3.29Å; L53-Q55 PolarHBondContact O-N 3.42Å
54	F	24.3	Very low	27.8	Very low	205 Å²	205	126.6 Å²	126.6	90%	0.899	71%	0.708	S	S	*	*			trans	-81.1	100.4	157.7	-120.2	-92	0	0	0	107	T52 P56	T52-F54 PolarHBondContact O-N 2.96Å; F54-P56 WeakPolarHBondContact O-CD 3.3Å
55	Q	22.9	Very low	27.5	Very low	160 Å²	160	131.2 Å²	131.2	75%	0.748	74%	0.735	S	S	*	*			trans	-74.8	119	164.5	-92.7	171.1	-43.8	0	0	108.4	L53 T57	L53-Q55 PolarHBondContact O-N 3.42Å; Q55-T57 PolarHBondContact O-N 3.09Å
56	P	23.7	Very low	27.3	Very low	120 Å²	120	129.7 Å²	129.7	78%	0.779	74%	0.735	S	S	*	*			trans	-69.6	117.8	175.7	-9.8	24.9	0	0	0	108.9	F54 S58	F54-P56 WeakPolarHBondContact O-CD 3.3Å; P56-S58 PolarHBondContact O-N 2.95Å; P56-S58 VanDerWaalsContact O-N 3.09Å
57	T	27.2	Very low	26.9	Very low	135 Å²	135	130 Å²	130	83%	0.828	74%	0.736	S	S	*	*			trans	-70.1	104.9	167	43.7	0	0	0	0	108.4	Q55 S59	Q55-T57 PolarHBondContact O-N 3.09Å; T57-S59 PolarHBondContact O-N 3.48Å
58	S	26	Very low	26.8	Very low	127 Å²	127	135.3 Å²	135.3	89%	0.888	76%	0.76	S	S	*	*			trans	-63	96.9	171.3	35.6	0	0	0	0	109.9	P56	P56-S58 PolarHBondContact O-N 2.95Å; P56-S58 VanDerWaalsContact O-N 3.09Å
59	S	30.1	Very low	26.6	Very low	101 Å²	101	139.4 Å²	139.4	71%	0.706	77%	0.768	S	S	*	*			trans	-109	114.5	156	55.7	0	0	0	0	108	T57 T61	T57-S59 PolarHBondContact O-N 3.48Å; S59-T61 PolarHBondContact O-N 3.21Å
60	S	22.3	Very low	26.7	Very low	120 Å²	120	139.7 Å²	139.7	84%	0.839	78%	0.777	S	S	*	*			trans	-71.6	108.8	-178.9	51.8	0	0	0	0	110.5
61	T	28.5	Very low	27.1	Very low	118 Å²	118	140.6 Å²	140.6	72%	0.724	78%	0.777	S	S	*	*			trans	-136.3	99.4	157.7	-5	0	0	0	0	108.2	S59 I63	S59-T61 PolarHBondContact O-N 3.21Å; T61-I63 PolarHBondContact O-N 3.09Å
62	S	21.9	Very low	27.8	Very low	126 Å²	126	144 Å²	144	88%	0.881	78%	0.782	S	S	*	*			trans	-66.4	97.2	176.1	53	0	0	0	0	110
63	I	30	Very low	28.8	Very low	130 Å²	130	141 Å²	141	67%	0.667	77%	0.766	S	S	*	*			trans	-117.3	107.6	165.7	-60	175.7	0	0	0	106.8	T61 L65	T61-I63 PolarHBondContact O-N 3.09Å; I63-L65 HydrophobicContact CG2-CD1 4.29Å; I63-L65 PolarHBondContact O-N 3.4Å
64	K	21.6	Very low	29.9	Very low	208 Å²	208	136.2 Å²	136.2	90%	0.904	74%	0.742	S	S	*	*			trans	-59.5	101.6	169.1	-93.8	177.2	170.8	173.8	0	108
65	L	25.3	Very low	30.9	Very low	149 Å²	149	128 Å²	128	78%	0.78	71%	0.714	S	S	*	*			trans	-101.4	102.9	163.7	-132	92.5	0	0	0	108.5	I63	I63-L65 HydrophobicContact CG2-CD1 4.29Å; I63-L65 PolarHBondContact O-N 3.4Å
66	K	25.3	Very low	32.2	Very low	185 Å²	185	124 Å²	124	80%	0.804	70%	0.697	S	S	*	*			trans	-74.6	126.5	153.2	-111.2	171	173.4	179.5	0	105.5
67	D	27.7	Very low	33.4	Very low	146 Å²	146	120 Å²	120	78%	0.781	67%	0.668	S	S	*	*	S	Bend	trans	141.4	123.3	148.6	-66.5	-21.5	0	0	0	112.1
68	H	30.9	Very low	34.1	Very low	166 Å²	166	120.7 Å²	120.7	77%	0.769	66%	0.662	S	S	*	*			trans	65.2	75.7	165	-106.9	53.7	0	0	0	117.9	T70	H68-T70 PolarHBondContact O-N 3.37Å
69	Q	29.5	Very low	35	Very low	180 Å²	180	120.7 Å²	120.7	84%	0.841	66%	0.659	S	S	*	*			trans	-68.3	82.2	152.4	-77.1	178.3	-16.3	0	0	109.5
70	T	37.2	Very low	35.8	Very low	84 Å²	84	119.8 Å²	119.8	52%	0.515	64%	0.642	S	S	.	*			trans	-99.4	71.1	156.8	57.2	0	0	0	0	107.4	H68 L72	H68-T70 PolarHBondContact O-N 3.37Å; T70-L72 PolarHBondContact O-N 3.35Å
71	N	37.3	Very low	36.7	Very low	138 Å²	138	122.3 Å²	122.3	74%	0.738	64%	0.638	S	S	*	*			trans	-72.6	73.6	160.1	-66	-21.6	0	0	0	106.1	S73	N71-S73 PolarHBondContact O-N 3.19Å
72	L	41.6	Very low	37.6	Very low	155 Å²	155	123.6 Å²	123.6	81%	0.812	63%	0.633	S	S	*	*			trans	-76.9	66.8	166.2	-166.5	82.3	0	0	0	105.9	T70 L74	T70-L72 PolarHBondContact O-N 3.35Å; L72-L74 PolarHBondContact O-N 2.96Å
73	S	46.7	Very low	38.9	Very low	59 Å²	59	120.6 Å²	120.6	41%	0.413	60%	0.603	S	S	.	*			trans	-54.3	119.1	172.6	55	0	0	0	0	106	N71 G75 E291	N71-S73 PolarHBondContact O-N 3.19Å; S73-G75 VanDerWaalsContact O-CA 3.25Å; S73-G75 WeakPolarHBondContact O-CA 3.39Å; S73-G75 PolarHBondContact O-N 3.01Å; S73-E291 WeakPolarHBondContact CA-OE1 3.5Å
74	L	48.2	Very low	39.7	Very low	49 Å²	49	119.1 Å²	119.1	26%	0.257	60%	0.599	S	S	.	*			trans	-43.6	107.1	170.7	-110.3	147.3	0	0	0	106.6	L72 L76 V287 E291 I294	L72-L74 PolarHBondContact O-N 2.96Å; L74-L76 PolarHBondContact O-N 3.32Å; L74-V287 HydrophobicContact CB-CG1 3.46Å; L74-V287 VanDerWaalsContact CB-CG1 3.46Å; L74-V287 HydrophobicContact CD1-CG1 4.14Å; L74-V287 HydrophobicContact CD2-CG1 4.13Å; L74-V287 HydrophobicContact CG-CG1 4.13Å; L74-E291 HydrophobicContact CD1-CB 4.14Å; L74-E291 HydrophobicContact CD1-CG 4.45Å; L74-I294 HydrophobicContact CD1-CD1 3.3Å; L74-I294 HydrophobicContact CG-CD1 4.49Å
75	G	44.9	Very low	41	Very low	31 Å²	31	114 Å²	114	32%	0.32	58%	0.582	S	S	.	*			trans	-53.9	103.1	-152.9	0	0	0	0	0	111	S73 R366	S73-G75 VanDerWaalsContact O-CA 3.25Å; S73-G75 WeakPolarHBondContact O-CA 3.39Å; S73-G75 PolarHBondContact O-N 3.01Å; G75-R366 PolarHBondContact O-NH1 2.95Å
76	L	49.9	Very low	41.9	Very low	76 Å²	76	115.6 Å²	115.6	40%	0.398	58%	0.582	S	S	.	*			trans	-49.7	147	168.2	-75.9	86	0	0	0	106.7	L74 H78	L74-L76 PolarHBondContact O-N 3.32Å; L76-H78 PolarHBondContact O-N 3.45Å; L76-H78 PolarHBondContact O-ND1 2.96Å
77	F	49.2	Very low	43.1	Very low	37 Å²	37	111.3 Å²	111.3	16%	0.162	57%	0.565	C	S	.	*			trans	-50.9	112.9	169.1	-77.7	-86.2	0	0	0	106.4	E280 F283 D284 L363	F77-E280 HydrophobicContact CD1-CB 4.45Å; F77-E280 HydrophobicContact CD1-CG 4.18Å; F77-E280 HydrophobicContact CD2-CB 3.67Å; F77-E280 HydrophobicContact CD2-CG 4.12Å; F77-E280 HydrophobicContact CE1-CB 4.41Å; F77-E280 HydrophobicContact CE1-CG 3.79Å; F77-E280 HydrophobicContact CE2-CB 3.65Å; F77-E280 HydrophobicContact CE2-CG 3.75Å; F77-E280 HydrophobicContact CG-CB 4.12Å; F77-E280 HydrophobicContact CG-CG 4.36Å; F77-E280 HydrophobicContact CZ-CB 4.05Å; F77-E280 HydrophobicContact CZ-CG 3.59Å; F77-F283 HydrophobicContact CE2-CD1 4.04Å; F77-D284 WeakPolarHBondContact CB-OD2 3.47Å; F77-D284 WeakPolarHBondContact CD2-OD1 3.32Å; F77-D284 WeakPolarHBondContact CD2-OD2 3.39Å; F77-D284 PolarHBondContact N-OD1 3.15Å; F77-D284 PolarHBondContact N-OD2 2.96Å; F77-L363 HydrophobicContact CE2-CD1 3.96Å; F77-L363 HydrophobicContact CZ-CB 4.13Å; F77-L363 HydrophobicContact CZ-CD1 3.87Å
78	H	42.7	Very low	44.1	Very low	150 Å²	150	108.9 Å²	108.9	69%	0.694	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-56.1	145.9	-174.6	-75.8	56.8	0	0	0	107.5	L76 K80	L76-H78 PolarHBondContact O-N 3.45Å; L76-H78 PolarHBondContact O-ND1 2.96Å; H78-K80 PolarHBondContact O-N 3.08Å
79	P	43.8	Very low	44.9	Very low	127 Å²	127	104.5 Å²	104.5	83%	0.825	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-50	116.3	-173.7	18.3	-31.2	0	0	0	109.5
80	K	46.5	Very low	46	Very low	81 Å²	81	100.6 Å²	100.6	35%	0.352	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-50.4	144.9	175.2	-71.2	174.8	-179.7	158.9	0	107.8	H78 K82 E195 S277 E280	H78-K80 PolarHBondContact O-N 3.08Å; K80-K82 PolarHBondContact O-N 3.38Å; K80-E195 IonicContact NZ-OE2 3.09Å; K80-S277 VanDerWaalsContact NZ-CA 3.28Å; K80-S277 PolarHBondContact NZ-OG 3.48Å; K80-E280 VanDerWaalsContact CE-OE2 3.27Å; K80-E280 WeakPolarHBondContact CE-OE2 3.43Å; K80-E280 IonicContact NZ-OE2 2.66Å; K80-E280 PolarHBondContact NZ-OE2 3.16Å
81	K	43.1	Very low	46.7	Very low	173 Å²	173	97.4 Å²	97.4	75%	0.752	51%	0.509	S	S	*	.			trans	-66.4	72.7	176.2	-164.2	-176.3	-178.3	-171	0	108.4	R83	K81-R83 PolarHBondContact O-N 3.01Å
82	K	45.4	Very low	47.5	Very low	145 Å²	145	100 Å²	100	63%	0.63	51%	0.513	S	S	*	.			trans	-66.2	102.6	173.6	-169.8	175.1	-177.4	177.7	0	105	K80 V84	K80-K82 PolarHBondContact O-N 3.38Å; K82-V84 PolarHBondContact O-N 3.05Å; K82-V84 VanDerWaalsContact O-N 3.12Å
83	R	50.5	Low	48.1	Very low	64 Å²	64	100.6 Å²	100.6	24%	0.242	51%	0.512	C	S	.	.			trans	-58.2	120.1	175.5	-71.9	177.9	179	-168	-12.9	106	K81 E213 D214	K81-R83 PolarHBondContact O-N 3.01Å; R83-E213 IonicContact CZ-OE2 2.73Å; R83-E213 IonicContact NE-OE2 2.69Å; R83-E213 PolarHBondContact NE-OE2 3.5Å; R83-E213 IonicContact NH1-OE2 2.99Å; R83-E213 IonicContact NH2-OE2 3.52Å; R83-E213 PolarHBondContact NH2-OE2 3.27Å; R83-D214 IonicContact CZ-OD1 3.35Å; R83-D214 IonicContact NH1-OD1 2.64Å; R83-D214 PolarHBondContact NH1-OD1 3.44Å
84	V	47.1	Very low	48.8	Very low	98 Å²	98	100.8 Å²	100.8	59%	0.594	51%	0.513	S	S	*	.			trans	-69.9	132.9	-170.7	175	0	0	0	0	108.4	K82 K86 E87	K82-V84 PolarHBondContact O-N 3.05Å; K82-V84 VanDerWaalsContact O-N 3.12Å; V84-K86 HydrophobicContact CG1-CB 4.28Å; V84-K86 HydrophobicContact CG1-CD 4.46Å; V84-K86 HydrophobicContact CG1-CG 4.16Å; V84-K86 PolarHBondContact O-N 2.91Å; V84-E87 PolarHBondContact O-N 2.9Å
85	D	48	Very low	50.1	Low	101 Å²	101	100.5 Å²	100.5	54%	0.54	52%	0.522	S	S	.	.	G	3₁₀ helix	trans	-47.8	-10.1	-179	-50.5	-43.3	0	0	0	115.9	E87 I88	D85-E87 PolarHBondContact O-N 3.26Å; D85-I88 HydrophobicContact CB-CD1 4.23Å; D85-I88 WeakPolarHBondContact O-CD1 3.4Å; D85-I88 WeakPolarHBondContact O-CG1 3.36Å; D85-I88 PolarHBondContact O-N 3.28Å
86	K	44.2	Very low	52	Low	182 Å²	182	100.7 Å²	100.7	79%	0.791	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-64.9	-20	179	-77.6	-176.1	175.8	179.3	0	113.9	V84 I88	V84-K86 HydrophobicContact CG1-CB 4.28Å; V84-K86 HydrophobicContact CG1-CD 4.46Å; V84-K86 HydrophobicContact CG1-CG 4.16Å; V84-K86 PolarHBondContact O-N 2.91Å; K86-I88 VanDerWaalsContact C-N 3.34Å; K86-I88 PolarHBondContact O-N 2.95Å
87	E	50.2	Low	53.8	Low	96 Å²	96	99.9 Å²	99.9	45%	0.449	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-81.3	-5.6	-179.2	-66.2	-174.8	-171.4	0	0	114.1	V84 D85 A89 D90 L91 R200	V84-E87 PolarHBondContact O-N 2.9Å; D85-E87 PolarHBondContact O-N 3.26Å; E87-A89 PolarHBondContact O-N 3.31Å; E87-D90 CarbonylContact O-C 3.53Å; E87-D90 PolarHBondContact O-N 3.01Å; E87-L91 PolarHBondContact O-N 2.97Å; E87-R200 IonicContact OE2-CZ 3.83Å; E87-R200 IonicContact OE2-NH1 2.72Å; E87-R200 PolarHBondContact OE2-NH1 3.34Å
88	I	49.2	Very low	55.8	Low	94 Å²	94	99.8 Å²	99.8	48%	0.482	51%	0.508	S	S	.	.	H	α-helix	trans	-66.5	-38.4	-173.3	-58.4	167.4	0	0	0	112.5	D85 K86 D90 L91	D85-I88 HydrophobicContact CB-CD1 4.23Å; D85-I88 WeakPolarHBondContact O-CD1 3.4Å; D85-I88 WeakPolarHBondContact O-CG1 3.36Å; D85-I88 PolarHBondContact O-N 3.28Å; K86-I88 VanDerWaalsContact C-N 3.34Å; K86-I88 PolarHBondContact O-N 2.95Å; I88-D90 VanDerWaalsContact C-N 3.33Å; I88-L91 WeakPolarHBondContact O-CB 3.32Å; I88-L91 PolarHBondContact O-N 3.36Å
89	A	48.7	Very low	58.2	Low	75 Å²	75	92.8 Å²	92.8	62%	0.62	48%	0.475	S	S	*	.	H	α-helix	trans	-68	-36	177.7	0	0	0	0	0	111.8	E87 L91	E87-A89 PolarHBondContact O-N 3.31Å; A89-L91 PolarHBondContact O-N 3.48Å
90	D	51.5	Low	60.6	Low	97 Å²	97	86.7 Å²	86.7	52%	0.519	44%	0.436	S	S	.	.	H	α-helix	trans	-73.2	-20.2	174.7	-61.9	-21.8	0	0	0	111.5	E87 I88 Q93 S94	E87-D90 CarbonylContact O-C 3.53Å; E87-D90 PolarHBondContact O-N 3.01Å; I88-D90 VanDerWaalsContact C-N 3.33Å; D90-Q93 PolarHBondContact O-N 3.14Å; D90-S94 WeakPolarHBondContact O-CB 3.24Å; D90-S94 PolarHBondContact O-N 2.93Å; D90-S94 PolarHBondContact O-OG 3.15Å
91	L	52.2	Low	62.8	Low	18 Å²	18	82.9 Å²	82.9	9%	0.094	42%	0.419	C	S	.	.	H	α-helix	trans	-63.8	-49.8	-178.6	-157.4	78.6	0	0	0	112.6	E87 I88 A89 Q93 S94 G95 F96 D98 R200	E87-L91 PolarHBondContact O-N 2.97Å; I88-L91 WeakPolarHBondContact O-CB 3.32Å; I88-L91 PolarHBondContact O-N 3.36Å; A89-L91 PolarHBondContact O-N 3.48Å; L91-Q93 PolarHBondContact O-N 3.05Å; L91-S94 WeakPolarHBondContact CA-OG 3.41Å; L91-S94 PolarHBondContact O-N 3.01Å; L91-S94 VanDerWaalsContact O-N 3.1Å; L91-S94 PolarHBondContact O-OG 3.29Å; L91-G95 PolarHBondContact O-N 2.68Å; L91-F96 HydrophobicContact CD1-CB 3.88Å; L91-F96 HydrophobicContact CG-CB 4.13Å; L91-F96 PolarHBondContact O-N 2.96Å; L91-D98 HydrophobicContact CD2-CB 4.14Å; L91-R200 HydrophobicContact CD1-CG 3.94Å
92	K	53.7	Low	65.3	Low	192 Å²	192	75.5 Å²	75.5	84%	0.835	39%	0.387	S	S	*	.	H	α-helix	trans	-65.2	-30.8	177.9	-70.4	-171.1	-180	-177.3	0	112.1
93	Q	53.6	Low	67.5	Low	168 Å²	168	68.6 Å²	68.6	79%	0.785	36%	0.357	S	S	*	.	H	α-helix	trans	-72.6	-30.7	175.3	-64.4	-175.5	13.1	0	0	112.1	D90 L91	D90-Q93 PolarHBondContact O-N 3.14Å; L91-Q93 PolarHBondContact O-N 3.05Å
94	S	62.5	Low	69.5	Low	63 Å²	63	65.5 Å²	65.5	44%	0.441	35%	0.345	S	S	.	.	H	α-helix	trans	-83.8	-5.6	-179.5	57.9	0	0	0	0	114.4	D90 L91 F96	D90-S94 WeakPolarHBondContact O-CB 3.24Å; D90-S94 PolarHBondContact O-N 2.93Å; D90-S94 PolarHBondContact O-OG 3.15Å; L91-S94 WeakPolarHBondContact CA-OG 3.41Å; L91-S94 PolarHBondContact O-N 3.01Å; L91-S94 VanDerWaalsContact O-N 3.1Å; L91-S94 PolarHBondContact O-OG 3.29Å; S94-F96 VanDerWaalsContact C-N 3.26Å; S94-F96 WeakPolarHBondContact O-CD2 3.45Å; S94-F96 PolarHBondContact O-N 3.05Å
95	G	75.9	Confident	71.6	Confident	43 Å²	43	60.9 Å²	60.9	44%	0.443	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	15.4	-179.2	0	0	0	0	0	113.9	L91	L91-G95 PolarHBondContact O-N 2.68Å
96	F	84.9	Confident	73.4	Confident	35 Å²	35	57.3 Å²	57.3	15%	0.154	30%	0.297	C	S	.	.			trans	-95.3	149.7	174.4	-72.3	-93.9	0	0	0	110.9	L91 S94 R200 Y201 C202 D214	L91-F96 HydrophobicContact CD1-CB 3.88Å; L91-F96 HydrophobicContact CG-CB 4.13Å; L91-F96 PolarHBondContact O-N 2.96Å; S94-F96 VanDerWaalsContact C-N 3.26Å; S94-F96 WeakPolarHBondContact O-CD2 3.45Å; S94-F96 PolarHBondContact O-N 3.05Å; F96-R200 HydrophobicContact CB-CB 4.45Å; F96-R200 HydrophobicContact CD1-CB 4.07Å; F96-Y201 CarbonylContact C-O 3.59Å; F96-Y201 WeakPolarHBondContact CA-O 3.42Å; F96-C202 HydrophobicContact CD1-CB 3.7Å; F96-C202 HydrophobicContact CE1-CB 3.73Å; F96-C202 HydrophobicContact CG-CB 4.18Å; F96-C202 HydrophobicContact CZ-CB 4.24Å; F96-D214 HydrophobicContact CE1-CB 4.12Å
97	Y	88.2	Confident	75.6	Confident	58 Å²	58	50.4 Å²	50.4	23%	0.227	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	154.6	174.2	-63	-75.2	0	0	0	109.2	N168 R200 Y201 L203	Y97-N168 HydrophobicContact CD1-CB 4.45Å; Y97-N168 VanDerWaalsContact CD1-OD1 3.24Å; Y97-N168 WeakPolarHBondContact CD1-OD1 3.41Å; Y97-R200 CarbonylContact O-C 3.56Å; Y97-R200 WeakPolarHBondContact O-CA 3.36Å; Y97-Y201 VanDerWaalsContact CB-CZ 3.42Å; Y97-Y201 AromaticContact CD2-CE2 3.98Å; Y97-Y201 HydrophobicContact CD2-CE2 3.98Å; Y97-Y201 HydrophobicContact CG-CE1 4.17Å; Y97-Y201 HydrophobicContact CG-CE2 4.35Å; Y97-Y201 AromaticContact CG-CZ 3.91Å; Y97-Y201 PolarHBondContact N-O 3.13Å; Y97-Y201 WeakPolarHBondContact O-CD1 3.4Å; Y97-Y201 PolarHBondContact O-N 2.98Å; Y97-L203 HydrophobicContact CD2-CD1 4.46Å; Y97-L203 HydrophobicContact CD2-CG 4.28Å; Y97-L203 HydrophobicContact CE2-CD1 3.69Å; Y97-L203 HydrophobicContact CE2-CG 3.88Å
98	D	90.4	Very high	77.5	Confident	36 Å²	36	46.2 Å²	46.2	19%	0.193	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	147.4	-175.8	-169.9	60.2	0	0	0	112.6	L91 S100 N168	L91-D98 HydrophobicContact CD2-CB 4.14Å; D98-S100 PolarHBondContact OD2-OG 2.96Å; D98-N168 PolarHBondContact O-N 2.78Å
99	I	92.9	Very high	79.5	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.01	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	117.3	169	-58.5	160.7	0	0	0	107.2	V165 F166 W167 D198 L199 Y201 I215 L270	I99-V165 HydrophobicContact CG2-CG1 3.69Å; I99-F166 CarbonylContact C-O 3.57Å; I99-F166 VanDerWaalsContact CA-O 3.25Å; I99-F166 WeakPolarHBondContact CA-O 3.34Å; I99-W167 HydrophobicContact CD1-CD2 4.11Å; I99-W167 HydrophobicContact CD1-CE3 3.7Å; I99-W167 HydrophobicContact CD1-CH2 3.52Å; I99-W167 HydrophobicContact CD1-CZ2 3.93Å; I99-W167 HydrophobicContact CD1-CZ3 3.4Å; I99-W167 HydrophobicContact CG1-CD2 3.84Å; I99-W167 HydrophobicContact CG1-CE3 3.69Å; I99-W167 HydrophobicContact CG1-CG 4.4Å; I99-W167 HydrophobicContact CG1-CH2 4.34Å; I99-W167 HydrophobicContact CG1-CZ2 4.46Å; I99-W167 HydrophobicContact CG1-CZ3 3.96Å; I99-W167 HydrophobicContact CG2-CD2 4.42Å; I99-D198 CarbonylContact O-C 3.41Å; I99-D198 WeakPolarHBondContact O-CA 3.3Å; I99-L199 HydrophobicContact CB-CB 4.13Å; I99-L199 HydrophobicContact CD1-CB 4.38Å; I99-L199 PolarHBondContact N-O 3.01Å; I99-L199 PolarHBondContact O-N 2.83Å; I99-Y201 HydrophobicContact CD1-CD1 3.65Å; I99-Y201 HydrophobicContact CD1-CG 4.08Å; I99-Y201 HydrophobicContact CG1-CD1 3.51Å; I99-Y201 HydrophobicContact CG1-CE1 4Å; I99-Y201 HydrophobicContact CG1-CG 4.42Å; I99-I215 HydrophobicContact CD1-CD1 3.83Å; I99-L270 HydrophobicContact CG2-CD2 3.64Å
100	S	93.4	Very high	81.4	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	116.4	-177.5	-75.7	0	0	0	0	110.4	D98 F166 R196 D198	D98-S100 PolarHBondContact OD2-OG 2.96Å; S100-F166 PolarHBondContact N-O 3.14Å; S100-F166 PolarHBondContact O-N 2.81Å; S100-R196 PolarHBondContact OG-NH2 3.49Å; S100-D198 PolarHBondContact OG-OD1 3.26Å; S100-D198 VanDerWaalsContact OG-OD1 3.06Å
101	G	94.3	Very high	83.2	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	128.1	173.4	0	0	0	0	0	111.5	A164 R196 E197	G101-A164 CarbonylContact C-O 3.56Å; G101-A164 WeakPolarHBondContact CA-O 3.47Å; G101-R196 CarbonylContact O-C 3.5Å; G101-R196 VanDerWaalsContact O-CA 3.27Å; G101-R196 WeakPolarHBondContact O-CA 3.49Å; G101-E197 PolarHBondContact N-O 2.88Å; G101-E197 PolarHBondContact O-N 3.24Å
102	Y	94.6	Very high	84.9	Confident	18 Å²	18	49.2 Å²	49.2	7%	0.071	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	123.2	-179	-72.4	-88.9	0	0	0	112	V163 A164 F166 E171 H174 L178 I194 E195 R196	Y102-V163 CarbonylContact O-C 3.58Å; Y102-V163 VanDerWaalsContact O-CA 3.3Å; Y102-V163 WeakPolarHBondContact O-CA 3.41Å; Y102-V163 WeakPolarHBondContact O-CG1 3.21Å; Y102-A164 PolarHBondContact N-O 3.47Å; Y102-A164 PolarHBondContact O-N 3.43Å; Y102-F166 AromaticContact CD2-CD2 3.51Å; Y102-F166 HydrophobicContact CD2-CD2 3.51Å; Y102-F166 AromaticContact CD2-CE2 3.47Å; Y102-F166 HydrophobicContact CD2-CE2 3.47Å; Y102-F166 VanDerWaalsContact CD2-CE2 3.47Å; Y102-F166 AromaticContact CE2-CD2 3.67Å; Y102-F166 HydrophobicContact CE2-CD2 3.67Å; Y102-F166 AromaticContact CE2-CE2 3.85Å; Y102-F166 HydrophobicContact CE2-CE2 3.85Å; Y102-F166 HydrophobicContact CG-CE2 4.34Å; Y102-E171 PolarHBondContact OH-OE2 3.43Å; Y102-H174 HydrophobicContact CE2-CB 4.14Å; Y102-H174 AromaticContact CE2-CG 3.88Å; Y102-H174 AromaticContact CE2-ND1 3.57Å; Y102-H174 AromaticContact CZ-ND1 3.71Å; Y102-H174 PolarHBondContact OH-ND1 3.01Å; Y102-L178 HydrophobicContact CD1-CD1 3.8Å; Y102-L178 HydrophobicContact CD2-CD1 4.45Å; Y102-L178 HydrophobicContact CE1-CD1 4.07Å; Y102-L178 HydrophobicContact CG-CD1 3.99Å; Y102-L178 HydrophobicContact CG-CD2 4.36Å; Y102-I194 HydrophobicContact CD1-CG2 3.96Å; Y102-E195 CarbonylContact C-O 3.6Å; Y102-E195 WeakPolarHBondContact CA-O 3.5Å; Y102-R196 HydrophobicContact CD1-CB 4.15Å; Y102-R196 HydrophobicContact CD1-CG 4.17Å; Y102-R196 HydrophobicContact CE1-CB 4.06Å; Y102-R196 HydrophobicContact CE1-CG 3.77Å; Y102-R196 VanDerWaalsContact OH-CZ 3.26Å; Y102-R196 PolarHBondContact OH-NH1 2.82Å; Y102-R196 VanDerWaalsContact OH-NH1 3.09Å
103	G	92.5	Very high	86.6	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	106.7	171.2	0	0	0	0	0	109.8	I194 E195	G103-I194 WeakPolarHBondContact O-CA 3.22Å; G103-I194 WeakPolarHBondContact O-CG2 3.44Å; G103-E195 PolarHBondContact N-O 3.3Å; G103-E195 PolarHBondContact O-N 2.66Å
104	F	91.3	Very high	88.2	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.197	C	C	.	.			trans	-122.5	-15.6	-169.9	64.9	-89.2	0	0	0	114.3	G162 A164 L178 F181 R182 S185 L189	F104-G162 VanDerWaalsContact CD1-O 3.29Å; F104-G162 WeakPolarHBondContact CD1-O 3.37Å; F104-G162 WeakPolarHBondContact CE1-O 3.47Å; F104-G162 PolarHBondContact N-O 3Å; F104-A164 HydrophobicContact CD1-CB 4.4Å; F104-A164 HydrophobicContact CE1-CB 3.78Å; F104-L178 HydrophobicContact CB-CD2 4.29Å; F104-L178 HydrophobicContact CD1-CD2 3.82Å; F104-L178 HydrophobicContact CE1-CD2 4.44Å; F104-L178 HydrophobicContact CG-CD2 4.1Å; F104-F181 HydrophobicContact CE2-CB 3.86Å; F104-F181 HydrophobicContact CZ-CB 3.82Å; F104-F181 HydrophobicContact CZ-CD2 4.46Å; F104-R182 HydrophobicContact CD2-CG 4.03Å; F104-S185 WeakPolarHBondContact CE2-OG 3.47Å; F104-L189 PolarHBondContact O-N 2.97Å
105	A	90.9	Very high	89.4	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.008	20%	0.201	C	C	.	.			trans	-149.9	176.3	-179.2	0	0	0	0	0	112.1	G162	A105-G162 PolarHBondContact N-O 3.33Å
106	Q	87.1	Confident	89.9	Confident	25 Å²	25	39.9 Å²	39.9	12%	0.117	19%	0.191	C	C	.	.	S	Bend	trans	-89.1	-39.4	174.8	-70.8	-179.6	54.9	0	0	112.4	N161 E186 G187 K275	Q106-N161 CarbonylContact O-C 3.56Å; Q106-E186 PolarHBondContact N-O 3.03Å; Q106-E186 VanDerWaalsContact N-O 3.12Å; Q106-G187 PolarHBondContact N-O 3.29Å; Q106-K275 PolarHBondContact O-NZ 2.64Å
107	C	88.7	Confident	90	Very high	37 Å²	37	38.2 Å²	38.2	25%	0.25	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	154.9	171	59.5	0	0	0	0	111.8	N160 S185 E186	C107-N160 CarbonylContact C-O 3.32Å; C107-N160 WeakPolarHBondContact CA-O 3.23Å; C107-N160 WeakPolarHBondContact CB-O 3.41Å; C107-S185 CarbonylContact O-C 3.55Å; C107-S185 VanDerWaalsContact O-CA 3.28Å; C107-S185 WeakPolarHBondContact O-CA 3.42Å; C107-S185 WeakPolarHBondContact O-CB 3.1Å; C107-E186 PolarHBondContact N-O 3.04Å; C107-E186 PolarHBondContact O-N 3.31Å
108	T	90.6	Very high	89.8	Confident	9 Å²	9	38.5 Å²	38.5	6%	0.055	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	130.6	-179.6	-60.2	0	0	0	0	109.7	L110 L113 I158 N160 S185	T108-L110 HydrophobicContact CG2-CD2 4.22Å; T108-L110 PolarHBondContact O-N 3.27Å; T108-L110 VanDerWaalsContact O-N 3.16Å; T108-L113 HydrophobicContact CG2-CD2 4.18Å; T108-I158 HydrophobicContact CG2-CG2 4.26Å; T108-N160 PolarHBondContact N-O 2.87Å; T108-S185 WeakPolarHBondContact CB-OG 3.38Å; T108-S185 WeakPolarHBondContact CG2-OG 3.32Å; T108-S185 PolarHBondContact OG1-OG 3.28Å
109	D	91.5	Very high	89.5	Confident	78 Å²	78	44.5 Å²	44.5	42%	0.417	22%	0.218	S	C	.	.			trans	-80.9	96.2	174.8	-171.1	-18	0	0	0	110.4	K111 M112 L113 F184	D109-K111 VanDerWaalsContact C-N 3.26Å; D109-K111 PolarHBondContact O-N 3.14Å; D109-K111 WeakPolarHBondContact OD1-CB 3.47Å; D109-K111 PolarHBondContact OD1-N 2.96Å; D109-M112 HydrophobicContact CB-CB 4.33Å; D109-M112 PolarHBondContact O-N 2.94Å; D109-M112 PolarHBondContact OD1-N 3.33Å; D109-M112 WeakPolarHBondContact OD2-CG 3.45Å; D109-L113 WeakPolarHBondContact O-CB 3.48Å; D109-L113 PolarHBondContact O-N 2.7Å; D109-F184 PolarHBondContact N-O 2.94Å
110	L	89.5	Confident	88.9	Confident	12 Å²	12	48.1 Å²	48.1	6%	0.063	23%	0.234	C	C	.	.	H	α-helix	trans	-64.2	-27.5	-179.5	-57.1	-177.2	0	0	0	113.2	T108 R114 E136 L138 I158 N160	T108-L110 HydrophobicContact CG2-CD2 4.22Å; T108-L110 PolarHBondContact O-N 3.27Å; T108-L110 VanDerWaalsContact O-N 3.16Å; L110-R114 WeakPolarHBondContact O-CB 3.41Å; L110-R114 PolarHBondContact O-N 3.34Å; L110-E136 WeakPolarHBondContact CD1-O 3.45Å; L110-L138 HydrophobicContact CD2-CB 4.13Å; L110-I158 HydrophobicContact CD2-CB 4.39Å; L110-I158 HydrophobicContact CD2-CG2 3.83Å; L110-N160 HydrophobicContact CD1-CB 3.91Å; L110-N160 HydrophobicContact CG-CB 4.2Å
111	K	89	Confident	87.8	Confident	153 Å²	153	52.8 Å²	52.8	67%	0.665	26%	0.259	S	S	*	.	H	α-helix	trans	-72.7	-45.1	-177.9	-64.4	178.8	-179	177.4	0	110.7	D109 S115	D109-K111 VanDerWaalsContact C-N 3.26Å; D109-K111 PolarHBondContact O-N 3.14Å; D109-K111 WeakPolarHBondContact OD1-CB 3.47Å; D109-K111 PolarHBondContact OD1-N 2.96Å; K111-S115 WeakPolarHBondContact O-CB 3.44Å; K111-S115 PolarHBondContact O-N 3.48Å; K111-S115 PolarHBondContact O-OG 3.09Å
112	M	88.1	Confident	86.7	Confident	104 Å²	104	59.5 Å²	59.5	51%	0.512	30%	0.295	S	S	.	.	H	α-helix	trans	-66.9	-42.6	175.6	-71.3	-62.2	-64.9	0	0	111.1	D109 S115 Y116 F184	D109-M112 HydrophobicContact CB-CB 4.33Å; D109-M112 PolarHBondContact O-N 2.94Å; D109-M112 PolarHBondContact OD1-N 3.33Å; D109-M112 WeakPolarHBondContact OD2-CG 3.45Å; M112-S115 PolarHBondContact O-N 2.97Å; M112-Y116 PolarHBondContact O-N 2.88Å; M112-F184 HydrophobicContact CB-CD1 3.92Å; M112-F184 HydrophobicContact CB-CE1 4.48Å
113	L	89	Confident	85.5	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62.3	-46.5	177.2	-179.5	59.1	0	0	0	111.8	T108 D109 S115 Y116 L117 L138 I158 F181 F184	T108-L113 HydrophobicContact CG2-CD2 4.18Å; D109-L113 WeakPolarHBondContact O-CB 3.48Å; D109-L113 PolarHBondContact O-N 2.7Å; L113-S115 VanDerWaalsContact C-N 3.31Å; L113-S115 PolarHBondContact O-N 2.77Å; L113-Y116 WeakPolarHBondContact O-CB 3.38Å; L113-Y116 PolarHBondContact O-N 3.32Å; L113-Y116 VanDerWaalsContact O-N 3.13Å; L113-L117 HydrophobicContact CD1-CD1 3.77Å; L113-L117 HydrophobicContact CD1-CG 3.98Å; L113-L117 HydrophobicContact CG-CD1 3.77Å; L113-L117 HydrophobicContact CG-CG 4.39Å; L113-L117 WeakPolarHBondContact O-CG 3.48Å; L113-L117 PolarHBondContact O-N 3.13Å; L113-L138 HydrophobicContact CB-CD2 4.48Å; L113-L138 HydrophobicContact CD2-CD2 4.1Å; L113-L138 HydrophobicContact CG-CD2 4.01Å; L113-I158 HydrophobicContact CD2-CD1 4.08Å; L113-I158 HydrophobicContact CD2-CG2 3.9Å; L113-F181 HydrophobicContact CD1-CD1 3.82Å; L113-F181 HydrophobicContact CD1-CE1 4.27Å; L113-F181 HydrophobicContact CD2-CD1 3.92Å; L113-F181 HydrophobicContact CD2-CE1 4.32Å; L113-F184 HydrophobicContact CB-CB 4.28Å; L113-F184 HydrophobicContact CB-CD2 4.5Å; L113-F184 HydrophobicContact CB-CG 4.33Å; L113-F184 HydrophobicContact CD1-CD2 3.65Å; L113-F184 HydrophobicContact CD1-CE2 4.1Å; L113-F184 HydrophobicContact CD1-CG 4.3Å
114	R	87.1	Confident	84.9	Confident	138 Å²	138	64.7 Å²	64.7	52%	0.521	32%	0.321	S	S	.	.	H	α-helix	trans	-59.1	-42.5	174.8	-174.9	176.7	-178.2	178	2	111.7	L110 Y116 L117 S118 L138	L110-R114 WeakPolarHBondContact O-CB 3.41Å; L110-R114 PolarHBondContact O-N 3.34Å; R114-Y116 VanDerWaalsContact C-N 3.28Å; R114-Y116 PolarHBondContact O-N 3.07Å; R114-L117 PolarHBondContact O-N 3.26Å; R114-S118 WeakPolarHBondContact O-CB 3.45Å; R114-S118 PolarHBondContact O-N 2.98Å; R114-L138 HydrophobicContact CB-CD1 4.01Å; R114-L138 HydrophobicContact CB-CD2 4.12Å; R114-L138 HydrophobicContact CG-CD1 3.97Å
115	S	87.7	Confident	84.4	Confident	73 Å²	73	69.9 Å²	69.9	51%	0.51	34%	0.344	S	S	.	.	H	α-helix	trans	-65.4	-31.6	177.4	-57	0	0	0	0	112.7	K111 M112 L113	K111-S115 WeakPolarHBondContact O-CB 3.44Å; K111-S115 PolarHBondContact O-N 3.48Å; K111-S115 PolarHBondContact O-OG 3.09Å; M112-S115 PolarHBondContact O-N 2.97Å; L113-S115 VanDerWaalsContact C-N 3.31Å; L113-S115 PolarHBondContact O-N 2.77Å
116	Y	87.1	Confident	83.9	Confident	58 Å²	58	71.9 Å²	71.9	23%	0.227	35%	0.352	C	S	.	.	H	α-helix	trans	-73.1	-50.4	174.4	176.4	-101.4	0	0	0	111.5	M112 L113 R114 S118 K119 F120 F184	M112-Y116 PolarHBondContact O-N 2.88Å; L113-Y116 WeakPolarHBondContact O-CB 3.38Å; L113-Y116 PolarHBondContact O-N 3.32Å; L113-Y116 VanDerWaalsContact O-N 3.13Å; R114-Y116 VanDerWaalsContact C-N 3.28Å; R114-Y116 PolarHBondContact O-N 3.07Å; Y116-S118 VanDerWaalsContact C-N 3.32Å; Y116-S118 PolarHBondContact O-N 3.23Å; Y116-K119 VanDerWaalsContact O-CB 3.28Å; Y116-K119 WeakPolarHBondContact O-CB 3.44Å; Y116-K119 WeakPolarHBondContact O-CG 3.35Å; Y116-K119 PolarHBondContact O-N 3.38Å; Y116-K119 VanDerWaalsContact O-N 3.14Å; Y116-F120 HydrophobicContact CD1-CE2 4.28Å; Y116-F120 HydrophobicContact CE1-CD2 4.49Å; Y116-F120 AromaticContact CE1-CE2 3.73Å; Y116-F120 HydrophobicContact CE1-CE2 3.73Å; Y116-F120 HydrophobicContact CE2-CE2 4.18Å; Y116-F120 AromaticContact CZ-CE2 3.68Å; Y116-F184 VanDerWaalsContact CB-CZ 3.48Å; Y116-F184 AromaticContact CD1-CE2 3.72Å; Y116-F184 HydrophobicContact CD1-CE2 3.72Å; Y116-F184 AromaticContact CD1-CZ 3.88Å; Y116-F184 HydrophobicContact CD1-CZ 3.88Å; Y116-F184 HydrophobicContact CD2-CE2 4.3Å; Y116-F184 AromaticContact CD2-CZ 3.66Å; Y116-F184 HydrophobicContact CD2-CZ 3.66Å; Y116-F184 HydrophobicContact CE1-CE2 4.23Å; Y116-F184 HydrophobicContact CE2-CZ 4.33Å; Y116-F184 HydrophobicContact CG-CE1 4.39Å; Y116-F184 AromaticContact CG-CE2 3.75Å; Y116-F184 HydrophobicContact CG-CE2 3.75Å; Y116-F184 AromaticContact CG-CZ 3.39Å; Y116-F184 HydrophobicContact CG-CZ 3.39Å
117	L	85.5	Confident	83.4	Confident	0 Å²	0	72 Å²	72	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-68.5	-30.9	-177.5	-66.6	168.6	0	0	0	112.7	L113 R114 K119 F120 Y124 F126 L138 I140	L113-L117 HydrophobicContact CD1-CD1 3.77Å; L113-L117 HydrophobicContact CD1-CG 3.98Å; L113-L117 HydrophobicContact CG-CD1 3.77Å; L113-L117 HydrophobicContact CG-CG 4.39Å; L113-L117 WeakPolarHBondContact O-CG 3.48Å; L113-L117 PolarHBondContact O-N 3.13Å; R114-L117 PolarHBondContact O-N 3.26Å; L117-K119 PolarHBondContact O-N 2.92Å; L117-K119 VanDerWaalsContact O-N 3.12Å; L117-F120 CarbonylContact O-C 3.53Å; L117-F120 WeakPolarHBondContact O-CA 3.49Å; L117-F120 WeakPolarHBondContact O-CB 3.36Å; L117-F120 PolarHBondContact O-N 3.48Å; L117-Y124 HydrophobicContact CD2-CD2 4.27Å; L117-Y124 HydrophobicContact CD2-CE2 3.86Å; L117-F126 HydrophobicContact CB-CE1 4.09Å; L117-F126 HydrophobicContact CB-CZ 3.7Å; L117-L138 HydrophobicContact CD1-CD2 4.05Å; L117-I140 HydrophobicContact CD1-CD1 3.29Å; L117-I140 HydrophobicContact CD1-CG1 4.15Å
118	S	85	Confident	82.8	Confident	64 Å²	64	76.2 Å²	76.2	45%	0.448	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-61.1	-18.4	174	177.2	0	0	0	0	112.9	R114 Y116 F120 D121	R114-S118 WeakPolarHBondContact O-CB 3.45Å; R114-S118 PolarHBondContact O-N 2.98Å; Y116-S118 VanDerWaalsContact C-N 3.32Å; Y116-S118 PolarHBondContact O-N 3.23Å; S118-F120 PolarHBondContact O-N 3.18Å; S118-D121 PolarHBondContact O-N 2.96Å
119	K	84.5	Confident	82.3	Confident	162 Å²	162	77.2 Å²	77.2	70%	0.704	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-70.6	-21	171.3	-59.1	176.5	-177.5	178.2	0	112.5	Y116 L117	Y116-K119 VanDerWaalsContact O-CB 3.28Å; Y116-K119 WeakPolarHBondContact O-CB 3.44Å; Y116-K119 WeakPolarHBondContact O-CG 3.35Å; Y116-K119 PolarHBondContact O-N 3.38Å; Y116-K119 VanDerWaalsContact O-N 3.14Å; L117-K119 PolarHBondContact O-N 2.92Å; L117-K119 VanDerWaalsContact O-N 3.12Å
120	F	78.9	Confident	81.7	Confident	78 Å²	78	75.2 Å²	75.2	34%	0.342	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-104.7	38	177.8	-56.2	-80.9	0	0	0	111	Y116 L117 S118 N122 L123 Y124	Y116-F120 HydrophobicContact CD1-CE2 4.28Å; Y116-F120 HydrophobicContact CE1-CD2 4.49Å; Y116-F120 AromaticContact CE1-CE2 3.73Å; Y116-F120 HydrophobicContact CE1-CE2 3.73Å; Y116-F120 HydrophobicContact CE2-CE2 4.18Å; Y116-F120 AromaticContact CZ-CE2 3.68Å; L117-F120 CarbonylContact O-C 3.53Å; L117-F120 WeakPolarHBondContact O-CA 3.49Å; L117-F120 WeakPolarHBondContact O-CB 3.36Å; L117-F120 PolarHBondContact O-N 3.48Å; S118-F120 PolarHBondContact O-N 3.18Å; F120-N122 PolarHBondContact O-N 3.37Å; F120-L123 HydrophobicContact CB-CD1 4.28Å; F120-L123 HydrophobicContact CD1-CD1 4.34Å; F120-L123 PolarHBondContact O-N 3.39Å; F120-Y124 HydrophobicContact CB-CD2 3.91Å; F120-Y124 HydrophobicContact CB-CE2 3.95Å; F120-Y124 PolarHBondContact O-N 2.96Å
121	D	70.2	Confident	81.2	Confident	98 Å²	98	78.7 Å²	78.7	52%	0.524	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-26	-179.2	-152.9	44.3	0	0	0	112.8	S118 L123	S118-D121 PolarHBondContact O-N 2.96Å; D121-L123 PolarHBondContact O-N 2.97Å
122	N	71.9	Confident	80.7	Confident	141 Å²	141	77.3 Å²	77.3	75%	0.754	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-13.9	175.5	-61.3	-10.7	0	0	0	114.2	F120 L143	F120-N122 PolarHBondContact O-N 3.37Å; N122-L143 WeakPolarHBondContact O-CD2 3.46Å
123	L	70.4	Confident	80.5	Confident	99 Å²	99	72.5 Å²	72.5	52%	0.518	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-26.2	-177.9	-63.2	178.5	0	0	0	112.7	F120 D121 L143	F120-L123 HydrophobicContact CB-CD1 4.28Å; F120-L123 HydrophobicContact CD1-CD1 4.34Å; F120-L123 PolarHBondContact O-N 3.39Å; D121-L123 PolarHBondContact O-N 2.97Å; L123-L143 PolarHBondContact O-N 3.17Å
124	Y	79.5	Confident	80.1	Confident	29 Å²	29	75.4 Å²	75.4	11%	0.114	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	130.6	-164.9	-59.6	-49.8	0	0	0	111.3	L117 F120 I140 W154	L117-Y124 HydrophobicContact CD2-CD2 4.27Å; L117-Y124 HydrophobicContact CD2-CE2 3.86Å; F120-Y124 HydrophobicContact CB-CD2 3.91Å; F120-Y124 HydrophobicContact CB-CE2 3.95Å; F120-Y124 PolarHBondContact O-N 2.96Å; Y124-I140 HydrophobicContact CD1-CG2 3.59Å; Y124-I140 HydrophobicContact CE1-CG2 4.39Å; Y124-I140 HydrophobicContact CG-CG2 3.71Å; Y124-W154 AromaticContact CD1-CH2 3.49Å; Y124-W154 HydrophobicContact CD1-CH2 3.49Å; Y124-W154 VanDerWaalsContact CD1-CH2 3.49Å; Y124-W154 AromaticContact CD1-CZ2 3.96Å; Y124-W154 HydrophobicContact CD1-CZ2 3.96Å; Y124-W154 AromaticContact CE1-CH2 3.45Å; Y124-W154 HydrophobicContact CE1-CH2 3.45Å; Y124-W154 VanDerWaalsContact CE1-CH2 3.45Å; Y124-W154 AromaticContact CE1-CZ2 3.77Å; Y124-W154 HydrophobicContact CE1-CZ2 3.77Å
125	K	80.6	Confident	80	Confident	108 Å²	108	72.6 Å²	72.6	47%	0.47	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	139.5	164.5	-179.2	-178.7	176.3	-174.2	0	108.4	P127 S141 L143	K125-P127 HydrophobicContact CG-CG 4.39Å; K125-P127 VanDerWaalsContact O-CD 3.31Å; K125-P127 WeakPolarHBondContact O-CD 3.14Å; K125-S141 PolarHBondContact N-O 3.09Å; K125-S141 PolarHBondContact O-N 2.99Å; K125-L143 HydrophobicContact CB-CD1 4.46Å
126	F	80.9	Confident	79.9	Confident	43 Å²	43	73.7 Å²	73.7	19%	0.189	39%	0.393	C	S	.	.			trans	-109.9	91	169.9	-60.9	-83.6	0	0	0	109.3	L117 L138 I140	L117-F126 HydrophobicContact CB-CE1 4.09Å; L117-F126 HydrophobicContact CB-CZ 3.7Å; F126-L138 HydrophobicContact CD1-CD1 4.27Å; F126-L138 HydrophobicContact CE1-CD1 4.5Å; F126-I140 HydrophobicContact CE1-CG1 4.22Å
127	P	76.2	Confident	80.1	Confident	29 Å²	29	71.1 Å²	71.1	19%	0.188	38%	0.383	C	S	.	.			trans	-60.3	150.9	175.4	-19.9	32.3	0	0	0	111.8	K125 L129 L139 S141 L260	K125-P127 HydrophobicContact CG-CG 4.39Å; K125-P127 VanDerWaalsContact O-CD 3.31Å; K125-P127 WeakPolarHBondContact O-CD 3.14Å; P127-L129 PolarHBondContact O-N 3.35Å; P127-L129 VanDerWaalsContact O-N 3.17Å; P127-L139 HydrophobicContact CB-CD2 3.74Å; P127-L139 HydrophobicContact CG-CD2 3.68Å; P127-L139 HydrophobicContact CG-CG 4.05Å; P127-S141 WeakPolarHBondContact CG-OG 3.43Å; P127-L260 HydrophobicContact CB-CD2 3.96Å
128	T	75.7	Confident	80.3	Confident	125 Å²	125	71.7 Å²	71.7	77%	0.767	39%	0.386	S	S	*	.			trans	-76.6	104.4	179.9	-52.3	0	0	0	0	109.5
129	L	79.3	Confident	80.6	Confident	29 Å²	29	68.9 Å²	68.9	15%	0.152	37%	0.366	C	S	.	.			trans	-82.8	153.4	164.5	-71.6	173.6	0	0	0	110.4	P127 V137 L139 L260	P127-L129 PolarHBondContact O-N 3.35Å; P127-L129 VanDerWaalsContact O-N 3.17Å; L129-V137 HydrophobicContact CD1-CG1 3.82Å; L129-V137 HydrophobicContact CD1-CG2 4.48Å; L129-L139 HydrophobicContact CD1-CB 3.63Å; L129-L139 HydrophobicContact CD2-CD2 4.16Å; L129-L139 HydrophobicContact CG-CB 4.15Å; L129-L139 HydrophobicContact CG-CD2 4.24Å; L129-L260 HydrophobicContact CD2-CD2 4.14Å
130	P	79.3	Confident	80.8	Confident	36 Å²	36	61.2 Å²	61.2	23%	0.234	33%	0.333	C	S	.	.			trans	-50.5	141.7	170.9	-24.5	32.9	0	0	0	111.8	E132 L133 S134 F336	P130-E132 WeakPolarHBondContact CB-OE2 3.45Å; P130-E132 PolarHBondContact O-N 3.25Å; P130-E132 VanDerWaalsContact O-N 3.07Å; P130-L133 PolarHBondContact O-N 2.91Å; P130-S134 PolarHBondContact O-N 3.49Å; P130-F336 HydrophobicContact CB-CE2 4.32Å; P130-F336 HydrophobicContact CG-CE2 4.17Å; P130-F336 HydrophobicContact CG-CZ 4.47Å
131	S	78.6	Confident	81.2	Confident	85 Å²	85	58 Å²	58	59%	0.594	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-31.3	-175.4	27.3	0	0	0	0	113.1	L133 S134	S131-L133 VanDerWaalsContact C-N 3.28Å; S131-L133 PolarHBondContact O-N 2.92Å; S131-S134 WeakPolarHBondContact O-CB 3.44Å; S131-S134 PolarHBondContact O-N 3.35Å; S131-S134 PolarHBondContact O-OG 2.88Å
132	E	79	Confident	81.8	Confident	124 Å²	124	57.1 Å²	57.1	58%	0.579	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-38.1	-178.7	-55.8	67.7	-134.2	0	0	110.7	P130	P130-E132 WeakPolarHBondContact CB-OE2 3.45Å; P130-E132 PolarHBondContact O-N 3.25Å; P130-E132 VanDerWaalsContact O-N 3.07Å
133	L	83.8	Confident	81.9	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.021	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-84.9	-15.8	-177.7	-69.6	-174.8	0	0	0	113.7	P130 S131 S135 E136 V137 F264 F336	P130-L133 PolarHBondContact O-N 2.91Å; S131-L133 VanDerWaalsContact C-N 3.28Å; S131-L133 PolarHBondContact O-N 2.92Å; L133-S135 PolarHBondContact O-N 3.48Å; L133-E136 PolarHBondContact O-N 3.23Å; L133-V137 HydrophobicContact CB-CG1 3.74Å; L133-V137 HydrophobicContact CD1-CG1 4.38Å; L133-V137 HydrophobicContact CG-CG1 4.47Å; L133-V137 WeakPolarHBondContact O-CG1 3.49Å; L133-V137 PolarHBondContact O-N 3.3Å; L133-F264 HydrophobicContact CD1-CD1 3.93Å; L133-F264 HydrophobicContact CD1-CD2 4.38Å; L133-F264 HydrophobicContact CD1-CE1 3.56Å; L133-F264 HydrophobicContact CD1-CE2 4.06Å; L133-F264 HydrophobicContact CD1-CG 4.33Å; L133-F264 HydrophobicContact CD1-CZ 3.63Å; L133-F264 HydrophobicContact CD2-CE1 4.06Å; L133-F264 HydrophobicContact CD2-CZ 3.7Å; L133-F264 HydrophobicContact CG-CE1 4.48Å; L133-F264 HydrophobicContact CG-CZ 4.3Å; L133-F336 HydrophobicContact CD1-CD1 4.46Å; L133-F336 HydrophobicContact CD1-CD2 4.12Å; L133-F336 HydrophobicContact CD1-CE1 3.92Å; L133-F336 HydrophobicContact CD1-CE2 3.54Å; L133-F336 HydrophobicContact CD1-CZ 3.42Å; L133-F336 VanDerWaalsContact CD1-CZ 3.42Å; L133-F336 HydrophobicContact CD2-CB 4.45Å; L133-F336 HydrophobicContact CD2-CD1 4.28Å; L133-F336 HydrophobicContact CD2-CD2 3.79Å; L133-F336 HydrophobicContact CD2-CE2 4.1Å; L133-F336 HydrophobicContact CD2-CG 3.89Å; L133-F336 HydrophobicContact CD2-CZ 4.46Å; L133-F336 HydrophobicContact CG-CD2 3.81Å; L133-F336 HydrophobicContact CG-CE2 3.64Å; L133-F336 HydrophobicContact CG-CG 4.36Å; L133-F336 HydrophobicContact CG-CZ 4.06Å
134	S	82.1	Confident	81.4	Confident	60 Å²	60	52 Å²	52	42%	0.42	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-61.1	-18.3	-174.2	69.4	0	0	0	0	114.8	P130 S131	P130-S134 PolarHBondContact O-N 3.49Å; S131-S134 WeakPolarHBondContact O-CB 3.44Å; S131-S134 PolarHBondContact O-N 3.35Å; S131-S134 PolarHBondContact O-OG 2.88Å
135	S	83.5	Confident	80.2	Confident	79 Å²	79	58.5 Å²	58.5	55%	0.552	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-91.5	-16.1	175.6	-63.4	0	0	0	0	113.5	L133 N160	L133-S135 PolarHBondContact O-N 3.48Å; S135-N160 PolarHBondContact O-ND2 3.36Å
136	E	86.1	Confident	78.8	Confident	97 Å²	97	59.6 Å²	59.6	45%	0.453	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-32.4	-172.8	-61.9	-168.6	165.7	0	0	112.9	L110 L133 F159 N160	L110-E136 WeakPolarHBondContact CD1-O 3.45Å; L133-E136 PolarHBondContact O-N 3.23Å; E136-F159 CarbonylContact O-C 3.34Å; E136-F159 WeakPolarHBondContact O-CA 3.35Å; E136-N160 PolarHBondContact O-N 3.36Å
137	V	90.5	Very high	77	Confident	3 Å²	3	65.1 Å²	65.1	2%	0.018	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	141.3	-178.4	58.8	0	0	0	0	112	L129 L133 F157 I158 F159 F264	L129-V137 HydrophobicContact CD1-CG1 3.82Å; L129-V137 HydrophobicContact CD1-CG2 4.48Å; L133-V137 HydrophobicContact CB-CG1 3.74Å; L133-V137 HydrophobicContact CD1-CG1 4.38Å; L133-V137 HydrophobicContact CG-CG1 4.47Å; L133-V137 WeakPolarHBondContact O-CG1 3.49Å; L133-V137 PolarHBondContact O-N 3.3Å; V137-F157 HydrophobicContact CG2-CB 4.2Å; V137-F157 HydrophobicContact CG2-CD1 3.96Å; V137-I158 CarbonylContact C-O 3.59Å; V137-I158 WeakPolarHBondContact CA-O 3.48Å; V137-F159 HydrophobicContact CB-CD1 4.23Å; V137-F159 HydrophobicContact CB-CE1 4.31Å; V137-F159 HydrophobicContact CG2-CD1 4.35Å; V137-F159 HydrophobicContact CG2-CE1 4.21Å; V137-F159 HydrophobicContact CG2-CZ 4.4Å; V137-F264 HydrophobicContact CB-CE2 4.02Å; V137-F264 HydrophobicContact CG1-CD2 4.17Å; V137-F264 HydrophobicContact CG1-CE2 3.54Å; V137-F264 HydrophobicContact CG1-CZ 4.28Å; V137-F264 HydrophobicContact CG2-CD2 4.36Å; V137-F264 HydrophobicContact CG2-CE2 4.12Å
138	L	90.6	Very high	75.7	Confident	13 Å²	13	67.2 Å²	67.2	7%	0.068	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	123.6	168.2	176.6	65.6	0	0	0	108.4	L110 L113 R114 L117 F126 I140 I158	L110-L138 HydrophobicContact CD2-CB 4.13Å; L113-L138 HydrophobicContact CB-CD2 4.48Å; L113-L138 HydrophobicContact CD2-CD2 4.1Å; L113-L138 HydrophobicContact CG-CD2 4.01Å; R114-L138 HydrophobicContact CB-CD1 4.01Å; R114-L138 HydrophobicContact CB-CD2 4.12Å; R114-L138 HydrophobicContact CG-CD1 3.97Å; L117-L138 HydrophobicContact CD1-CD2 4.05Å; F126-L138 HydrophobicContact CD1-CD1 4.27Å; F126-L138 HydrophobicContact CE1-CD1 4.5Å; L138-I140 HydrophobicContact CG-CG1 4.35Å; L138-I158 HydrophobicContact CB-CB 4.44Å; L138-I158 HydrophobicContact CD2-CD1 4.3Å; L138-I158 PolarHBondContact N-O 3.22Å; L138-I158 PolarHBondContact O-N 2.89Å
139	L	90.6	Very high	74.5	Confident	4 Å²	4	70.1 Å²	70.1	2%	0.021	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	134.2	173.6	170.4	64.9	0	0	0	110.5	P127 L129 D155 A156 F157 L260	P127-L139 HydrophobicContact CB-CD2 3.74Å; P127-L139 HydrophobicContact CG-CD2 3.68Å; P127-L139 HydrophobicContact CG-CG 4.05Å; L129-L139 HydrophobicContact CD1-CB 3.63Å; L129-L139 HydrophobicContact CD2-CD2 4.16Å; L129-L139 HydrophobicContact CG-CB 4.15Å; L129-L139 HydrophobicContact CG-CD2 4.24Å; L139-D155 HydrophobicContact CD1-CB 4.26Å; L139-A156 WeakPolarHBondContact CA-O 3.5Å; L139-F157 HydrophobicContact CB-CD1 4.28Å; L139-F157 HydrophobicContact CB-CE1 4.29Å; L139-F157 HydrophobicContact CD1-CD1 3.95Å; L139-F157 HydrophobicContact CD1-CD2 4.27Å; L139-F157 HydrophobicContact CD1-CE1 3.67Å; L139-F157 HydrophobicContact CD1-CE2 4.02Å; L139-F157 HydrophobicContact CD1-CG 4.25Å; L139-F157 HydrophobicContact CD1-CZ 3.72Å; L139-F157 HydrophobicContact CD2-CE1 4.16Å; L139-F157 HydrophobicContact CD2-CZ 4.47Å; L139-F157 HydrophobicContact CG-CE1 4.26Å; L139-L260 HydrophobicContact CD2-CD1 3.32Å; L139-L260 HydrophobicContact CD2-CD2 3.65Å; L139-L260 HydrophobicContact CD2-CG 3.86Å
140	I	89	Confident	73.2	Confident	2 Å²	2	75.1 Å²	75.1	1%	0.01	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	130.2	173.9	-49.1	166.2	0	0	0	107.4	L117 Y124 F126 L138 W154 D155 A156 I158 F181	L117-I140 HydrophobicContact CD1-CD1 3.29Å; L117-I140 HydrophobicContact CD1-CG1 4.15Å; Y124-I140 HydrophobicContact CD1-CG2 3.59Å; Y124-I140 HydrophobicContact CE1-CG2 4.39Å; Y124-I140 HydrophobicContact CG-CG2 3.71Å; F126-I140 HydrophobicContact CE1-CG1 4.22Å; L138-I140 HydrophobicContact CG-CG1 4.35Å; I140-W154 HydrophobicContact CB-CZ3 4.5Å; I140-W154 HydrophobicContact CG2-CH2 4.08Å; I140-W154 HydrophobicContact CG2-CZ3 4.12Å; I140-D155 CarbonylContact O-C 3.59Å; I140-D155 WeakPolarHBondContact O-CA 3.47Å; I140-A156 HydrophobicContact CB-CB 4.43Å; I140-A156 PolarHBondContact N-O 3.13Å; I140-A156 PolarHBondContact O-N 2.81Å; I140-I158 HydrophobicContact CD1-CD1 3.3Å; I140-I158 HydrophobicContact CG1-CD1 4.06Å; I140-F181 HydrophobicContact CD1-CZ 4.43Å
141	S	86.5	Confident	72.3	Confident	9 Å²	9	78.7 Å²	78.7	6%	0.063	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	151.3	174.2	-61.7	0	0	0	0	110	K125 P127 L143 D155	K125-S141 PolarHBondContact N-O 3.09Å; K125-S141 PolarHBondContact O-N 2.99Å; P127-S141 WeakPolarHBondContact CG-OG 3.43Å; S141-L143 PolarHBondContact O-N 3.48Å; S141-D155 WeakPolarHBondContact CB-OD1 3.27Å; S141-D155 PolarHBondContact OG-OD1 2.85Å
142	Q	83	Confident	71.9	Confident	80 Å²	80	76 Å²	76	37%	0.374	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	132.7	171.2	-166.4	174.3	5.7	0	0	110.8	S144 P153 W154	Q142-S144 PolarHBondContact O-N 3.25Å; Q142-P153 HydrophobicContact CB-CB 4.06Å; Q142-W154 HydrophobicContact CB-CD2 3.77Å; Q142-W154 VanDerWaalsContact CB-CE2 3.48Å; Q142-W154 HydrophobicContact CB-CG 3.87Å; Q142-W154 HydrophobicContact CB-CZ2 4Å; Q142-W154 HydrophobicContact CG-CD2 4.47Å; Q142-W154 HydrophobicContact CG-CG 4.48Å; Q142-W154 HydrophobicContact CG-CZ2 4.21Å; Q142-W154 VanDerWaalsContact CG-NE1 3.3Å; Q142-W154 PolarHBondContact N-O 3.29Å
143	L	74.3	Confident	72	Confident	66 Å²	66	72 Å²	72	35%	0.346	39%	0.388	S	S	.	.			trans	-76	104.5	165.8	-168.8	69.2	0	0	0	109.1	N122 L123 K125 S141 E145	N122-L143 WeakPolarHBondContact O-CD2 3.46Å; L123-L143 PolarHBondContact O-N 3.17Å; K125-L143 HydrophobicContact CB-CD1 4.46Å; S141-L143 PolarHBondContact O-N 3.48Å; L143-E145 HydrophobicContact CD2-CG 4.44Å; L143-E145 HydrophobicContact CG-CG 4.49Å; L143-E145 PolarHBondContact O-N 3.38Å
144	S	60.6	Low	72.1	Confident	68 Å²	68	72.7 Å²	72.7	48%	0.476	39%	0.39	S	S	.	.			trans	-80.3	102.7	173.4	-72.3	0	0	0	0	110.3	Q142	Q142-S144 PolarHBondContact O-N 3.25Å
145	E	54	Low	72.5	Confident	165 Å²	165	70.2 Å²	70.2	77%	0.771	37%	0.372	S	S	*	.			trans	-87.4	-1.4	170.3	-73.1	-168.1	163.3	0	0	113.6	L143	L143-E145 HydrophobicContact CD2-CG 4.44Å; L143-E145 HydrophobicContact CG-CG 4.49Å; L143-E145 PolarHBondContact O-N 3.38Å
146	I	50.6	Low	72.9	Confident	130 Å²	130	66.4 Å²	66.4	67%	0.667	35%	0.346	S	S	*	.	S	Bend	trans	-135.5	129	-166.5	-60.4	167.9	0	0	0	110.4	T148	I146-T148 HydrophobicContact CG2-CG2 4.32Å; I146-T148 PolarHBondContact O-N 3.04Å
147	N	43.9	Very low	73.3	Confident	160 Å²	160	61.8 Å²	61.8	86%	0.856	32%	0.324	S	S	*	.			trans	-59.1	48.4	173.4	-65.5	-26.7	0	0	0	114	E149	N147-E149 PolarHBondContact O-N 2.94Å
148	T	48.1	Very low	73.5	Confident	72 Å²	72	61.7 Å²	61.7	44%	0.442	32%	0.323	S	S	.	.			trans	-75.8	85.8	160.8	51.1	0	0	0	0	106.5	I146 N150 N151	I146-T148 HydrophobicContact CG2-CG2 4.32Å; I146-T148 PolarHBondContact O-N 3.04Å; T148-N150 PolarHBondContact O-N 3.09Å; T148-N151 PolarHBondContact O-N 3.12Å
149	E	50.4	Low	73.7	Confident	187 Å²	187	61.4 Å²	61.4	87%	0.874	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	-16.3	179	-66.3	-174.4	164	0	0	113.5	N147	N147-E149 PolarHBondContact O-N 2.94Å
150	N	52.7	Low	73.7	Confident	133 Å²	133	64.3 Å²	64.3	71%	0.711	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	-4.6	-175.9	-68.7	-7	0	0	0	115.9	T148	T148-N150 PolarHBondContact O-N 3.09Å
151	N	61.4	Low	73.8	Confident	111 Å²	111	65.7 Å²	65.7	59%	0.594	35%	0.345	S	S	*	.			trans	-103.5	107.2	178.3	-77.8	-13.2	0	0	0	110.5	T148	T148-N151 PolarHBondContact O-N 3.12Å
152	N	69.7	Low	73.9	Confident	28 Å²	28	65.2 Å²	65.2	15%	0.15	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-59.3	126.3	166.6	-168.4	24.8	0	0	0	108.8	N168 Y201	N152-N168 PolarHBondContact O-ND2 3.11Å; N152-Y201 PolarHBondContact ND2-OH 3.45Å
153	P	79.9	Confident	74.5	Confident	40 Å²	40	61.4 Å²	61.4	26%	0.26	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-56.5	149.2	176.3	24	-35	0	0	0	110.7	Q142	Q142-P153 HydrophobicContact CB-CB 4.06Å
154	W	86.3	Confident	75.5	Confident	20 Å²	20	58.3 Å²	58.3	8%	0.076	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-76	144	170.2	62.5	-106.3	0	0	0	110	Y124 I140 Q142 A156 W167 N168 M169	Y124-W154 AromaticContact CD1-CH2 3.49Å; Y124-W154 HydrophobicContact CD1-CH2 3.49Å; Y124-W154 VanDerWaalsContact CD1-CH2 3.49Å; Y124-W154 AromaticContact CD1-CZ2 3.96Å; Y124-W154 HydrophobicContact CD1-CZ2 3.96Å; Y124-W154 AromaticContact CE1-CH2 3.45Å; Y124-W154 HydrophobicContact CE1-CH2 3.45Å; Y124-W154 VanDerWaalsContact CE1-CH2 3.45Å; Y124-W154 AromaticContact CE1-CZ2 3.77Å; Y124-W154 HydrophobicContact CE1-CZ2 3.77Å; I140-W154 HydrophobicContact CB-CZ3 4.5Å; I140-W154 HydrophobicContact CG2-CH2 4.08Å; I140-W154 HydrophobicContact CG2-CZ3 4.12Å; Q142-W154 HydrophobicContact CB-CD2 3.77Å; Q142-W154 VanDerWaalsContact CB-CE2 3.48Å; Q142-W154 HydrophobicContact CB-CG 3.87Å; Q142-W154 HydrophobicContact CB-CZ2 4Å; Q142-W154 HydrophobicContact CG-CD2 4.47Å; Q142-W154 HydrophobicContact CG-CG 4.48Å; Q142-W154 HydrophobicContact CG-CZ2 4.21Å; Q142-W154 VanDerWaalsContact CG-NE1 3.3Å; Q142-W154 PolarHBondContact N-O 3.29Å; W154-A156 HydrophobicContact CE3-CB 4.46Å; W154-A156 HydrophobicContact CZ3-CB 4.17Å; W154-W167 WeakPolarHBondContact CA-O 3.48Å; W154-W167 VanDerWaalsContact CB-O 3.32Å; W154-W167 WeakPolarHBondContact CB-O 3.39Å; W154-N168 WeakPolarHBondContact CB-O 3.43Å; W154-M169 HydrophobicContact CB-CB 4.12Å; W154-M169 HydrophobicContact CD2-CE 3.6Å; W154-M169 HydrophobicContact CE3-CE 3.16Å; W154-M169 HydrophobicContact CG-CE 4.27Å; W154-M169 HydrophobicContact CH2-CE 4.13Å; W154-M169 HydrophobicContact CZ2-CE 4.49Å; W154-M169 HydrophobicContact CZ3-CE 3.47Å; W154-M169 VanDerWaalsContact CZ3-CE 3.47Å
155	D	90.4	Very high	77.2	Confident	7 Å²	7	55 Å²	55	4%	0.037	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	146.9	174.5	-63.5	-43.1	0	0	0	109.4	L139 I140 S141 F157 W167 K263	L139-D155 HydrophobicContact CD1-CB 4.26Å; I140-D155 CarbonylContact O-C 3.59Å; I140-D155 WeakPolarHBondContact O-CA 3.47Å; S141-D155 WeakPolarHBondContact CB-OD1 3.27Å; S141-D155 PolarHBondContact OG-OD1 2.85Å; D155-F157 HydrophobicContact CB-CE2 4.48Å; D155-W167 HydrophobicContact CB-CB 4.1Å; D155-W167 PolarHBondContact N-O 3.39Å; D155-W167 VanDerWaalsContact N-O 3.08Å; D155-W167 PolarHBondContact O-N 3.02Å; D155-K263 IonicContact OD2-NZ 3.97Å; D155-K263 PolarHBondContact OD2-NZ 2.88Å
156	A	92.8	Very high	79.2	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	121.4	178.3	0	0	0	0	0	110	L139 I140 W154 V165 F166 M169	L139-A156 WeakPolarHBondContact CA-O 3.5Å; I140-A156 HydrophobicContact CB-CB 4.43Å; I140-A156 PolarHBondContact N-O 3.13Å; I140-A156 PolarHBondContact O-N 2.81Å; W154-A156 HydrophobicContact CE3-CB 4.46Å; W154-A156 HydrophobicContact CZ3-CB 4.17Å; A156-V165 CarbonylContact C-O 3.53Å; A156-V165 WeakPolarHBondContact CA-O 3.39Å; A156-F166 HydrophobicContact CB-CD1 3.67Å; A156-F166 HydrophobicContact CB-CE1 4.02Å; A156-M169 HydrophobicContact CB-CE 4.05Å
157	F	94.5	Very high	81.2	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	119.9	173.6	-65.6	-91	0	0	0	109.1	V137 L139 D155 F159 A164 V165 W167 L260 K263 F264 S267	V137-F157 HydrophobicContact CG2-CB 4.2Å; V137-F157 HydrophobicContact CG2-CD1 3.96Å; L139-F157 HydrophobicContact CB-CD1 4.28Å; L139-F157 HydrophobicContact CB-CE1 4.29Å; L139-F157 HydrophobicContact CD1-CD1 3.95Å; L139-F157 HydrophobicContact CD1-CD2 4.27Å; L139-F157 HydrophobicContact CD1-CE1 3.67Å; L139-F157 HydrophobicContact CD1-CE2 4.02Å; L139-F157 HydrophobicContact CD1-CG 4.25Å; L139-F157 HydrophobicContact CD1-CZ 3.72Å; L139-F157 HydrophobicContact CD2-CE1 4.16Å; L139-F157 HydrophobicContact CD2-CZ 4.47Å; L139-F157 HydrophobicContact CG-CE1 4.26Å; D155-F157 HydrophobicContact CB-CE2 4.48Å; F157-F159 HydrophobicContact CB-CE2 3.79Å; F157-F159 HydrophobicContact CB-CZ 4.24Å; F157-A164 CarbonylContact O-C 3.57Å; F157-A164 VanDerWaalsContact O-CA 3.3Å; F157-A164 WeakPolarHBondContact O-CA 3.18Å; F157-V165 HydrophobicContact CB-CB 4.43Å; F157-V165 PolarHBondContact N-O 2.92Å; F157-V165 PolarHBondContact O-N 2.8Å; F157-W167 AromaticContact CD2-CD1 3.74Å; F157-W167 AromaticContact CD2-NE1 3.64Å; F157-W167 AromaticContact CE2-CD1 3.81Å; F157-W167 AromaticContact CE2-NE1 3.64Å; F157-L260 HydrophobicContact CZ-CD1 4.43Å; F157-K263 HydrophobicContact CE2-CB 4.1Å; F157-K263 HydrophobicContact CZ-CB 4Å; F157-F264 HydrophobicContact CD1-CD2 4.07Å; F157-F264 HydrophobicContact CE1-CB 3.86Å; F157-F264 HydrophobicContact CE1-CD2 4.09Å; F157-F264 HydrophobicContact CE1-CG 4.49Å; F157-F264 HydrophobicContact CZ-CB 4.28Å; F157-S267 WeakPolarHBondContact CD2-OG 3.4Å; F157-S267 WeakPolarHBondContact CE2-OG 3.45Å
158	I	94.8	Very high	83.4	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	119.5	177.6	-58.6	134.2	0	0	0	108.2	T108 L110 L113 V137 L138 I140 A164 F181	T108-I158 HydrophobicContact CG2-CG2 4.26Å; L110-I158 HydrophobicContact CD2-CB 4.39Å; L110-I158 HydrophobicContact CD2-CG2 3.83Å; L113-I158 HydrophobicContact CD2-CD1 4.08Å; L113-I158 HydrophobicContact CD2-CG2 3.9Å; V137-I158 CarbonylContact C-O 3.59Å; V137-I158 WeakPolarHBondContact CA-O 3.48Å; L138-I158 HydrophobicContact CB-CB 4.44Å; L138-I158 HydrophobicContact CD2-CD1 4.3Å; L138-I158 PolarHBondContact N-O 3.22Å; L138-I158 PolarHBondContact O-N 2.89Å; I140-I158 HydrophobicContact CD1-CD1 3.3Å; I140-I158 HydrophobicContact CG1-CD1 4.06Å; I158-A164 HydrophobicContact CG1-CB 4.3Å; I158-F181 HydrophobicContact CD1-CE1 3.8Å; I158-F181 HydrophobicContact CD1-CE2 3.96Å; I158-F181 HydrophobicContact CD1-CZ 3.49Å; I158-F181 VanDerWaalsContact CD1-CZ 3.49Å; I158-F181 HydrophobicContact CG1-CD2 4.24Å; I158-F181 HydrophobicContact CG1-CE1 4.38Å; I158-F181 HydrophobicContact CG1-CE2 3.72Å; I158-F181 HydrophobicContact CG1-CZ 3.82Å
159	F	94.1	Very high	85.3	Confident	8 Å²	8	32.4 Å²	32.4	4%	0.035	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	147.3	-178	-65.3	-94	0	0	0	110.9	E136 V137 F157 N161 G162 V163 V165 F264 D268 A271	E136-F159 CarbonylContact O-C 3.34Å; E136-F159 WeakPolarHBondContact O-CA 3.35Å; V137-F159 HydrophobicContact CB-CD1 4.23Å; V137-F159 HydrophobicContact CB-CE1 4.31Å; V137-F159 HydrophobicContact CG2-CD1 4.35Å; V137-F159 HydrophobicContact CG2-CE1 4.21Å; V137-F159 HydrophobicContact CG2-CZ 4.4Å; F157-F159 HydrophobicContact CB-CE2 3.79Å; F157-F159 HydrophobicContact CB-CZ 4.24Å; F159-N161 WeakPolarHBondContact CB-OD1 3.27Å; F159-N161 PolarHBondContact O-N 3.18Å; F159-N161 VanDerWaalsContact O-N 3.09Å; F159-G162 PolarHBondContact O-N 3.12Å; F159-V163 WeakPolarHBondContact CB-O 3.18Å; F159-V163 PolarHBondContact N-O 3.29Å; F159-V165 HydrophobicContact CE2-CB 4.48Å; F159-V165 HydrophobicContact CE2-CG2 4.01Å; F159-F264 AromaticContact CE1-CE2 3.91Å; F159-F264 HydrophobicContact CE1-CE2 3.91Å; F159-F264 HydrophobicContact CZ-CE2 4.31Å; F159-D268 HydrophobicContact CE1-CB 4.16Å; F159-D268 HydrophobicContact CZ-CB 4.26Å; F159-A271 HydrophobicContact CD1-CB 4.4Å; F159-A271 HydrophobicContact CD2-CB 3.65Å; F159-A271 HydrophobicContact CE1-CB 4.33Å; F159-A271 HydrophobicContact CE2-CB 3.58Å; F159-A271 HydrophobicContact CG-CB 4.08Å; F159-A271 HydrophobicContact CZ-CB 3.94Å
160	N	91.4	Very high	87	Confident	64 Å²	64	26.6 Å²	26.6	34%	0.342	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-17.7	177.8	69.8	0.6	0	0	0	113.2	C107 T108 L110 S135 E136 G162	C107-N160 CarbonylContact C-O 3.32Å; C107-N160 WeakPolarHBondContact CA-O 3.23Å; C107-N160 WeakPolarHBondContact CB-O 3.41Å; T108-N160 PolarHBondContact N-O 2.87Å; L110-N160 HydrophobicContact CD1-CB 3.91Å; L110-N160 HydrophobicContact CG-CB 4.2Å; S135-N160 PolarHBondContact O-ND2 3.36Å; E136-N160 PolarHBondContact O-N 3.36Å; N160-G162 PolarHBondContact O-N 3.08Å
161	N	89.5	Confident	88.5	Confident	31 Å²	31	23.4 Å²	23.4	17%	0.166	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	9.9	-179	69.1	3.3	0	0	0	113.3	Q106 F159 V163 K275	Q106-N161 CarbonylContact O-C 3.56Å; F159-N161 WeakPolarHBondContact CB-OD1 3.27Å; F159-N161 PolarHBondContact O-N 3.18Å; F159-N161 VanDerWaalsContact O-N 3.09Å; N161-V163 WeakPolarHBondContact OD1-CB 3.41Å; N161-V163 WeakPolarHBondContact OD1-CG2 3.28Å; N161-V163 PolarHBondContact OD1-N 3.23Å; N161-K275 PolarHBondContact O-NZ 3.05Å
162	G	90.5	Very high	89.6	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	79.8	23.3	176.5	0	0	0	0	0	114.5	F104 A105 F159 N160	F104-G162 VanDerWaalsContact CD1-O 3.29Å; F104-G162 WeakPolarHBondContact CD1-O 3.37Å; F104-G162 WeakPolarHBondContact CE1-O 3.47Å; F104-G162 PolarHBondContact N-O 3Å; A105-G162 PolarHBondContact N-O 3.33Å; F159-G162 PolarHBondContact O-N 3.12Å; N160-G162 PolarHBondContact O-N 3.08Å
163	V	94	Very high	90.4	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	138.2	174.9	-176.4	0	0	0	0	109.6	Y102 F159 N161 A271 V274 K275	Y102-V163 CarbonylContact O-C 3.58Å; Y102-V163 VanDerWaalsContact O-CA 3.3Å; Y102-V163 WeakPolarHBondContact O-CA 3.41Å; Y102-V163 WeakPolarHBondContact O-CG1 3.21Å; F159-V163 WeakPolarHBondContact CB-O 3.18Å; F159-V163 PolarHBondContact N-O 3.29Å; N161-V163 WeakPolarHBondContact OD1-CB 3.41Å; N161-V163 WeakPolarHBondContact OD1-CG2 3.28Å; N161-V163 PolarHBondContact OD1-N 3.23Å; V163-A271 HydrophobicContact CB-CB 4.24Å; V163-A271 HydrophobicContact CG1-CB 3.83Å; V163-V274 HydrophobicContact CG1-CB 4.01Å; V163-V274 HydrophobicContact CG1-CG1 3.87Å; V163-V274 HydrophobicContact CG2-CG1 4.25Å; V163-K275 HydrophobicContact CG2-CB 4.16Å; V163-K275 HydrophobicContact CG2-CD 4.38Å
164	A	95.5	Very high	90.9	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	138.6	172.1	0	0	0	0	0	109.6	G101 Y102 F104 F157 I158 F166 F181	G101-A164 CarbonylContact C-O 3.56Å; G101-A164 WeakPolarHBondContact CA-O 3.47Å; Y102-A164 PolarHBondContact N-O 3.47Å; Y102-A164 PolarHBondContact O-N 3.43Å; F104-A164 HydrophobicContact CD1-CB 4.4Å; F104-A164 HydrophobicContact CE1-CB 3.78Å; F157-A164 CarbonylContact O-C 3.57Å; F157-A164 VanDerWaalsContact O-CA 3.3Å; F157-A164 WeakPolarHBondContact O-CA 3.18Å; I158-A164 HydrophobicContact CG1-CB 4.3Å; A164-F166 HydrophobicContact CB-CE1 4.37Å; A164-F166 HydrophobicContact CB-CE2 4.4Å; A164-F166 HydrophobicContact CB-CZ 4Å; A164-F181 HydrophobicContact CB-CD2 4.23Å; A164-F181 HydrophobicContact CB-CE2 4.19Å
165	V	96.4	Very high	90.9	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	121.3	176.9	177.8	0	0	0	0	108.4	I99 A156 F157 F159 L270 A271	I99-V165 HydrophobicContact CG2-CG1 3.69Å; A156-V165 CarbonylContact C-O 3.53Å; A156-V165 WeakPolarHBondContact CA-O 3.39Å; F157-V165 HydrophobicContact CB-CB 4.43Å; F157-V165 PolarHBondContact N-O 2.92Å; F157-V165 PolarHBondContact O-N 2.8Å; F159-V165 HydrophobicContact CE2-CB 4.48Å; F159-V165 HydrophobicContact CE2-CG2 4.01Å; V165-L270 HydrophobicContact CG1-CD2 3.91Å; V165-L270 HydrophobicContact CG2-CD2 4.34Å; V165-L270 HydrophobicContact CG2-CG 4.47Å; V165-A271 HydrophobicContact CG2-CB 4.25Å
166	F	95.3	Very high	90.8	Very high	1 Å²	1	34 Å²	34	0%	0.004	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	133.2	179.3	-55	-62.8	0	0	0	110.3	I99 S100 Y102 A156 A164 M169 H174 L177 L178 F181	I99-F166 CarbonylContact C-O 3.57Å; I99-F166 VanDerWaalsContact CA-O 3.25Å; I99-F166 WeakPolarHBondContact CA-O 3.34Å; S100-F166 PolarHBondContact N-O 3.14Å; S100-F166 PolarHBondContact O-N 2.81Å; Y102-F166 AromaticContact CD2-CD2 3.51Å; Y102-F166 HydrophobicContact CD2-CD2 3.51Å; Y102-F166 AromaticContact CD2-CE2 3.47Å; Y102-F166 HydrophobicContact CD2-CE2 3.47Å; Y102-F166 VanDerWaalsContact CD2-CE2 3.47Å; Y102-F166 AromaticContact CE2-CD2 3.67Å; Y102-F166 HydrophobicContact CE2-CD2 3.67Å; Y102-F166 AromaticContact CE2-CE2 3.85Å; Y102-F166 HydrophobicContact CE2-CE2 3.85Å; Y102-F166 HydrophobicContact CG-CE2 4.34Å; A156-F166 HydrophobicContact CB-CD1 3.67Å; A156-F166 HydrophobicContact CB-CE1 4.02Å; A164-F166 HydrophobicContact CB-CE1 4.37Å; A164-F166 HydrophobicContact CB-CE2 4.4Å; A164-F166 HydrophobicContact CB-CZ 4Å; F166-M169 HydrophobicContact CB-CB 3.87Å; F166-M169 HydrophobicContact CB-SD 4.28Å; F166-M169 HydrophobicContact CD1-CE 3.69Å; F166-M169 HydrophobicContact CD1-SD 3.6Å; F166-M169 VanDerWaalsContact CD1-SD 3.6Å; F166-M169 HydrophobicContact CE1-CE 4.2Å; F166-M169 HydrophobicContact CE1-SD 4.02Å; F166-M169 HydrophobicContact CG-CE 4.45Å; F166-M169 HydrophobicContact CG-SD 3.95Å; F166-H174 AromaticContact CD2-CD2 3.6Å; F166-H174 AromaticContact CD2-NE2 3.89Å; F166-H174 HydrophobicContact CE2-CB 4.4Å; F166-H174 AromaticContact CG-CD2 3.92Å; F166-L177 HydrophobicContact CE1-CD1 4.11Å; F166-L177 HydrophobicContact CZ-CB 4.44Å; F166-L178 HydrophobicContact CE2-CD2 4.32Å; F166-L178 HydrophobicContact CE2-CG 4.33Å; F166-L178 HydrophobicContact CZ-CD2 4.34Å; F166-L178 HydrophobicContact CZ-CG 4.42Å; F166-F181 AromaticContact CE1-CE2 3.76Å; F166-F181 HydrophobicContact CE1-CE2 3.76Å; F166-F181 HydrophobicContact CE1-CZ 4.35Å; F166-F181 HydrophobicContact CZ-CD2 4.45Å; F166-F181 AromaticContact CZ-CE2 3.76Å; F166-F181 HydrophobicContact CZ-CE2 3.76Å
167	W	93.1	Very high	90.6	Very high	1 Å²	1	34.4 Å²	34.4	0%	0.004	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	123.3	177	-71.4	71	0	0	0	109.4	I99 W154 D155 F157 M169 Y201 I215 K263 F266 S267	I99-W167 HydrophobicContact CD1-CD2 4.11Å; I99-W167 HydrophobicContact CD1-CE3 3.7Å; I99-W167 HydrophobicContact CD1-CH2 3.52Å; I99-W167 HydrophobicContact CD1-CZ2 3.93Å; I99-W167 HydrophobicContact CD1-CZ3 3.4Å; I99-W167 HydrophobicContact CG1-CD2 3.84Å; I99-W167 HydrophobicContact CG1-CE3 3.69Å; I99-W167 HydrophobicContact CG1-CG 4.4Å; I99-W167 HydrophobicContact CG1-CH2 4.34Å; I99-W167 HydrophobicContact CG1-CZ2 4.46Å; I99-W167 HydrophobicContact CG1-CZ3 3.96Å; I99-W167 HydrophobicContact CG2-CD2 4.42Å; W154-W167 WeakPolarHBondContact CA-O 3.48Å; W154-W167 VanDerWaalsContact CB-O 3.32Å; W154-W167 WeakPolarHBondContact CB-O 3.39Å; D155-W167 HydrophobicContact CB-CB 4.1Å; D155-W167 PolarHBondContact N-O 3.39Å; D155-W167 VanDerWaalsContact N-O 3.08Å; D155-W167 PolarHBondContact O-N 3.02Å; F157-W167 AromaticContact CD2-CD1 3.74Å; F157-W167 AromaticContact CD2-NE1 3.64Å; F157-W167 AromaticContact CE2-CD1 3.81Å; F157-W167 AromaticContact CE2-NE1 3.64Å; W167-M169 PolarHBondContact O-N 2.87Å; W167-Y201 AromaticContact CE3-CD1 3.89Å; W167-Y201 HydrophobicContact CE3-CD1 3.89Å; W167-Y201 HydrophobicContact CE3-CD2 4.43Å; W167-Y201 AromaticContact CE3-CE1 3.74Å; W167-Y201 HydrophobicContact CE3-CE1 3.74Å; W167-Y201 HydrophobicContact CE3-CE2 4.34Å; W167-Y201 HydrophobicContact CE3-CG 4.2Å; W167-Y201 HydrophobicContact CZ3-CD1 4.04Å; W167-Y201 HydrophobicContact CZ3-CD2 4.19Å; W167-Y201 HydrophobicContact CZ3-CE1 4.31Å; W167-Y201 AromaticContact CZ3-CG 3.93Å; W167-Y201 HydrophobicContact CZ3-CG 3.93Å; W167-I215 HydrophobicContact CH2-CD1 4.46Å; W167-K263 HydrophobicContact CD2-CD 4.47Å; W167-K263 HydrophobicContact CE3-CD 4.31Å; W167-K263 HydrophobicContact CE3-CG 4.29Å; W167-K263 HydrophobicContact CH2-CB 4.25Å; W167-K263 HydrophobicContact CH2-CG 4.13Å; W167-K263 HydrophobicContact CZ2-CB 4.07Å; W167-K263 HydrophobicContact CZ2-CG 4.4Å; W167-K263 WeakPolarHBondContact CZ2-O 3.41Å; W167-K263 HydrophobicContact CZ3-CG 4.06Å; W167-F266 HydrophobicContact CH2-CB 3.95Å; W167-F266 HydrophobicContact CH2-CD2 4.1Å; W167-F266 HydrophobicContact CH2-CG 4.47Å; W167-F266 HydrophobicContact CZ2-CB 3.87Å; W167-S267 PolarHBondContact NE1-OG 3.09Å
168	N	90.1	Very high	90.4	Very high	41 Å²	41	34.8 Å²	34.8	22%	0.219	18%	0.183	C	C	.	.	S	Bend	trans	49.8	29.8	179.5	-168.5	38.8	0	0	0	114	Y97 D98 N152 W154 Y201	Y97-N168 HydrophobicContact CD1-CB 4.45Å; Y97-N168 VanDerWaalsContact CD1-OD1 3.24Å; Y97-N168 WeakPolarHBondContact CD1-OD1 3.41Å; D98-N168 PolarHBondContact O-N 2.78Å; N152-N168 PolarHBondContact O-ND2 3.11Å; W154-N168 WeakPolarHBondContact CB-O 3.43Å; N168-Y201 HydrophobicContact CB-CE1 4.4Å; N168-Y201 WeakPolarHBondContact CB-OH 3.37Å
169	M	89.1	Confident	90.2	Very high	8 Å²	8	40.3 Å²	40.3	4%	0.039	21%	0.207	C	C	.	.			trans	-89.4	137.1	177.3	-174.6	175.8	-71.2	0	0	109.4	W154 A156 F166 W167 N173 H174 L177	W154-M169 HydrophobicContact CB-CB 4.12Å; W154-M169 HydrophobicContact CD2-CE 3.6Å; W154-M169 HydrophobicContact CE3-CE 3.16Å; W154-M169 HydrophobicContact CG-CE 4.27Å; W154-M169 HydrophobicContact CH2-CE 4.13Å; W154-M169 HydrophobicContact CZ2-CE 4.49Å; W154-M169 HydrophobicContact CZ3-CE 3.47Å; W154-M169 VanDerWaalsContact CZ3-CE 3.47Å; A156-M169 HydrophobicContact CB-CE 4.05Å; F166-M169 HydrophobicContact CB-CB 3.87Å; F166-M169 HydrophobicContact CB-SD 4.28Å; F166-M169 HydrophobicContact CD1-CE 3.69Å; F166-M169 HydrophobicContact CD1-SD 3.6Å; F166-M169 VanDerWaalsContact CD1-SD 3.6Å; F166-M169 HydrophobicContact CE1-CE 4.2Å; F166-M169 HydrophobicContact CE1-SD 4.02Å; F166-M169 HydrophobicContact CG-CE 4.45Å; F166-M169 HydrophobicContact CG-SD 3.95Å; W167-M169 PolarHBondContact O-N 2.87Å; M169-N173 HydrophobicContact CG-CB 3.93Å; M169-N173 HydrophobicContact SD-CB 4.02Å; M169-H174 WeakPolarHBondContact CB-NE2 3.48Å; M169-H174 PolarHBondContact O-NE2 3.1Å; M169-L177 HydrophobicContact CE-CD1 3.44Å; M169-L177 VanDerWaalsContact CE-CD1 3.44Å; M169-L177 HydrophobicContact SD-CD1 3.48Å; M169-L177 WeakPolarHBondContact SD-CD1 3.38Å
170	P	85.7	Confident	89.9	Confident	66 Å²	66	42.1 Å²	42.1	43%	0.429	22%	0.215	S	C	.	.			trans	-64.2	139.1	172.3	-22.2	33.5	0	0	0	112	E172 N173 H174	P170-E172 PolarHBondContact O-N 3.25Å; P170-E172 VanDerWaalsContact O-N 3.1Å; P170-N173 WeakPolarHBondContact O-CB 3.47Å; P170-N173 PolarHBondContact O-N 2.87Å; P170-H174 PolarHBondContact O-N 3.3Å
171	E	84	Confident	89.8	Confident	65 Å²	65	39 Å²	39	30%	0.304	20%	0.199	S	C	.	.	H	α-helix	trans	-53.1	-33.5	179.3	-70	-60.8	140.4	0	0	114.8	Y102 N173 H174 R196	Y102-E171 PolarHBondContact OH-OE2 3.43Å; E171-N173 PolarHBondContact O-N 3.35Å; E171-H174 VanDerWaalsContact CD-CE1 3.46Å; E171-H174 WeakPolarHBondContact O-CB 3.33Å; E171-H174 PolarHBondContact O-N 2.98Å; E171-H174 IonicContact OE1-CE1 3.05Å; E171-H174 PolarHBondContact OE1-CE1 3.15Å; E171-H174 IonicContact OE1-ND1 3.89Å; E171-H174 PolarHBondContact OE1-ND1 3.02Å; E171-H174 IonicContact OE2-CE1 3.9Å; E171-H174 IonicContact OE2-ND1 3.25Å; E171-H174 PolarHBondContact OE2-ND1 3.39Å; E171-R196 VanDerWaalsContact CD-NH2 3.32Å; E171-R196 IonicContact OE1-CZ 3.57Å; E171-R196 IonicContact OE1-NH1 3.55Å; E171-R196 IonicContact OE1-NH2 2.98Å; E171-R196 PolarHBondContact OE1-NH2 2.7Å; E171-R196 IonicContact OE2-CZ 3.02Å; E171-R196 IonicContact OE2-NH1 2.87Å; E171-R196 PolarHBondContact OE2-NH1 2.89Å; E171-R196 IonicContact OE2-NH2 2.68Å; E171-R196 PolarHBondContact OE2-NH2 3.35Å
172	E	84.2	Confident	89.8	Confident	160 Å²	160	39.1 Å²	39.1	75%	0.748	20%	0.197	S	C	*	.	H	α-helix	trans	-61.3	-33.5	178.3	-61.8	172.7	-130.9	0	0	111.6	P170	P170-E172 PolarHBondContact O-N 3.25Å; P170-E172 VanDerWaalsContact O-N 3.1Å
173	N	86.7	Confident	89.7	Confident	68 Å²	68	45.5 Å²	45.5	36%	0.364	23%	0.227	S	C	.	.	H	α-helix	trans	-80.2	-27.4	179.9	-66.5	9.5	0	0	0	111.7	M169 P170 E171 Q175 S176 L177	M169-N173 HydrophobicContact CG-CB 3.93Å; M169-N173 HydrophobicContact SD-CB 4.02Å; P170-N173 WeakPolarHBondContact O-CB 3.47Å; P170-N173 PolarHBondContact O-N 2.87Å; E171-N173 PolarHBondContact O-N 3.35Å; N173-Q175 VanDerWaalsContact C-N 3.3Å; N173-Q175 PolarHBondContact O-N 3.13Å; N173-S176 PolarHBondContact O-N 2.81Å; N173-L177 PolarHBondContact O-N 2.76Å
174	H	89.8	Confident	89.6	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.009	24%	0.235	C	C	.	.	H	α-helix	trans	-54.5	-48	178.4	-62.7	171.4	0	0	0	110.6	Y102 F166 M169 P170 E171 S176 L178	Y102-H174 HydrophobicContact CE2-CB 4.14Å; Y102-H174 AromaticContact CE2-CG 3.88Å; Y102-H174 AromaticContact CE2-ND1 3.57Å; Y102-H174 AromaticContact CZ-ND1 3.71Å; Y102-H174 PolarHBondContact OH-ND1 3.01Å; F166-H174 AromaticContact CD2-CD2 3.6Å; F166-H174 AromaticContact CD2-NE2 3.89Å; F166-H174 HydrophobicContact CE2-CB 4.4Å; F166-H174 AromaticContact CG-CD2 3.92Å; M169-H174 WeakPolarHBondContact CB-NE2 3.48Å; M169-H174 PolarHBondContact O-NE2 3.1Å; P170-H174 PolarHBondContact O-N 3.3Å; E171-H174 VanDerWaalsContact CD-CE1 3.46Å; E171-H174 WeakPolarHBondContact O-CB 3.33Å; E171-H174 PolarHBondContact O-N 2.98Å; E171-H174 IonicContact OE1-CE1 3.05Å; E171-H174 PolarHBondContact OE1-CE1 3.15Å; E171-H174 IonicContact OE1-ND1 3.89Å; E171-H174 PolarHBondContact OE1-ND1 3.02Å; E171-H174 IonicContact OE2-CE1 3.9Å; E171-H174 IonicContact OE2-ND1 3.25Å; E171-H174 PolarHBondContact OE2-ND1 3.39Å; H174-S176 PolarHBondContact O-N 3.01Å; H174-L178 VanDerWaalsContact O-CB 3.25Å; H174-L178 WeakPolarHBondContact O-CB 3.27Å; H174-L178 WeakPolarHBondContact O-CD1 3.1Å; H174-L178 WeakPolarHBondContact O-CG 3.47Å; H174-L178 PolarHBondContact O-N 3.28Å
175	Q	87.4	Confident	89.4	Confident	130 Å²	130	48 Å²	48	61%	0.607	24%	0.239	S	C	*	.	H	α-helix	trans	-65.7	-38.3	-177	-63.4	-173.7	2.5	0	0	113	N173 K179	N173-Q175 VanDerWaalsContact C-N 3.3Å; N173-Q175 PolarHBondContact O-N 3.13Å; Q175-K179 VanDerWaalsContact O-CG 3.29Å; Q175-K179 WeakPolarHBondContact O-CG 3.39Å; Q175-K179 PolarHBondContact O-N 3.35Å; Q175-K179 VanDerWaalsContact O-N 3.17Å
176	S	88.5	Confident	88.9	Confident	68 Å²	68	53.1 Å²	53.1	48%	0.476	26%	0.263	S	S	.	.	H	α-helix	trans	-68.1	-48.8	-179.8	-60.5	0	0	0	0	110.8	N173 H174 L178 K179 E180	N173-S176 PolarHBondContact O-N 2.81Å; H174-S176 PolarHBondContact O-N 3.01Å; S176-L178 PolarHBondContact O-N 3.06Å; S176-K179 WeakPolarHBondContact O-CB 3.26Å; S176-K179 PolarHBondContact O-N 3.5Å; S176-E180 PolarHBondContact O-N 3.48Å
177	L	88.4	Confident	88.4	Confident	10 Å²	10	54.4 Å²	54.4	5%	0.052	28%	0.277	C	S	.	.	H	α-helix	trans	-66.4	-39.3	178	-71	179.8	0	0	0	112.6	F166 M169 N173 K179 E180 F181	F166-L177 HydrophobicContact CE1-CD1 4.11Å; F166-L177 HydrophobicContact CZ-CB 4.44Å; M169-L177 HydrophobicContact CE-CD1 3.44Å; M169-L177 VanDerWaalsContact CE-CD1 3.44Å; M169-L177 HydrophobicContact SD-CD1 3.48Å; M169-L177 WeakPolarHBondContact SD-CD1 3.38Å; N173-L177 PolarHBondContact O-N 2.76Å; L177-K179 VanDerWaalsContact C-N 3.26Å; L177-K179 PolarHBondContact O-N 2.79Å; L177-E180 WeakPolarHBondContact O-CA 3.25Å; L177-E180 WeakPolarHBondContact O-CB 3.37Å; L177-E180 PolarHBondContact O-N 3.32Å; L177-F181 HydrophobicContact CB-CE1 4.37Å; L177-F181 HydrophobicContact CB-CE2 4.01Å; L177-F181 HydrophobicContact CB-CZ 3.85Å; L177-F181 HydrophobicContact CD1-CZ 4.36Å; L177-F181 HydrophobicContact CD2-CE1 4.4Å; L177-F181 HydrophobicContact CD2-CZ 4.31Å; L177-F181 HydrophobicContact CG-CZ 4.42Å; L177-F181 WeakPolarHBondContact O-CD1 3.49Å; L177-F181 WeakPolarHBondContact O-CG 3.5Å; L177-F181 PolarHBondContact O-N 2.85Å
178	L	90.1	Very high	88.1	Confident	8 Å²	8	58.7 Å²	58.7	4%	0.042	30%	0.299	C	S	.	.	H	α-helix	trans	-61.8	-35.4	175.7	-72.7	170.9	0	0	0	111.9	Y102 F104 F166 H174 S176 E180 R182	Y102-L178 HydrophobicContact CD1-CD1 3.8Å; Y102-L178 HydrophobicContact CD2-CD1 4.45Å; Y102-L178 HydrophobicContact CE1-CD1 4.07Å; Y102-L178 HydrophobicContact CG-CD1 3.99Å; Y102-L178 HydrophobicContact CG-CD2 4.36Å; F104-L178 HydrophobicContact CB-CD2 4.29Å; F104-L178 HydrophobicContact CD1-CD2 3.82Å; F104-L178 HydrophobicContact CE1-CD2 4.44Å; F104-L178 HydrophobicContact CG-CD2 4.1Å; F166-L178 HydrophobicContact CE2-CD2 4.32Å; F166-L178 HydrophobicContact CE2-CG 4.33Å; F166-L178 HydrophobicContact CZ-CD2 4.34Å; F166-L178 HydrophobicContact CZ-CG 4.42Å; H174-L178 VanDerWaalsContact O-CB 3.25Å; H174-L178 WeakPolarHBondContact O-CB 3.27Å; H174-L178 WeakPolarHBondContact O-CD1 3.1Å; H174-L178 WeakPolarHBondContact O-CG 3.47Å; H174-L178 PolarHBondContact O-N 3.28Å; S176-L178 PolarHBondContact O-N 3.06Å; L178-E180 VanDerWaalsContact C-N 3.33Å; L178-R182 WeakPolarHBondContact O-CB 2.88Å; L178-R182 WeakPolarHBondContact O-CG 3.46Å; L178-R182 PolarHBondContact O-N 2.94Å
179	K	89.4	Confident	88	Confident	116 Å²	116	58.5 Å²	58.5	50%	0.504	30%	0.297	S	S	.	.	H	α-helix	trans	-66.7	-34.1	173.3	-74.4	171	-176.3	173.9	0	112.3	Q175 S176 L177 Q183	Q175-K179 VanDerWaalsContact O-CG 3.29Å; Q175-K179 WeakPolarHBondContact O-CG 3.39Å; Q175-K179 PolarHBondContact O-N 3.35Å; Q175-K179 VanDerWaalsContact O-N 3.17Å; S176-K179 WeakPolarHBondContact O-CB 3.26Å; S176-K179 PolarHBondContact O-N 3.5Å; L177-K179 VanDerWaalsContact C-N 3.26Å; L177-K179 PolarHBondContact O-N 2.79Å; K179-Q183 PolarHBondContact O-NE2 2.86Å
180	E	88.1	Confident	87.8	Confident	45 Å²	45	63.6 Å²	63.6	21%	0.21	32%	0.321	C	S	.	.	H	α-helix	trans	-70.4	-49.5	174	-67.3	176.9	-167.2	0	0	111.1	S176 L177 L178 R182 Q183 F184	S176-E180 PolarHBondContact O-N 3.48Å; L177-E180 WeakPolarHBondContact O-CA 3.25Å; L177-E180 WeakPolarHBondContact O-CB 3.37Å; L177-E180 PolarHBondContact O-N 3.32Å; L178-E180 VanDerWaalsContact C-N 3.33Å; E180-R182 VanDerWaalsContact C-N 3.28Å; E180-R182 PolarHBondContact O-N 3.12Å; E180-Q183 WeakPolarHBondContact O-CB 3.33Å; E180-Q183 PolarHBondContact O-N 2.89Å; E180-F184 WeakPolarHBondContact O-CD2 3.43Å
181	F	90.3	Very high	87.6	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-62.2	-35.2	-178.5	-58.2	-17.3	0	0	0	112.4	F104 L113 I140 I158 A164 F166 L177 Q183 F184 S185	F104-F181 HydrophobicContact CE2-CB 3.86Å; F104-F181 HydrophobicContact CZ-CB 3.82Å; F104-F181 HydrophobicContact CZ-CD2 4.46Å; L113-F181 HydrophobicContact CD1-CD1 3.82Å; L113-F181 HydrophobicContact CD1-CE1 4.27Å; L113-F181 HydrophobicContact CD2-CD1 3.92Å; L113-F181 HydrophobicContact CD2-CE1 4.32Å; I140-F181 HydrophobicContact CD1-CZ 4.43Å; I158-F181 HydrophobicContact CD1-CE1 3.8Å; I158-F181 HydrophobicContact CD1-CE2 3.96Å; I158-F181 HydrophobicContact CD1-CZ 3.49Å; I158-F181 VanDerWaalsContact CD1-CZ 3.49Å; I158-F181 HydrophobicContact CG1-CD2 4.24Å; I158-F181 HydrophobicContact CG1-CE1 4.38Å; I158-F181 HydrophobicContact CG1-CE2 3.72Å; I158-F181 HydrophobicContact CG1-CZ 3.82Å; A164-F181 HydrophobicContact CB-CD2 4.23Å; A164-F181 HydrophobicContact CB-CE2 4.19Å; F166-F181 AromaticContact CE1-CE2 3.76Å; F166-F181 HydrophobicContact CE1-CE2 3.76Å; F166-F181 HydrophobicContact CE1-CZ 4.35Å; F166-F181 HydrophobicContact CZ-CD2 4.45Å; F166-F181 AromaticContact CZ-CE2 3.76Å; F166-F181 HydrophobicContact CZ-CE2 3.76Å; L177-F181 HydrophobicContact CB-CE1 4.37Å; L177-F181 HydrophobicContact CB-CE2 4.01Å; L177-F181 HydrophobicContact CB-CZ 3.85Å; L177-F181 HydrophobicContact CD1-CZ 4.36Å; L177-F181 HydrophobicContact CD2-CE1 4.4Å; L177-F181 HydrophobicContact CD2-CZ 4.31Å; L177-F181 HydrophobicContact CG-CZ 4.42Å; L177-F181 WeakPolarHBondContact O-CD1 3.49Å; L177-F181 WeakPolarHBondContact O-CG 3.5Å; L177-F181 PolarHBondContact O-N 2.85Å; F181-Q183 PolarHBondContact O-N 3.34Å; F181-F184 PolarHBondContact O-N 3.33Å; F181-F184 VanDerWaalsContact O-N 3.11Å; F181-S185 PolarHBondContact O-N 3.31Å; F181-S185 PolarHBondContact O-OG 3.06Å
182	R	88.3	Confident	87.5	Confident	33 Å²	33	71.3 Å²	71.3	13%	0.125	36%	0.357	C	S	.	.	H	α-helix	trans	-60	-28.5	174.7	-80	179.3	-173.4	107.2	24.7	113.5	F104 L178 E180 F184 S185 I188	F104-R182 HydrophobicContact CD2-CG 4.03Å; L178-R182 WeakPolarHBondContact O-CB 2.88Å; L178-R182 WeakPolarHBondContact O-CG 3.46Å; L178-R182 PolarHBondContact O-N 2.94Å; E180-R182 VanDerWaalsContact C-N 3.28Å; E180-R182 PolarHBondContact O-N 3.12Å; R182-F184 PolarHBondContact O-N 3.47Å; R182-S185 PolarHBondContact O-N 3.26Å; R182-I188 HydrophobicContact CB-CG2 4.49Å; R182-I188 HydrophobicContact CG-CG2 3.98Å; R182-I188 WeakPolarHBondContact O-CD1 3.38Å
183	Q	89.8	Confident	87.5	Confident	133 Å²	133	67 Å²	67	62%	0.621	34%	0.338	S	S	*	.	H	α-helix	trans	-68.5	-23.2	178.2	-64.1	172	40.2	0	0	112.5	K179 E180 F181	K179-Q183 PolarHBondContact O-NE2 2.86Å; E180-Q183 WeakPolarHBondContact O-CB 3.33Å; E180-Q183 PolarHBondContact O-N 2.89Å; F181-Q183 PolarHBondContact O-N 3.34Å
184	F	90.6	Very high	87.6	Confident	39 Å²	39	65.4 Å²	65.4	17%	0.171	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	15.1	-178	-57.1	-79.4	0	0	0	113.1	D109 M112 L113 Y116 E180 F181 R182	D109-F184 PolarHBondContact N-O 2.94Å; M112-F184 HydrophobicContact CB-CD1 3.92Å; M112-F184 HydrophobicContact CB-CE1 4.48Å; L113-F184 HydrophobicContact CB-CB 4.28Å; L113-F184 HydrophobicContact CB-CD2 4.5Å; L113-F184 HydrophobicContact CB-CG 4.33Å; L113-F184 HydrophobicContact CD1-CD2 3.65Å; L113-F184 HydrophobicContact CD1-CE2 4.1Å; L113-F184 HydrophobicContact CD1-CG 4.3Å; Y116-F184 VanDerWaalsContact CB-CZ 3.48Å; Y116-F184 AromaticContact CD1-CE2 3.72Å; Y116-F184 HydrophobicContact CD1-CE2 3.72Å; Y116-F184 AromaticContact CD1-CZ 3.88Å; Y116-F184 HydrophobicContact CD1-CZ 3.88Å; Y116-F184 HydrophobicContact CD2-CE2 4.3Å; Y116-F184 AromaticContact CD2-CZ 3.66Å; Y116-F184 HydrophobicContact CD2-CZ 3.66Å; Y116-F184 HydrophobicContact CE1-CE2 4.23Å; Y116-F184 HydrophobicContact CE2-CZ 4.33Å; Y116-F184 HydrophobicContact CG-CE1 4.39Å; Y116-F184 AromaticContact CG-CE2 3.75Å; Y116-F184 HydrophobicContact CG-CE2 3.75Å; Y116-F184 AromaticContact CG-CZ 3.39Å; Y116-F184 HydrophobicContact CG-CZ 3.39Å; E180-F184 WeakPolarHBondContact O-CD2 3.43Å; F181-F184 PolarHBondContact O-N 3.33Å; F181-F184 VanDerWaalsContact O-N 3.11Å; R182-F184 PolarHBondContact O-N 3.47Å
185	S	91.1	Very high	87.6	Confident	13 Å²	13	67 Å²	67	9%	0.091	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	148.8	-173.5	-58.4	0	0	0	0	112.5	F104 C107 T108 F181 R182	F104-S185 WeakPolarHBondContact CE2-OG 3.47Å; C107-S185 CarbonylContact O-C 3.55Å; C107-S185 VanDerWaalsContact O-CA 3.28Å; C107-S185 WeakPolarHBondContact O-CA 3.42Å; C107-S185 WeakPolarHBondContact O-CB 3.1Å; T108-S185 WeakPolarHBondContact CB-OG 3.38Å; T108-S185 WeakPolarHBondContact CG2-OG 3.32Å; T108-S185 PolarHBondContact OG1-OG 3.28Å; F181-S185 PolarHBondContact O-N 3.31Å; F181-S185 PolarHBondContact O-OG 3.06Å; R182-S185 PolarHBondContact O-N 3.26Å
186	E	87.7	Confident	87.7	Confident	109 Å²	109	64.1 Å²	64.1	51%	0.509	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	151.2	174.2	-48.6	-178.4	169.1	0	0	110.6	Q106 C107	Q106-E186 PolarHBondContact N-O 3.03Å; Q106-E186 VanDerWaalsContact N-O 3.12Å; C107-E186 PolarHBondContact N-O 3.04Å; C107-E186 PolarHBondContact O-N 3.31Å
187	G	84.5	Confident	87.9	Confident	28 Å²	28	62.5 Å²	62.5	29%	0.289	31%	0.306	S	S	.	.	S	Bend	trans	64.7	45.5	-176.4	0	0	0	0	0	112.6	Q106	Q106-G187 PolarHBondContact N-O 3.29Å
188	I	86.9	Confident	88	Confident	90 Å²	90	63.6 Å²	63.6	46%	0.462	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-61.8	133.4	-178	-57.5	159.6	0	0	0	110.1	R182	R182-I188 HydrophobicContact CB-CG2 4.49Å; R182-I188 HydrophobicContact CG-CG2 3.98Å; R182-I188 WeakPolarHBondContact O-CD1 3.38Å
189	L	86.8	Confident	88.1	Confident	37 Å²	37	63.3 Å²	63.3	19%	0.194	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-86.1	144.7	174.8	-62	164.5	0	0	0	110.3	F104 L193 L278	F104-L189 PolarHBondContact O-N 2.97Å; L189-L193 HydrophobicContact CB-CB 4.42Å; L189-L278 HydrophobicContact CD1-CD1 3.92Å; L189-L278 HydrophobicContact CD1-CD2 3.34Å; L189-L278 HydrophobicContact CD1-CG 4.25Å
190	E	85.1	Confident	88.2	Confident	115 Å²	115	60.1 Å²	60.1	54%	0.537	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-64.3	156	170.4	-56.3	-176.9	170.2	0	0	110.5	N192 L193 I194	E190-N192 PolarHBondContact O-N 2.55Å; E190-N192 VanDerWaalsContact O-N 3.09Å; E190-L193 HydrophobicContact CB-CD1 4.16Å; E190-L193 HydrophobicContact CG-CD1 4.4Å; E190-L193 PolarHBondContact O-N 3.44Å; E190-I194 PolarHBondContact O-N 2.78Å
191	E	82.6	Confident	88.3	Confident	135 Å²	135	58 Å²	58	63%	0.631	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-59	-30.2	-174.3	-67.2	-175.7	168	0	0	113.8	L193 I194	E191-L193 VanDerWaalsContact C-N 3.3Å; E191-L193 PolarHBondContact O-N 2.83Å; E191-I194 HydrophobicContact CB-CD1 4.15Å; E191-I194 HydrophobicContact CG-CD1 4.28Å; E191-I194 WeakPolarHBondContact O-CD1 3.47Å
192	N	80.7	Confident	88.1	Confident	158 Å²	158	58.6 Å²	58.6	85%	0.845	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-75.7	-17.5	178.2	-61.7	-24	0	0	0	113.8	E190	E190-N192 PolarHBondContact O-N 2.55Å; E190-N192 VanDerWaalsContact O-N 3.09Å
193	L	85	Confident	88	Confident	69 Å²	69	60.2 Å²	60.2	36%	0.361	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-104	0.4	-177.4	-78.5	148.5	0	0	0	112.2	L189 E190 E191 E195	L189-L193 HydrophobicContact CB-CB 4.42Å; E190-L193 HydrophobicContact CB-CD1 4.16Å; E190-L193 HydrophobicContact CG-CD1 4.4Å; E190-L193 PolarHBondContact O-N 3.44Å; E191-L193 VanDerWaalsContact C-N 3.3Å; E191-L193 PolarHBondContact O-N 2.83Å; L193-E195 PolarHBondContact O-N 2.98Å
194	I	88.1	Confident	87.7	Confident	35 Å²	35	55.3 Å²	55.3	18%	0.179	28%	0.279	C	S	.	.			trans	-67.1	120.6	173.9	-59.2	160.6	0	0	0	107.9	Y102 G103 E190 E191	Y102-I194 HydrophobicContact CD1-CG2 3.96Å; G103-I194 WeakPolarHBondContact O-CA 3.22Å; G103-I194 WeakPolarHBondContact O-CG2 3.44Å; E190-I194 PolarHBondContact O-N 2.78Å; E191-I194 HydrophobicContact CB-CD1 4.15Å; E191-I194 HydrophobicContact CG-CD1 4.28Å; E191-I194 WeakPolarHBondContact O-CD1 3.47Å
195	E	89.8	Confident	87.2	Confident	37 Å²	37	58.6 Å²	58.6	17%	0.173	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	135.7	171.4	-75.7	-66.4	112.7	0	0	109.9	K80 Y102 G103 L193 V274 S277 L278 N281	K80-E195 IonicContact NZ-OE2 3.09Å; Y102-E195 CarbonylContact C-O 3.6Å; Y102-E195 WeakPolarHBondContact CA-O 3.5Å; G103-E195 PolarHBondContact N-O 3.3Å; G103-E195 PolarHBondContact O-N 2.66Å; L193-E195 PolarHBondContact O-N 2.98Å; E195-V274 HydrophobicContact CB-CG1 4.45Å; E195-S277 WeakPolarHBondContact OE2-CB 3.26Å; E195-L278 HydrophobicContact CB-CD2 3.76Å; E195-L278 HydrophobicContact CB-CG 4.29Å; E195-L278 HydrophobicContact CG-CD2 3.6Å; E195-L278 HydrophobicContact CG-CG 4.29Å; E195-N281 WeakPolarHBondContact CG-ND2 3.5Å; E195-N281 PolarHBondContact OE1-ND2 3.28Å
196	R	90.7	Very high	86.7	Confident	69 Å²	69	62.7 Å²	62.7	26%	0.26	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	133.3	176.5	-179.5	-173.9	169.2	152.7	13.6	109.2	S100 G101 Y102 E171 D198	S100-R196 PolarHBondContact OG-NH2 3.49Å; G101-R196 CarbonylContact O-C 3.5Å; G101-R196 VanDerWaalsContact O-CA 3.27Å; G101-R196 WeakPolarHBondContact O-CA 3.49Å; Y102-R196 HydrophobicContact CD1-CB 4.15Å; Y102-R196 HydrophobicContact CD1-CG 4.17Å; Y102-R196 HydrophobicContact CE1-CB 4.06Å; Y102-R196 HydrophobicContact CE1-CG 3.77Å; Y102-R196 VanDerWaalsContact OH-CZ 3.26Å; Y102-R196 PolarHBondContact OH-NH1 2.82Å; Y102-R196 VanDerWaalsContact OH-NH1 3.09Å; E171-R196 VanDerWaalsContact CD-NH2 3.32Å; E171-R196 IonicContact OE1-CZ 3.57Å; E171-R196 IonicContact OE1-NH1 3.55Å; E171-R196 IonicContact OE1-NH2 2.98Å; E171-R196 PolarHBondContact OE1-NH2 2.7Å; E171-R196 IonicContact OE2-CZ 3.02Å; E171-R196 IonicContact OE2-NH1 2.87Å; E171-R196 PolarHBondContact OE2-NH1 2.89Å; E171-R196 IonicContact OE2-NH2 2.68Å; E171-R196 PolarHBondContact OE2-NH2 3.35Å; R196-D198 WeakPolarHBondContact CG-OD1 3.42Å; R196-D198 IonicContact CZ-OD1 3Å; R196-D198 IonicContact CZ-OD2 3.84Å; R196-D198 VanDerWaalsContact NE-CG 3.27Å; R196-D198 IonicContact NE-OD1 3.71Å; R196-D198 PolarHBondContact NE-OD1 3Å; R196-D198 IonicContact NE-OD2 3.56Å; R196-D198 PolarHBondContact NE-OD2 3.34Å; R196-D198 IonicContact NH2-OD1 3Å; R196-D198 PolarHBondContact NH2-OD1 3.5Å; R196-D198 VanDerWaalsContact NH2-OD1 3.09Å; R196-D198 IonicContact NH2-OD2 3.22Å
197	E	91.9	Very high	86.6	Confident	34 Å²	34	65 Å²	65	16%	0.159	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	127.4	176.4	-167.1	169.4	161.6	0	0	109.5	G101 L270 S273 V274 L354	G101-E197 PolarHBondContact N-O 2.88Å; G101-E197 PolarHBondContact O-N 3.24Å; E197-L270 HydrophobicContact CB-CD1 4.09Å; E197-L270 HydrophobicContact CG-CD1 3.85Å; E197-S273 WeakPolarHBondContact OE1-CB 3.42Å; E197-S273 PolarHBondContact OE1-OG 3.34Å; E197-S273 WeakPolarHBondContact OE2-CB 3.46Å; E197-S273 PolarHBondContact OE2-OG 3.12Å; E197-V274 HydrophobicContact CB-CG2 3.59Å; E197-L354 WeakPolarHBondContact OE1-CD2 3.24Å
198	D	91.4	Very high	86.8	Confident	32 Å²	32	64.5 Å²	64.5	17%	0.171	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	134.8	-170.7	-54.3	-48.1	0	0	0	110.6	I99 S100 R196	I99-D198 CarbonylContact O-C 3.41Å; I99-D198 WeakPolarHBondContact O-CA 3.3Å; S100-D198 PolarHBondContact OG-OD1 3.26Å; S100-D198 VanDerWaalsContact OG-OD1 3.06Å; R196-D198 WeakPolarHBondContact CG-OD1 3.42Å; R196-D198 IonicContact CZ-OD1 3Å; R196-D198 IonicContact CZ-OD2 3.84Å; R196-D198 VanDerWaalsContact NE-CG 3.27Å; R196-D198 IonicContact NE-OD1 3.71Å; R196-D198 PolarHBondContact NE-OD1 3Å; R196-D198 IonicContact NE-OD2 3.56Å; R196-D198 PolarHBondContact NE-OD2 3.34Å; R196-D198 IonicContact NH2-OD1 3Å; R196-D198 PolarHBondContact NH2-OD1 3.5Å; R196-D198 VanDerWaalsContact NH2-OD1 3.09Å; R196-D198 IonicContact NH2-OD2 3.22Å
199	L	92.5	Very high	86.8	Confident	3 Å²	3	65 Å²	65	2%	0.016	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	166.5	173.7	-65	-178.9	0	0	0	109.8	I99 E213 I215 L270 L350 L354	I99-L199 HydrophobicContact CB-CB 4.13Å; I99-L199 HydrophobicContact CD1-CB 4.38Å; I99-L199 PolarHBondContact N-O 3.01Å; I99-L199 PolarHBondContact O-N 2.83Å; L199-E213 HydrophobicContact CD2-CB 3.98Å; L199-I215 HydrophobicContact CD1-CD1 4.34Å; L199-L270 HydrophobicContact CD1-CB 4.4Å; L199-L270 HydrophobicContact CD1-CD1 3.85Å; L199-L270 HydrophobicContact CD1-CD2 4.1Å; L199-L270 HydrophobicContact CD1-CG 4.34Å; L199-L270 HydrophobicContact CG-CD1 4.04Å; L199-L270 HydrophobicContact CG-CD2 4.37Å; L199-L350 HydrophobicContact CD1-CD1 4Å; L199-L350 HydrophobicContact CD1-CD2 3.93Å; L199-L354 HydrophobicContact CD2-CD2 4.12Å
200	R	89.6	Confident	86.9	Confident	48 Å²	48	63.9 Å²	63.9	18%	0.181	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	148.2	175.5	-62	-178.1	-66	-159.1	6.6	109.8	E87 L91 F96 Y97 D214 I215	E87-R200 IonicContact OE2-CZ 3.83Å; E87-R200 IonicContact OE2-NH1 2.72Å; E87-R200 PolarHBondContact OE2-NH1 3.34Å; L91-R200 HydrophobicContact CD1-CG 3.94Å; F96-R200 HydrophobicContact CB-CB 4.45Å; F96-R200 HydrophobicContact CD1-CB 4.07Å; Y97-R200 CarbonylContact O-C 3.56Å; Y97-R200 WeakPolarHBondContact O-CA 3.36Å; R200-D214 IonicContact CZ-OD1 3.05Å; R200-D214 IonicContact CZ-OD2 3.4Å; R200-D214 IonicContact NE-OD1 3.26Å; R200-D214 PolarHBondContact NE-OD1 3.29Å; R200-D214 IonicContact NE-OD2 3.37Å; R200-D214 IonicContact NH2-OD1 2.64Å; R200-D214 PolarHBondContact NH2-OD1 3.32Å; R200-D214 IonicContact NH2-OD2 3.04Å; R200-D214 PolarHBondContact NH2-OD2 3.36Å; R200-D214 WeakPolarHBondContact O-CA 3.26Å; R200-I215 PolarHBondContact O-N 3.02Å
201	Y	90.9	Very high	86.9	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	155	167.7	77.3	-73.5	0	0	0	112.1	F96 Y97 I99 N152 W167 N168 L203 I215 L217	F96-Y201 CarbonylContact C-O 3.59Å; F96-Y201 WeakPolarHBondContact CA-O 3.42Å; Y97-Y201 VanDerWaalsContact CB-CZ 3.42Å; Y97-Y201 AromaticContact CD2-CE2 3.98Å; Y97-Y201 HydrophobicContact CD2-CE2 3.98Å; Y97-Y201 HydrophobicContact CG-CE1 4.17Å; Y97-Y201 HydrophobicContact CG-CE2 4.35Å; Y97-Y201 AromaticContact CG-CZ 3.91Å; Y97-Y201 PolarHBondContact N-O 3.13Å; Y97-Y201 WeakPolarHBondContact O-CD1 3.4Å; Y97-Y201 PolarHBondContact O-N 2.98Å; I99-Y201 HydrophobicContact CD1-CD1 3.65Å; I99-Y201 HydrophobicContact CD1-CG 4.08Å; I99-Y201 HydrophobicContact CG1-CD1 3.51Å; I99-Y201 HydrophobicContact CG1-CE1 4Å; I99-Y201 HydrophobicContact CG1-CG 4.42Å; N152-Y201 PolarHBondContact ND2-OH 3.45Å; W167-Y201 AromaticContact CE3-CD1 3.89Å; W167-Y201 HydrophobicContact CE3-CD1 3.89Å; W167-Y201 HydrophobicContact CE3-CD2 4.43Å; W167-Y201 AromaticContact CE3-CE1 3.74Å; W167-Y201 HydrophobicContact CE3-CE1 3.74Å; W167-Y201 HydrophobicContact CE3-CE2 4.34Å; W167-Y201 HydrophobicContact CE3-CG 4.2Å; W167-Y201 HydrophobicContact CZ3-CD1 4.04Å; W167-Y201 HydrophobicContact CZ3-CD2 4.19Å; W167-Y201 HydrophobicContact CZ3-CE1 4.31Å; W167-Y201 AromaticContact CZ3-CG 3.93Å; W167-Y201 HydrophobicContact CZ3-CG 3.93Å; N168-Y201 HydrophobicContact CB-CE1 4.4Å; N168-Y201 WeakPolarHBondContact CB-OH 3.37Å; Y201-L203 HydrophobicContact CD2-CD2 3.96Å; Y201-L203 HydrophobicContact CE2-CD2 3.63Å; Y201-I215 CarbonylContact C-O 3.52Å; Y201-I215 WeakPolarHBondContact CA-O 3.49Å; Y201-I215 WeakPolarHBondContact CB-O 3.42Å; Y201-L217 HydrophobicContact CD2-CB 4.3Å; Y201-L217 HydrophobicContact CD2-CD2 4.39Å
202	C	86.5	Confident	87	Confident	14 Å²	14	57.9 Å²	57.9	10%	0.095	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	159.8	169.2	63.5	0	0	0	0	109.2	F96 I215 Y216 L217	F96-C202 HydrophobicContact CD1-CB 3.7Å; F96-C202 HydrophobicContact CE1-CB 3.73Å; F96-C202 HydrophobicContact CG-CB 4.18Å; F96-C202 HydrophobicContact CZ-CB 4.24Å; C202-I215 PolarHBondContact N-O 3.45Å; C202-Y216 WeakPolarHBondContact SG-CD1 3.49Å; C202-Y216 WeakPolarHBondContact SG-CE1 3.39Å; C202-L217 PolarHBondContact O-N 3.17Å
203	L	85.8	Confident	87.2	Confident	66 Å²	66	53.2 Å²	53.2	35%	0.346	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	128.7	-177.2	-54.2	176.4	0	0	0	109	Y97 Y201 L217 I219	Y97-L203 HydrophobicContact CD2-CD1 4.46Å; Y97-L203 HydrophobicContact CD2-CG 4.28Å; Y97-L203 HydrophobicContact CE2-CD1 3.69Å; Y97-L203 HydrophobicContact CE2-CG 3.88Å; Y201-L203 HydrophobicContact CD2-CD2 3.96Å; Y201-L203 HydrophobicContact CE2-CD2 3.63Å; L203-L217 HydrophobicContact CD2-CB 4.5Å; L203-L217 HydrophobicContact CD2-CD2 4.49Å; L203-I219 HydrophobicContact CB-CD1 4.32Å; L203-I219 HydrophobicContact CD1-CD1 3.74Å; L203-I219 HydrophobicContact CD2-CD1 3.25Å; L203-I219 HydrophobicContact CD2-CG1 3.88Å; L203-I219 HydrophobicContact CG-CD1 3.91Å
204	T	84.2	Confident	87.4	Confident	30 Å²	30	51.2 Å²	51.2	18%	0.184	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	154.1	177.9	-176.7	0	0	0	0	110.4	D206 L217 H218 I219	T204-D206 VanDerWaalsContact C-N 3.33Å; T204-D206 PolarHBondContact OG1-N 3.01Å; T204-L217 PolarHBondContact N-O 3.41Å; T204-H218 WeakPolarHBondContact O-CA 3.49Å; T204-I219 PolarHBondContact O-N 3.3Å; T204-I219 VanDerWaalsContact O-N 3.09Å
205	N	79.8	Confident	87.6	Confident	109 Å²	109	49.6 Å²	49.6	58%	0.583	26%	0.257	S	S	*	.	S	Bend	trans	-84.3	-14.8	170.9	-58.8	-17.9	0	0	0	111.6	H218	N205-H218 PolarHBondContact O-CE1 2.9Å; N205-H218 PolarHBondContact O-ND1 2.75Å
206	D	80.9	Confident	87.6	Confident	98 Å²	98	50.3 Å²	50.3	52%	0.524	26%	0.258	S	S	.	.	S	Bend	trans	-79.5	173.9	176.7	-165.1	19.2	0	0	0	111.3	T204 H218	T204-D206 VanDerWaalsContact C-N 3.33Å; T204-D206 PolarHBondContact OG1-N 3.01Å; D206-H218 WeakPolarHBondContact O-CB 3.3Å; D206-H218 PolarHBondContact O-ND1 3.46Å
207	Q	84.7	Confident	87.5	Confident	157 Å²	157	47 Å²	47	73%	0.734	25%	0.246	S	C	*	.	P	Polyproline II helix	trans	-57	148.3	175.7	-64.4	-174.6	-15.6	0	0	112.5	R209	Q207-R209 PolarHBondContact O-N 3.14Å
208	T	88.3	Confident	87	Confident	18 Å²	18	47.5 Å²	47.5	11%	0.11	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-62.9	124.6	178.9	-65.7	0	0	0	0	111.1	Y216 L217 H218 E262 F266 L346	T208-Y216 CarbonylContact C-O 3.52Å; T208-Y216 VanDerWaalsContact CA-O 3.26Å; T208-Y216 WeakPolarHBondContact CA-O 3.32Å; T208-L217 HydrophobicContact CG2-CD1 4.16Å; T208-H218 WeakPolarHBondContact OG1-CB 3.34Å; T208-H218 PolarHBondContact OG1-N 3.29Å; T208-E262 VanDerWaalsContact CB-OE2 3.31Å; T208-E262 WeakPolarHBondContact CB-OE2 3.48Å; T208-E262 PolarHBondContact OG1-OE2 3.44Å; T208-F266 HydrophobicContact CG2-CE2 3.5Å; T208-F266 HydrophobicContact CG2-CZ 3.57Å; T208-L346 HydrophobicContact CG2-CD1 3.78Å; T208-L346 HydrophobicContact CG2-CD2 3.92Å; T208-L346 HydrophobicContact CG2-CG 4.48Å
209	R	88.7	Confident	86.2	Confident	102 Å²	102	48.5 Å²	48.5	39%	0.385	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	148	-177.7	64.1	-178.6	177.3	84.7	6	112	Q207 Y216	Q207-R209 PolarHBondContact O-N 3.14Å; R209-Y216 HydrophobicContact CG-CD2 4.34Å; R209-Y216 HydrophobicContact CG-CG 4.2Å; R209-Y216 PolarHBondContact N-O 3.4Å; R209-Y216 VanDerWaalsContact NH2-CD1 3.33Å; R209-Y216 WeakPolarHBondContact O-CB 3.41Å; R209-Y216 PolarHBondContact O-N 2.87Å
210	V	88.9	Confident	84.6	Confident	13 Å²	13	50.3 Å²	50.3	8%	0.079	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	122.7	174.8	-174.6	0	0	0	0	108.9	G212 I215 F266 K349 L350 V353	V210-G212 WeakPolarHBondContact CG1-O 3.45Å; V210-I215 HydrophobicContact CG2-CG1 4.5Å; V210-F266 HydrophobicContact CG2-CD1 4.35Å; V210-F266 HydrophobicContact CG2-CE1 3.36Å; V210-F266 HydrophobicContact CG2-CZ 3.77Å; V210-K349 HydrophobicContact CB-CG 3.84Å; V210-K349 HydrophobicContact CG2-CG 4.12Å; V210-L350 HydrophobicContact CG1-CD1 4.27Å; V210-V353 HydrophobicContact CG1-CG2 4.11Å
211	V	85.2	Confident	83	Confident	73 Å²	73	50.6 Å²	50.6	44%	0.442	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	112.4	175.8	177.5	0	0	0	0	109.7	E213 D214 Y216	V211-E213 PolarHBondContact O-N 3.04Å; V211-D214 PolarHBondContact N-O 3.02Å; V211-D214 PolarHBondContact O-N 2.91Å; V211-D214 VanDerWaalsContact O-N 3.12Å; V211-Y216 HydrophobicContact CB-CD2 4.39Å; V211-Y216 HydrophobicContact CB-CE2 3.93Å; V211-Y216 HydrophobicContact CG2-CD2 4.4Å; V211-Y216 HydrophobicContact CG2-CE2 4.27Å
212	G	84.6	Confident	81	Confident	51 Å²	51	57.2 Å²	57.2	53%	0.526	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.8	-129.1	-166.7	0	0	0	0	0	109.1	V210 V353	V210-G212 WeakPolarHBondContact CG1-O 3.45Å; G212-V353 WeakPolarHBondContact O-CG1 3.45Å; G212-V353 VanDerWaalsContact O-CG2 3.3Å; G212-V353 WeakPolarHBondContact O-CG2 3.5Å
213	E	84.9	Confident	79.1	Confident	60 Å²	60	63.7 Å²	63.7	28%	0.28	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	4.7	175	-65.4	163.2	-171.2	0	0	112.3	R83 L199 V211 V353	R83-E213 IonicContact CZ-OE2 2.73Å; R83-E213 IonicContact NE-OE2 2.69Å; R83-E213 PolarHBondContact NE-OE2 3.5Å; R83-E213 IonicContact NH1-OE2 2.99Å; R83-E213 IonicContact NH2-OE2 3.52Å; R83-E213 PolarHBondContact NH2-OE2 3.27Å; L199-E213 HydrophobicContact CD2-CB 3.98Å; V211-E213 PolarHBondContact O-N 3.04Å; E213-V353 HydrophobicContact CB-CG1 4.37Å; E213-V353 HydrophobicContact CG-CG1 3.74Å
214	D	88.9	Confident	77.2	Confident	27 Å²	27	63.3 Å²	63.3	14%	0.144	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	129.7	-178.2	-58.3	-26.8	0	0	0	109.8	R83 F96 R200 V211	R83-D214 IonicContact CZ-OD1 3.35Å; R83-D214 IonicContact NH1-OD1 2.64Å; R83-D214 PolarHBondContact NH1-OD1 3.44Å; F96-D214 HydrophobicContact CE1-CB 4.12Å; R200-D214 IonicContact CZ-OD1 3.05Å; R200-D214 IonicContact CZ-OD2 3.4Å; R200-D214 IonicContact NE-OD1 3.26Å; R200-D214 PolarHBondContact NE-OD1 3.29Å; R200-D214 IonicContact NE-OD2 3.37Å; R200-D214 IonicContact NH2-OD1 2.64Å; R200-D214 PolarHBondContact NH2-OD1 3.32Å; R200-D214 IonicContact NH2-OD2 3.04Å; R200-D214 PolarHBondContact NH2-OD2 3.36Å; R200-D214 WeakPolarHBondContact O-CA 3.26Å; V211-D214 PolarHBondContact N-O 3.02Å; V211-D214 PolarHBondContact O-N 2.91Å; V211-D214 VanDerWaalsContact O-N 3.12Å
215	I	91.6	Very high	75.4	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	131.3	-175.6	-60.5	167.4	0	0	0	109.4	I99 W167 L199 R200 Y201 C202 V210 F266 L350	I99-I215 HydrophobicContact CD1-CD1 3.83Å; W167-I215 HydrophobicContact CH2-CD1 4.46Å; L199-I215 HydrophobicContact CD1-CD1 4.34Å; R200-I215 PolarHBondContact O-N 3.02Å; Y201-I215 CarbonylContact C-O 3.52Å; Y201-I215 WeakPolarHBondContact CA-O 3.49Å; Y201-I215 WeakPolarHBondContact CB-O 3.42Å; C202-I215 PolarHBondContact N-O 3.45Å; V210-I215 HydrophobicContact CG2-CG1 4.5Å; I215-F266 HydrophobicContact CD1-CB 4.03Å; I215-F266 HydrophobicContact CD1-CD1 4.11Å; I215-F266 HydrophobicContact CD1-CD2 4.22Å; I215-F266 HydrophobicContact CD1-CG 3.87Å; I215-F266 HydrophobicContact CG2-CD2 3.93Å; I215-F266 HydrophobicContact CG2-CE2 3.56Å; I215-F266 HydrophobicContact CG2-CZ 3.89Å; I215-L350 HydrophobicContact CD1-CD2 4.22Å
216	Y	89.4	Confident	73.7	Confident	53 Å²	53	62.5 Å²	62.5	21%	0.208	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	100.5	170.8	-65.2	-104.7	0	0	0	105.8	C202 T208 R209 V211	C202-Y216 WeakPolarHBondContact SG-CD1 3.49Å; C202-Y216 WeakPolarHBondContact SG-CE1 3.39Å; T208-Y216 CarbonylContact C-O 3.52Å; T208-Y216 VanDerWaalsContact CA-O 3.26Å; T208-Y216 WeakPolarHBondContact CA-O 3.32Å; R209-Y216 HydrophobicContact CG-CD2 4.34Å; R209-Y216 HydrophobicContact CG-CG 4.2Å; R209-Y216 PolarHBondContact N-O 3.4Å; R209-Y216 VanDerWaalsContact NH2-CD1 3.33Å; R209-Y216 WeakPolarHBondContact O-CB 3.41Å; R209-Y216 PolarHBondContact O-N 2.87Å; V211-Y216 HydrophobicContact CB-CD2 4.39Å; V211-Y216 HydrophobicContact CB-CE2 3.93Å; V211-Y216 HydrophobicContact CG2-CD2 4.4Å; V211-Y216 HydrophobicContact CG2-CE2 4.27Å
217	L	88.1	Confident	71.9	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	125.9	-176	-175.9	67.8	0	0	0	109.7	Y201 C202 L203 T204 T208 I219 E262 K263 F266	Y201-L217 HydrophobicContact CD2-CB 4.3Å; Y201-L217 HydrophobicContact CD2-CD2 4.39Å; C202-L217 PolarHBondContact O-N 3.17Å; L203-L217 HydrophobicContact CD2-CB 4.5Å; L203-L217 HydrophobicContact CD2-CD2 4.49Å; T204-L217 PolarHBondContact N-O 3.41Å; T208-L217 HydrophobicContact CG2-CD1 4.16Å; L217-I219 PolarHBondContact O-N 2.87Å; L217-E262 HydrophobicContact CD1-CB 4.13Å; L217-K263 HydrophobicContact CD1-CG 4.47Å; L217-K263 HydrophobicContact CD2-CD 4.3Å; L217-K263 HydrophobicContact CD2-CG 3.83Å; L217-F266 HydrophobicContact CD1-CE2 4.37Å
218	H	83.1	Confident	69.7	Low	43 Å²	43	65.7 Å²	65.7	20%	0.199	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	120.5	170.9	-178.2	61.7	0	0	0	109.3	T204 N205 D206 T208 D224	T204-H218 WeakPolarHBondContact O-CA 3.49Å; N205-H218 PolarHBondContact O-CE1 2.9Å; N205-H218 PolarHBondContact O-ND1 2.75Å; D206-H218 WeakPolarHBondContact O-CB 3.3Å; D206-H218 PolarHBondContact O-ND1 3.46Å; T208-H218 WeakPolarHBondContact OG1-CB 3.34Å; T208-H218 PolarHBondContact OG1-N 3.29Å; H218-D224 IonicContact CE1-OD2 3.86Å
219	I	73	Confident	67.5	Low	53 Å²	53	68 Å²	68	27%	0.272	36%	0.359	S	S	.	.			trans	-113.1	117	161.3	-66.2	-174.9	0	0	0	106.6	L203 T204 L217 S221	L203-I219 HydrophobicContact CB-CD1 4.32Å; L203-I219 HydrophobicContact CD1-CD1 3.74Å; L203-I219 HydrophobicContact CD2-CD1 3.25Å; L203-I219 HydrophobicContact CD2-CG1 3.88Å; L203-I219 HydrophobicContact CG-CD1 3.91Å; T204-I219 PolarHBondContact O-N 3.3Å; T204-I219 VanDerWaalsContact O-N 3.09Å; L217-I219 PolarHBondContact O-N 2.87Å; I219-S221 VanDerWaalsContact C-N 3.33Å; I219-S221 PolarHBondContact O-N 2.87Å
220	P	59.4	Low	65.3	Low	42 Å²	42	67.1 Å²	67.1	27%	0.273	36%	0.36	S	S	.	.			trans	-65.4	98.8	172.6	14.9	-14.8	0	0	0	108.3	T255	P220-T255 HydrophobicContact CB-CG2 4.49Å; P220-T255 HydrophobicContact CG-CG2 4.1Å
221	S	55.5	Low	63	Low	54 Å²	54	75.8 Å²	75.8	38%	0.378	40%	0.399	S	S	.	.			trans	-69.5	142	166.9	-172	0	0	0	0	107.3	I219 K223 D224	I219-S221 VanDerWaalsContact C-N 3.33Å; I219-S221 PolarHBondContact O-N 2.87Å; S221-K223 PolarHBondContact O-N 3Å; S221-D224 PolarHBondContact O-N 3.07Å
222	L	49	Very low	61	Low	138 Å²	138	80.5 Å²	80.5	72%	0.723	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-11.1	-177.4	-152.8	82.6	0	0	0	115
223	K	47.2	Very low	58.9	Low	151 Å²	151	84.6 Å²	84.6	66%	0.657	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-27.1	177.5	-66.6	-177.2	178.4	177.6	0	114	S221 V225 S226	S221-K223 PolarHBondContact O-N 3Å; K223-V225 PolarHBondContact O-N 3.14Å; K223-S226 VanDerWaalsContact O-CB 3.26Å; K223-S226 WeakPolarHBondContact O-CB 3.44Å; K223-S226 PolarHBondContact O-N 2.74Å; K223-S226 PolarHBondContact O-OG 2.95Å
224	D	46.3	Very low	57	Low	58 Å²	58	89.9 Å²	89.9	31%	0.31	44%	0.441	S	S	.	.	H	α-helix	trans	-69	-20.7	-171.5	-67.7	-25	0	0	0	113.7	H218 S221 S226	H218-D224 IonicContact CE1-OD2 3.86Å; S221-D224 PolarHBondContact O-N 3.07Å; D224-S226 PolarHBondContact O-N 3.19Å
225	V	46.4	Very low	54.7	Low	79 Å²	79	97.3 Å²	97.3	48%	0.479	48%	0.475	S	S	.	.	H	α-helix	trans	-70.2	-15.6	171.9	-173.4	0	0	0	0	112.2	K223	K223-V225 PolarHBondContact O-N 3.14Å
226	S	44.7	Very low	52.3	Low	43 Å²	43	102.6 Å²	102.6	30%	0.301	51%	0.511	S	S	.	.	H	α-helix	trans	-76.8	-37	-179.1	-36.7	0	0	0	0	112	K223 D224 H228 T229 E230	K223-S226 VanDerWaalsContact O-CB 3.26Å; K223-S226 WeakPolarHBondContact O-CB 3.44Å; K223-S226 PolarHBondContact O-N 2.74Å; K223-S226 PolarHBondContact O-OG 2.95Å; D224-S226 PolarHBondContact O-N 3.19Å; S226-H228 PolarHBondContact O-N 2.9Å; S226-T229 PolarHBondContact O-N 3.05Å; S226-E230 PolarHBondContact O-N 3.43Å
227	H	42.7	Very low	49.8	Very low	138 Å²	138	110.9 Å²	110.9	64%	0.639	54%	0.544	S	S	*	.	H	α-helix	trans	-74.5	-24.4	-168	-75.4	-58.7	0	0	0	114.3	T229	H227-T229 VanDerWaalsContact C-N 3.34Å
228	H	37.4	Very low	47.4	Very low	184 Å²	184	119.1 Å²	119.1	85%	0.852	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-7	174.5	-77.3	-62.3	0	0	0	114.5	S226	S226-H228 PolarHBondContact O-N 2.9Å
229	T	42.5	Very low	45.8	Very low	65 Å²	65	123.7 Å²	123.7	40%	0.399	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-123.4	1.9	-178.4	-18.2	0	0	0	0	114.2	S226 H227 Q231 R233	S226-T229 PolarHBondContact O-N 3.05Å; H227-T229 VanDerWaalsContact C-N 3.34Å; T229-Q231 PolarHBondContact O-N 2.9Å; T229-R233 PolarHBondContact O-N 3.37Å
230	E	42.8	Very low	44.7	Very low	85 Å²	85	128 Å²	128	40%	0.397	63%	0.628	S	S	.	*	G	3₁₀ helix	trans	-70.3	-31.4	179.4	-128.3	95.8	-124.1	0	0	112.6	S226 Q232 R233	S226-E230 PolarHBondContact O-N 3.43Å; E230-Q232 PolarHBondContact O-N 3.21Å; E230-R233 IonicContact OE1-CZ 3.03Å; E230-R233 VanDerWaalsContact OE1-CZ 3.25Å; E230-R233 IonicContact OE1-NH1 3.59Å; E230-R233 PolarHBondContact OE1-NH1 3.05Å; E230-R233 IonicContact OE1-NH2 2.71Å; E230-R233 PolarHBondContact OE1-NH2 3.35Å
231	Q	41.1	Very low	44.5	Very low	194 Å²	194	129.6 Å²	129.6	91%	0.907	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-75.6	-7.6	-178.6	-71.6	-170.1	-9.9	0	0	114.5	T229	T229-Q231 PolarHBondContact O-N 2.9Å
232	Q	42	Very low	44.5	Very low	172 Å²	172	133.7 Å²	133.7	80%	0.804	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-118	-0.2	176.8	-71	-177.4	-20.1	0	0	114.2	E230 Q234	E230-Q232 PolarHBondContact O-N 3.21Å; Q232-Q234 PolarHBondContact O-N 3.01Å
233	R	41.6	Very low	44.7	Very low	137 Å²	137	134.2 Å²	134.2	52%	0.517	65%	0.653	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.9	1.7	-171.6	-142.3	-172.7	-62.9	128.9	5.5	116.1	T229 E230 Q235	T229-R233 PolarHBondContact O-N 3.37Å; E230-R233 IonicContact OE1-CZ 3.03Å; E230-R233 VanDerWaalsContact OE1-CZ 3.25Å; E230-R233 IonicContact OE1-NH1 3.59Å; E230-R233 PolarHBondContact OE1-NH1 3.05Å; E230-R233 IonicContact OE1-NH2 2.71Å; E230-R233 PolarHBondContact OE1-NH2 3.35Å; R233-Q235 VanDerWaalsContact C-N 3.28Å; R233-Q235 PolarHBondContact O-N 2.87Å
234	Q	43.4	Very low	45	Very low	172 Å²	172	131.4 Å²	131.4	80%	0.804	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-2.6	-176.3	-108.3	82.4	21.7	0	0	116.1	Q232	Q232-Q234 PolarHBondContact O-N 3.01Å
235	Q	42.2	Very low	45.3	Very low	183 Å²	183	134.4 Å²	134.4	86%	0.855	66%	0.658	S	S	*	*	S	Bend	trans	-135.1	4.2	-166.2	-106.2	158.8	-4.3	0	0	121	R233	R233-Q235 VanDerWaalsContact C-N 3.28Å; R233-Q235 PolarHBondContact O-N 2.87Å
236	S	40.7	Very low	45.6	Very low	110 Å²	110	138 Å²	138	77%	0.769	67%	0.667	S	S	*	*			trans	-150.8	88.1	168.9	-153.6	0	0	0	0	112.7
237	Y	36.2	Very low	45.9	Very low	228 Å²	228	138.9 Å²	138.9	89%	0.894	67%	0.673	S	S	*	*			trans	-65.4	136.1	156.8	-173.3	-96.8	0	0	0	107.3
238	K	38.5	Very low	46.4	Very low	172 Å²	172	137.5 Å²	137.5	75%	0.748	67%	0.665	S	S	*	*	S	Bend	trans	103.7	129.4	170.8	-144.8	170.2	-168	177.5	0	113.8
239	D	48.8	Very low	47	Very low	140 Å²	140	134.8 Å²	134.8	75%	0.749	66%	0.657	S	S	*	*			trans	83.5	68.6	-177.1	-51.8	-18.7	0	0	0	115.3	T241	D239-T241 PolarHBondContact O-N 2.87Å; D239-T241 VanDerWaalsContact O-N 3.07Å
240	L	50.4	Low	47.4	Very low	142 Å²	142	133.2 Å²	133.2	74%	0.743	65%	0.65	S	S	*	*			trans	-68.1	95.7	156.9	-73.5	166.1	0	0	0	107.8
241	T	54.7	Low	47.6	Very low	76 Å²	76	131.3 Å²	131.3	47%	0.466	65%	0.646	S	S	.	*			trans	-62.3	142.5	174.9	-29.2	0	0	0	0	109.1	D239 E243 D244	D239-T241 PolarHBondContact O-N 2.87Å; D239-T241 VanDerWaalsContact O-N 3.07Å; T241-E243 HydrophobicContact CG2-CB 4.43Å; T241-E243 HydrophobicContact CG2-CG 4.32Å; T241-E243 PolarHBondContact O-N 3.31Å; T241-D244 PolarHBondContact O-N 3.45Å
242	L	55.5	Low	48	Very low	141 Å²	141	124 Å²	124	74%	0.738	62%	0.619	S	S	*	*	H	α-helix	trans	-52	-24.9	174.3	-78.4	166.6	0	0	0	112.8	D244 Q245 F246	L242-D244 VanDerWaalsContact C-N 3.34Å; L242-D244 PolarHBondContact O-N 3.26Å; L242-Q245 PolarHBondContact O-N 3.17Å; L242-F246 PolarHBondContact O-N 3.45Å
243	E	54	Low	48.6	Very low	149 Å²	149	118.7 Å²	118.7	70%	0.696	60%	0.601	S	S	*	*	H	α-helix	trans	-61.4	-35.1	174.5	-64.6	-177.9	160.9	0	0	113.3	T241 F246 S247	T241-E243 HydrophobicContact CG2-CB 4.43Å; T241-E243 HydrophobicContact CG2-CG 4.32Å; T241-E243 PolarHBondContact O-N 3.31Å; E243-F246 PolarHBondContact O-N 3.37Å; E243-S247 WeakPolarHBondContact O-CB 3.47Å; E243-S247 PolarHBondContact O-N 2.93Å; E243-S247 PolarHBondContact O-OG 3.42Å
244	D	53	Low	49.2	Very low	91 Å²	91	117.8 Å²	117.8	49%	0.487	61%	0.606	S	S	.	*	H	α-helix	trans	-72.8	-33.7	176.6	-84.3	-11.5	0	0	0	111.9	T241 L242 S247 K248	T241-D244 PolarHBondContact O-N 3.45Å; L242-D244 VanDerWaalsContact C-N 3.34Å; L242-D244 PolarHBondContact O-N 3.26Å; D244-S247 WeakPolarHBondContact CA-OG 3.24Å; D244-S247 PolarHBondContact O-OG 2.91Å; D244-K248 VanDerWaalsContact O-CB 3.27Å; D244-K248 WeakPolarHBondContact O-CB 3.34Å; D244-K248 PolarHBondContact O-N 3.4Å
245	Q	51.5	Low	49.7	Very low	121 Å²	121	112.2 Å²	112.2	57%	0.565	58%	0.583	S	S	*	*	H	α-helix	trans	-70	-39.1	173.3	-65.1	-172.4	8.5	0	0	110.8	L242 K248 L249	L242-Q245 PolarHBondContact O-N 3.17Å; Q245-K248 PolarHBondContact O-N 3.26Å; Q245-L249 WeakPolarHBondContact O-CB 3.46Å; Q245-L249 PolarHBondContact O-N 3.49Å
246	F	53.3	Low	50.7	Low	156 Å²	156	109.7 Å²	109.7	68%	0.684	57%	0.572	S	S	*	*	H	α-helix	trans	-67.1	-42.3	176.1	-167.5	-96.6	0	0	0	111.7	L242 E243 K248 L249 A250	L242-F246 PolarHBondContact O-N 3.45Å; E243-F246 PolarHBondContact O-N 3.37Å; F246-K248 VanDerWaalsContact C-N 3.28Å; F246-K248 PolarHBondContact O-N 2.84Å; F246-L249 PolarHBondContact O-N 3.47Å; F246-A250 WeakPolarHBondContact O-CB 3.37Å; F246-A250 PolarHBondContact O-N 3.43Å
247	S	51.5	Low	52	Low	61 Å²	61	108.4 Å²	108.4	43%	0.427	56%	0.556	S	S	.	*	H	α-helix	trans	-65	-33.1	175.2	70.7	0	0	0	0	111.9	E243 D244 S251	E243-S247 WeakPolarHBondContact O-CB 3.47Å; E243-S247 PolarHBondContact O-N 2.93Å; E243-S247 PolarHBondContact O-OG 3.42Å; D244-S247 WeakPolarHBondContact CA-OG 3.24Å; D244-S247 PolarHBondContact O-OG 2.91Å; S247-S251 VanDerWaalsContact O-CB 3.26Å; S247-S251 WeakPolarHBondContact O-CB 3.48Å; S247-S251 PolarHBondContact O-N 2.92Å; S247-S251 PolarHBondContact O-OG 3.24Å
248	K	53.6	Low	53.9	Low	108 Å²	108	100.1 Å²	100.1	47%	0.47	53%	0.527	S	S	.	.	H	α-helix	trans	-71	-41.3	173.8	-163.9	170	-172.6	175.7	0	113.1	D244 Q245 F246 S251 A252	D244-K248 VanDerWaalsContact O-CB 3.27Å; D244-K248 WeakPolarHBondContact O-CB 3.34Å; D244-K248 PolarHBondContact O-N 3.4Å; Q245-K248 PolarHBondContact O-N 3.26Å; F246-K248 VanDerWaalsContact C-N 3.28Å; F246-K248 PolarHBondContact O-N 2.84Å; K248-S251 WeakPolarHBondContact CA-OG 3.27Å; K248-S251 PolarHBondContact O-OG 3.06Å; K248-S251 VanDerWaalsContact O-OG 3.05Å; K248-A252 VanDerWaalsContact O-CB 3.29Å; K248-A252 WeakPolarHBondContact O-CB 3.47Å; K248-A252 PolarHBondContact O-N 2.9Å
249	L	50.2	Low	56	Low	128 Å²	128	92.8 Å²	92.8	67%	0.67	50%	0.497	S	S	*	.	H	α-helix	trans	-70.9	-38.6	175.5	-151.1	85.2	0	0	0	111.3	Q245 F246 A252 S253	Q245-L249 WeakPolarHBondContact O-CB 3.46Å; Q245-L249 PolarHBondContact O-N 3.49Å; F246-L249 PolarHBondContact O-N 3.47Å; L249-A252 PolarHBondContact O-N 3.37Å; L249-S253 WeakPolarHBondContact O-CB 3.2Å; L249-S253 PolarHBondContact O-N 3.1Å
250	A	49.3	Very low	57.9	Low	32 Å²	32	87.2 Å²	87.2	26%	0.264	47%	0.468	S	S	.	.	H	α-helix	trans	-66.5	-44.6	175.3	0	0	0	0	0	110.8	F246 S253 L254	F246-A250 WeakPolarHBondContact O-CB 3.37Å; F246-A250 PolarHBondContact O-N 3.43Å; A250-S253 PolarHBondContact O-N 3.46Å; A250-L254 WeakPolarHBondContact O-CB 3.43Å; A250-L254 WeakPolarHBondContact O-CD1 3.49Å; A250-L254 WeakPolarHBondContact O-CG 3.48Å; A250-L254 PolarHBondContact O-N 2.92Å
251	S	46.9	Very low	59.7	Low	45 Å²	45	81.2 Å²	81.2	32%	0.315	44%	0.436	S	S	.	.	H	α-helix	trans	-64.6	-38.6	173.2	50.9	0	0	0	0	111.8	S247 K248 T255	S247-S251 VanDerWaalsContact O-CB 3.26Å; S247-S251 WeakPolarHBondContact O-CB 3.48Å; S247-S251 PolarHBondContact O-N 2.92Å; S247-S251 PolarHBondContact O-OG 3.24Å; K248-S251 WeakPolarHBondContact CA-OG 3.27Å; K248-S251 PolarHBondContact O-OG 3.06Å; K248-S251 VanDerWaalsContact O-OG 3.05Å; S251-T255 WeakPolarHBondContact O-CB 3.3Å; S251-T255 WeakPolarHBondContact O-CG2 3.23Å; S251-T255 PolarHBondContact O-N 2.65Å; S251-T255 PolarHBondContact O-OG1 3.34Å
252	A	51.3	Low	61.5	Low	40 Å²	40	78.5 Å²	78.5	33%	0.331	42%	0.418	S	S	.	.	H	α-helix	trans	-62.1	-46.9	172.8	0	0	0	0	0	112.5	K248 L249 T255 E256	K248-A252 VanDerWaalsContact O-CB 3.29Å; K248-A252 WeakPolarHBondContact O-CB 3.47Å; K248-A252 PolarHBondContact O-N 2.9Å; L249-A252 PolarHBondContact O-N 3.37Å; A252-T255 WeakPolarHBondContact CA-OG1 3.4Å; A252-T255 PolarHBondContact O-N 2.65Å; A252-T255 PolarHBondContact O-OG1 2.78Å; A252-E256 WeakPolarHBondContact O-CG 3.28Å; A252-E256 PolarHBondContact O-N 2.91Å
253	S	54.1	Low	63.2	Low	61 Å²	61	72.4 Å²	72.4	43%	0.427	39%	0.386	S	S	.	.	H	α-helix	trans	-64.3	-48.8	176.9	-174.2	0	0	0	0	111.9	L249 A250 T255 E256 D257	L249-S253 WeakPolarHBondContact O-CB 3.2Å; L249-S253 PolarHBondContact O-N 3.1Å; A250-S253 PolarHBondContact O-N 3.46Å; S253-T255 PolarHBondContact O-N 2.85Å; S253-E256 PolarHBondContact O-N 2.89Å; S253-D257 WeakPolarHBondContact O-CB 3.4Å; S253-D257 PolarHBondContact O-N 3.48Å
254	L	53.4	Low	65	Low	118 Å²	118	65.5 Å²	65.5	62%	0.618	35%	0.353	S	S	*	.	H	α-helix	trans	-62.4	-31.2	179	-70	171.5	0	0	0	111.7	A250 N258	A250-L254 WeakPolarHBondContact O-CB 3.43Å; A250-L254 WeakPolarHBondContact O-CD1 3.49Å; A250-L254 WeakPolarHBondContact O-CG 3.48Å; A250-L254 PolarHBondContact O-N 2.92Å; L254-N258 WeakPolarHBondContact O-CB 3.41Å; L254-N258 PolarHBondContact O-N 3.42Å
255	T	55.1	Low	66.9	Low	54 Å²	54	61.2 Å²	61.2	33%	0.331	33%	0.33	S	S	.	.	H	α-helix	trans	-78.3	-38.1	177.2	51.1	0	0	0	0	112.9	P220 S251 A252 S253 D257 N258 S259	P220-T255 HydrophobicContact CB-CG2 4.49Å; P220-T255 HydrophobicContact CG-CG2 4.1Å; S251-T255 WeakPolarHBondContact O-CB 3.3Å; S251-T255 WeakPolarHBondContact O-CG2 3.23Å; S251-T255 PolarHBondContact O-N 2.65Å; S251-T255 PolarHBondContact O-OG1 3.34Å; A252-T255 WeakPolarHBondContact CA-OG1 3.4Å; A252-T255 PolarHBondContact O-N 2.65Å; A252-T255 PolarHBondContact O-OG1 2.78Å; S253-T255 PolarHBondContact O-N 2.85Å; T255-D257 VanDerWaalsContact C-N 3.32Å; T255-N258 PolarHBondContact O-N 3.46Å; T255-S259 PolarHBondContact O-N 3.24Å
256	E	62	Low	69	Low	131 Å²	131	55.5 Å²	55.5	61%	0.612	30%	0.304	S	S	*	.	H	α-helix	trans	-59.5	-45	169.3	-75.9	-176.2	-165.4	0	0	110.9	A252 S253 N258 S259 L260	A252-E256 WeakPolarHBondContact O-CG 3.28Å; A252-E256 PolarHBondContact O-N 2.91Å; S253-E256 PolarHBondContact O-N 2.89Å; E256-N258 VanDerWaalsContact C-N 3.32Å; E256-N258 PolarHBondContact O-N 2.87Å; E256-S259 PolarHBondContact O-N 3.08Å; E256-L260 WeakPolarHBondContact O-CB 3.28Å; E256-L260 PolarHBondContact O-N 3.13Å
257	D	68.1	Low	71	Confident	82 Å²	82	48.1 Å²	48.1	44%	0.439	27%	0.271	S	S	.	.	H	α-helix	trans	-62.9	-38.7	177.3	-68.1	-26	0	0	0	111.6	S253 T255 L261	S253-D257 WeakPolarHBondContact O-CB 3.4Å; S253-D257 PolarHBondContact O-N 3.48Å; T255-D257 VanDerWaalsContact C-N 3.32Å; D257-L261 WeakPolarHBondContact O-CB 3.5Å; D257-L261 PolarHBondContact O-N 2.72Å
258	N	77	Confident	73	Confident	55 Å²	55	46 Å²	46	29%	0.294	26%	0.255	S	S	.	.	H	α-helix	trans	-69.1	-46.1	177.4	-164.4	48.6	0	0	0	112.1	L254 T255 E256 L260 L261 E262	L254-N258 WeakPolarHBondContact O-CB 3.41Å; L254-N258 PolarHBondContact O-N 3.42Å; T255-N258 PolarHBondContact O-N 3.46Å; E256-N258 VanDerWaalsContact C-N 3.32Å; E256-N258 PolarHBondContact O-N 2.87Å; N258-L260 VanDerWaalsContact C-N 3.26Å; N258-L260 PolarHBondContact O-N 3.43Å; N258-L261 WeakPolarHBondContact O-CB 2.96Å; N258-L261 PolarHBondContact O-N 2.82Å; N258-L261 VanDerWaalsContact O-N 3.09Å; N258-E262 PolarHBondContact ND2-OE1 3.08Å; N258-E262 WeakPolarHBondContact O-CG 3.26Å; N258-E262 PolarHBondContact O-N 3.14Å
259	S	82.8	Confident	74.9	Confident	17 Å²	17	40.8 Å²	40.8	12%	0.119	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-38.5	177.1	-171.6	0	0	0	0	111.5	T255 E256 L261 E262 K263	T255-S259 PolarHBondContact O-N 3.24Å; E256-S259 PolarHBondContact O-N 3.08Å; S259-L261 VanDerWaalsContact C-N 3.33Å; S259-L261 PolarHBondContact O-N 3.35Å; S259-E262 PolarHBondContact O-N 3.27Å; S259-K263 WeakPolarHBondContact O-CG 3.27Å; S259-K263 PolarHBondContact O-N 3.46Å
260	L	87	Confident	77.1	Confident	24 Å²	24	34.8 Å²	34.8	13%	0.126	20%	0.201	C	C	.	.	H	α-helix	trans	-62.3	-42	174.9	-173.2	71.4	0	0	0	112.1	P127 L129 L139 F157 E256 N258 K263 F264	P127-L260 HydrophobicContact CB-CD2 3.96Å; L129-L260 HydrophobicContact CD2-CD2 4.14Å; L139-L260 HydrophobicContact CD2-CD1 3.32Å; L139-L260 HydrophobicContact CD2-CD2 3.65Å; L139-L260 HydrophobicContact CD2-CG 3.86Å; F157-L260 HydrophobicContact CZ-CD1 4.43Å; E256-L260 WeakPolarHBondContact O-CB 3.28Å; E256-L260 PolarHBondContact O-N 3.13Å; N258-L260 VanDerWaalsContact C-N 3.26Å; N258-L260 PolarHBondContact O-N 3.43Å; L260-K263 WeakPolarHBondContact O-CB 3.22Å; L260-K263 PolarHBondContact O-N 3.37Å; L260-F264 PolarHBondContact O-N 3.24Å
261	L	89.5	Confident	79.2	Confident	15 Å²	15	33.2 Å²	33.2	8%	0.079	19%	0.188	C	C	.	.	H	α-helix	trans	-67.9	-36.4	178.8	-178.8	58.1	0	0	0	112.4	D257 N258 S259 F264 A265 F336 R340 V343	D257-L261 WeakPolarHBondContact O-CB 3.5Å; D257-L261 PolarHBondContact O-N 2.72Å; N258-L261 WeakPolarHBondContact O-CB 2.96Å; N258-L261 PolarHBondContact O-N 2.82Å; N258-L261 VanDerWaalsContact O-N 3.09Å; S259-L261 VanDerWaalsContact C-N 3.33Å; S259-L261 PolarHBondContact O-N 3.35Å; L261-F264 HydrophobicContact CD1-CD1 4.24Å; L261-F264 WeakPolarHBondContact O-CB 3.46Å; L261-F264 PolarHBondContact O-N 3.36Å; L261-A265 PolarHBondContact O-N 3.46Å; L261-F336 HydrophobicContact CD1-CE1 3.65Å; L261-F336 HydrophobicContact CD1-CZ 3.45Å; L261-F336 VanDerWaalsContact CD1-CZ 3.45Å; L261-R340 VanDerWaalsContact CD2-NH1 3.25Å; L261-V343 HydrophobicContact CD1-CG1 4.23Å; L261-V343 HydrophobicContact CD2-CG2 3.66Å; L261-V343 HydrophobicContact CG-CB 4.42Å; L261-V343 HydrophobicContact CG-CG1 3.91Å; L261-V343 HydrophobicContact CG-CG2 3.72Å
262	E	91.4	Very high	81.4	Confident	19 Å²	19	31.3 Å²	31.3	9%	0.089	18%	0.175	C	C	.	.	H	α-helix	trans	-63.6	-44.1	171.1	-65.4	179.3	-178.6	0	0	111.6	T208 L217 N258 S259 F264 A265 F266 L346	T208-E262 VanDerWaalsContact CB-OE2 3.31Å; T208-E262 WeakPolarHBondContact CB-OE2 3.48Å; T208-E262 PolarHBondContact OG1-OE2 3.44Å; L217-E262 HydrophobicContact CD1-CB 4.13Å; N258-E262 PolarHBondContact ND2-OE1 3.08Å; N258-E262 WeakPolarHBondContact O-CG 3.26Å; N258-E262 PolarHBondContact O-N 3.14Å; S259-E262 PolarHBondContact O-N 3.27Å; E262-F264 VanDerWaalsContact C-N 3.31Å; E262-F264 PolarHBondContact O-N 2.92Å; E262-A265 PolarHBondContact O-N 3.48Å; E262-F266 WeakPolarHBondContact O-CD2 3.4Å; E262-F266 PolarHBondContact O-N 3.09Å; E262-F266 VanDerWaalsContact O-N 3.14Å; E262-L346 HydrophobicContact CB-CD1 3.98Å; E262-L346 HydrophobicContact CG-CD1 3.61Å
263	K	92	Very high	83.3	Confident	13 Å²	13	29.4 Å²	29.4	6%	0.057	16%	0.159	C	C	.	.	H	α-helix	trans	-60.3	-40.8	172.8	-70	-174.3	-171.2	-172.3	0	111.7	D155 F157 W167 L217 S259 L260 F266 S267	D155-K263 IonicContact OD2-NZ 3.97Å; D155-K263 PolarHBondContact OD2-NZ 2.88Å; F157-K263 HydrophobicContact CE2-CB 4.1Å; F157-K263 HydrophobicContact CZ-CB 4Å; W167-K263 HydrophobicContact CD2-CD 4.47Å; W167-K263 HydrophobicContact CE3-CD 4.31Å; W167-K263 HydrophobicContact CE3-CG 4.29Å; W167-K263 HydrophobicContact CH2-CB 4.25Å; W167-K263 HydrophobicContact CH2-CG 4.13Å; W167-K263 HydrophobicContact CZ2-CB 4.07Å; W167-K263 HydrophobicContact CZ2-CG 4.4Å; W167-K263 WeakPolarHBondContact CZ2-O 3.41Å; W167-K263 HydrophobicContact CZ3-CG 4.06Å; L217-K263 HydrophobicContact CD1-CG 4.47Å; L217-K263 HydrophobicContact CD2-CD 4.3Å; L217-K263 HydrophobicContact CD2-CG 3.83Å; S259-K263 WeakPolarHBondContact O-CG 3.27Å; S259-K263 PolarHBondContact O-N 3.46Å; L260-K263 WeakPolarHBondContact O-CB 3.22Å; L260-K263 PolarHBondContact O-N 3.37Å; K263-F266 PolarHBondContact O-N 2.99Å; K263-S267 WeakPolarHBondContact O-CB 3.45Å; K263-S267 PolarHBondContact O-N 3.49Å; K263-S267 PolarHBondContact O-OG 3.15Å
264	F	92.5	Very high	85.2	Confident	5 Å²	5	26.6 Å²	26.6	2%	0.022	14%	0.139	C	C	.	.	H	α-helix	trans	-60.1	-47.7	175.5	170.6	-101.9	0	0	0	111.1	L133 V137 F157 F159 L260 L261 E262 F266 S267 D268 F336	L133-F264 HydrophobicContact CD1-CD1 3.93Å; L133-F264 HydrophobicContact CD1-CD2 4.38Å; L133-F264 HydrophobicContact CD1-CE1 3.56Å; L133-F264 HydrophobicContact CD1-CE2 4.06Å; L133-F264 HydrophobicContact CD1-CG 4.33Å; L133-F264 HydrophobicContact CD1-CZ 3.63Å; L133-F264 HydrophobicContact CD2-CE1 4.06Å; L133-F264 HydrophobicContact CD2-CZ 3.7Å; L133-F264 HydrophobicContact CG-CE1 4.48Å; L133-F264 HydrophobicContact CG-CZ 4.3Å; V137-F264 HydrophobicContact CB-CE2 4.02Å; V137-F264 HydrophobicContact CG1-CD2 4.17Å; V137-F264 HydrophobicContact CG1-CE2 3.54Å; V137-F264 HydrophobicContact CG1-CZ 4.28Å; V137-F264 HydrophobicContact CG2-CD2 4.36Å; V137-F264 HydrophobicContact CG2-CE2 4.12Å; F157-F264 HydrophobicContact CD1-CD2 4.07Å; F157-F264 HydrophobicContact CE1-CB 3.86Å; F157-F264 HydrophobicContact CE1-CD2 4.09Å; F157-F264 HydrophobicContact CE1-CG 4.49Å; F157-F264 HydrophobicContact CZ-CB 4.28Å; F159-F264 AromaticContact CE1-CE2 3.91Å; F159-F264 HydrophobicContact CE1-CE2 3.91Å; F159-F264 HydrophobicContact CZ-CE2 4.31Å; L260-F264 PolarHBondContact O-N 3.24Å; L261-F264 HydrophobicContact CD1-CD1 4.24Å; L261-F264 WeakPolarHBondContact O-CB 3.46Å; L261-F264 PolarHBondContact O-N 3.36Å; E262-F264 VanDerWaalsContact C-N 3.31Å; E262-F264 PolarHBondContact O-N 2.92Å; F264-F266 VanDerWaalsContact C-N 3.31Å; F264-F266 PolarHBondContact O-N 3.21Å; F264-S267 CarbonylContact O-C 3.54Å; F264-S267 WeakPolarHBondContact O-CA 3.42Å; F264-S267 WeakPolarHBondContact O-CB 3.36Å; F264-S267 PolarHBondContact O-N 3.29Å; F264-D268 HydrophobicContact CE1-CB 4.47Å; F264-D268 HydrophobicContact CE2-CB 4.47Å; F264-D268 HydrophobicContact CZ-CB 4.24Å; F264-D268 WeakPolarHBondContact O-CB 3.37Å; F264-D268 PolarHBondContact O-N 3.31Å; F264-F336 AromaticContact CD1-CE1 3.85Å; F264-F336 HydrophobicContact CD1-CE1 3.85Å; F264-F336 HydrophobicContact CD1-CZ 4.46Å; F264-F336 AromaticContact CE1-CD1 3.88Å; F264-F336 HydrophobicContact CE1-CD1 3.88Å; F264-F336 AromaticContact CE1-CE1 3.58Å; F264-F336 HydrophobicContact CE1-CE1 3.58Å; F264-F336 HydrophobicContact CE1-CZ 4.33Å
265	A	92.9	Very high	87	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-58	-42.1	179.5	0	0	0	0	0	112.8	L261 E262 A269 Y337 V343 F347	L261-A265 PolarHBondContact O-N 3.46Å; E262-A265 PolarHBondContact O-N 3.48Å; A265-A269 PolarHBondContact O-N 3.42Å; A265-A269 VanDerWaalsContact O-N 3.14Å; A265-Y337 HydrophobicContact CB-CE1 4.11Å; A265-V343 HydrophobicContact CB-CG1 3.52Å; A265-F347 HydrophobicContact CB-CB 4.18Å; A265-F347 WeakPolarHBondContact O-CD2 3.4Å
266	F	95.2	Very high	88.8	Confident	2 Å²	2	19.3 Å²	19.3	1%	0.009	10%	0.098	C	C	.	.	H	α-helix	trans	-68.8	-39	174.2	-66	-49.6	0	0	0	112.9	W167 T208 V210 I215 L217 E262 K263 F264 D268 A269 L270 L346 L350	W167-F266 HydrophobicContact CH2-CB 3.95Å; W167-F266 HydrophobicContact CH2-CD2 4.1Å; W167-F266 HydrophobicContact CH2-CG 4.47Å; W167-F266 HydrophobicContact CZ2-CB 3.87Å; T208-F266 HydrophobicContact CG2-CE2 3.5Å; T208-F266 HydrophobicContact CG2-CZ 3.57Å; V210-F266 HydrophobicContact CG2-CD1 4.35Å; V210-F266 HydrophobicContact CG2-CE1 3.36Å; V210-F266 HydrophobicContact CG2-CZ 3.77Å; I215-F266 HydrophobicContact CD1-CB 4.03Å; I215-F266 HydrophobicContact CD1-CD1 4.11Å; I215-F266 HydrophobicContact CD1-CD2 4.22Å; I215-F266 HydrophobicContact CD1-CG 3.87Å; I215-F266 HydrophobicContact CG2-CD2 3.93Å; I215-F266 HydrophobicContact CG2-CE2 3.56Å; I215-F266 HydrophobicContact CG2-CZ 3.89Å; L217-F266 HydrophobicContact CD1-CE2 4.37Å; E262-F266 WeakPolarHBondContact O-CD2 3.4Å; E262-F266 PolarHBondContact O-N 3.09Å; E262-F266 VanDerWaalsContact O-N 3.14Å; K263-F266 PolarHBondContact O-N 2.99Å; F264-F266 VanDerWaalsContact C-N 3.31Å; F264-F266 PolarHBondContact O-N 3.21Å; F266-D268 VanDerWaalsContact C-N 3.33Å; F266-A269 PolarHBondContact O-N 2.78Å; F266-L270 WeakPolarHBondContact O-CB 2.81Å; F266-L270 PolarHBondContact O-N 2.81Å; F266-L346 HydrophobicContact CE1-CB 3.83Å; F266-L346 HydrophobicContact CE2-CD1 4.45Å; F266-L346 HydrophobicContact CZ-CB 3.87Å; F266-L346 HydrophobicContact CZ-CD1 4.2Å; F266-L346 HydrophobicContact CZ-CD2 4.08Å; F266-L346 HydrophobicContact CZ-CG 4.27Å; F266-L350 HydrophobicContact CB-CD2 3.87Å; F266-L350 HydrophobicContact CD1-CB 3.93Å; F266-L350 HydrophobicContact CD1-CD2 3.64Å; F266-L350 HydrophobicContact CD1-CG 4.36Å; F266-L350 HydrophobicContact CE1-CB 4.33Å; F266-L350 HydrophobicContact CG-CD2 4.19Å; F266-L350 WeakPolarHBondContact O-CD2 3.42Å
267	S	95.1	Very high	90.2	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-64.1	-40.1	177.2	-56.6	0	0	0	0	111.9	F157 W167 K263 F264 L270 A271	F157-S267 WeakPolarHBondContact CD2-OG 3.4Å; F157-S267 WeakPolarHBondContact CE2-OG 3.45Å; W167-S267 PolarHBondContact NE1-OG 3.09Å; K263-S267 WeakPolarHBondContact O-CB 3.45Å; K263-S267 PolarHBondContact O-N 3.49Å; K263-S267 PolarHBondContact O-OG 3.15Å; F264-S267 CarbonylContact O-C 3.54Å; F264-S267 WeakPolarHBondContact O-CA 3.42Å; F264-S267 WeakPolarHBondContact O-CB 3.36Å; F264-S267 PolarHBondContact O-N 3.29Å; S267-L270 PolarHBondContact O-N 3.19Å; S267-A271 WeakPolarHBondContact O-CB 3.3Å; S267-A271 PolarHBondContact O-N 3.03Å
268	D	94.1	Very high	91.2	Very high	16 Å²	16	10.5 Å²	10.5	9%	0.086	6%	0.055	C	C	.	.	H	α-helix	trans	-65.4	-49	178.1	-174.1	30.7	0	0	0	110.5	F159 F264 F266 L270 A271 L272 Y337 F347	F159-D268 HydrophobicContact CE1-CB 4.16Å; F159-D268 HydrophobicContact CZ-CB 4.26Å; F264-D268 HydrophobicContact CE1-CB 4.47Å; F264-D268 HydrophobicContact CE2-CB 4.47Å; F264-D268 HydrophobicContact CZ-CB 4.24Å; F264-D268 WeakPolarHBondContact O-CB 3.37Å; F264-D268 PolarHBondContact O-N 3.31Å; F266-D268 VanDerWaalsContact C-N 3.33Å; D268-L270 VanDerWaalsContact C-N 3.32Å; D268-L270 PolarHBondContact O-N 3.49Å; D268-A271 PolarHBondContact O-N 3.31Å; D268-A271 VanDerWaalsContact O-N 3.1Å; D268-L272 WeakPolarHBondContact O-CG 3.05Å; D268-L272 PolarHBondContact O-N 3.38Å; D268-Y337 WeakPolarHBondContact CB-OH 3.28Å; D268-Y337 WeakPolarHBondContact OD2-CE2 3.11Å; D268-Y337 PolarHBondContact OD2-OH 3.04Å; D268-F347 HydrophobicContact CB-CD2 4.29Å; D268-F347 HydrophobicContact CB-CE2 4.19Å; D268-F347 WeakPolarHBondContact OD2-CE2 3.47Å
269	A	93.7	Very high	91.9	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-59.3	-41	175.2	0	0	0	0	0	112.8	A265 F266 L272 S273 F347 L350 K351	A265-A269 PolarHBondContact O-N 3.42Å; A265-A269 VanDerWaalsContact O-N 3.14Å; F266-A269 PolarHBondContact O-N 2.78Å; A269-L272 PolarHBondContact O-N 3.12Å; A269-S273 PolarHBondContact O-N 2.72Å; A269-S273 VanDerWaalsContact O-N 3.14Å; A269-F347 HydrophobicContact CB-CD2 3.75Å; A269-F347 HydrophobicContact CB-CE2 3.94Å; A269-L350 HydrophobicContact CB-CB 4.05Å; A269-L350 HydrophobicContact CB-CD2 4.03Å; A269-L350 HydrophobicContact CB-CG 4.1Å; A269-K351 HydrophobicContact CB-CB 4.49Å
270	L	94.7	Very high	92.3	Very high	1 Å²	1	7.6 Å²	7.6	1%	0.005	4%	0.038	C	C	.	.	H	α-helix	trans	-66.4	-41	174.4	-177.3	59.9	0	0	0	111.5	I99 V165 E197 L199 F266 S267 D268 L272 S273 V274 L354	I99-L270 HydrophobicContact CG2-CD2 3.64Å; V165-L270 HydrophobicContact CG1-CD2 3.91Å; V165-L270 HydrophobicContact CG2-CD2 4.34Å; V165-L270 HydrophobicContact CG2-CG 4.47Å; E197-L270 HydrophobicContact CB-CD1 4.09Å; E197-L270 HydrophobicContact CG-CD1 3.85Å; L199-L270 HydrophobicContact CD1-CB 4.4Å; L199-L270 HydrophobicContact CD1-CD1 3.85Å; L199-L270 HydrophobicContact CD1-CD2 4.1Å; L199-L270 HydrophobicContact CD1-CG 4.34Å; L199-L270 HydrophobicContact CG-CD1 4.04Å; L199-L270 HydrophobicContact CG-CD2 4.37Å; F266-L270 WeakPolarHBondContact O-CB 2.81Å; F266-L270 PolarHBondContact O-N 2.81Å; S267-L270 PolarHBondContact O-N 3.19Å; D268-L270 VanDerWaalsContact C-N 3.32Å; D268-L270 PolarHBondContact O-N 3.49Å; L270-L272 VanDerWaalsContact C-N 3.3Å; L270-L272 PolarHBondContact O-N 2.91Å; L270-S273 WeakPolarHBondContact O-CB 3.46Å; L270-S273 PolarHBondContact O-N 3.09Å; L270-S273 VanDerWaalsContact O-N 3.1Å; L270-V274 HydrophobicContact CD1-CG2 4.42Å; L270-V274 WeakPolarHBondContact O-CG2 3.45Å; L270-V274 PolarHBondContact O-N 2.98Å; L270-L354 HydrophobicContact CD1-CD1 4.22Å
271	A	93.8	Very high	92.5	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-63.2	-37.6	178.3	0	0	0	0	0	112	F159 V163 V165 S267 D268 V274 K275	F159-A271 HydrophobicContact CD1-CB 4.4Å; F159-A271 HydrophobicContact CD2-CB 3.65Å; F159-A271 HydrophobicContact CE1-CB 4.33Å; F159-A271 HydrophobicContact CE2-CB 3.58Å; F159-A271 HydrophobicContact CG-CB 4.08Å; F159-A271 HydrophobicContact CZ-CB 3.94Å; V163-A271 HydrophobicContact CB-CB 4.24Å; V163-A271 HydrophobicContact CG1-CB 3.83Å; V165-A271 HydrophobicContact CG2-CB 4.25Å; S267-A271 WeakPolarHBondContact O-CB 3.3Å; S267-A271 PolarHBondContact O-N 3.03Å; D268-A271 PolarHBondContact O-N 3.31Å; D268-A271 VanDerWaalsContact O-N 3.1Å; A271-V274 PolarHBondContact O-N 3.29Å; A271-K275 VanDerWaalsContact O-CB 3.28Å; A271-K275 WeakPolarHBondContact O-CB 3.35Å; A271-K275 PolarHBondContact O-N 3.27Å
272	L	92.7	Very high	92.5	Very high	5 Å²	5	8.4 Å²	8.4	3%	0.026	5%	0.046	C	C	.	.	H	α-helix	trans	-62.4	-43.4	171.3	-67	179.1	0	0	0	111.9	D268 A269 L270 K275 L276 S329 L330 F347	D268-L272 WeakPolarHBondContact O-CG 3.05Å; D268-L272 PolarHBondContact O-N 3.38Å; A269-L272 PolarHBondContact O-N 3.12Å; L270-L272 VanDerWaalsContact C-N 3.3Å; L270-L272 PolarHBondContact O-N 2.91Å; L272-K275 PolarHBondContact O-N 2.99Å; L272-L276 VanDerWaalsContact O-CB 3.3Å; L272-L276 WeakPolarHBondContact O-CB 3.35Å; L272-L276 PolarHBondContact O-N 2.91Å; L272-S329 VanDerWaalsContact CD1-O 3.3Å; L272-S329 WeakPolarHBondContact CD1-O 3.12Å; L272-L330 HydrophobicContact CB-CD2 3.85Å; L272-L330 HydrophobicContact CD2-CD2 3.74Å; L272-L330 HydrophobicContact CD2-CG 4.27Å; L272-L330 HydrophobicContact CG-CD2 4.32Å; L272-L330 WeakPolarHBondContact O-CD2 3.09Å; L272-F347 HydrophobicContact CD1-CE2 3.75Å; L272-F347 HydrophobicContact CD1-CZ 3.51Å
273	S	92.8	Very high	92.5	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-61.1	-46	177.1	-168	0	0	0	0	112	E197 A269 L270 L276 S277 R359	E197-S273 WeakPolarHBondContact OE1-CB 3.42Å; E197-S273 PolarHBondContact OE1-OG 3.34Å; E197-S273 WeakPolarHBondContact OE2-CB 3.46Å; E197-S273 PolarHBondContact OE2-OG 3.12Å; A269-S273 PolarHBondContact O-N 2.72Å; A269-S273 VanDerWaalsContact O-N 3.14Å; L270-S273 WeakPolarHBondContact O-CB 3.46Å; L270-S273 PolarHBondContact O-N 3.09Å; L270-S273 VanDerWaalsContact O-N 3.1Å; S273-L276 WeakPolarHBondContact O-CB 3.31Å; S273-L276 PolarHBondContact O-N 2.83Å; S273-S277 PolarHBondContact O-N 3.38Å; S273-S277 PolarHBondContact O-OG 2.93Å; S273-R359 PolarHBondContact O-NH2 3.1Å; S273-R359 PolarHBondContact OG-NH1 3.27Å
274	V	93	Very high	92.4	Very high	1 Å²	1	7.8 Å²	7.8	1%	0.006	4%	0.044	C	C	.	.	H	α-helix	trans	-66.1	-41.7	177	173.7	0	0	0	0	111.4	V163 E195 E197 L270 A271 L276 S277 L278	V163-V274 HydrophobicContact CG1-CB 4.01Å; V163-V274 HydrophobicContact CG1-CG1 3.87Å; V163-V274 HydrophobicContact CG2-CG1 4.25Å; E195-V274 HydrophobicContact CB-CG1 4.45Å; E197-V274 HydrophobicContact CB-CG2 3.59Å; L270-V274 HydrophobicContact CD1-CG2 4.42Å; L270-V274 WeakPolarHBondContact O-CG2 3.45Å; L270-V274 PolarHBondContact O-N 2.98Å; A271-V274 PolarHBondContact O-N 3.29Å; V274-L276 VanDerWaalsContact C-N 3.32Å; V274-L276 PolarHBondContact O-N 3.12Å; V274-S277 WeakPolarHBondContact O-CA 3.26Å; V274-S277 WeakPolarHBondContact O-CB 3.3Å; V274-S277 PolarHBondContact O-N 2.86Å; V274-S277 VanDerWaalsContact O-N 3.14Å; V274-L278 PolarHBondContact O-N 3.14Å; V274-L278 VanDerWaalsContact O-N 3.08Å
275	K	91.7	Very high	92.2	Very high	20 Å²	20	10 Å²	10	9%	0.087	6%	0.057	C	C	.	.	H	α-helix	trans	-63.7	-41.1	176.5	-173.8	61	169.5	-165.4	0	111.6	Q106 N161 V163 A271 L272 S277 L278 L279	Q106-K275 PolarHBondContact O-NZ 2.64Å; N161-K275 PolarHBondContact O-NZ 3.05Å; V163-K275 HydrophobicContact CG2-CB 4.16Å; V163-K275 HydrophobicContact CG2-CD 4.38Å; A271-K275 VanDerWaalsContact O-CB 3.28Å; A271-K275 WeakPolarHBondContact O-CB 3.35Å; A271-K275 PolarHBondContact O-N 3.27Å; L272-K275 PolarHBondContact O-N 2.99Å; K275-S277 VanDerWaalsContact C-N 3.28Å; K275-S277 PolarHBondContact O-N 2.69Å; K275-L278 HydrophobicContact CD-CD1 4.28Å; K275-L278 WeakPolarHBondContact O-CB 3.46Å; K275-L278 PolarHBondContact O-N 3.17Å; K275-L279 PolarHBondContact O-N 3.23Å
276	L	92.2	Very high	92.1	Very high	0 Å²	0	10 Å²	10	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-61.8	-40.3	173.6	-178.2	59.9	0	0	0	110.9	L272 S273 V274 L278 L279 E280 L330 V356 R359 I360 L363	L272-L276 VanDerWaalsContact O-CB 3.3Å; L272-L276 WeakPolarHBondContact O-CB 3.35Å; L272-L276 PolarHBondContact O-N 2.91Å; S273-L276 WeakPolarHBondContact O-CB 3.31Å; S273-L276 PolarHBondContact O-N 2.83Å; V274-L276 VanDerWaalsContact C-N 3.32Å; V274-L276 PolarHBondContact O-N 3.12Å; L276-L278 VanDerWaalsContact C-N 3.29Å; L276-L278 PolarHBondContact O-N 2.79Å; L276-L279 PolarHBondContact O-N 3.25Å; L276-L279 VanDerWaalsContact O-N 3.08Å; L276-E280 HydrophobicContact CD1-CG 4.45Å; L276-E280 HydrophobicContact CG-CG 4.35Å; L276-E280 VanDerWaalsContact O-CG 3.32Å; L276-E280 WeakPolarHBondContact O-CG 3.32Å; L276-E280 PolarHBondContact O-N 2.84Å; L276-L330 HydrophobicContact CB-CD2 4.38Å; L276-V356 HydrophobicContact CD2-CG1 4.17Å; L276-R359 HydrophobicContact CD2-CB 3.49Å; L276-R359 VanDerWaalsContact CD2-CB 3.49Å; L276-I360 HydrophobicContact CD1-CG1 3.84Å; L276-I360 HydrophobicContact CD2-CD1 4.5Å; L276-I360 HydrophobicContact CD2-CG1 3.74Å; L276-I360 HydrophobicContact CG-CG1 4.45Å; L276-L363 HydrophobicContact CD1-CD2 3.81Å
277	S	91.4	Very high	91.8	Very high	2 Å²	2	10.1 Å²	10.1	1%	0.014	6%	0.059	C	C	.	.	H	α-helix	trans	-56.2	-41.5	174.3	-62.2	0	0	0	0	112.9	K80 E195 S273 V274 K275 L279 E280 N281 R359	K80-S277 VanDerWaalsContact NZ-CA 3.28Å; K80-S277 PolarHBondContact NZ-OG 3.48Å; E195-S277 WeakPolarHBondContact OE2-CB 3.26Å; S273-S277 PolarHBondContact O-N 3.38Å; S273-S277 PolarHBondContact O-OG 2.93Å; V274-S277 WeakPolarHBondContact O-CA 3.26Å; V274-S277 WeakPolarHBondContact O-CB 3.3Å; V274-S277 PolarHBondContact O-N 2.86Å; V274-S277 VanDerWaalsContact O-N 3.14Å; K275-S277 VanDerWaalsContact C-N 3.28Å; K275-S277 PolarHBondContact O-N 2.69Å; S277-L279 PolarHBondContact O-N 2.84Å; S277-E280 PolarHBondContact O-N 3.38Å; S277-N281 PolarHBondContact O-N 2.86Å; S277-R359 PolarHBondContact OG-NH2 3.1Å
278	L	90.7	Very high	91.5	Very high	25 Å²	25	13.5 Å²	13.5	13%	0.131	8%	0.079	C	C	.	.	H	α-helix	trans	-63.1	-40.5	174.9	-66.4	177.1	0	0	0	112.7	L189 E195 V274 K275 L276 G282	L189-L278 HydrophobicContact CD1-CD1 3.92Å; L189-L278 HydrophobicContact CD1-CD2 3.34Å; L189-L278 HydrophobicContact CD1-CG 4.25Å; E195-L278 HydrophobicContact CB-CD2 3.76Å; E195-L278 HydrophobicContact CB-CG 4.29Å; E195-L278 HydrophobicContact CG-CD2 3.6Å; E195-L278 HydrophobicContact CG-CG 4.29Å; V274-L278 PolarHBondContact O-N 3.14Å; V274-L278 VanDerWaalsContact O-N 3.08Å; K275-L278 HydrophobicContact CD-CD1 4.28Å; K275-L278 WeakPolarHBondContact O-CB 3.46Å; K275-L278 PolarHBondContact O-N 3.17Å; L276-L278 VanDerWaalsContact C-N 3.29Å; L276-L278 PolarHBondContact O-N 2.79Å; L278-G282 PolarHBondContact O-N 3.5Å
279	L	91.3	Very high	91.3	Very high	11 Å²	11	16.2 Å²	16.2	6%	0.058	9%	0.091	C	C	.	.	H	α-helix	trans	-70.3	-39.3	178.2	-65.5	177.8	0	0	0	112.2	K275 L276 S277 G282 F283 L323 L324 L330 L363	K275-L279 PolarHBondContact O-N 3.23Å; L276-L279 PolarHBondContact O-N 3.25Å; L276-L279 VanDerWaalsContact O-N 3.08Å; S277-L279 PolarHBondContact O-N 2.84Å; L279-G282 PolarHBondContact O-N 3.21Å; L279-F283 WeakPolarHBondContact O-CB 3.43Å; L279-F283 PolarHBondContact O-N 3.3Å; L279-L323 HydrophobicContact CD2-CB 3.74Å; L279-L323 HydrophobicContact CD2-CD1 4.09Å; L279-L324 HydrophobicContact CD1-CB 4.17Å; L279-L330 HydrophobicContact CD1-CD1 4.08Å; L279-L363 HydrophobicContact CB-CD2 4.23Å
280	E	91.4	Very high	91	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-59.3	-46.8	174.4	-72.5	173.7	162.6	0	0	111.1	F77 K80 L276 S277 F283 D284 R359 L363	F77-E280 HydrophobicContact CD1-CB 4.45Å; F77-E280 HydrophobicContact CD1-CG 4.18Å; F77-E280 HydrophobicContact CD2-CB 3.67Å; F77-E280 HydrophobicContact CD2-CG 4.12Å; F77-E280 HydrophobicContact CE1-CB 4.41Å; F77-E280 HydrophobicContact CE1-CG 3.79Å; F77-E280 HydrophobicContact CE2-CB 3.65Å; F77-E280 HydrophobicContact CE2-CG 3.75Å; F77-E280 HydrophobicContact CG-CB 4.12Å; F77-E280 HydrophobicContact CG-CG 4.36Å; F77-E280 HydrophobicContact CZ-CB 4.05Å; F77-E280 HydrophobicContact CZ-CG 3.59Å; K80-E280 VanDerWaalsContact CE-OE2 3.27Å; K80-E280 WeakPolarHBondContact CE-OE2 3.43Å; K80-E280 IonicContact NZ-OE2 2.66Å; K80-E280 PolarHBondContact NZ-OE2 3.16Å; L276-E280 HydrophobicContact CD1-CG 4.45Å; L276-E280 HydrophobicContact CG-CG 4.35Å; L276-E280 VanDerWaalsContact O-CG 3.32Å; L276-E280 WeakPolarHBondContact O-CG 3.32Å; L276-E280 PolarHBondContact O-N 2.84Å; S277-E280 PolarHBondContact O-N 3.38Å; E280-F283 WeakPolarHBondContact O-CB 3.45Å; E280-F283 PolarHBondContact O-N 3.01Å; E280-D284 PolarHBondContact O-N 3.03Å; E280-R359 VanDerWaalsContact CD-NH2 3.3Å; E280-R359 IonicContact OE1-CZ 3.72Å; E280-R359 IonicContact OE1-NE 3.36Å; E280-R359 PolarHBondContact OE1-NE 3.07Å; E280-R359 IonicContact OE1-NH2 3.05Å; E280-R359 PolarHBondContact OE1-NH2 3.08Å; E280-R359 IonicContact OE2-CZ 2.98Å; E280-R359 IonicContact OE2-NE 3.54Å; E280-R359 IonicContact OE2-NH2 2.74Å; E280-R359 PolarHBondContact OE2-NH2 3.33Å; E280-L363 HydrophobicContact CG-CD2 4.06Å
281	N	90.5	Very high	90.7	Very high	41 Å²	41	18.6 Å²	18.6	22%	0.219	10%	0.103	C	C	.	.	H	α-helix	trans	-67.2	-38.9	177.5	-72.9	0.5	0	0	0	112.8	E195 S277 F283 D284 T285	E195-N281 WeakPolarHBondContact CG-ND2 3.5Å; E195-N281 PolarHBondContact OE1-ND2 3.28Å; S277-N281 PolarHBondContact O-N 2.86Å; N281-F283 VanDerWaalsContact C-N 3.25Å; N281-F283 PolarHBondContact O-N 3.48Å; N281-D284 PolarHBondContact O-N 3.11Å; N281-T285 PolarHBondContact O-N 2.84Å; N281-T285 PolarHBondContact O-OG1 2.76Å
282	G	89.3	Confident	90.4	Very high	15 Å²	15	21.6 Å²	21.6	16%	0.155	12%	0.122	C	C	.	.	H	α-helix	trans	-59.8	-39.4	172.7	0	0	0	0	0	111.6	L278 L279 A286	L278-G282 PolarHBondContact O-N 3.5Å; L279-G282 PolarHBondContact O-N 3.21Å; G282-A286 PolarHBondContact O-N 2.71Å
283	F	91.9	Very high	90.1	Very high	3 Å²	3	22.9 Å²	22.9	1%	0.013	13%	0.126	C	C	.	.	H	α-helix	trans	-68.2	-46.3	174.1	176.7	-100.9	0	0	0	112.6	F77 L279 E280 N281 T285 A286 V287 L317 I320 L363 R366 L367 C370	F77-F283 HydrophobicContact CE2-CD1 4.04Å; L279-F283 WeakPolarHBondContact O-CB 3.43Å; L279-F283 PolarHBondContact O-N 3.3Å; E280-F283 WeakPolarHBondContact O-CB 3.45Å; E280-F283 PolarHBondContact O-N 3.01Å; N281-F283 VanDerWaalsContact C-N 3.25Å; N281-F283 PolarHBondContact O-N 3.48Å; F283-T285 PolarHBondContact O-N 2.69Å; F283-A286 WeakPolarHBondContact O-CA 3.2Å; F283-A286 WeakPolarHBondContact O-CB 3.35Å; F283-A286 PolarHBondContact O-N 2.9Å; F283-V287 HydrophobicContact CD1-CG2 3.79Å; F283-V287 HydrophobicContact CD2-CG2 4.3Å; F283-V287 HydrophobicContact CE1-CG2 3.3Å; F283-V287 HydrophobicContact CE2-CG2 3.84Å; F283-V287 HydrophobicContact CG-CG2 4.28Å; F283-V287 HydrophobicContact CZ-CG2 3.32Å; F283-V287 WeakPolarHBondContact O-CG2 3.3Å; F283-V287 PolarHBondContact O-N 2.85Å; F283-L317 HydrophobicContact CD2-CD2 4.26Å; F283-L317 HydrophobicContact CE2-CD2 4.13Å; F283-I320 HydrophobicContact CB-CD1 4.19Å; F283-L363 HydrophobicContact CB-CD1 3.73Å; F283-L363 HydrophobicContact CD1-CD1 3.78Å; F283-L363 HydrophobicContact CD2-CD1 4.36Å; F283-L363 HydrophobicContact CE1-CD1 4.5Å; F283-L363 HydrophobicContact CG-CD1 3.68Å; F283-R366 HydrophobicContact CE1-CB 3.65Å; F283-R366 HydrophobicContact CZ-CB 3.6Å; F283-L367 HydrophobicContact CD2-CB 4.39Å; F283-L367 HydrophobicContact CE2-CB 4.06Å; F283-L367 HydrophobicContact CE2-CG 4.47Å; F283-C370 HydrophobicContact CE2-CB 4.32Å
284	D	89.7	Confident	89.8	Confident	15 Å²	15	25.1 Å²	25.1	8%	0.08	14%	0.138	C	C	.	.	H	α-helix	trans	-58.1	-37.3	177.9	-83.6	-6.9	0	0	0	111.9	F77 E280 N281 A286 V287 V288	F77-D284 WeakPolarHBondContact CB-OD2 3.47Å; F77-D284 WeakPolarHBondContact CD2-OD1 3.32Å; F77-D284 WeakPolarHBondContact CD2-OD2 3.39Å; F77-D284 PolarHBondContact N-OD1 3.15Å; F77-D284 PolarHBondContact N-OD2 2.96Å; E280-D284 PolarHBondContact O-N 3.03Å; N281-D284 PolarHBondContact O-N 3.11Å; D284-A286 PolarHBondContact O-N 2.89Å; D284-V287 WeakPolarHBondContact O-CB 3.29Å; D284-V287 PolarHBondContact O-N 2.81Å; D284-V288 WeakPolarHBondContact O-CG2 3.48Å; D284-V288 PolarHBondContact O-N 3.27Å
285	T	89.4	Confident	89.5	Confident	51 Å²	51	29.3 Å²	29.3	31%	0.313	16%	0.157	S	C	.	.	H	α-helix	trans	-59.9	-47.3	173.7	-55.8	0	0	0	0	111.3	F49 N281 F283 V287 V288 E289	F49-T285 HydrophobicContact CD1-CG2 4.01Å; F49-T285 HydrophobicContact CE1-CG2 3.64Å; F49-T285 HydrophobicContact CZ-CG2 4.09Å; N281-T285 PolarHBondContact O-N 2.84Å; N281-T285 PolarHBondContact O-OG1 2.76Å; F283-T285 PolarHBondContact O-N 2.69Å; T285-V287 VanDerWaalsContact C-N 3.31Å; T285-V287 PolarHBondContact O-N 3.07Å; T285-V288 PolarHBondContact O-N 3.49Å; T285-E289 PolarHBondContact O-N 3.42Å
286	A	88.9	Confident	89.2	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-64.8	-35.7	177.1	0	0	0	0	0	112.2	G282 F283 D284 E289 I290 L317	G282-A286 PolarHBondContact O-N 2.71Å; F283-A286 WeakPolarHBondContact O-CA 3.2Å; F283-A286 WeakPolarHBondContact O-CB 3.35Å; F283-A286 PolarHBondContact O-N 2.9Å; D284-A286 PolarHBondContact O-N 2.89Å; A286-E289 PolarHBondContact O-N 2.71Å; A286-I290 WeakPolarHBondContact O-CD1 3.28Å; A286-I290 VanDerWaalsContact O-CG1 3.27Å; A286-I290 WeakPolarHBondContact O-CG1 3.33Å; A286-I290 PolarHBondContact O-N 3.05Å; A286-I290 VanDerWaalsContact O-N 3.15Å; A286-L317 HydrophobicContact CB-CD2 4.15Å
287	V	89.6	Confident	88.8	Confident	5 Å²	5	37 Å²	37	3%	0.03	19%	0.193	C	C	.	.	H	α-helix	trans	-64.6	-45.6	177.7	168.4	0	0	0	0	111.6	L74 F283 D284 T285 E289 I290 E291	L74-V287 HydrophobicContact CB-CG1 3.46Å; L74-V287 VanDerWaalsContact CB-CG1 3.46Å; L74-V287 HydrophobicContact CD1-CG1 4.14Å; L74-V287 HydrophobicContact CD2-CG1 4.13Å; L74-V287 HydrophobicContact CG-CG1 4.13Å; F283-V287 HydrophobicContact CD1-CG2 3.79Å; F283-V287 HydrophobicContact CD2-CG2 4.3Å; F283-V287 HydrophobicContact CE1-CG2 3.3Å; F283-V287 HydrophobicContact CE2-CG2 3.84Å; F283-V287 HydrophobicContact CG-CG2 4.28Å; F283-V287 HydrophobicContact CZ-CG2 3.32Å; F283-V287 WeakPolarHBondContact O-CG2 3.3Å; F283-V287 PolarHBondContact O-N 2.85Å; D284-V287 WeakPolarHBondContact O-CB 3.29Å; D284-V287 PolarHBondContact O-N 2.81Å; T285-V287 VanDerWaalsContact C-N 3.31Å; T285-V287 PolarHBondContact O-N 3.07Å; V287-E289 PolarHBondContact O-N 3.09Å; V287-I290 CarbonylContact O-C 3.57Å; V287-I290 PolarHBondContact O-N 2.95Å; V287-E291 PolarHBondContact O-N 3.09Å
288	V	89.8	Confident	88.5	Confident	70 Å²	70	43.3 Å²	43.3	42%	0.424	22%	0.22	S	C	.	.	H	α-helix	trans	-58.7	-34.4	177.4	169.8	0	0	0	0	111.4	D284 T285 P292	D284-V288 WeakPolarHBondContact O-CG2 3.48Å; D284-V288 PolarHBondContact O-N 3.27Å; T285-V288 PolarHBondContact O-N 3.49Å; V288-P292 WeakPolarHBondContact O-CD 3.38Å
289	E	88.7	Confident	88.2	Confident	74 Å²	74	46.1 Å²	46.1	35%	0.346	24%	0.238	S	C	.	.	H	α-helix	trans	-76.5	-25.9	177	-65.7	174.3	111.8	0	0	113.6	T285 A286 V287 W293 K313	T285-E289 PolarHBondContact O-N 3.42Å; A286-E289 PolarHBondContact O-N 2.71Å; V287-E289 PolarHBondContact O-N 3.09Å; E289-W293 PolarHBondContact O-NE1 2.84Å; E289-K313 IonicContact OE1-NZ 2.77Å; E289-K313 PolarHBondContact OE1-NZ 3.1Å; E289-K313 WeakPolarHBondContact OE2-CE 3.36Å; E289-K313 IonicContact OE2-NZ 3.94Å; E289-K313 PolarHBondContact OE2-NZ 2.88Å
290	I	88.3	Confident	87.3	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-83.6	-29.5	177.6	-70.1	168.4	0	0	0	111.5	A286 V287 W293 I294 L317 C370 L373	A286-I290 WeakPolarHBondContact O-CD1 3.28Å; A286-I290 VanDerWaalsContact O-CG1 3.27Å; A286-I290 WeakPolarHBondContact O-CG1 3.33Å; A286-I290 PolarHBondContact O-N 3.05Å; A286-I290 VanDerWaalsContact O-N 3.15Å; V287-I290 CarbonylContact O-C 3.57Å; V287-I290 PolarHBondContact O-N 2.95Å; I290-W293 WeakPolarHBondContact O-CA 3.22Å; I290-W293 WeakPolarHBondContact O-CB 3.48Å; I290-W293 PolarHBondContact O-N 2.69Å; I290-I294 HydrophobicContact CG2-CD1 4.13Å; I290-I294 HydrophobicContact CG2-CG1 4.47Å; I290-I294 PolarHBondContact O-N 2.99Å; I290-L317 HydrophobicContact CD1-CD1 4Å; I290-L317 HydrophobicContact CD1-CD2 4.32Å; I290-L317 HydrophobicContact CD1-CG 4.45Å; I290-C370 HydrophobicContact CD1-CB 4.43Å; I290-L373 HydrophobicContact CG2-CD2 3.46Å; I290-L373 VanDerWaalsContact CG2-CD2 3.46Å
291	E	88.6	Confident	86.2	Confident	50 Å²	50	58.9 Å²	58.9	23%	0.234	31%	0.306	C	S	.	.	H	α-helix	trans	-53.1	-45.9	-177.9	-179.2	178.3	-175.3	0	0	113.7	S73 L74 V287 W293 I294 E295	S73-E291 WeakPolarHBondContact CA-OE1 3.5Å; L74-E291 HydrophobicContact CD1-CB 4.14Å; L74-E291 HydrophobicContact CD1-CG 4.45Å; V287-E291 PolarHBondContact O-N 3.09Å; E291-W293 PolarHBondContact O-N 2.73Å; E291-W293 VanDerWaalsContact O-N 3.12Å; E291-I294 PolarHBondContact O-N 3.06Å; E291-I294 VanDerWaalsContact O-N 3.09Å; E291-E295 PolarHBondContact O-N 3.22Å; E291-E295 VanDerWaalsContact O-N 3.09Å
292	P	87	Confident	84.8	Confident	62 Å²	62	59.6 Å²	59.6	40%	0.403	32%	0.324	S	S	.	.	H	α-helix	trans	-61.8	-22.6	174.5	-23	33.2	0	0	0	113.9	V288 K296	V288-P292 WeakPolarHBondContact O-CD 3.38Å; P292-K296 VanDerWaalsContact O-CG 3.27Å; P292-K296 WeakPolarHBondContact O-CG 3.17Å; P292-K296 PolarHBondContact O-N 2.79Å
293	W	87	Confident	83.7	Confident	33 Å²	33	59.8 Å²	59.8	13%	0.125	32%	0.323	C	S	.	.	H	α-helix	trans	-74.6	-40.5	177.7	-58.1	10.9	0	0	0	109.8	E289 I290 E291 E295 K296 M297 F305 V310 K313 L377	E289-W293 PolarHBondContact O-NE1 2.84Å; I290-W293 WeakPolarHBondContact O-CA 3.22Å; I290-W293 WeakPolarHBondContact O-CB 3.48Å; I290-W293 PolarHBondContact O-N 2.69Å; E291-W293 PolarHBondContact O-N 2.73Å; E291-W293 VanDerWaalsContact O-N 3.12Å; W293-E295 VanDerWaalsContact C-N 3.35Å; W293-K296 WeakPolarHBondContact O-CB 3.48Å; W293-K296 PolarHBondContact O-N 2.8Å; W293-M297 WeakPolarHBondContact O-CG 3.41Å; W293-M297 PolarHBondContact O-N 2.9Å; W293-F305 HydrophobicContact CB-CE1 3.62Å; W293-F305 HydrophobicContact CB-CZ 3.88Å; W293-F305 HydrophobicContact CD2-CD1 4.34Å; W293-F305 HydrophobicContact CD2-CE1 4.13Å; W293-F305 HydrophobicContact CG-CD1 4.29Å; W293-F305 AromaticContact CG-CE1 3.64Å; W293-F305 HydrophobicContact CG-CE1 3.64Å; W293-F305 HydrophobicContact CG-CZ 4.39Å; W293-V310 HydrophobicContact CZ3-CG2 4.2Å; W293-K313 HydrophobicContact CH2-CB 3.75Å; W293-K313 HydrophobicContact CH2-CG 3.27Å; W293-K313 HydrophobicContact CZ2-CG 3.76Å; W293-K313 HydrophobicContact CZ3-CB 4.12Å; W293-K313 HydrophobicContact CZ3-CG 4.05Å; W293-L377 HydrophobicContact CE3-CD1 3.78Å; W293-L377 HydrophobicContact CZ3-CD1 4.29Å
294	I	86	Confident	82.7	Confident	47 Å²	47	71.4 Å²	71.4	24%	0.241	37%	0.367	C	S	.	.	H	α-helix	trans	-62.3	-44.5	174	-65.7	162.2	0	0	0	110.4	L74 I290 E291 K296 M297 K298 L373	L74-I294 HydrophobicContact CD1-CD1 3.3Å; L74-I294 HydrophobicContact CG-CD1 4.49Å; I290-I294 HydrophobicContact CG2-CD1 4.13Å; I290-I294 HydrophobicContact CG2-CG1 4.47Å; I290-I294 PolarHBondContact O-N 2.99Å; E291-I294 PolarHBondContact O-N 3.06Å; E291-I294 VanDerWaalsContact O-N 3.09Å; I294-K296 VanDerWaalsContact C-N 3.32Å; I294-K296 PolarHBondContact O-N 2.75Å; I294-M297 HydrophobicContact CB-CE 4.28Å; I294-M297 HydrophobicContact CG1-CE 3.91Å; I294-M297 WeakPolarHBondContact O-CB 3.41Å; I294-M297 PolarHBondContact O-N 2.99Å; I294-M297 VanDerWaalsContact O-N 3.13Å; I294-K298 WeakPolarHBondContact O-CG 3.12Å; I294-K298 PolarHBondContact O-N 3.06Å; I294-L373 HydrophobicContact CD1-CD2 3.72Å; I294-L373 HydrophobicContact CG1-CD2 3.59Å
295	E	87	Confident	82.3	Confident	88 Å²	88	71.7 Å²	71.7	41%	0.411	37%	0.368	S	S	.	.	H	α-helix	trans	-60.3	-40.5	174.7	-72	-57.5	139.3	0	0	112.6	E291 W293 M297 K298	E291-E295 PolarHBondContact O-N 3.22Å; E291-E295 VanDerWaalsContact O-N 3.09Å; W293-E295 VanDerWaalsContact C-N 3.35Å; E295-M297 PolarHBondContact O-N 3Å; E295-K298 WeakPolarHBondContact O-CB 3.09Å; E295-K298 PolarHBondContact O-N 3Å; E295-K298 IonicContact OE1-NZ 2.84Å; E295-K298 PolarHBondContact OE1-NZ 3.19Å; E295-K298 IonicContact OE2-NZ 2.7Å; E295-K298 PolarHBondContact OE2-NZ 3.26Å
296	K	85.1	Confident	82.2	Confident	114 Å²	114	78.3 Å²	78.3	50%	0.496	39%	0.387	S	S	.	.	H	α-helix	trans	-63.9	-40.1	173.9	-76.5	171	-176.1	174	0	112.5	P292 W293 I294 K298 T299 A303 F305	P292-K296 VanDerWaalsContact O-CG 3.27Å; P292-K296 WeakPolarHBondContact O-CG 3.17Å; P292-K296 PolarHBondContact O-N 2.79Å; W293-K296 WeakPolarHBondContact O-CB 3.48Å; W293-K296 PolarHBondContact O-N 2.8Å; I294-K296 VanDerWaalsContact C-N 3.32Å; I294-K296 PolarHBondContact O-N 2.75Å; K296-K298 VanDerWaalsContact C-N 3.34Å; K296-T299 PolarHBondContact O-N 2.85Å; K296-T299 PolarHBondContact O-OG1 2.97Å; K296-A303 HydrophobicContact CB-CB 3.86Å; K296-F305 HydrophobicContact CB-CZ 4.11Å; K296-F305 HydrophobicContact CD-CE1 4.27Å
297	M	83.3	Confident	82.1	Confident	68 Å²	68	84 Å²	84	34%	0.335	41%	0.414	S	S	.	.	H	α-helix	trans	-65.2	-36.6	176.5	-70.2	-169.1	-54.5	0	0	112.4	W293 I294 E295 T299 G300 F305 L373 L377	W293-M297 WeakPolarHBondContact O-CG 3.41Å; W293-M297 PolarHBondContact O-N 2.9Å; I294-M297 HydrophobicContact CB-CE 4.28Å; I294-M297 HydrophobicContact CG1-CE 3.91Å; I294-M297 WeakPolarHBondContact O-CB 3.41Å; I294-M297 PolarHBondContact O-N 2.99Å; I294-M297 VanDerWaalsContact O-N 3.13Å; E295-M297 PolarHBondContact O-N 3Å; M297-T299 PolarHBondContact O-N 3.12Å; M297-T299 VanDerWaalsContact O-N 3.15Å; M297-G300 PolarHBondContact O-N 3.1Å; M297-F305 HydrophobicContact CG-CE2 4.09Å; M297-F305 HydrophobicContact CG-CZ 4.21Å; M297-L373 HydrophobicContact CE-CD1 3.2Å; M297-L373 HydrophobicContact CE-CG 4.46Å; M297-L373 HydrophobicContact SD-CD1 3.83Å; M297-L377 HydrophobicContact CG-CD2 4.29Å; M297-L377 HydrophobicContact SD-CD2 3.65Å; M297-L377 HydrophobicContact SD-CG 4.24Å
298	K	85.5	Confident	82.1	Confident	134 Å²	134	86.6 Å²	86.6	58%	0.583	43%	0.431	S	S	*	.	H	α-helix	trans	-56.8	-29.7	175.8	-74.2	167.3	63.7	-162.2	0	112.6	I294 E295 K296 G300	I294-K298 WeakPolarHBondContact O-CG 3.12Å; I294-K298 PolarHBondContact O-N 3.06Å; E295-K298 WeakPolarHBondContact O-CB 3.09Å; E295-K298 PolarHBondContact O-N 3Å; E295-K298 IonicContact OE1-NZ 2.84Å; E295-K298 PolarHBondContact OE1-NZ 3.19Å; E295-K298 IonicContact OE2-NZ 2.7Å; E295-K298 PolarHBondContact OE2-NZ 3.26Å; K296-K298 VanDerWaalsContact C-N 3.34Å; K298-G300 PolarHBondContact O-N 2.79Å
299	T	83.5	Confident	82.1	Confident	85 Å²	85	84.6 Å²	84.6	52%	0.521	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-14.2	177.5	72.5	0	0	0	0	113.8	K296 M297 R301	K296-T299 PolarHBondContact O-N 2.85Å; K296-T299 PolarHBondContact O-OG1 2.97Å; M297-T299 PolarHBondContact O-N 3.12Å; M297-T299 VanDerWaalsContact O-N 3.15Å; T299-R301 PolarHBondContact O-N 3.27Å
300	G	73	Confident	82.2	Confident	66 Å²	66	81.1 Å²	81.1	68%	0.68	41%	0.406	S	S	*	.			trans	65.8	-7.3	-177.4	0	0	0	0	0	114.8	M297 K298 G302	M297-G300 PolarHBondContact O-N 3.1Å; K298-G300 PolarHBondContact O-N 2.79Å; G300-G302 PolarHBondContact O-N 3.4Å
301	R	67.5	Low	82.3	Confident	213 Å²	213	86.7 Å²	86.7	80%	0.804	44%	0.436	S	S	*	.	S	Bend	trans	-79.7	72.8	179.6	-67.6	-178.1	-179.5	150	0.9	109.5	T299 A303	T299-R301 PolarHBondContact O-N 3.27Å; R301-A303 VanDerWaalsContact C-N 3.27Å; R301-A303 WeakPolarHBondContact O-CA 3.48Å; R301-A303 PolarHBondContact O-N 3.38Å
302	G	62.4	Low	82.5	Confident	57 Å²	57	92.2 Å²	92.2	59%	0.588	45%	0.454	S	S	*	.			trans	10	71.6	171.7	0	0	0	0	0	113.9	G300 R304	G300-G302 PolarHBondContact O-N 3.4Å; G302-R304 PolarHBondContact O-N 3.09Å
303	A	65	Low	82.7	Confident	18 Å²	18	89.8 Å²	89.8	15%	0.149	44%	0.437	C	S	.	.			trans	-62.2	119.8	-169.1	0	0	0	0	0	107.7	K296 R301 F305	K296-A303 HydrophobicContact CB-CB 3.86Å; R301-A303 VanDerWaalsContact C-N 3.27Å; R301-A303 WeakPolarHBondContact O-CA 3.48Å; R301-A303 PolarHBondContact O-N 3.38Å; A303-F305 HydrophobicContact CB-CD2 4.05Å; A303-F305 HydrophobicContact CB-CE1 4.36Å; A303-F305 HydrophobicContact CB-CE2 3.43Å; A303-F305 VanDerWaalsContact CB-CE2 3.43Å; A303-F305 HydrophobicContact CB-CZ 3.61Å; A303-F305 WeakPolarHBondContact O-CD2 3.33Å; A303-F305 PolarHBondContact O-N 3.22Å
304	R	71.6	Confident	83	Confident	247 Å²	247	89.5 Å²	89.5	93%	0.932	44%	0.439	S	S	*	.			trans	-75.3	80	-177.5	-172.6	-179.3	-83.8	156.5	-5.6	108.8	G302	G302-R304 PolarHBondContact O-N 3.09Å
305	F	82	Confident	83.3	Confident	22 Å²	22	89 Å²	89	10%	0.096	45%	0.445	C	S	.	.			trans	-72.4	139.2	169.2	-59.1	-74.2	0	0	0	109.5	W293 K296 M297 A303 V310 L377 L381	W293-F305 HydrophobicContact CB-CE1 3.62Å; W293-F305 HydrophobicContact CB-CZ 3.88Å; W293-F305 HydrophobicContact CD2-CD1 4.34Å; W293-F305 HydrophobicContact CD2-CE1 4.13Å; W293-F305 HydrophobicContact CG-CD1 4.29Å; W293-F305 AromaticContact CG-CE1 3.64Å; W293-F305 HydrophobicContact CG-CE1 3.64Å; W293-F305 HydrophobicContact CG-CZ 4.39Å; K296-F305 HydrophobicContact CB-CZ 4.11Å; K296-F305 HydrophobicContact CD-CE1 4.27Å; M297-F305 HydrophobicContact CG-CE2 4.09Å; M297-F305 HydrophobicContact CG-CZ 4.21Å; A303-F305 HydrophobicContact CB-CD2 4.05Å; A303-F305 HydrophobicContact CB-CE1 4.36Å; A303-F305 HydrophobicContact CB-CE2 3.43Å; A303-F305 VanDerWaalsContact CB-CE2 3.43Å; A303-F305 HydrophobicContact CB-CZ 3.61Å; A303-F305 WeakPolarHBondContact O-CD2 3.33Å; A303-F305 PolarHBondContact O-N 3.22Å; F305-V310 HydrophobicContact CB-CG2 3.96Å; F305-L377 HydrophobicContact CD2-CD2 3.61Å; F305-L377 HydrophobicContact CE2-CD2 3.48Å; F305-L377 VanDerWaalsContact CE2-CD2 3.48Å; F305-L377 HydrophobicContact CG-CD2 4.49Å; F305-L377 HydrophobicContact CZ-CD2 4.31Å; F305-L381 HydrophobicContact CB-CD1 4.28Å; F305-L381 HydrophobicContact CB-CD2 4.36Å; F305-L381 VanDerWaalsContact O-CD2 3.23Å; F305-L381 WeakPolarHBondContact O-CD2 3.36Å
306	R	86.1	Confident	83.6	Confident	190 Å²	190	86.8 Å²	86.8	72%	0.717	44%	0.435	S	S	*	.			trans	-77.1	129.2	171.1	-174.4	175.7	168.2	145.1	-1.1	108.1	S308 A309 V310	R306-S308 VanDerWaalsContact CD-OG 3.28Å; R306-S308 WeakPolarHBondContact CD-OG 3.5Å; R306-S308 WeakPolarHBondContact CG-OG 3.45Å; R306-S308 PolarHBondContact NE-OG 2.91Å; R306-S308 PolarHBondContact O-N 3.34Å; R306-A309 HydrophobicContact CB-CB 4.21Å; R306-A309 WeakPolarHBondContact O-CA 3.43Å; R306-A309 WeakPolarHBondContact O-CB 3.1Å; R306-A309 PolarHBondContact O-N 3.49Å; R306-V310 PolarHBondContact O-N 3.46Å
307	Q	87.2	Confident	83.9	Confident	121 Å²	121	81.4 Å²	81.4	57%	0.565	41%	0.412	S	S	*	.	H	α-helix	trans	-53.8	-39.1	178.9	-172	-178.3	6.9	0	0	112.6	A309 V310 L311 L381	Q307-A309 VanDerWaalsContact C-N 3.28Å; Q307-A309 PolarHBondContact O-N 3.14Å; Q307-V310 PolarHBondContact O-N 3.04Å; Q307-L311 WeakPolarHBondContact O-CB 3.18Å; Q307-L311 PolarHBondContact O-N 2.96Å; Q307-L381 HydrophobicContact CB-CD1 4.21Å
308	S	89.9	Confident	84.4	Confident	58 Å²	58	84.6 Å²	84.6	41%	0.406	42%	0.421	S	S	.	.	H	α-helix	trans	-66.4	-28.3	176.6	71	0	0	0	0	113.5	R306 R312	R306-S308 VanDerWaalsContact CD-OG 3.28Å; R306-S308 WeakPolarHBondContact CD-OG 3.5Å; R306-S308 WeakPolarHBondContact CG-OG 3.45Å; R306-S308 PolarHBondContact NE-OG 2.91Å; R306-S308 PolarHBondContact O-N 3.34Å; S308-R312 VanDerWaalsContact O-CB 3.26Å; S308-R312 WeakPolarHBondContact O-CB 3.36Å; S308-R312 PolarHBondContact O-N 3.44Å
309	A	90	Very high	84.7	Confident	29 Å²	29	79.7 Å²	79.7	24%	0.24	40%	0.403	C	S	.	.	H	α-helix	trans	-72.1	-44.8	176.7	0	0	0	0	0	110.5	R306 Q307 R312 K313	R306-A309 HydrophobicContact CB-CB 4.21Å; R306-A309 WeakPolarHBondContact O-CA 3.43Å; R306-A309 WeakPolarHBondContact O-CB 3.1Å; R306-A309 PolarHBondContact O-N 3.49Å; Q307-A309 VanDerWaalsContact C-N 3.28Å; Q307-A309 PolarHBondContact O-N 3.14Å; A309-R312 PolarHBondContact O-N 2.91Å; A309-K313 PolarHBondContact O-N 2.95Å; A309-K313 VanDerWaalsContact O-N 3.1Å
310	V	90.3	Very high	85	Confident	1 Å²	1	76.3 Å²	76.3	1%	0.006	38%	0.381	C	S	.	.	H	α-helix	trans	-60.1	-51.2	174.9	-178.9	0	0	0	0	110.1	W293 F305 R306 Q307 R312 K313 T314 T374 L377 T378 L381	W293-V310 HydrophobicContact CZ3-CG2 4.2Å; F305-V310 HydrophobicContact CB-CG2 3.96Å; R306-V310 PolarHBondContact O-N 3.46Å; Q307-V310 PolarHBondContact O-N 3.04Å; V310-R312 VanDerWaalsContact C-N 3.3Å; V310-R312 PolarHBondContact O-N 3.24Å; V310-K313 PolarHBondContact O-N 3.35Å; V310-K313 VanDerWaalsContact O-N 3.13Å; V310-T314 PolarHBondContact O-N 2.66Å; V310-T314 PolarHBondContact O-OG1 2.98Å; V310-T374 HydrophobicContact CG1-CG2 3.79Å; V310-L377 HydrophobicContact CG1-CB 4.03Å; V310-L377 HydrophobicContact CG2-CB 4.34Å; V310-T378 WeakPolarHBondContact CG1-OG1 3.45Å; V310-L381 HydrophobicContact CB-CD1 4.38Å; V310-L381 HydrophobicContact CG2-CD1 3.76Å
311	L	91.2	Very high	85.9	Confident	118 Å²	118	75.7 Å²	75.7	62%	0.618	36%	0.359	S	S	*	.	H	α-helix	trans	-58.9	-39.1	178.8	-176.8	63.6	0	0	0	112.7	Q307 T314 G315	Q307-L311 WeakPolarHBondContact O-CB 3.18Å; Q307-L311 PolarHBondContact O-N 2.96Å; L311-T314 WeakPolarHBondContact CA-OG1 3.44Å; L311-T314 WeakPolarHBondContact O-CB 3.39Å; L311-T314 PolarHBondContact O-N 3.4Å; L311-G315 PolarHBondContact O-N 3.36Å
312	R	92.3	Very high	86.9	Confident	166 Å²	166	69.2 Å²	69.2	63%	0.626	34%	0.338	S	S	*	.	H	α-helix	trans	-61.9	-46.7	176.2	-179.9	166.8	65	169.5	5.2	111.2	S308 A309 V310 T314 G315 E316	S308-R312 VanDerWaalsContact O-CB 3.26Å; S308-R312 WeakPolarHBondContact O-CB 3.36Å; S308-R312 PolarHBondContact O-N 3.44Å; A309-R312 PolarHBondContact O-N 2.91Å; V310-R312 VanDerWaalsContact C-N 3.3Å; V310-R312 PolarHBondContact O-N 3.24Å; R312-T314 VanDerWaalsContact C-N 3.34Å; R312-G315 PolarHBondContact O-N 3.05Å; R312-G315 VanDerWaalsContact O-N 3.14Å; R312-E316 WeakPolarHBondContact O-CG 3.39Å; R312-E316 PolarHBondContact O-N 2.92Å
313	K	90.9	Very high	88.2	Confident	11 Å²	11	67.4 Å²	67.4	5%	0.048	32%	0.315	C	S	.	.	H	α-helix	trans	-66.7	-34.5	175.7	-66.9	-50.4	-178.4	-167.1	0	112.8	E289 W293 A309 V310 G315 E316 L317	E289-K313 IonicContact OE1-NZ 2.77Å; E289-K313 PolarHBondContact OE1-NZ 3.1Å; E289-K313 WeakPolarHBondContact OE2-CE 3.36Å; E289-K313 IonicContact OE2-NZ 3.94Å; E289-K313 PolarHBondContact OE2-NZ 2.88Å; W293-K313 HydrophobicContact CH2-CB 3.75Å; W293-K313 HydrophobicContact CH2-CG 3.27Å; W293-K313 HydrophobicContact CZ2-CG 3.76Å; W293-K313 HydrophobicContact CZ3-CB 4.12Å; W293-K313 HydrophobicContact CZ3-CG 4.05Å; A309-K313 PolarHBondContact O-N 2.95Å; A309-K313 VanDerWaalsContact O-N 3.1Å; V310-K313 PolarHBondContact O-N 3.35Å; V310-K313 VanDerWaalsContact O-N 3.13Å; K313-G315 VanDerWaalsContact C-N 3.31Å; K313-G315 PolarHBondContact O-N 3.25Å; K313-E316 WeakPolarHBondContact CD-OE2 3.29Å; K313-E316 WeakPolarHBondContact CE-OE2 3.46Å; K313-E316 IonicContact NZ-OE1 2.83Å; K313-E316 PolarHBondContact NZ-OE1 3.27Å; K313-E316 IonicContact NZ-OE2 2.55Å; K313-E316 PolarHBondContact NZ-OE2 2.87Å; K313-E316 PolarHBondContact O-N 3.04Å; K313-L317 WeakPolarHBondContact O-CG 3.33Å; K313-L317 PolarHBondContact O-N 3.31Å
314	T	92.7	Very high	89.3	Confident	26 Å²	26	66.5 Å²	66.5	16%	0.16	31%	0.308	C	S	.	.	H	α-helix	trans	-54.6	-50.5	168	-38.2	0	0	0	0	110.5	V310 L311 R312 E316 L317 Y318 T374	V310-T314 PolarHBondContact O-N 2.66Å; V310-T314 PolarHBondContact O-OG1 2.98Å; L311-T314 WeakPolarHBondContact CA-OG1 3.44Å; L311-T314 WeakPolarHBondContact O-CB 3.39Å; L311-T314 PolarHBondContact O-N 3.4Å; R312-T314 VanDerWaalsContact C-N 3.34Å; T314-E316 VanDerWaalsContact C-N 3.35Å; T314-E316 PolarHBondContact O-N 3.37Å; T314-L317 PolarHBondContact O-N 3.17Å; T314-Y318 HydrophobicContact CG2-CD2 3.73Å; T314-Y318 HydrophobicContact CG2-CE2 3.74Å; T314-Y318 WeakPolarHBondContact O-CB 3.44Å; T314-Y318 VanDerWaalsContact O-CD2 3.3Å; T314-Y318 WeakPolarHBondContact O-CD2 3.47Å; T314-Y318 PolarHBondContact O-N 3.32Å; T314-T374 HydrophobicContact CG2-CG2 3.94Å; T314-T374 WeakPolarHBondContact OG1-CG2 3.31Å
315	G	94.1	Very high	89.9	Confident	36 Å²	36	58.6 Å²	58.6	37%	0.371	28%	0.284	S	S	.	.	H	α-helix	trans	-60	-41.2	179	0	0	0	0	0	113.5	L311 R312 K313 Y318 T319	L311-G315 PolarHBondContact O-N 3.36Å; R312-G315 PolarHBondContact O-N 3.05Å; R312-G315 VanDerWaalsContact O-N 3.14Å; K313-G315 VanDerWaalsContact C-N 3.31Å; K313-G315 PolarHBondContact O-N 3.25Å; G315-Y318 PolarHBondContact O-N 3.47Å; G315-T319 WeakPolarHBondContact O-CB 3.1Å; G315-T319 PolarHBondContact O-N 3.43Å; G315-T319 PolarHBondContact O-OG1 3.18Å
316	E	92.2	Very high	89.9	Confident	43 Å²	43	60.9 Å²	60.9	20%	0.201	30%	0.3	C	S	.	.	H	α-helix	trans	-63	-47.9	176.2	-69	170.8	-151.7	0	0	111.7	R312 K313 T314 Y318 T319 I320	R312-E316 WeakPolarHBondContact O-CG 3.39Å; R312-E316 PolarHBondContact O-N 2.92Å; K313-E316 WeakPolarHBondContact CD-OE2 3.29Å; K313-E316 WeakPolarHBondContact CE-OE2 3.46Å; K313-E316 IonicContact NZ-OE1 2.83Å; K313-E316 PolarHBondContact NZ-OE1 3.27Å; K313-E316 IonicContact NZ-OE2 2.55Å; K313-E316 PolarHBondContact NZ-OE2 2.87Å; K313-E316 PolarHBondContact O-N 3.04Å; T314-E316 VanDerWaalsContact C-N 3.35Å; T314-E316 PolarHBondContact O-N 3.37Å; E316-Y318 PolarHBondContact O-N 3.25Å; E316-T319 WeakPolarHBondContact O-CB 3.25Å; E316-T319 PolarHBondContact O-N 3.32Å; E316-T319 VanDerWaalsContact O-N 3.13Å; E316-I320 PolarHBondContact O-N 3.19Å; E316-I320 VanDerWaalsContact O-N 3.17Å
317	L	92.6	Very high	89.5	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-61.4	-42.4	176.3	-68.1	172.7	0	0	0	112.2	F283 A286 I290 K313 T314 T319 I320 K321 C370 N371	F283-L317 HydrophobicContact CD2-CD2 4.26Å; F283-L317 HydrophobicContact CE2-CD2 4.13Å; A286-L317 HydrophobicContact CB-CD2 4.15Å; I290-L317 HydrophobicContact CD1-CD1 4Å; I290-L317 HydrophobicContact CD1-CD2 4.32Å; I290-L317 HydrophobicContact CD1-CG 4.45Å; K313-L317 WeakPolarHBondContact O-CG 3.33Å; K313-L317 PolarHBondContact O-N 3.31Å; T314-L317 PolarHBondContact O-N 3.17Å; L317-T319 VanDerWaalsContact C-N 3.29Å; L317-T319 PolarHBondContact O-N 3.22Å; L317-I320 PolarHBondContact O-N 3.03Å; L317-K321 PolarHBondContact O-N 3.35Å; L317-C370 HydrophobicContact CD1-CB 3.78Å; L317-C370 HydrophobicContact CD2-CB 4.01Å; L317-N371 WeakPolarHBondContact CB-OD1 3.36Å
318	Y	92.8	Very high	88.4	Confident	135 Å²	135	51.5 Å²	51.5	53%	0.529	27%	0.273	S	S	.	.	H	α-helix	trans	-67.4	-29.6	175.8	-92.1	-88.1	0	0	0	112.6	T314 G315 E316 K321 H322	T314-Y318 HydrophobicContact CG2-CD2 3.73Å; T314-Y318 HydrophobicContact CG2-CE2 3.74Å; T314-Y318 WeakPolarHBondContact O-CB 3.44Å; T314-Y318 VanDerWaalsContact O-CD2 3.3Å; T314-Y318 WeakPolarHBondContact O-CD2 3.47Å; T314-Y318 PolarHBondContact O-N 3.32Å; G315-Y318 PolarHBondContact O-N 3.47Å; E316-Y318 PolarHBondContact O-N 3.25Å; Y318-K321 PolarHBondContact O-N 3.33Å; Y318-H322 VanDerWaalsContact O-CB 3.24Å; Y318-H322 WeakPolarHBondContact O-CB 3.49Å; Y318-H322 PolarHBondContact O-N 3.26Å
319	T	91	Very high	87.1	Confident	31 Å²	31	50.4 Å²	50.4	19%	0.19	27%	0.265	C	S	.	.	H	α-helix	trans	-64.3	-46.2	174	-57.5	0	0	0	0	109.8	I43 L47 G315 E316 L317 K321 H322 L323	I43-T319 HydrophobicContact CG2-CG2 4.19Å; L47-T319 HydrophobicContact CD1-CG2 3.66Å; G315-T319 WeakPolarHBondContact O-CB 3.1Å; G315-T319 PolarHBondContact O-N 3.43Å; G315-T319 PolarHBondContact O-OG1 3.18Å; E316-T319 WeakPolarHBondContact O-CB 3.25Å; E316-T319 PolarHBondContact O-N 3.32Å; E316-T319 VanDerWaalsContact O-N 3.13Å; L317-T319 VanDerWaalsContact C-N 3.29Å; L317-T319 PolarHBondContact O-N 3.22Å; T319-K321 PolarHBondContact O-N 2.69Å; T319-H322 PolarHBondContact O-N 2.91Å; T319-L323 HydrophobicContact CG2-CD1 4.1Å; T319-L323 HydrophobicContact CG2-CG 4.45Å; T319-L323 VanDerWaalsContact O-CG 3.23Å; T319-L323 WeakPolarHBondContact O-CG 3.37Å; T319-L323 PolarHBondContact O-N 3.33Å
320	I	91.2	Very high	86.3	Confident	13 Å²	13	49.1 Å²	49.1	7%	0.067	25%	0.254	C	S	.	.	H	α-helix	trans	-62.1	-44.7	176.1	-60.5	164.3	0	0	0	110.8	F283 E316 L317 H322 L323 L324 L367	F283-I320 HydrophobicContact CB-CD1 4.19Å; E316-I320 PolarHBondContact O-N 3.19Å; E316-I320 VanDerWaalsContact O-N 3.17Å; L317-I320 PolarHBondContact O-N 3.03Å; I320-H322 VanDerWaalsContact C-N 3.31Å; I320-H322 PolarHBondContact O-N 3.04Å; I320-L323 PolarHBondContact O-N 2.88Å; I320-L324 WeakPolarHBondContact O-CB 3.46Å; I320-L324 PolarHBondContact O-N 2.96Å; I320-L367 HydrophobicContact CB-CD1 4.08Å; I320-L367 HydrophobicContact CG2-CD1 3.82Å
321	K	90.3	Very high	85.4	Confident	53 Å²	53	53.1 Å²	53.1	23%	0.23	28%	0.275	C	S	.	.	H	α-helix	trans	-59.4	-42.8	176.5	-166.6	169.7	-171	152.9	0	112	L317 Y318 T319 N325 L367 D368	L317-K321 PolarHBondContact O-N 3.35Å; Y318-K321 PolarHBondContact O-N 3.33Å; T319-K321 PolarHBondContact O-N 2.69Å; K321-N325 WeakPolarHBondContact O-CB 3.33Å; K321-N325 VanDerWaalsContact O-CG 3.3Å; K321-N325 PolarHBondContact O-N 3.21Å; K321-N325 PolarHBondContact O-ND2 3.05Å; K321-L367 HydrophobicContact CB-CD1 4.02Å; K321-L367 HydrophobicContact CB-CD2 3.76Å; K321-L367 HydrophobicContact CD-CD2 3.65Å; K321-L367 HydrophobicContact CG-CD2 3.87Å; K321-D368 IonicContact NZ-OD1 3.68Å; K321-D368 PolarHBondContact NZ-OD1 2.89Å
322	H	90	Very high	84.9	Confident	77 Å²	77	54 Å²	54	36%	0.356	28%	0.276	S	S	.	.	H	α-helix	trans	-63.4	-47.2	176.6	177.2	63.5	0	0	0	111.2	Y318 T319 I320 L324 N325 V326	Y318-H322 VanDerWaalsContact O-CB 3.24Å; Y318-H322 WeakPolarHBondContact O-CB 3.49Å; Y318-H322 PolarHBondContact O-N 3.26Å; T319-H322 PolarHBondContact O-N 2.91Å; I320-H322 VanDerWaalsContact C-N 3.31Å; I320-H322 PolarHBondContact O-N 3.04Å; H322-L324 VanDerWaalsContact C-N 3.32Å; H322-L324 PolarHBondContact O-N 3.43Å; H322-N325 PolarHBondContact O-N 3.29Å; H322-V326 WeakPolarHBondContact CE1-CG2 3.36Å; H322-V326 WeakPolarHBondContact O-CB 3.25Å; H322-V326 VanDerWaalsContact O-CG2 3.28Å; H322-V326 WeakPolarHBondContact O-CG2 3.37Å; H322-V326 PolarHBondContact O-N 2.82Å
323	L	88.8	Confident	84.4	Confident	19 Å²	19	47.8 Å²	47.8	10%	0.099	26%	0.256	C	S	.	.	H	α-helix	trans	-61.8	-39.8	178.8	-67.7	171	0	0	0	112.3	Y44 L279 T319 I320 S327	Y44-L323 HydrophobicContact CE1-CD2 3.52Å; L279-L323 HydrophobicContact CD2-CB 3.74Å; L279-L323 HydrophobicContact CD2-CD1 4.09Å; T319-L323 HydrophobicContact CG2-CD1 4.1Å; T319-L323 HydrophobicContact CG2-CG 4.45Å; T319-L323 VanDerWaalsContact O-CG 3.23Å; T319-L323 WeakPolarHBondContact O-CG 3.37Å; T319-L323 PolarHBondContact O-N 3.33Å; I320-L323 PolarHBondContact O-N 2.88Å; L323-S327 WeakPolarHBondContact O-CB 3.3Å; L323-S327 PolarHBondContact O-N 3.03Å; L323-S327 VanDerWaalsContact O-N 3.12Å; L323-S327 PolarHBondContact O-OG 3.26Å
324	L	87.7	Confident	84.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.1	-44.3	175	-171.8	146.9	0	0	0	111.4	L279 I320 H322 I331 I360 L363 N364	L279-L324 HydrophobicContact CD1-CB 4.17Å; I320-L324 WeakPolarHBondContact O-CB 3.46Å; I320-L324 PolarHBondContact O-N 2.96Å; H322-L324 VanDerWaalsContact C-N 3.32Å; H322-L324 PolarHBondContact O-N 3.43Å; L324-I331 HydrophobicContact CD2-CD1 4.29Å; L324-I360 HydrophobicContact CD2-CG2 4.4Å; L324-L363 HydrophobicContact CD1-CD2 3.68Å; L324-L363 HydrophobicContact CD1-CG 4.12Å; L324-N364 WeakPolarHBondContact CD2-OD1 3.36Å
325	N	84	Confident	83.8	Confident	80 Å²	80	52.9 Å²	52.9	43%	0.428	29%	0.285	S	S	.	.	H	α-helix	trans	-77.4	-30.5	-178.6	-70.4	-13.6	0	0	0	114	K321 H322 S327	K321-N325 WeakPolarHBondContact O-CB 3.33Å; K321-N325 VanDerWaalsContact O-CG 3.3Å; K321-N325 PolarHBondContact O-N 3.21Å; K321-N325 PolarHBondContact O-ND2 3.05Å; H322-N325 PolarHBondContact O-N 3.29Å; N325-S327 VanDerWaalsContact C-N 3.29Å
326	V	83.6	Confident	83.5	Confident	71 Å²	71	52.8 Å²	52.8	43%	0.43	27%	0.274	S	S	.	.	H	α-helix	trans	-69.8	-32.1	174.3	166.7	0	0	0	0	110.9	H322 T328	H322-V326 WeakPolarHBondContact CE1-CG2 3.36Å; H322-V326 WeakPolarHBondContact O-CB 3.25Å; H322-V326 VanDerWaalsContact O-CG2 3.28Å; H322-V326 WeakPolarHBondContact O-CG2 3.37Å; H322-V326 PolarHBondContact O-N 2.82Å; V326-T328 PolarHBondContact O-N 3.34Å
327	S	77.6	Confident	83.4	Confident	28 Å²	28	50.8 Å²	50.8	20%	0.196	26%	0.264	C	S	.	.			trans	-75.7	66.1	172.7	-52.9	0	0	0	0	109.2	L323 N325 S329 L330	L323-S327 WeakPolarHBondContact O-CB 3.3Å; L323-S327 PolarHBondContact O-N 3.03Å; L323-S327 VanDerWaalsContact O-N 3.12Å; L323-S327 PolarHBondContact O-OG 3.26Å; N325-S327 VanDerWaalsContact C-N 3.29Å; S327-S329 PolarHBondContact O-N 2.81Å; S327-S329 VanDerWaalsContact O-N 3.15Å; S327-L330 VanDerWaalsContact CB-CD1 3.49Å; S327-L330 VanDerWaalsContact O-CB 3.26Å; S327-L330 WeakPolarHBondContact O-CB 3.5Å; S327-L330 PolarHBondContact O-N 2.82Å
328	T	63.7	Low	83.1	Confident	85 Å²	85	59.2 Å²	59.2	52%	0.521	30%	0.296	S	S	.	.	H	α-helix	trans	-52.1	-37.5	-177.2	50.5	0	0	0	0	111.9	V326 L330 I331 E332	V326-T328 PolarHBondContact O-N 3.34Å; T328-L330 PolarHBondContact O-N 2.87Å; T328-L330 VanDerWaalsContact O-N 3.11Å; T328-I331 PolarHBondContact O-N 2.83Å; T328-E332 PolarHBondContact O-N 2.89Å
329	S	63.2	Low	82.7	Confident	36 Å²	36	61.1 Å²	61.1	25%	0.252	31%	0.31	S	S	.	.	H	α-helix	trans	-59.8	-19.3	176.3	-42.6	0	0	0	0	114.4	L272 S327	L272-S329 VanDerWaalsContact CD1-O 3.3Å; L272-S329 WeakPolarHBondContact CD1-O 3.12Å; S327-S329 PolarHBondContact O-N 2.81Å; S327-S329 VanDerWaalsContact O-N 3.15Å
330	L	72.5	Confident	82.6	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-71.4	-35.1	171.9	-68.7	177.1	0	0	0	111.3	L272 L276 L279 S327 T328 I360	L272-L330 HydrophobicContact CB-CD2 3.85Å; L272-L330 HydrophobicContact CD2-CD2 3.74Å; L272-L330 HydrophobicContact CD2-CG 4.27Å; L272-L330 HydrophobicContact CG-CD2 4.32Å; L272-L330 WeakPolarHBondContact O-CD2 3.09Å; L276-L330 HydrophobicContact CB-CD2 4.38Å; L279-L330 HydrophobicContact CD1-CD1 4.08Å; S327-L330 VanDerWaalsContact CB-CD1 3.49Å; S327-L330 VanDerWaalsContact O-CB 3.26Å; S327-L330 WeakPolarHBondContact O-CB 3.5Å; S327-L330 PolarHBondContact O-N 2.82Å; T328-L330 PolarHBondContact O-N 2.87Å; T328-L330 VanDerWaalsContact O-N 3.11Å; L330-I360 HydrophobicContact CB-CD1 3.77Å; L330-I360 WeakPolarHBondContact O-CD1 3.32Å
331	I	70.6	Confident	82.5	Confident	85 Å²	85	66.7 Å²	66.7	44%	0.436	34%	0.336	S	S	.	.	H	α-helix	trans	-94.6	-42.4	-170.9	-55.8	173.7	0	0	0	110.6	L324 T328	L324-I331 HydrophobicContact CD2-CD1 4.29Å; T328-I331 PolarHBondContact O-N 2.83Å
332	E	80.6	Confident	82.4	Confident	138 Å²	138	68.1 Å²	68.1	65%	0.645	35%	0.346	S	S	*	.	S	Bend	trans	-118.5	155.5	-173.3	-65	-179.4	171.8	0	0	111.3	T328 P334	T328-E332 PolarHBondContact O-N 2.89Å; E332-P334 WeakPolarHBondContact O-CD 3.37Å
333	T	83	Confident	82.4	Confident	35 Å²	35	64.4 Å²	64.4	22%	0.215	33%	0.329	C	S	.	.			trans	-76.3	123	175	-51.1	0	0	0	0	108.7	Y337 E344 F347 E348	T333-Y337 HydrophobicContact CG2-CD2 4.21Å; T333-E344 HydrophobicContact CG2-CG 4.12Å; T333-F347 HydrophobicContact CG2-CD1 4.41Å; T333-F347 HydrophobicContact CG2-CE1 4.3Å; T333-E348 PolarHBondContact OG1-OE1 2.91Å
334	P	85	Confident	82.6	Confident	24 Å²	24	66.3 Å²	66.3	16%	0.156	34%	0.337	C	S	.	.			trans	-57.4	142.5	-177.2	-27.4	34.7	0	0	0	113.9	E332 F336 Y337	E332-P334 WeakPolarHBondContact O-CD 3.37Å; P334-F336 PolarHBondContact O-N 2.82Å; P334-Y337 HydrophobicContact CB-CD2 3.91Å; P334-Y337 HydrophobicContact CB-CE2 4.07Å; P334-Y337 HydrophobicContact CG-CD2 4.07Å; P334-Y337 HydrophobicContact CG-CE2 3.9Å; P334-Y337 PolarHBondContact O-N 2.78Å
335	D	85.3	Confident	82.8	Confident	120 Å²	120	73.3 Å²	73.3	64%	0.642	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-53.8	-29.7	178.7	-67.3	-3.6	0	0	0	112.8	Y337 W338	D335-Y337 PolarHBondContact O-N 2.76Å; D335-Y337 VanDerWaalsContact O-N 3.07Å; D335-W338 WeakPolarHBondContact O-CB 3.36Å; D335-W338 PolarHBondContact O-N 3.46Å
336	F	87.5	Confident	83.2	Confident	34 Å²	34	70.5 Å²	70.5	15%	0.149	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-49.6	-34.2	174.7	175.5	-103.7	0	0	0	113.3	P130 L133 L261 F264 P334	P130-F336 HydrophobicContact CB-CE2 4.32Å; P130-F336 HydrophobicContact CG-CE2 4.17Å; P130-F336 HydrophobicContact CG-CZ 4.47Å; L133-F336 HydrophobicContact CD1-CD1 4.46Å; L133-F336 HydrophobicContact CD1-CD2 4.12Å; L133-F336 HydrophobicContact CD1-CE1 3.92Å; L133-F336 HydrophobicContact CD1-CE2 3.54Å; L133-F336 HydrophobicContact CD1-CZ 3.42Å; L133-F336 VanDerWaalsContact CD1-CZ 3.42Å; L133-F336 HydrophobicContact CD2-CB 4.45Å; L133-F336 HydrophobicContact CD2-CD1 4.28Å; L133-F336 HydrophobicContact CD2-CD2 3.79Å; L133-F336 HydrophobicContact CD2-CE2 4.1Å; L133-F336 HydrophobicContact CD2-CG 3.89Å; L133-F336 HydrophobicContact CD2-CZ 4.46Å; L133-F336 HydrophobicContact CG-CD2 3.81Å; L133-F336 HydrophobicContact CG-CE2 3.64Å; L133-F336 HydrophobicContact CG-CG 4.36Å; L133-F336 HydrophobicContact CG-CZ 4.06Å; L261-F336 HydrophobicContact CD1-CE1 3.65Å; L261-F336 HydrophobicContact CD1-CZ 3.45Å; L261-F336 VanDerWaalsContact CD1-CZ 3.45Å; F264-F336 AromaticContact CD1-CE1 3.85Å; F264-F336 HydrophobicContact CD1-CE1 3.85Å; F264-F336 HydrophobicContact CD1-CZ 4.46Å; F264-F336 AromaticContact CE1-CD1 3.88Å; F264-F336 HydrophobicContact CE1-CD1 3.88Å; F264-F336 AromaticContact CE1-CE1 3.58Å; F264-F336 HydrophobicContact CE1-CE1 3.58Å; F264-F336 HydrophobicContact CE1-CZ 4.33Å; P334-F336 PolarHBondContact O-N 2.82Å
337	Y	89.9	Confident	83.7	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-85.3	-15.1	-178	-62.9	-70.8	0	0	0	114	A265 D268 T333 P334 D335 E339 R340 V343 F347	A265-Y337 HydrophobicContact CB-CE1 4.11Å; D268-Y337 WeakPolarHBondContact CB-OH 3.28Å; D268-Y337 WeakPolarHBondContact OD2-CE2 3.11Å; D268-Y337 PolarHBondContact OD2-OH 3.04Å; T333-Y337 HydrophobicContact CG2-CD2 4.21Å; P334-Y337 HydrophobicContact CB-CD2 3.91Å; P334-Y337 HydrophobicContact CB-CE2 4.07Å; P334-Y337 HydrophobicContact CG-CD2 4.07Å; P334-Y337 HydrophobicContact CG-CE2 3.9Å; P334-Y337 PolarHBondContact O-N 2.78Å; D335-Y337 PolarHBondContact O-N 2.76Å; D335-Y337 VanDerWaalsContact O-N 3.07Å; Y337-E339 VanDerWaalsContact C-N 3.26Å; Y337-E339 PolarHBondContact O-N 2.78Å; Y337-R340 CarbonylContact O-C 3.53Å; Y337-R340 WeakPolarHBondContact O-CA 3.46Å; Y337-R340 PolarHBondContact O-N 3.11Å; Y337-V343 HydrophobicContact CD1-CG1 4.07Å; Y337-V343 HydrophobicContact CE1-CG1 3.91Å; Y337-F347 HydrophobicContact CD2-CD1 4.42Å; Y337-F347 HydrophobicContact CE1-CB 4.08Å; Y337-F347 HydrophobicContact CE1-CG 4.36Å; Y337-F347 HydrophobicContact CE2-CD1 4.17Å; Y337-F347 AromaticContact CE2-CD2 3.98Å; Y337-F347 HydrophobicContact CE2-CD2 3.98Å; Y337-F347 HydrophobicContact CE2-CE1 4.36Å; Y337-F347 HydrophobicContact CE2-CE2 4.17Å; Y337-F347 AromaticContact CE2-CG 3.98Å; Y337-F347 HydrophobicContact CE2-CG 3.98Å; Y337-F347 HydrophobicContact CE2-CZ 4.35Å; Y337-F347 AromaticContact CZ-CD2 3.79Å; Y337-F347 AromaticContact CZ-CG 3.88Å; Y337-F347 WeakPolarHBondContact OH-CD2 3.49Å
338	W	85.9	Confident	84.4	Confident	178 Å²	178	68.5 Å²	68.5	67%	0.674	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-31	-172.3	-72.4	18.6	0	0	0	113.4	D335 R340	D335-W338 WeakPolarHBondContact O-CB 3.36Å; D335-W338 PolarHBondContact O-N 3.46Å; W338-R340 VanDerWaalsContact C-N 3.31Å
339	E	85.2	Confident	85.8	Confident	175 Å²	175	69.3 Å²	69.3	82%	0.818	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-3.3	177	-61.5	-177.7	174.9	0	0	112.6	Y337	Y337-E339 VanDerWaalsContact C-N 3.26Å; Y337-E339 PolarHBondContact O-N 2.78Å
340	R	88.7	Confident	87.2	Confident	90 Å²	90	67.6 Å²	67.6	34%	0.34	32%	0.32	S	S	.	.			trans	-135.2	68.3	-166.2	-62.3	171.2	179.7	-84	-0.1	111.2	L261 Y337 W338 D342 V343 E344	L261-R340 VanDerWaalsContact CD2-NH1 3.25Å; Y337-R340 CarbonylContact O-C 3.53Å; Y337-R340 WeakPolarHBondContact O-CA 3.46Å; Y337-R340 PolarHBondContact O-N 3.11Å; W338-R340 VanDerWaalsContact C-N 3.31Å; R340-D342 VanDerWaalsContact C-N 3.26Å; R340-D342 PolarHBondContact O-N 2.99Å; R340-V343 HydrophobicContact CB-CB 4.28Å; R340-V343 HydrophobicContact CB-CG2 4.45Å; R340-V343 PolarHBondContact O-N 2.82Å; R340-E344 WeakPolarHBondContact O-CB 3.37Å; R340-E344 PolarHBondContact O-N 2.84Å
341	P	89.2	Confident	88.2	Confident	72 Å²	72	67.9 Å²	67.9	47%	0.468	32%	0.321	S	S	.	.	H	α-helix	trans	-69.6	-20.4	-170.8	28.8	-37.1	0	0	0	114.2	K345	P341-K345 VanDerWaalsContact O-CD 3.27Å; P341-K345 WeakPolarHBondContact O-CD 3.38Å; P341-K345 WeakPolarHBondContact O-CE 3.48Å; P341-K345 WeakPolarHBondContact O-CG 3.33Å; P341-K345 PolarHBondContact O-N 2.75Å
342	D	88.9	Confident	89.2	Confident	82 Å²	82	72.3 Å²	72.3	44%	0.439	33%	0.334	S	S	.	.	H	α-helix	trans	-67.9	-47.3	172.2	54.4	-33.9	0	0	0	111.4	R340	R340-D342 VanDerWaalsContact C-N 3.26Å; R340-D342 PolarHBondContact O-N 2.99Å
343	V	89.7	Confident	89.8	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-74.3	-38.9	179.1	-178	0	0	0	0	111.2	L261 A265 Y337 R340 K345 L346 F347	L261-V343 HydrophobicContact CD1-CG1 4.23Å; L261-V343 HydrophobicContact CD2-CG2 3.66Å; L261-V343 HydrophobicContact CG-CB 4.42Å; L261-V343 HydrophobicContact CG-CG1 3.91Å; L261-V343 HydrophobicContact CG-CG2 3.72Å; A265-V343 HydrophobicContact CB-CG1 3.52Å; Y337-V343 HydrophobicContact CD1-CG1 4.07Å; Y337-V343 HydrophobicContact CE1-CG1 3.91Å; R340-V343 HydrophobicContact CB-CB 4.28Å; R340-V343 HydrophobicContact CB-CG2 4.45Å; R340-V343 PolarHBondContact O-N 2.82Å; V343-K345 VanDerWaalsContact C-N 3.27Å; V343-K345 PolarHBondContact O-N 2.7Å; V343-L346 WeakPolarHBondContact O-CB 3.14Å; V343-L346 PolarHBondContact O-N 2.84Å; V343-L346 VanDerWaalsContact O-N 3.08Å; V343-F347 PolarHBondContact O-N 2.83Å; V343-F347 VanDerWaalsContact O-N 3.1Å
344	E	92.1	Very high	90.2	Very high	58 Å²	58	66.2 Å²	66.2	27%	0.271	31%	0.305	S	S	.	.	H	α-helix	trans	-54	-43.9	174.9	-171.1	-174.7	178	0	0	111.8	T333 R340 L346 F347 E348	T333-E344 HydrophobicContact CG2-CG 4.12Å; R340-E344 WeakPolarHBondContact O-CB 3.37Å; R340-E344 PolarHBondContact O-N 2.84Å; E344-L346 VanDerWaalsContact C-N 3.27Å; E344-L346 PolarHBondContact O-N 2.84Å; E344-F347 PolarHBondContact O-N 3.16Å; E344-E348 HydrophobicContact CG-CG 4.49Å; E344-E348 WeakPolarHBondContact O-CB 3.36Å; E344-E348 PolarHBondContact O-N 2.82Å
345	K	93	Very high	90.5	Very high	147 Å²	147	68 Å²	68	64%	0.639	32%	0.318	S	S	*	.	H	α-helix	trans	-59.9	-37.7	178.6	-75.5	165	-169.9	171.7	0	112.2	P341 V343 K349	P341-K345 VanDerWaalsContact O-CD 3.27Å; P341-K345 WeakPolarHBondContact O-CD 3.38Å; P341-K345 WeakPolarHBondContact O-CE 3.48Å; P341-K345 WeakPolarHBondContact O-CG 3.33Å; P341-K345 PolarHBondContact O-N 2.75Å; V343-K345 VanDerWaalsContact C-N 3.27Å; V343-K345 PolarHBondContact O-N 2.7Å; K345-K349 WeakPolarHBondContact O-CB 3.4Å; K345-K349 PolarHBondContact O-N 3.05Å
346	L	92.8	Very high	90.8	Very high	21 Å²	21	62.2 Å²	62.2	11%	0.11	29%	0.287	C	S	.	.	H	α-helix	trans	-70	-45.1	178.9	-60.8	179.4	0	0	0	111.1	T208 E262 F266 V343 E344 K349 L350	T208-L346 HydrophobicContact CG2-CD1 3.78Å; T208-L346 HydrophobicContact CG2-CD2 3.92Å; T208-L346 HydrophobicContact CG2-CG 4.48Å; E262-L346 HydrophobicContact CB-CD1 3.98Å; E262-L346 HydrophobicContact CG-CD1 3.61Å; F266-L346 HydrophobicContact CE1-CB 3.83Å; F266-L346 HydrophobicContact CE2-CD1 4.45Å; F266-L346 HydrophobicContact CZ-CB 3.87Å; F266-L346 HydrophobicContact CZ-CD1 4.2Å; F266-L346 HydrophobicContact CZ-CD2 4.08Å; F266-L346 HydrophobicContact CZ-CG 4.27Å; V343-L346 WeakPolarHBondContact O-CB 3.14Å; V343-L346 PolarHBondContact O-N 2.84Å; V343-L346 VanDerWaalsContact O-N 3.08Å; E344-L346 VanDerWaalsContact C-N 3.27Å; E344-L346 PolarHBondContact O-N 2.84Å; L346-K349 PolarHBondContact O-N 3.43Å; L346-L350 PolarHBondContact O-N 3.33Å
347	F	93.1	Very high	90.9	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-57.5	-54.2	174.2	171.2	-97.5	0	0	0	111.3	A265 D268 A269 L272 T333 Y337 V343 E344 K349 L350 K351	A265-F347 HydrophobicContact CB-CB 4.18Å; A265-F347 WeakPolarHBondContact O-CD2 3.4Å; D268-F347 HydrophobicContact CB-CD2 4.29Å; D268-F347 HydrophobicContact CB-CE2 4.19Å; D268-F347 WeakPolarHBondContact OD2-CE2 3.47Å; A269-F347 HydrophobicContact CB-CD2 3.75Å; A269-F347 HydrophobicContact CB-CE2 3.94Å; L272-F347 HydrophobicContact CD1-CE2 3.75Å; L272-F347 HydrophobicContact CD1-CZ 3.51Å; T333-F347 HydrophobicContact CG2-CD1 4.41Å; T333-F347 HydrophobicContact CG2-CE1 4.3Å; Y337-F347 HydrophobicContact CD2-CD1 4.42Å; Y337-F347 HydrophobicContact CE1-CB 4.08Å; Y337-F347 HydrophobicContact CE1-CG 4.36Å; Y337-F347 HydrophobicContact CE2-CD1 4.17Å; Y337-F347 AromaticContact CE2-CD2 3.98Å; Y337-F347 HydrophobicContact CE2-CD2 3.98Å; Y337-F347 HydrophobicContact CE2-CE1 4.36Å; Y337-F347 HydrophobicContact CE2-CE2 4.17Å; Y337-F347 AromaticContact CE2-CG 3.98Å; Y337-F347 HydrophobicContact CE2-CG 3.98Å; Y337-F347 HydrophobicContact CE2-CZ 4.35Å; Y337-F347 AromaticContact CZ-CD2 3.79Å; Y337-F347 AromaticContact CZ-CG 3.88Å; Y337-F347 WeakPolarHBondContact OH-CD2 3.49Å; V343-F347 PolarHBondContact O-N 2.83Å; V343-F347 VanDerWaalsContact O-N 3.1Å; E344-F347 PolarHBondContact O-N 3.16Å; F347-K349 VanDerWaalsContact C-N 3.29Å; F347-K349 PolarHBondContact O-N 3.14Å; F347-L350 PolarHBondContact O-N 3.44Å; F347-K351 HydrophobicContact CD1-CD 4.48Å; F347-K351 HydrophobicContact CE1-CD 3.72Å; F347-K351 HydrophobicContact CZ-CD 4Å; F347-K351 VanDerWaalsContact O-CB 3.26Å; F347-K351 WeakPolarHBondContact O-CB 3.38Å; F347-K351 PolarHBondContact O-N 2.78Å
348	E	92.4	Very high	91	Very high	57 Å²	57	66.5 Å²	66.5	27%	0.266	32%	0.321	S	S	.	.	H	α-helix	trans	-64	-34.6	-179.8	-77.3	-61.1	148.5	0	0	112	T333 E344 K351 Y352	T333-E348 PolarHBondContact OG1-OE1 2.91Å; E344-E348 HydrophobicContact CG-CG 4.49Å; E344-E348 WeakPolarHBondContact O-CB 3.36Å; E344-E348 PolarHBondContact O-N 2.82Å; E348-K351 IonicContact OE1-NZ 3.67Å; E348-K351 PolarHBondContact OE1-NZ 2.89Å; E348-K351 IonicContact OE2-NZ 2.87Å; E348-Y352 VanDerWaalsContact O-CB 3.26Å; E348-Y352 WeakPolarHBondContact O-CB 3.45Å; E348-Y352 PolarHBondContact O-N 2.83Å
349	K	93.3	Very high	91.3	Very high	103 Å²	103	59.9 Å²	59.9	45%	0.448	30%	0.296	S	S	.	.	H	α-helix	trans	-62.9	-46.8	175.5	-175.1	66.7	175.5	-176.1	0	111.6	V210 K345 L346 F347 Y352 V353	V210-K349 HydrophobicContact CB-CG 3.84Å; V210-K349 HydrophobicContact CG2-CG 4.12Å; K345-K349 WeakPolarHBondContact O-CB 3.4Å; K345-K349 PolarHBondContact O-N 3.05Å; L346-K349 PolarHBondContact O-N 3.43Å; F347-K349 VanDerWaalsContact C-N 3.29Å; F347-K349 PolarHBondContact O-N 3.14Å; K349-Y352 PolarHBondContact O-N 2.89Å; K349-V353 WeakPolarHBondContact O-CG2 3.41Å; K349-V353 PolarHBondContact O-N 3.08Å; K349-V353 VanDerWaalsContact O-N 3.08Å
350	L	93.4	Very high	91.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-71.4	-41.6	178.9	-174.5	60.6	0	0	0	111.4	L199 V210 I215 F266 A269 L346 F347 Y352 V353 L354	L199-L350 HydrophobicContact CD1-CD1 4Å; L199-L350 HydrophobicContact CD1-CD2 3.93Å; V210-L350 HydrophobicContact CG1-CD1 4.27Å; I215-L350 HydrophobicContact CD1-CD2 4.22Å; F266-L350 HydrophobicContact CB-CD2 3.87Å; F266-L350 HydrophobicContact CD1-CB 3.93Å; F266-L350 HydrophobicContact CD1-CD2 3.64Å; F266-L350 HydrophobicContact CD1-CG 4.36Å; F266-L350 HydrophobicContact CE1-CB 4.33Å; F266-L350 HydrophobicContact CG-CD2 4.19Å; F266-L350 WeakPolarHBondContact O-CD2 3.42Å; A269-L350 HydrophobicContact CB-CB 4.05Å; A269-L350 HydrophobicContact CB-CD2 4.03Å; A269-L350 HydrophobicContact CB-CG 4.1Å; L346-L350 PolarHBondContact O-N 3.33Å; F347-L350 PolarHBondContact O-N 3.44Å; L350-Y352 PolarHBondContact O-N 3.26Å; L350-V353 HydrophobicContact CD1-CB 4.45Å; L350-V353 HydrophobicContact CD1-CG1 4.42Å; L350-V353 WeakPolarHBondContact O-CB 3.27Å; L350-V353 PolarHBondContact O-N 3.32Å; L350-L354 HydrophobicContact CD1-CD1 4.2Å; L350-L354 HydrophobicContact CD1-CG 4.05Å; L350-L354 HydrophobicContact CD2-CD1 4.37Å; L350-L354 HydrophobicContact CG-CD1 3.88Å; L350-L354 HydrophobicContact CG-CG 4.16Å; L350-L354 WeakPolarHBondContact O-CB 3.39Å; L350-L354 WeakPolarHBondContact O-CG 3.41Å; L350-L354 PolarHBondContact O-N 2.95Å
351	K	92	Very high	91.7	Very high	6 Å²	6	55.1 Å²	55.1	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-55.4	-39.1	173.4	-178.2	-180	167.4	-171.7	0	112.2	A269 F347 E348 S355 V356	A269-K351 HydrophobicContact CB-CB 4.49Å; F347-K351 HydrophobicContact CD1-CD 4.48Å; F347-K351 HydrophobicContact CE1-CD 3.72Å; F347-K351 HydrophobicContact CZ-CD 4Å; F347-K351 VanDerWaalsContact O-CB 3.26Å; F347-K351 WeakPolarHBondContact O-CB 3.38Å; F347-K351 PolarHBondContact O-N 2.78Å; E348-K351 IonicContact OE1-NZ 3.67Å; E348-K351 PolarHBondContact OE1-NZ 2.89Å; E348-K351 IonicContact OE2-NZ 2.87Å; K351-S355 PolarHBondContact O-N 3.21Å; K351-V356 HydrophobicContact CG-CB 3.92Å; K351-V356 HydrophobicContact CG-CG1 4.43Å; K351-V356 HydrophobicContact CG-CG2 4.28Å; K351-V356 PolarHBondContact O-N 3Å; K351-V356 VanDerWaalsContact O-N 3.15Å
352	Y	92.6	Very high	91.8	Very high	179 Å²	179	54.6 Å²	54.6	70%	0.702	27%	0.271	S	S	*	.	H	α-helix	trans	-66.1	-47.6	172.9	175.7	-97.1	0	0	0	112.3	E348 K349 L350 L354 S355	E348-Y352 VanDerWaalsContact O-CB 3.26Å; E348-Y352 WeakPolarHBondContact O-CB 3.45Å; E348-Y352 PolarHBondContact O-N 2.83Å; K349-Y352 PolarHBondContact O-N 2.89Å; L350-Y352 PolarHBondContact O-N 3.26Å; Y352-L354 PolarHBondContact O-N 3.3Å; Y352-S355 WeakPolarHBondContact O-CA 3.44Å; Y352-S355 PolarHBondContact O-N 2.92Å
353	V	92.2	Very high	91.9	Very high	31 Å²	31	50.7 Å²	50.7	19%	0.188	25%	0.25	C	C	.	.	H	α-helix	trans	-58	-48.6	177.2	163.1	0	0	0	0	111.3	V210 G212 E213 K349 L350 S355	V210-V353 HydrophobicContact CG1-CG2 4.11Å; G212-V353 WeakPolarHBondContact O-CG1 3.45Å; G212-V353 VanDerWaalsContact O-CG2 3.3Å; G212-V353 WeakPolarHBondContact O-CG2 3.5Å; E213-V353 HydrophobicContact CB-CG1 4.37Å; E213-V353 HydrophobicContact CG-CG1 3.74Å; K349-V353 WeakPolarHBondContact O-CG2 3.41Å; K349-V353 PolarHBondContact O-N 3.08Å; K349-V353 VanDerWaalsContact O-N 3.08Å; L350-V353 HydrophobicContact CD1-CB 4.45Å; L350-V353 HydrophobicContact CD1-CG1 4.42Å; L350-V353 WeakPolarHBondContact O-CB 3.27Å; L350-V353 PolarHBondContact O-N 3.32Å; V353-S355 PolarHBondContact O-N 3.26Å; V353-S355 VanDerWaalsContact O-N 3.09Å; V353-S355 PolarHBondContact O-OG 3.23Å
354	L	91.6	Very high	92	Very high	14 Å²	14	52.5 Å²	52.5	7%	0.073	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-2.3	177	-62.8	-179.9	0	0	0	112.9	E197 L199 L270 L350 Y352 V356	E197-L354 WeakPolarHBondContact OE1-CD2 3.24Å; L199-L354 HydrophobicContact CD2-CD2 4.12Å; L270-L354 HydrophobicContact CD1-CD1 4.22Å; L350-L354 HydrophobicContact CD1-CD1 4.2Å; L350-L354 HydrophobicContact CD1-CG 4.05Å; L350-L354 HydrophobicContact CD2-CD1 4.37Å; L350-L354 HydrophobicContact CG-CD1 3.88Å; L350-L354 HydrophobicContact CG-CG 4.16Å; L350-L354 WeakPolarHBondContact O-CB 3.39Å; L350-L354 WeakPolarHBondContact O-CG 3.41Å; L350-L354 PolarHBondContact O-N 2.95Å; Y352-L354 PolarHBondContact O-N 3.3Å; L354-V356 HydrophobicContact CB-CG2 3.9Å; L354-V356 PolarHBondContact O-N 3.1Å; L354-V356 VanDerWaalsContact O-N 3.09Å
355	S	91.1	Very high	92	Very high	60 Å²	60	53.4 Å²	53.4	42%	0.42	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	28.6	176.4	-61.6	0	0	0	0	113.7	K351 Y352 V353 S357 S358 R359	K351-S355 PolarHBondContact O-N 3.21Å; Y352-S355 WeakPolarHBondContact O-CA 3.44Å; Y352-S355 PolarHBondContact O-N 2.92Å; V353-S355 PolarHBondContact O-N 3.26Å; V353-S355 VanDerWaalsContact O-N 3.09Å; V353-S355 PolarHBondContact O-OG 3.23Å; S355-S357 VanDerWaalsContact C-N 3.33Å; S355-S357 PolarHBondContact O-N 3.07Å; S355-S358 PolarHBondContact O-N 2.92Å; S355-R359 WeakPolarHBondContact O-CG 3.19Å; S355-R359 PolarHBondContact O-N 3.5Å
356	V	91.3	Very high	91.9	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-54.4	-50	-174.3	175.7	0	0	0	0	110.4	L276 K351 L354 S358 R359 I360	L276-V356 HydrophobicContact CD2-CG1 4.17Å; K351-V356 HydrophobicContact CG-CB 3.92Å; K351-V356 HydrophobicContact CG-CG1 4.43Å; K351-V356 HydrophobicContact CG-CG2 4.28Å; K351-V356 PolarHBondContact O-N 3Å; K351-V356 VanDerWaalsContact O-N 3.15Å; L354-V356 HydrophobicContact CB-CG2 3.9Å; L354-V356 PolarHBondContact O-N 3.1Å; L354-V356 VanDerWaalsContact O-N 3.09Å; V356-S358 VanDerWaalsContact C-N 3.3Å; V356-S358 PolarHBondContact O-N 3.47Å; V356-R359 PolarHBondContact O-N 3.19Å; V356-I360 HydrophobicContact CG1-CD1 3.77Å; V356-I360 HydrophobicContact CG1-CG1 4.5Å; V356-I360 VanDerWaalsContact O-CG1 3.28Å; V356-I360 WeakPolarHBondContact O-CG1 3.48Å; V356-I360 PolarHBondContact O-N 3.36Å
357	S	91	Very high	91.9	Very high	52 Å²	52	48.9 Å²	48.9	36%	0.364	25%	0.25	S	C	.	.	H	α-helix	trans	-62.8	-33	-179.9	-49.5	0	0	0	0	113.7	S355 K361	S355-S357 VanDerWaalsContact C-N 3.33Å; S355-S357 PolarHBondContact O-N 3.07Å; S357-K361 WeakPolarHBondContact O-CG 3.36Å; S357-K361 PolarHBondContact O-N 2.92Å
358	S	90.9	Very high	91.9	Very high	71 Å²	71	52.5 Å²	52.5	50%	0.497	27%	0.269	S	S	.	.	H	α-helix	trans	-75.3	-43.6	177.8	-166.7	0	0	0	0	110.8	S355 V356 I360 K361 V362	S355-S358 PolarHBondContact O-N 2.92Å; V356-S358 VanDerWaalsContact C-N 3.3Å; V356-S358 PolarHBondContact O-N 3.47Å; S358-I360 PolarHBondContact O-N 3.02Å; S358-K361 WeakPolarHBondContact O-CB 3.41Å; S358-K361 PolarHBondContact O-N 3.22Å; S358-V362 WeakPolarHBondContact O-CG2 3.39Å; S358-V362 PolarHBondContact O-N 3.05Å
359	R	92.2	Very high	91.9	Very high	40 Å²	40	55.2 Å²	55.2	15%	0.151	28%	0.283	C	S	.	.	H	α-helix	trans	-59.4	-43.3	175.5	-73.3	171	61.7	-163.8	-1	112.1	S273 L276 S277 E280 S355 V356 K361 V362 L363	S273-R359 PolarHBondContact O-NH2 3.1Å; S273-R359 PolarHBondContact OG-NH1 3.27Å; L276-R359 HydrophobicContact CD2-CB 3.49Å; L276-R359 VanDerWaalsContact CD2-CB 3.49Å; S277-R359 PolarHBondContact OG-NH2 3.1Å; E280-R359 VanDerWaalsContact CD-NH2 3.3Å; E280-R359 IonicContact OE1-CZ 3.72Å; E280-R359 IonicContact OE1-NE 3.36Å; E280-R359 PolarHBondContact OE1-NE 3.07Å; E280-R359 IonicContact OE1-NH2 3.05Å; E280-R359 PolarHBondContact OE1-NH2 3.08Å; E280-R359 IonicContact OE2-CZ 2.98Å; E280-R359 IonicContact OE2-NE 3.54Å; E280-R359 IonicContact OE2-NH2 2.74Å; E280-R359 PolarHBondContact OE2-NH2 3.33Å; S355-R359 WeakPolarHBondContact O-CG 3.19Å; S355-R359 PolarHBondContact O-N 3.5Å; V356-R359 PolarHBondContact O-N 3.19Å; R359-K361 VanDerWaalsContact C-N 3.35Å; R359-K361 PolarHBondContact O-N 3.42Å; R359-V362 PolarHBondContact O-N 3.49Å; R359-L363 WeakPolarHBondContact O-CB 3.32Å; R359-L363 PolarHBondContact O-N 2.88Å
360	I	91.3	Very high	91.8	Very high	11 Å²	11	50.6 Å²	50.6	6%	0.056	26%	0.264	C	S	.	.	H	α-helix	trans	-59.1	-44.2	174.6	-69.1	163.9	0	0	0	111.5	L276 L324 L330 V356 S358 V362 L363 N364	L276-I360 HydrophobicContact CD1-CG1 3.84Å; L276-I360 HydrophobicContact CD2-CD1 4.5Å; L276-I360 HydrophobicContact CD2-CG1 3.74Å; L276-I360 HydrophobicContact CG-CG1 4.45Å; L324-I360 HydrophobicContact CD2-CG2 4.4Å; L330-I360 HydrophobicContact CB-CD1 3.77Å; L330-I360 WeakPolarHBondContact O-CD1 3.32Å; V356-I360 HydrophobicContact CG1-CD1 3.77Å; V356-I360 HydrophobicContact CG1-CG1 4.5Å; V356-I360 VanDerWaalsContact O-CG1 3.28Å; V356-I360 WeakPolarHBondContact O-CG1 3.48Å; V356-I360 PolarHBondContact O-N 3.36Å; S358-I360 PolarHBondContact O-N 3.02Å; I360-V362 PolarHBondContact O-N 2.74Å; I360-L363 PolarHBondContact O-N 3.08Å; I360-N364 WeakPolarHBondContact CG2-ND2 3.49Å; I360-N364 WeakPolarHBondContact O-CB 3.43Å; I360-N364 PolarHBondContact O-N 2.75Å; I360-N364 PolarHBondContact O-ND2 3.03Å
361	K	91.1	Very high	91.7	Very high	154 Å²	154	51.5 Å²	51.5	67%	0.67	27%	0.269	S	S	*	.	H	α-helix	trans	-62.5	-43.6	178.3	-72.6	173.7	-177.1	-179.1	0	111.8	S357 S358 R359 S365	S357-K361 WeakPolarHBondContact O-CG 3.36Å; S357-K361 PolarHBondContact O-N 2.92Å; S358-K361 WeakPolarHBondContact O-CB 3.41Å; S358-K361 PolarHBondContact O-N 3.22Å; R359-K361 VanDerWaalsContact C-N 3.35Å; R359-K361 PolarHBondContact O-N 3.42Å; K361-S365 WeakPolarHBondContact O-CB 3.43Å; K361-S365 PolarHBondContact O-N 2.75Å
362	V	91.2	Very high	91.8	Very high	61 Å²	61	57.2 Å²	57.2	37%	0.37	30%	0.295	S	S	.	.	H	α-helix	trans	-64.3	-46.8	177.2	174.7	0	0	0	0	110.8	S358 R359 I360 S365 R366	S358-V362 WeakPolarHBondContact O-CG2 3.39Å; S358-V362 PolarHBondContact O-N 3.05Å; R359-V362 PolarHBondContact O-N 3.49Å; I360-V362 PolarHBondContact O-N 2.74Å; V362-S365 PolarHBondContact O-N 3.05Å; V362-R366 HydrophobicContact CG1-CG 4.49Å; V362-R366 VanDerWaalsContact O-CG 3.3Å; V362-R366 WeakPolarHBondContact O-CG 3.46Å; V362-R366 PolarHBondContact O-N 2.91Å
363	L	91.6	Very high	91.7	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-60.5	-47.6	178.2	179.6	58.4	0	0	0	111.5	F77 L276 L279 E280 F283 L324 R359 I360 S365 R366 L367	F77-L363 HydrophobicContact CE2-CD1 3.96Å; F77-L363 HydrophobicContact CZ-CB 4.13Å; F77-L363 HydrophobicContact CZ-CD1 3.87Å; L276-L363 HydrophobicContact CD1-CD2 3.81Å; L279-L363 HydrophobicContact CB-CD2 4.23Å; E280-L363 HydrophobicContact CG-CD2 4.06Å; F283-L363 HydrophobicContact CB-CD1 3.73Å; F283-L363 HydrophobicContact CD1-CD1 3.78Å; F283-L363 HydrophobicContact CD2-CD1 4.36Å; F283-L363 HydrophobicContact CE1-CD1 4.5Å; F283-L363 HydrophobicContact CG-CD1 3.68Å; L324-L363 HydrophobicContact CD1-CD2 3.68Å; L324-L363 HydrophobicContact CD1-CG 4.12Å; R359-L363 WeakPolarHBondContact O-CB 3.32Å; R359-L363 PolarHBondContact O-N 2.88Å; I360-L363 PolarHBondContact O-N 3.08Å; L363-S365 PolarHBondContact O-N 2.93Å; L363-R366 PolarHBondContact O-N 3.31Å; L363-L367 VanDerWaalsContact O-CB 3.26Å; L363-L367 WeakPolarHBondContact O-CB 3.26Å; L363-L367 PolarHBondContact O-N 2.87Å
364	N	91.7	Very high	91.6	Very high	38 Å²	38	48.4 Å²	48.4	20%	0.203	26%	0.259	C	S	.	.	H	α-helix	trans	-59.8	-45	177.2	-82.9	-32.8	0	0	0	112.3	L324 I360 R366 L367 D368	L324-N364 WeakPolarHBondContact CD2-OD1 3.36Å; I360-N364 WeakPolarHBondContact CG2-ND2 3.49Å; I360-N364 WeakPolarHBondContact O-CB 3.43Å; I360-N364 PolarHBondContact O-N 2.75Å; I360-N364 PolarHBondContact O-ND2 3.03Å; N364-R366 PolarHBondContact O-N 3.49Å; N364-L367 PolarHBondContact O-N 3.19Å; N364-D368 WeakPolarHBondContact O-CB 3.19Å; N364-D368 PolarHBondContact O-N 3.34Å
365	S	92.4	Very high	91.6	Very high	76 Å²	76	50.7 Å²	50.7	53%	0.531	28%	0.276	S	S	.	.	H	α-helix	trans	-61.6	-42.1	178	177.3	0	0	0	0	112.4	K361 V362 L363 D368 M369	K361-S365 WeakPolarHBondContact O-CB 3.43Å; K361-S365 PolarHBondContact O-N 2.75Å; V362-S365 PolarHBondContact O-N 3.05Å; L363-S365 PolarHBondContact O-N 2.93Å; S365-D368 PolarHBondContact O-N 3.27Å; S365-M369 PolarHBondContact O-N 2.86Å; S365-M369 VanDerWaalsContact O-N 3.12Å
366	R	91.3	Very high	91.6	Very high	73 Å²	73	52.3 Å²	52.3	28%	0.275	28%	0.279	S	S	.	.	H	α-helix	trans	-68	-40.1	176.9	-68.9	175	177.1	-153	-6.6	112	G75 F283 V362 L363 N364 D368 M369 C370	G75-R366 PolarHBondContact O-NH1 2.95Å; F283-R366 HydrophobicContact CE1-CB 3.65Å; F283-R366 HydrophobicContact CZ-CB 3.6Å; V362-R366 HydrophobicContact CG1-CG 4.49Å; V362-R366 VanDerWaalsContact O-CG 3.3Å; V362-R366 WeakPolarHBondContact O-CG 3.46Å; V362-R366 PolarHBondContact O-N 2.91Å; L363-R366 PolarHBondContact O-N 3.31Å; N364-R366 PolarHBondContact O-N 3.49Å; R366-D368 VanDerWaalsContact C-N 3.33Å; R366-D368 PolarHBondContact O-N 2.98Å; R366-M369 WeakPolarHBondContact O-CB 3.19Å; R366-M369 PolarHBondContact O-N 3.32Å; R366-C370 PolarHBondContact O-N 3.01Å
367	L	92	Very high	91.5	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63.5	-40.8	176.8	-172.6	150.5	0	0	0	111.4	F283 I320 K321 L363 N364 C370 N371	F283-L367 HydrophobicContact CD2-CB 4.39Å; F283-L367 HydrophobicContact CE2-CB 4.06Å; F283-L367 HydrophobicContact CE2-CG 4.47Å; I320-L367 HydrophobicContact CB-CD1 4.08Å; I320-L367 HydrophobicContact CG2-CD1 3.82Å; K321-L367 HydrophobicContact CB-CD1 4.02Å; K321-L367 HydrophobicContact CB-CD2 3.76Å; K321-L367 HydrophobicContact CD-CD2 3.65Å; K321-L367 HydrophobicContact CG-CD2 3.87Å; L363-L367 VanDerWaalsContact O-CB 3.26Å; L363-L367 WeakPolarHBondContact O-CB 3.26Å; L363-L367 PolarHBondContact O-N 2.87Å; N364-L367 PolarHBondContact O-N 3.19Å; L367-C370 PolarHBondContact O-N 3.36Å; L367-N371 WeakPolarHBondContact CD2-ND2 3.5Å; L367-N371 PolarHBondContact O-N 2.93Å; L367-N371 PolarHBondContact O-ND2 2.86Å
368	D	92.8	Very high	91.5	Very high	76 Å²	76	52.1 Å²	52.1	41%	0.406	28%	0.276	S	S	.	.	H	α-helix	trans	-64.7	-39.1	175.5	-73.6	-23.8	0	0	0	111.8	K321 N364 S365 R366 C370 N371 E372	K321-D368 IonicContact NZ-OD1 3.68Å; K321-D368 PolarHBondContact NZ-OD1 2.89Å; N364-D368 WeakPolarHBondContact O-CB 3.19Å; N364-D368 PolarHBondContact O-N 3.34Å; S365-D368 PolarHBondContact O-N 3.27Å; R366-D368 VanDerWaalsContact C-N 3.33Å; R366-D368 PolarHBondContact O-N 2.98Å; D368-C370 PolarHBondContact O-N 3.48Å; D368-N371 PolarHBondContact O-N 2.96Å; D368-E372 WeakPolarHBondContact O-CB 3.45Å; D368-E372 PolarHBondContact O-N 2.54Å
369	M	92	Very high	91.5	Very high	115 Å²	115	53.5 Å²	53.5	57%	0.567	28%	0.278	S	S	*	.	H	α-helix	trans	-60.1	-44.6	172.9	-175.5	-174.6	-62.7	0	0	112.3	S365 R366 E372 L373	S365-M369 PolarHBondContact O-N 2.86Å; S365-M369 VanDerWaalsContact O-N 3.12Å; R366-M369 WeakPolarHBondContact O-CB 3.19Å; R366-M369 PolarHBondContact O-N 3.32Å; M369-E372 PolarHBondContact O-N 3.31Å; M369-L373 PolarHBondContact O-N 3.32Å
370	C	91.4	Very high	91.3	Very high	6 Å²	6	55.6 Å²	55.6	4%	0.041	29%	0.289	C	S	.	.	H	α-helix	trans	-66.9	-35.9	176.8	-70	0	0	0	0	112.5	F283 I290 L317 R366 L367 D368 T374	F283-C370 HydrophobicContact CE2-CB 4.32Å; I290-C370 HydrophobicContact CD1-CB 4.43Å; L317-C370 HydrophobicContact CD1-CB 3.78Å; L317-C370 HydrophobicContact CD2-CB 4.01Å; R366-C370 PolarHBondContact O-N 3.01Å; L367-C370 PolarHBondContact O-N 3.36Å; D368-C370 PolarHBondContact O-N 3.48Å; C370-T374 WeakPolarHBondContact O-CB 3.21Å; C370-T374 PolarHBondContact O-N 3.05Å; C370-T374 PolarHBondContact O-OG1 3.42Å
371	N	92.7	Very high	91.1	Very high	19 Å²	19	56.3 Å²	56.3	10%	0.102	29%	0.293	C	S	.	.	H	α-helix	trans	-67.3	-41.2	174.4	-78.9	-31.2	0	0	0	112.1	L317 L367 D368 T374 S375	L317-N371 WeakPolarHBondContact CB-OD1 3.36Å; L367-N371 WeakPolarHBondContact CD2-ND2 3.5Å; L367-N371 PolarHBondContact O-N 2.93Å; L367-N371 PolarHBondContact O-ND2 2.86Å; D368-N371 PolarHBondContact O-N 2.96Å; N371-T374 PolarHBondContact O-N 3Å; N371-S375 WeakPolarHBondContact O-CB 3.46Å; N371-S375 PolarHBondContact O-N 2.88Å
372	E	93.5	Very high	91	Very high	126 Å²	126	51.9 Å²	51.9	59%	0.589	28%	0.28	S	S	*	.	H	α-helix	trans	-59.4	-47.9	174.3	-176.5	178.2	-175.7	0	0	110.8	D368 M369 T374 S375 I376	D368-E372 WeakPolarHBondContact O-CB 3.45Å; D368-E372 PolarHBondContact O-N 2.54Å; M369-E372 PolarHBondContact O-N 3.31Å; E372-T374 VanDerWaalsContact C-N 3.29Å; E372-T374 PolarHBondContact O-N 3.03Å; E372-S375 WeakPolarHBondContact O-CB 3.43Å; E372-S375 PolarHBondContact O-N 3.33Å; E372-S375 VanDerWaalsContact O-N 3.11Å; E372-I376 HydrophobicContact CG-CD1 4.13Å; E372-I376 WeakPolarHBondContact O-CG1 3.36Å; E372-I376 PolarHBondContact O-N 3.49Å
373	L	90.7	Very high	90.8	Very high	23 Å²	23	52.3 Å²	52.3	12%	0.12	29%	0.286	C	S	.	.	H	α-helix	trans	-54.8	-46.4	174.2	169.8	59.2	0	0	0	112.1	I290 I294 M297 M369 S375 I376 L377	I290-L373 HydrophobicContact CG2-CD2 3.46Å; I290-L373 VanDerWaalsContact CG2-CD2 3.46Å; I294-L373 HydrophobicContact CD1-CD2 3.72Å; I294-L373 HydrophobicContact CG1-CD2 3.59Å; M297-L373 HydrophobicContact CE-CD1 3.2Å; M297-L373 HydrophobicContact CE-CG 4.46Å; M297-L373 HydrophobicContact SD-CD1 3.83Å; M369-L373 PolarHBondContact O-N 3.32Å; L373-S375 VanDerWaalsContact C-N 3.3Å; L373-S375 PolarHBondContact O-N 2.92Å; L373-I376 PolarHBondContact O-N 3.09Å; L373-L377 HydrophobicContact CD1-CD1 4.18Å; L373-L377 HydrophobicContact CD1-CG 4.26Å; L373-L377 HydrophobicContact CG-CD1 4.3Å; L373-L377 WeakPolarHBondContact O-CG 3.32Å; L373-L377 PolarHBondContact O-N 2.7Å
374	T	90.1	Very high	90.6	Very high	1 Å²	1	56 Å²	56	1%	0.006	31%	0.309	C	S	.	.	H	α-helix	trans	-65.1	-35.3	179.9	-59.2	0	0	0	0	112	V310 T314 C370 N371 E372 T378	V310-T374 HydrophobicContact CG1-CG2 3.79Å; T314-T374 HydrophobicContact CG2-CG2 3.94Å; T314-T374 WeakPolarHBondContact OG1-CG2 3.31Å; C370-T374 WeakPolarHBondContact O-CB 3.21Å; C370-T374 PolarHBondContact O-N 3.05Å; C370-T374 PolarHBondContact O-OG1 3.42Å; N371-T374 PolarHBondContact O-N 3Å; E372-T374 VanDerWaalsContact C-N 3.29Å; E372-T374 PolarHBondContact O-N 3.03Å; T374-T378 WeakPolarHBondContact O-CB 3.15Å; T374-T378 PolarHBondContact O-N 2.88Å; T374-T378 PolarHBondContact O-OG1 3.13Å
375	S	92	Very high	90.3	Very high	62 Å²	62	59.1 Å²	59.1	43%	0.434	32%	0.322	S	S	.	.	H	α-helix	trans	-64.9	-47.5	173	-176.9	0	0	0	0	111.5	N371 E372 L373 L377 T378 N379	N371-S375 WeakPolarHBondContact O-CB 3.46Å; N371-S375 PolarHBondContact O-N 2.88Å; E372-S375 WeakPolarHBondContact O-CB 3.43Å; E372-S375 PolarHBondContact O-N 3.33Å; E372-S375 VanDerWaalsContact O-N 3.11Å; L373-S375 VanDerWaalsContact C-N 3.3Å; L373-S375 PolarHBondContact O-N 2.92Å; S375-L377 VanDerWaalsContact C-N 3.33Å; S375-L377 PolarHBondContact O-N 3.31Å; S375-T378 PolarHBondContact O-N 3.44Å; S375-N379 WeakPolarHBondContact O-CB 2.98Å; S375-N379 VanDerWaalsContact O-CG 3.25Å; S375-N379 PolarHBondContact O-N 3.14Å; S375-N379 PolarHBondContact O-ND2 3.07Å
376	I	91	Very high	90.3	Very high	94 Å²	94	59 Å²	59	48%	0.482	32%	0.321	S	S	.	.	H	α-helix	trans	-57.4	-46.8	176.3	-67.4	165.7	0	0	0	110.7	E372 L373 T378 N379 H380	E372-I376 HydrophobicContact CG-CD1 4.13Å; E372-I376 WeakPolarHBondContact O-CG1 3.36Å; E372-I376 PolarHBondContact O-N 3.49Å; L373-I376 PolarHBondContact O-N 3.09Å; I376-T378 PolarHBondContact O-N 3.39Å; I376-N379 PolarHBondContact O-N 3.43Å; I376-H380 WeakPolarHBondContact O-CB 3.49Å; I376-H380 PolarHBondContact O-N 3.42Å
377	L	88.8	Confident	90.3	Very high	5 Å²	5	58.6 Å²	58.6	3%	0.026	33%	0.326	C	S	.	.	H	α-helix	trans	-61.5	-44	177.4	-74.6	173.5	0	0	0	112	W293 M297 F305 V310 L373 S375 H380 L381	W293-L377 HydrophobicContact CE3-CD1 3.78Å; W293-L377 HydrophobicContact CZ3-CD1 4.29Å; M297-L377 HydrophobicContact CG-CD2 4.29Å; M297-L377 HydrophobicContact SD-CD2 3.65Å; M297-L377 HydrophobicContact SD-CG 4.24Å; F305-L377 HydrophobicContact CD2-CD2 3.61Å; F305-L377 HydrophobicContact CE2-CD2 3.48Å; F305-L377 VanDerWaalsContact CE2-CD2 3.48Å; F305-L377 HydrophobicContact CG-CD2 4.49Å; F305-L377 HydrophobicContact CZ-CD2 4.31Å; V310-L377 HydrophobicContact CG1-CB 4.03Å; V310-L377 HydrophobicContact CG2-CB 4.34Å; L373-L377 HydrophobicContact CD1-CD1 4.18Å; L373-L377 HydrophobicContact CD1-CG 4.26Å; L373-L377 HydrophobicContact CG-CD1 4.3Å; L373-L377 WeakPolarHBondContact O-CG 3.32Å; L373-L377 PolarHBondContact O-N 2.7Å; S375-L377 VanDerWaalsContact C-N 3.33Å; S375-L377 PolarHBondContact O-N 3.31Å; L377-H380 PolarHBondContact O-N 2.87Å; L377-L381 VanDerWaalsContact O-CG 3.27Å; L377-L381 WeakPolarHBondContact O-CG 3.42Å; L377-L381 PolarHBondContact O-N 2.89Å
378	T	90.4	Very high	90.2	Very high	44 Å²	44	67 Å²	67	27%	0.27	36%	0.358	S	S	.	.	H	α-helix	trans	-61.7	-45.9	177.8	-59	0	0	0	0	110.9	V310 T374 S375 I376 H380 L381 C382	V310-T378 WeakPolarHBondContact CG1-OG1 3.45Å; T374-T378 WeakPolarHBondContact O-CB 3.15Å; T374-T378 PolarHBondContact O-N 2.88Å; T374-T378 PolarHBondContact O-OG1 3.13Å; S375-T378 PolarHBondContact O-N 3.44Å; I376-T378 PolarHBondContact O-N 3.39Å; T378-H380 PolarHBondContact O-N 2.64Å; T378-L381 PolarHBondContact O-N 2.93Å; T378-C382 PolarHBondContact O-N 3.09Å; T378-C382 PolarHBondContact O-SG 3.33Å
379	N	90.6	Very high	90.2	Very high	99 Å²	99	66.9 Å²	66.9	53%	0.529	36%	0.357	S	S	.	.	H	α-helix	trans	-61.9	-43.2	177.5	-69.4	-27.3	0	0	0	112	S375 I376 L381 C382 S383	S375-N379 WeakPolarHBondContact O-CB 2.98Å; S375-N379 VanDerWaalsContact O-CG 3.25Å; S375-N379 PolarHBondContact O-N 3.14Å; S375-N379 PolarHBondContact O-ND2 3.07Å; I376-N379 PolarHBondContact O-N 3.43Å; N379-L381 PolarHBondContact O-N 2.76Å; N379-C382 PolarHBondContact O-N 2.84Å; N379-S383 PolarHBondContact O-N 2.97Å
380	H	88.5	Confident	90.4	Very high	85 Å²	85	66.7 Å²	66.7	39%	0.394	36%	0.355	S	S	.	.	H	α-helix	trans	-61.3	-43.5	175.3	175.9	-93	0	0	0	111.9	I376 L377 T378 S383 V384	I376-H380 WeakPolarHBondContact O-CB 3.49Å; I376-H380 PolarHBondContact O-N 3.42Å; L377-H380 PolarHBondContact O-N 2.87Å; T378-H380 PolarHBondContact O-N 2.64Å; H380-S383 PolarHBondContact O-N 2.58Å; H380-V384 WeakPolarHBondContact O-CG2 3.44Å; H380-V384 PolarHBondContact O-N 3.13Å
381	L	87.4	Confident	90.6	Very high	25 Å²	25	73.7 Å²	73.7	13%	0.131	38%	0.381	C	S	.	.	H	α-helix	trans	-64.7	-40.1	177.4	-69.3	176.4	0	0	0	112.6	F305 Q307 V310 L377 T378 N379 V384 H385	F305-L381 HydrophobicContact CB-CD1 4.28Å; F305-L381 HydrophobicContact CB-CD2 4.36Å; F305-L381 VanDerWaalsContact O-CD2 3.23Å; F305-L381 WeakPolarHBondContact O-CD2 3.36Å; Q307-L381 HydrophobicContact CB-CD1 4.21Å; V310-L381 HydrophobicContact CB-CD1 4.38Å; V310-L381 HydrophobicContact CG2-CD1 3.76Å; L377-L381 VanDerWaalsContact O-CG 3.27Å; L377-L381 WeakPolarHBondContact O-CG 3.42Å; L377-L381 PolarHBondContact O-N 2.89Å; T378-L381 PolarHBondContact O-N 2.93Å; N379-L381 PolarHBondContact O-N 2.76Å; L381-V384 PolarHBondContact O-N 3.05Å; L381-H385 PolarHBondContact O-N 3.05Å
382	C	88.7	Confident	90.7	Very high	61 Å²	61	78.2 Å²	78.2	41%	0.412	40%	0.402	S	S	.	.	H	α-helix	trans	-62.1	-42.4	173.7	-69.8	0	0	0	0	111.7	T378 N379 H385 S386	T378-C382 PolarHBondContact O-N 3.09Å; T378-C382 PolarHBondContact O-SG 3.33Å; N379-C382 PolarHBondContact O-N 2.84Å; C382-H385 WeakPolarHBondContact O-CB 3.15Å; C382-H385 PolarHBondContact O-N 2.93Å; C382-S386 PolarHBondContact O-N 3.32Å
383	S	88.1	Confident	90.8	Very high	70 Å²	70	76 Å²	76	49%	0.49	40%	0.397	S	S	.	.	H	α-helix	trans	-61.5	-47.6	176.6	178.3	0	0	0	0	111.9	N379 H380 H385 S386 V387	N379-S383 PolarHBondContact O-N 2.97Å; H380-S383 PolarHBondContact O-N 2.58Å; S383-H385 VanDerWaalsContact C-N 3.28Å; S383-H385 PolarHBondContact O-N 3.4Å; S383-S386 WeakPolarHBondContact O-CB 3.47Å; S383-S386 PolarHBondContact O-N 3.17Å; S383-S386 VanDerWaalsContact O-N 3.14Å; S383-V387 WeakPolarHBondContact O-CG2 3.17Å; S383-V387 PolarHBondContact O-N 2.99Å
384	V	86.8	Confident	91.1	Very high	78 Å²	78	78.7 Å²	78.7	47%	0.473	41%	0.411	S	S	.	.	H	α-helix	trans	-60.4	-38.7	176.1	171.7	0	0	0	0	111.6	H380 L381 R388	H380-V384 WeakPolarHBondContact O-CG2 3.44Å; H380-V384 PolarHBondContact O-N 3.13Å; L381-V384 PolarHBondContact O-N 3.05Å; V384-R388 WeakPolarHBondContact O-CB 3.37Å; V384-R388 PolarHBondContact O-N 3.05Å
385	H	86.1	Confident	91.4	Very high	103 Å²	103	83.1 Å²	83.1	48%	0.477	43%	0.434	S	S	.	.	H	α-helix	trans	-63.6	-44.6	175.3	-175.3	70	0	0	0	111.8	L381 C382 S383 R388 L389	L381-H385 PolarHBondContact O-N 3.05Å; C382-H385 WeakPolarHBondContact O-CB 3.15Å; C382-H385 PolarHBondContact O-N 2.93Å; S383-H385 VanDerWaalsContact C-N 3.28Å; S383-H385 PolarHBondContact O-N 3.4Å; H385-R388 WeakPolarHBondContact O-CB 3.38Å; H385-R388 PolarHBondContact O-N 2.8Å; H385-L389 WeakPolarHBondContact O-CG 3.42Å; H385-L389 PolarHBondContact O-N 3.42Å
386	S	90.9	Very high	91.7	Very high	73 Å²	73	85.5 Å²	85.5	51%	0.51	44%	0.441	S	S	.	.	H	α-helix	trans	-60.4	-48.8	177	-169	0	0	0	0	111.8	C382 S383 R388 L389 E390	C382-S386 PolarHBondContact O-N 3.32Å; S383-S386 WeakPolarHBondContact O-CB 3.47Å; S383-S386 PolarHBondContact O-N 3.17Å; S383-S386 VanDerWaalsContact O-N 3.14Å; S386-R388 VanDerWaalsContact C-N 3.28Å; S386-R388 PolarHBondContact O-N 3.42Å; S386-L389 WeakPolarHBondContact O-CB 3.31Å; S386-L389 PolarHBondContact O-N 3.23Å; S386-L389 VanDerWaalsContact O-N 3.14Å; S386-E390 PolarHBondContact O-N 3.44Å
387	V	90.9	Very high	91.9	Very high	65 Å²	65	85.2 Å²	85.2	39%	0.394	44%	0.44	S	S	.	.	H	α-helix	trans	-61.3	-38.3	177.1	172.6	0	0	0	0	110.9	S383 L389 E390 W391	S383-V387 WeakPolarHBondContact O-CG2 3.17Å; S383-V387 PolarHBondContact O-N 2.99Å; V387-L389 PolarHBondContact O-N 3.3Å; V387-E390 WeakPolarHBondContact O-CB 3.42Å; V387-E390 PolarHBondContact O-N 2.85Å; V387-W391 VanDerWaalsContact O-CD1 3.27Å; V387-W391 PolarHBondContact O-N 2.86Å
388	R	91.3	Very high	92.3	Very high	177 Å²	177	91.2 Å²	91.2	67%	0.668	47%	0.466	S	S	*	.	H	α-helix	trans	-63.6	-40.6	175.7	-170.4	-177.2	111.1	155.9	5.2	112.3	V384 H385 S386 E390 M392	V384-R388 WeakPolarHBondContact O-CB 3.37Å; V384-R388 PolarHBondContact O-N 3.05Å; H385-R388 WeakPolarHBondContact O-CB 3.38Å; H385-R388 PolarHBondContact O-N 2.8Å; S386-R388 VanDerWaalsContact C-N 3.28Å; S386-R388 PolarHBondContact O-N 3.42Å; R388-E390 VanDerWaalsContact C-N 3.35Å; R388-M392 WeakPolarHBondContact O-CB 3.38Å; R388-M392 PolarHBondContact O-N 3.49Å
389	L	92.9	Very high	92.6	Very high	74 Å²	74	92.2 Å²	92.2	39%	0.387	47%	0.472	S	S	.	.	H	α-helix	trans	-65.3	-40.9	175.9	-70.4	176.8	0	0	0	111.1	H385 S386 V387 M392 V393	H385-L389 WeakPolarHBondContact O-CG 3.42Å; H385-L389 PolarHBondContact O-N 3.42Å; S386-L389 WeakPolarHBondContact O-CB 3.31Å; S386-L389 PolarHBondContact O-N 3.23Å; S386-L389 VanDerWaalsContact O-N 3.14Å; V387-L389 PolarHBondContact O-N 3.3Å; L389-M392 WeakPolarHBondContact O-CB 3.49Å; L389-M392 PolarHBondContact O-N 3.43Å; L389-V393 WeakPolarHBondContact O-CG2 3.42Å; L389-V393 PolarHBondContact O-N 2.87Å
390	E	95.5	Very high	92.9	Very high	110 Å²	110	93.1 Å²	93.1	51%	0.514	47%	0.472	S	S	.	.	H	α-helix	trans	-59.4	-49.5	175.3	-175.4	-174.7	170.3	0	0	111.7	S386 V387 R388 M392 V393 I394	S386-E390 PolarHBondContact O-N 3.44Å; V387-E390 WeakPolarHBondContact O-CB 3.42Å; V387-E390 PolarHBondContact O-N 2.85Å; R388-E390 VanDerWaalsContact C-N 3.35Å; E390-M392 VanDerWaalsContact C-N 3.27Å; E390-M392 PolarHBondContact O-N 2.86Å; E390-V393 WeakPolarHBondContact O-CB 3.28Å; E390-V393 PolarHBondContact O-N 3.12Å; E390-I394 HydrophobicContact CG-CD1 4.26Å; E390-I394 WeakPolarHBondContact O-CG1 3.34Å; E390-I394 PolarHBondContact O-N 3.05Å
391	W	95.2	Very high	93.3	Very high	154 Å²	154	93.4 Å²	93.4	58%	0.583	48%	0.48	S	S	*	.	H	α-helix	trans	-61	-36.2	175.2	-85.1	99.4	0	0	0	112.7	V387 V393 I394 I395	V387-W391 VanDerWaalsContact O-CD1 3.27Å; V387-W391 PolarHBondContact O-N 2.86Å; W391-V393 VanDerWaalsContact C-N 3.29Å; W391-V393 PolarHBondContact O-N 3.43Å; W391-I394 PolarHBondContact O-N 2.96Å; W391-I395 WeakPolarHBondContact O-CB 3.47Å; W391-I395 WeakPolarHBondContact O-CD1 3.21Å; W391-I395 WeakPolarHBondContact O-CG1 3.07Å; W391-I395 PolarHBondContact O-N 3.01Å
392	M	96	Very high	93.7	Very high	114 Å²	114	96 Å²	96	56%	0.562	49%	0.493	S	S	*	.	H	α-helix	trans	-61.8	-39.6	174.4	-168.1	-171.2	80.9	0	0	111.4	R388 L389 E390 L396	R388-M392 WeakPolarHBondContact O-CB 3.38Å; R388-M392 PolarHBondContact O-N 3.49Å; L389-M392 WeakPolarHBondContact O-CB 3.49Å; L389-M392 PolarHBondContact O-N 3.43Å; E390-M392 VanDerWaalsContact C-N 3.27Å; E390-M392 PolarHBondContact O-N 2.86Å; M392-L396 WeakPolarHBondContact O-CB 3.46Å; M392-L396 PolarHBondContact O-N 3.37Å; M392-L396 VanDerWaalsContact O-N 3.08Å
393	V	95.7	Very high	94	Very high	80 Å²	80	100.1 Å²	100.1	49%	0.485	50%	0.504	S	S	.	.	H	α-helix	trans	-66	-46.4	175.4	173.4	0	0	0	0	111.1	L389 E390 W391 I395 L396 I397	L389-V393 WeakPolarHBondContact O-CG2 3.42Å; L389-V393 PolarHBondContact O-N 2.87Å; E390-V393 WeakPolarHBondContact O-CB 3.28Å; E390-V393 PolarHBondContact O-N 3.12Å; W391-V393 VanDerWaalsContact C-N 3.29Å; W391-V393 PolarHBondContact O-N 3.43Å; V393-I395 VanDerWaalsContact C-N 3.31Å; V393-I395 PolarHBondContact O-N 2.85Å; V393-L396 PolarHBondContact O-N 2.89Å; V393-L396 VanDerWaalsContact O-N 3.16Å; V393-I397 HydrophobicContact CG1-CD1 4.05Å; V393-I397 WeakPolarHBondContact O-CG1 3.1Å; V393-I397 PolarHBondContact O-N 3.29Å; V393-I397 VanDerWaalsContact O-N 3.09Å
394	I	96.7	Very high	94.3	Very high	78 Å²	78	102.5 Å²	102.5	40%	0.4	51%	0.508	S	S	.	.	H	α-helix	trans	-59.1	-43.7	178.4	-65.1	168	0	0	0	110.8	E390 W391 L396 I397 F398	E390-I394 HydrophobicContact CG-CD1 4.26Å; E390-I394 WeakPolarHBondContact O-CG1 3.34Å; E390-I394 PolarHBondContact O-N 3.05Å; W391-I394 PolarHBondContact O-N 2.96Å; I394-L396 VanDerWaalsContact C-N 3.34Å; I394-L396 PolarHBondContact O-N 3.29Å; I394-I397 PolarHBondContact O-N 2.93Å; I394-F398 WeakPolarHBondContact O-CB 3.19Å; I394-F398 PolarHBondContact O-N 3.27Å
395	I	97	Very high	94.6	Very high	95 Å²	95	101.4 Å²	101.4	49%	0.487	51%	0.507	S	S	.	.	H	α-helix	trans	-63.9	-40.2	177.9	-69.1	163.6	0	0	0	111.1	W391 V393 F398 V399	W391-I395 WeakPolarHBondContact O-CB 3.47Å; W391-I395 WeakPolarHBondContact O-CD1 3.21Å; W391-I395 WeakPolarHBondContact O-CG1 3.07Å; W391-I395 PolarHBondContact O-N 3.01Å; V393-I395 VanDerWaalsContact C-N 3.31Å; V393-I395 PolarHBondContact O-N 2.85Å; I395-F398 PolarHBondContact O-N 2.8Å; I395-V399 HydrophobicContact CG2-CG2 4.42Å; I395-V399 WeakPolarHBondContact O-CG2 3.48Å; I395-V399 PolarHBondContact O-N 2.67Å
396	L	96.8	Very high	95	Very high	111 Å²	111	100.9 Å²	100.9	58%	0.581	51%	0.511	S	S	*	.	H	α-helix	trans	-62.5	-44.7	179.4	-168.2	152.4	0	0	0	111.3	M392 V393 I394 V399 E400	M392-L396 WeakPolarHBondContact O-CB 3.46Å; M392-L396 PolarHBondContact O-N 3.37Å; M392-L396 VanDerWaalsContact O-N 3.08Å; V393-L396 PolarHBondContact O-N 2.89Å; V393-L396 VanDerWaalsContact O-N 3.16Å; I394-L396 VanDerWaalsContact C-N 3.34Å; I394-L396 PolarHBondContact O-N 3.29Å; L396-V399 PolarHBondContact O-N 2.99Å; L396-E400 PolarHBondContact O-N 3.34Å; L396-E400 VanDerWaalsContact O-N 3.09Å
397	I	96.1	Very high	95	Very high	89 Å²	89	102.1 Å²	102.1	46%	0.456	51%	0.512	S	S	.	.	H	α-helix	trans	-63.2	-43.6	175.4	-64.8	167.7	0	0	0	110.7	V393 I394 V399 E400 V401	V393-I397 HydrophobicContact CG1-CD1 4.05Å; V393-I397 WeakPolarHBondContact O-CG1 3.1Å; V393-I397 PolarHBondContact O-N 3.29Å; V393-I397 VanDerWaalsContact O-N 3.09Å; I394-I397 PolarHBondContact O-N 2.93Å; I397-V399 VanDerWaalsContact C-N 3.31Å; I397-V399 PolarHBondContact O-N 2.73Å; I397-E400 WeakPolarHBondContact O-CB 3.26Å; I397-E400 PolarHBondContact O-N 2.68Å; I397-V401 HydrophobicContact CG2-CG2 4.48Å; I397-V401 WeakPolarHBondContact O-CG2 3.5Å; I397-V401 PolarHBondContact O-N 2.84Å
398	F	97.2	Very high	95.1	Very high	131 Å²	131	107 Å²	107	58%	0.575	52%	0.524	S	S	*	.	H	α-helix	trans	-61	-41	179.1	-179	-106.3	0	0	0	112.3	I394 I395 V401 I402	I394-F398 WeakPolarHBondContact O-CB 3.19Å; I394-F398 PolarHBondContact O-N 3.27Å; I395-F398 PolarHBondContact O-N 2.8Å; F398-V401 PolarHBondContact O-N 3.2Å; F398-I402 HydrophobicContact CD1-CD1 3.78Å; F398-I402 HydrophobicContact CE1-CD1 3.27Å; F398-I402 HydrophobicContact CE1-CG1 4.31Å; F398-I402 HydrophobicContact CE2-CD1 4.34Å; F398-I402 HydrophobicContact CZ-CD1 3.59Å; F398-I402 HydrophobicContact CZ-CG1 4.32Å; F398-I402 WeakPolarHBondContact O-CG1 3.29Å; F398-I402 PolarHBondContact O-N 3.39Å
399	V	96.8	Very high	95.1	Very high	65 Å²	65	107.1 Å²	107.1	39%	0.394	53%	0.526	S	S	.	.	H	α-helix	trans	-63.7	-42.8	175.2	169.6	0	0	0	0	111.2	I395 L396 I397 V401 I402 F403	I395-V399 HydrophobicContact CG2-CG2 4.42Å; I395-V399 WeakPolarHBondContact O-CG2 3.48Å; I395-V399 PolarHBondContact O-N 2.67Å; L396-V399 PolarHBondContact O-N 2.99Å; I397-V399 VanDerWaalsContact C-N 3.31Å; I397-V399 PolarHBondContact O-N 2.73Å; V399-V401 PolarHBondContact O-N 2.92Å; V399-I402 PolarHBondContact O-N 3.05Å; V399-F403 HydrophobicContact CG1-CD2 3.69Å; V399-F403 HydrophobicContact CG1-CE2 3.52Å; V399-F403 VanDerWaalsContact O-CD2 3.24Å; V399-F403 WeakPolarHBondContact O-CD2 3.33Å; V399-F403 PolarHBondContact O-N 3.38Å
400	E	96.2	Very high	95	Very high	117 Å²	117	107.8 Å²	107.8	55%	0.547	53%	0.53	S	S	.	.	H	α-helix	trans	-58.9	-45.8	175.8	-174.7	175.1	-175.2	0	0	111.8	L396 I397 I402 F403 E404	L396-E400 PolarHBondContact O-N 3.34Å; L396-E400 VanDerWaalsContact O-N 3.09Å; I397-E400 WeakPolarHBondContact O-CB 3.26Å; I397-E400 PolarHBondContact O-N 2.68Å; E400-I402 VanDerWaalsContact C-N 3.34Å; E400-I402 PolarHBondContact O-N 2.83Å; E400-F403 PolarHBondContact O-N 3.22Å; E400-E404 PolarHBondContact O-N 2.7Å
401	V	96.4	Very high	94.6	Very high	91 Å²	91	110 Å²	110	55%	0.552	54%	0.538	S	S	*	.	H	α-helix	trans	-63.6	-38.4	177.5	175.3	0	0	0	0	111.8	I397 F398 V399 E404 A405	I397-V401 HydrophobicContact CG2-CG2 4.48Å; I397-V401 WeakPolarHBondContact O-CG2 3.5Å; I397-V401 PolarHBondContact O-N 2.84Å; F398-V401 PolarHBondContact O-N 3.2Å; V399-V401 PolarHBondContact O-N 2.92Å; V401-E404 PolarHBondContact O-N 2.92Å; V401-A405 WeakPolarHBondContact O-CB 3.26Å; V401-A405 PolarHBondContact O-N 2.76Å
402	I	95.9	Very high	94	Very high	80 Å²	80	105.1 Å²	105.1	41%	0.41	53%	0.527	S	S	.	.	H	α-helix	trans	-63.4	-44.7	175	-73.1	173.3	0	0	0	111.1	F398 V399 E400 E404 A405 V406	F398-I402 HydrophobicContact CD1-CD1 3.78Å; F398-I402 HydrophobicContact CE1-CD1 3.27Å; F398-I402 HydrophobicContact CE1-CG1 4.31Å; F398-I402 HydrophobicContact CE2-CD1 4.34Å; F398-I402 HydrophobicContact CZ-CD1 3.59Å; F398-I402 HydrophobicContact CZ-CG1 4.32Å; F398-I402 WeakPolarHBondContact O-CG1 3.29Å; F398-I402 PolarHBondContact O-N 3.39Å; V399-I402 PolarHBondContact O-N 3.05Å; E400-I402 VanDerWaalsContact C-N 3.34Å; E400-I402 PolarHBondContact O-N 2.83Å; I402-E404 VanDerWaalsContact C-N 3.32Å; I402-E404 PolarHBondContact O-N 3.38Å; I402-A405 PolarHBondContact O-N 3.21Å; I402-V406 HydrophobicContact CG2-CG2 4.28Å; I402-V406 WeakPolarHBondContact O-CG2 3.1Å; I402-V406 PolarHBondContact O-N 3.02Å
403	F	95.3	Very high	93	Very high	147 Å²	147	102.6 Å²	102.6	65%	0.645	53%	0.531	S	S	*	.	H	α-helix	trans	-59.6	-44	178.2	-87.5	-68.7	0	0	0	111.7	V399 E400 V406 N407	V399-F403 HydrophobicContact CG1-CD2 3.69Å; V399-F403 HydrophobicContact CG1-CE2 3.52Å; V399-F403 VanDerWaalsContact O-CD2 3.24Å; V399-F403 WeakPolarHBondContact O-CD2 3.33Å; V399-F403 PolarHBondContact O-N 3.38Å; E400-F403 PolarHBondContact O-N 3.22Å; F403-V406 PolarHBondContact O-N 2.68Å; F403-N407 WeakPolarHBondContact O-CB 3.42Å; F403-N407 PolarHBondContact O-N 3.42Å
404	E	94.9	Very high	91.2	Very high	120 Å²	120	106.1 Å²	106.1	56%	0.561	54%	0.539	S	S	*	.	H	α-helix	trans	-63.2	-41.5	175.3	-73.8	-63.7	163.8	0	0	112.1	E400 V401 I402 V406 N407 Y408	E400-E404 PolarHBondContact O-N 2.7Å; V401-E404 PolarHBondContact O-N 2.92Å; I402-E404 VanDerWaalsContact C-N 3.32Å; I402-E404 PolarHBondContact O-N 3.38Å; E404-V406 PolarHBondContact O-N 3.33Å; E404-N407 PolarHBondContact O-N 3.36Å; E404-Y408 VanDerWaalsContact O-CB 3.3Å; E404-Y408 WeakPolarHBondContact O-CB 3.47Å; E404-Y408 PolarHBondContact O-N 2.82Å
405	A	93.3	Very high	89	Confident	56 Å²	56	113.4 Å²	113.4	46%	0.463	57%	0.571	S	S	.	*	H	α-helix	trans	-64	-40.8	177.1	0	0	0	0	0	112.7	V401 I402 Y408 Y409	V401-A405 WeakPolarHBondContact O-CB 3.26Å; V401-A405 PolarHBondContact O-N 2.76Å; I402-A405 PolarHBondContact O-N 3.21Å; A405-Y408 PolarHBondContact O-N 3.49Å; A405-Y409 WeakPolarHBondContact O-CB 3.27Å; A405-Y409 PolarHBondContact O-N 3.02Å
406	V	94.1	Very high	88.6	Confident	92 Å²	92	114.3 Å²	114.3	56%	0.558	58%	0.575	S	S	*	*	H	α-helix	trans	-66.8	-44.1	176.8	171.6	0	0	0	0	111	I402 F403 E404 Y408 Y409 D410	I402-V406 HydrophobicContact CG2-CG2 4.28Å; I402-V406 WeakPolarHBondContact O-CG2 3.1Å; I402-V406 PolarHBondContact O-N 3.02Å; F403-V406 PolarHBondContact O-N 2.68Å; E404-V406 PolarHBondContact O-N 3.33Å; V406-Y408 VanDerWaalsContact C-N 3.32Å; V406-Y408 PolarHBondContact O-N 2.89Å; V406-Y409 PolarHBondContact O-N 2.83Å; V406-D410 PolarHBondContact O-N 3.27Å
407	N	91.7	Very high	88.1	Confident	98 Å²	98	114.5 Å²	114.5	52%	0.524	58%	0.575	S	S	.	*	H	α-helix	trans	-62.1	-41.6	176.6	-174.9	31.4	0	0	0	111.5	F403 E404 Y409 D410 K411	F403-N407 WeakPolarHBondContact O-CB 3.42Å; F403-N407 PolarHBondContact O-N 3.42Å; E404-N407 PolarHBondContact O-N 3.36Å; N407-Y409 VanDerWaalsContact C-N 3.34Å; N407-Y409 PolarHBondContact O-N 2.97Å; N407-D410 PolarHBondContact O-N 3.45Å; N407-K411 WeakPolarHBondContact O-CB 3.41Å; N407-K411 PolarHBondContact O-N 3.33Å
408	Y	91.8	Very high	87.7	Confident	167 Å²	167	115.9 Å²	115.9	66%	0.655	58%	0.582	S	S	*	*	H	α-helix	trans	-62.1	-41	174.4	-179.9	-98.9	0	0	0	112.3	E404 A405 V406 K411 S412	E404-Y408 VanDerWaalsContact O-CB 3.3Å; E404-Y408 WeakPolarHBondContact O-CB 3.47Å; E404-Y408 PolarHBondContact O-N 2.82Å; A405-Y408 PolarHBondContact O-N 3.49Å; V406-Y408 VanDerWaalsContact C-N 3.32Å; V406-Y408 PolarHBondContact O-N 2.89Å; Y408-K411 PolarHBondContact O-N 3.34Å; Y408-S412 WeakPolarHBondContact O-CB 3.4Å; Y408-S412 PolarHBondContact O-N 3.29Å; Y408-S412 PolarHBondContact O-OG 2.93Å
409	Y	92.2	Very high	87.1	Confident	181 Å²	181	115 Å²	115	71%	0.71	58%	0.582	S	S	*	*	H	α-helix	trans	-65.9	-45.4	177.1	-171.3	-95.4	0	0	0	112.2	A405 V406 N407 K411 S412 G413	A405-Y409 WeakPolarHBondContact O-CB 3.27Å; A405-Y409 PolarHBondContact O-N 3.02Å; V406-Y409 PolarHBondContact O-N 2.83Å; N407-Y409 VanDerWaalsContact C-N 3.34Å; N407-Y409 PolarHBondContact O-N 2.97Å; Y409-K411 VanDerWaalsContact C-N 3.27Å; Y409-K411 PolarHBondContact O-N 3.39Å; Y409-S412 PolarHBondContact O-N 2.99Å; Y409-G413 PolarHBondContact O-N 2.97Å
410	D	90.8	Very high	86.5	Confident	88 Å²	88	118.1 Å²	118.1	47%	0.471	59%	0.594	S	S	.	*	H	α-helix	trans	-63.9	-33.8	177.3	-169.9	55	0	0	0	112.2	V406 N407 K414	V406-D410 PolarHBondContact O-N 3.27Å; N407-D410 PolarHBondContact O-N 3.45Å; D410-K414 IonicContact OD1-NZ 2.88Å; D410-K414 IonicContact OD2-NZ 3.89Å; D410-K414 PolarHBondContact OD2-NZ 3.07Å
411	K	86.6	Confident	85.9	Confident	156 Å²	156	118.2 Å²	118.2	68%	0.678	60%	0.597	S	S	*	*	H	α-helix	trans	-70.9	-38	174.7	-167.7	172	-176.2	178.6	0	112.4	N407 Y408 Y409	N407-K411 WeakPolarHBondContact O-CB 3.41Å; N407-K411 PolarHBondContact O-N 3.33Å; Y408-K411 PolarHBondContact O-N 3.34Å; Y409-K411 VanDerWaalsContact C-N 3.27Å; Y409-K411 PolarHBondContact O-N 3.39Å
412	S	82.3	Confident	85.1	Confident	52 Å²	52	120.1 Å²	120.1	36%	0.364	60%	0.6	S	S	.	*	H	α-helix	trans	-76.7	-33	-179.5	-57.7	0	0	0	0	112.6	Y408 Y409 K414 H415	Y408-S412 WeakPolarHBondContact O-CB 3.4Å; Y408-S412 PolarHBondContact O-N 3.29Å; Y408-S412 PolarHBondContact O-OG 2.93Å; Y409-S412 PolarHBondContact O-N 2.99Å; S412-K414 PolarHBondContact O-N 3.22Å; S412-H415 PolarHBondContact O-N 3.47Å
413	G	75.2	Confident	84.3	Confident	61 Å²	61	123.2 Å²	123.2	63%	0.629	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-6	176.7	0	0	0	0	0	115.1	Y409	Y409-G413 PolarHBondContact O-N 2.97Å
414	K	58.6	Low	83.4	Confident	153 Å²	153	121.3 Å²	121.3	67%	0.665	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-1.4	173.8	-80.4	171.6	179.7	138.6	0	113.7	D410 S412	D410-K414 IonicContact OD1-NZ 2.88Å; D410-K414 IonicContact OD2-NZ 3.89Å; D410-K414 PolarHBondContact OD2-NZ 3.07Å; S412-K414 PolarHBondContact O-N 3.22Å
415	H	48.8	Very low	82.3	Confident	231 Å²	231	121.4 Å²	121.4	100%	1.069	62%	0.617	S	S	*	*			trans	-110.6	0	170.2	-80.4	-71.1	0	0	0	110.1	S412	S412-H415 PolarHBondContact O-N 3.47Å

Retrieved 415 of 415 residues in 135.3 ms (Link to these results)

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