A0A5K4ESW9_SCHMA Loading...

Eukaryotic elongation factor 2 kinase

AlphaFold DB , UniProt , Accession A0A5K4ESW9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 745 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	37.5	Very low	33.9	Very low	242 Å²	242	145.4 Å²	145.4	100%	1.192	85%	0.853	S	S	*	*				0	121.6	0	-89.2	178.6	171.7	0	0	106.5
2	E	35.4	Very low	33.7	Very low	195 Å²	195	144.1 Å²	144.1	91%	0.911	84%	0.84	S	S	*	*			trans	53.4	117.4	170.8	-66.2	-179.8	169.7	0	0	118.8
3	G	32.4	Very low	33.5	Very low	77 Å²	77	144.5 Å²	144.5	79%	0.794	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-82.5	149.8	-178.4	0	0	0	0	0	112.9
4	I	34.7	Very low	33.2	Very low	163 Å²	163	146.7 Å²	146.7	84%	0.836	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-96.7	125.8	171.1	-60.5	171.6	0	0	0	106.5	S6	I4-S6 PolarHBondContact O-N 3.1Å
5	P	35	Very low	33.2	Very low	123 Å²	123	145.1 Å²	145.1	80%	0.799	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-75.8	122.3	-173.1	26	-25.4	0	0	0	110.7
6	S	34.5	Very low	33.1	Very low	116 Å²	116	148.3 Å²	148.3	81%	0.811	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-65.2	133.7	170.3	52.6	0	0	0	0	110.9	I4 S8	I4-S6 PolarHBondContact O-N 3.1Å; S6-S8 PolarHBondContact O-N 2.97Å
7	E	32.4	Very low	33.1	Very low	193 Å²	193	145 Å²	145	90%	0.902	83%	0.83	S	S	*	*			trans	-42.1	120.6	177.8	-67.8	167.8	146.9	0	0	113.1	T9	E7-T9 PolarHBondContact O-N 2.8Å
8	S	32.2	Very low	33	Very low	116 Å²	116	146.4 Å²	146.4	81%	0.811	83%	0.833	S	S	*	*			trans	-69.5	115.9	169.4	54.5	0	0	0	0	109.5	S6	S6-S8 PolarHBondContact O-N 2.97Å
9	T	34.3	Very low	33	Very low	123 Å²	123	144.4 Å²	144.4	76%	0.755	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-58.3	149.8	166.7	33.5	0	0	0	0	111.3	E7 V11	E7-T9 PolarHBondContact O-N 2.8Å; T9-V11 PolarHBondContact O-N 3.27Å
10	P	31.7	Very low	32.8	Very low	127 Å²	127	147.8 Å²	147.8	83%	0.825	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-66.8	125.5	-171.3	-14.2	28.1	0	0	0	111.1	D12	P10-D12 PolarHBondContact O-N 3.47Å
11	V	32.9	Very low	32.9	Very low	124 Å²	124	148 Å²	148	75%	0.752	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-62.5	116.9	170	176.1	0	0	0	0	108.5	T9 L13	T9-V11 PolarHBondContact O-N 3.27Å; V11-L13 PolarHBondContact O-N 3.3Å; V11-L13 VanDerWaalsContact O-N 3.14Å
12	D	32.1	Very low	32.6	Very low	130 Å²	130	142 Å²	142	70%	0.695	81%	0.808	S	S	*	*			trans	-60.3	110.1	171.7	-171.6	0.5	0	0	0	109.7	P10 F14	P10-D12 PolarHBondContact O-N 3.47Å; D12-F14 VanDerWaalsContact C-N 3.27Å; D12-F14 PolarHBondContact O-N 3.28Å; D12-F14 PolarHBondContact OD1-N 3.37Å
13	L	30.3	Very low	32.7	Very low	149 Å²	149	138 Å²	138	78%	0.78	80%	0.802	S	S	*	*			trans	-87.4	20.9	-175.1	-82.9	168.6	0	0	0	113.5	V11 P15	V11-L13 PolarHBondContact O-N 3.3Å; V11-L13 VanDerWaalsContact O-N 3.14Å; L13-P15 VanDerWaalsContact C-CD 3.41Å; L13-P15 WeakPolarHBondContact O-CD 3.42Å
14	F	29.9	Very low	32.6	Very low	176 Å²	176	142.3 Å²	142.3	77%	0.772	81%	0.807	S	S	*	*			trans	-109.7	78.3	171.4	-67.9	-78.8	0	0	0	112.1	D12 Q16	D12-F14 VanDerWaalsContact C-N 3.27Å; D12-F14 PolarHBondContact O-N 3.28Å; D12-F14 PolarHBondContact OD1-N 3.37Å; F14-Q16 PolarHBondContact O-N 3.03Å
15	P	32.2	Very low	32.7	Very low	123 Å²	123	138.6 Å²	138.6	80%	0.799	80%	0.801	S	S	*	*			trans	-66.2	114	168	26.4	-29.1	0	0	0	109.2	L13 A17	L13-P15 VanDerWaalsContact C-CD 3.41Å; L13-P15 WeakPolarHBondContact O-CD 3.42Å; P15-A17 PolarHBondContact O-N 3.41Å
16	Q	32.7	Very low	32.6	Very low	195 Å²	195	138.7 Å²	138.7	91%	0.911	80%	0.804	S	S	*	*			trans	-55.2	112.6	166.9	-62.4	-179.4	4.1	0	0	109.9	F14	F14-Q16 PolarHBondContact O-N 3.03Å
17	A	32.2	Very low	32.5	Very low	93 Å²	93	138.3 Å²	138.3	77%	0.769	80%	0.8	S	S	*	*			trans	-176.7	72.6	149.2	0	0	0	0	0	110.6	P15	P15-A17 PolarHBondContact O-N 3.41Å
18	L	31.7	Very low	32.6	Very low	170 Å²	170	136.1 Å²	136.1	89%	0.89	79%	0.794	S	S	*	*			trans	-79.5	131	155.2	-84.9	166	0	0	0	108.3	K20	L18-K20 PolarHBondContact O-N 3.45Å
19	P	32.6	Very low	32.7	Very low	109 Å²	109	142 Å²	142	71%	0.708	80%	0.798	S	S	*	*			trans	-60.4	133.3	-179.6	-20.6	31	0	0	0	111.7	I21	P19-I21 PolarHBondContact O-N 3.43Å
20	K	28.7	Very low	32.6	Very low	212 Å²	212	146 Å²	146	92%	0.922	80%	0.801	S	S	*	*			trans	-62.8	102.2	175.7	-70.1	178.9	178.3	177.8	0	109.9	L18	L18-K20 PolarHBondContact O-N 3.45Å
21	I	34.7	Very low	33.1	Very low	153 Å²	153	145.3 Å²	145.3	79%	0.785	80%	0.797	S	S	*	*			trans	-81.3	134.8	167.3	-61.1	174.7	0	0	0	107.8	P19 S23	P19-I21 PolarHBondContact O-N 3.43Å; I21-S23 PolarHBondContact O-N 2.89Å
22	P	31.8	Very low	34.4	Very low	115 Å²	115	149.1 Å²	149.1	75%	0.747	80%	0.798	S	S	*	*			trans	-60.4	136.2	-170.9	-20.8	31.3	0	0	0	113.1	N24	P22-N24 VanDerWaalsContact C-N 3.33Å; P22-N24 PolarHBondContact O-N 3.03Å
23	S	36.9	Very low	35.5	Very low	112 Å²	112	148.6 Å²	148.6	78%	0.783	79%	0.789	S	S	*	*	S	Bend	trans	-66.6	84.6	174.7	53.9	0	0	0	0	110.6	I21	I21-S23 PolarHBondContact O-N 2.89Å
24	N	31.3	Very low	37	Very low	166 Å²	166	145.1 Å²	145.1	89%	0.888	77%	0.771	S	S	*	*			trans	-174.6	68	153.1	-92.3	-12.9	0	0	0	110	P22	P22-N24 VanDerWaalsContact C-N 3.33Å; P22-N24 PolarHBondContact O-N 3.03Å
25	A	36.3	Very low	38.7	Very low	86 Å²	86	139.3 Å²	139.3	71%	0.711	75%	0.752	S	S	*	*			trans	-152.1	116.4	155.2	0	0	0	0	0	106.8	C27	A25-C27 PolarHBondContact O-N 3.28Å
26	S	33.9	Very low	39.7	Very low	125 Å²	125	134.2 Å²	134.2	87%	0.874	72%	0.719	S	S	*	*			trans	-61.7	80.5	167.8	57.4	0	0	0	0	108.6	L28	S26-L28 PolarHBondContact O-N 2.86Å; S26-L28 VanDerWaalsContact O-N 3.12Å
27	C	32.3	Very low	41	Very low	108 Å²	108	131.2 Å²	131.2	73%	0.73	70%	0.699	S	S	*	*			trans	-73.9	107.1	178.9	-166.9	0	0	0	0	107.2	A25 R29	A25-C27 PolarHBondContact O-N 3.28Å; C27-R29 PolarHBondContact O-N 3.33Å; C27-R29 VanDerWaalsContact O-N 3.08Å
28	L	34.5	Very low	42.5	Very low	146 Å²	146	130.2 Å²	130.2	76%	0.764	68%	0.678	S	S	*	*			trans	-43.2	115.5	168.3	-73.8	154.8	0	0	0	108.4	S26 Y30	S26-L28 PolarHBondContact O-N 2.86Å; S26-L28 VanDerWaalsContact O-N 3.12Å; L28-Y30 PolarHBondContact O-N 2.75Å
29	R	34	Very low	43.7	Very low	239 Å²	239	122.8 Å²	122.8	90%	0.902	64%	0.64	S	S	*	*			trans	-60.7	101.4	172.8	-71.9	-175.8	-175	-177.2	1.9	107.3	C27 P31	C27-R29 PolarHBondContact O-N 3.33Å; C27-R29 VanDerWaalsContact O-N 3.08Å; R29-P31 VanDerWaalsContact O-CD 3.31Å; R29-P31 WeakPolarHBondContact O-CD 3.44Å; R29-P31 VanDerWaalsContact O-N 3.15Å
30	Y	32.7	Very low	44.6	Very low	207 Å²	207	120.1 Å²	120.1	81%	0.812	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-59.4	118.3	166.9	-80.3	-86.4	0	0	0	107.3	L28 R32	L28-Y30 PolarHBondContact O-N 2.75Å; Y30-R32 PolarHBondContact O-N 3.13Å
31	P	42.3	Very low	45.9	Very low	114 Å²	114	114.8 Å²	114.8	74%	0.74	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-60.8	130.5	179.6	23.1	-30.5	0	0	0	108.5	R29 K33	R29-P31 VanDerWaalsContact O-CD 3.31Å; R29-P31 WeakPolarHBondContact O-CD 3.44Å; R29-P31 VanDerWaalsContact O-N 3.15Å; P31-K33 PolarHBondContact O-N 3.27Å
32	R	59.4	Low	46.6	Very low	204 Å²	204	112.8 Å²	112.8	77%	0.77	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-51.5	125.6	175.1	172.2	178	164.7	167.3	-8.1	108.5	Y30 L34	Y30-R32 PolarHBondContact O-N 3.13Å; R32-L34 PolarHBondContact O-N 3.22Å
33	K	55.3	Low	47.6	Very low	119 Å²	119	114.7 Å²	114.7	52%	0.517	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-61.1	118.2	170.7	-73.6	-178.1	175.2	175.1	0	107.9	P31 E242	P31-K33 PolarHBondContact O-N 3.27Å; K33-E242 PolarHBondContact NZ-O 2.73Å
34	L	60.9	Low	48.4	Very low	76 Å²	76	114.1 Å²	114.1	40%	0.398	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-61	144.3	172.2	-66.1	172.9	0	0	0	109.6	R32 E38 I39 Q42	R32-L34 PolarHBondContact O-N 3.22Å; L34-E38 HydrophobicContact CB-CB 4.03Å; L34-E38 HydrophobicContact CD2-CB 4.02Å; L34-E38 HydrophobicContact CG-CB 4.48Å; L34-I39 HydrophobicContact CB-CD1 4.24Å; L34-I39 HydrophobicContact CB-CG1 3.67Å; L34-I39 HydrophobicContact CD1-CG1 4.31Å; L34-Q42 VanDerWaalsContact CD1-OE1 3.28Å
35	S	67	Low	49.1	Very low	53 Å²	53	113.2 Å²	113.2	37%	0.371	56%	0.563	S	S	.	*	P	Polyproline II helix	trans	-64.8	159	169.7	64.8	0	0	0	0	110.9	R37 E38 I39	S35-R37 PolarHBondContact O-N 2.78Å; S35-R37 VanDerWaalsContact O-N 3.13Å; S35-E38 VanDerWaalsContact CB-OE2 3.3Å; S35-E38 WeakPolarHBondContact CB-OE2 3.47Å; S35-E38 PolarHBondContact N-OE2 3.3Å; S35-E38 PolarHBondContact O-N 2.97Å; S35-E38 VanDerWaalsContact O-N 3.09Å; S35-E38 VanDerWaalsContact OG-CD 3.26Å; S35-E38 VanDerWaalsContact OG-CG 3.28Å; S35-E38 WeakPolarHBondContact OG-CG 3.28Å; S35-E38 PolarHBondContact OG-N 3.35Å; S35-E38 VanDerWaalsContact OG-N 3.16Å; S35-E38 PolarHBondContact OG-OE2 3.19Å; S35-I39 WeakPolarHBondContact O-CG1 3.48Å; S35-I39 PolarHBondContact O-N 2.95Å
36	V	52.2	Low	49.4	Very low	17 Å²	17	115.7 Å²	115.7	10%	0.103	56%	0.564	C	S	.	*	H	α-helix	trans	-53.8	-34.3	174.3	-179.6	0	0	0	0	111.4	K40 L171 W172 E175	V36-K40 WeakPolarHBondContact O-CG 3.45Å; V36-K40 PolarHBondContact O-N 2.68Å; V36-L171 HydrophobicContact CG1-CB 4.38Å; V36-W172 HydrophobicContact CG2-CE3 4.17Å; V36-W172 HydrophobicContact CG2-CH2 4Å; V36-W172 HydrophobicContact CG2-CZ2 4.38Å; V36-W172 HydrophobicContact CG2-CZ3 3.89Å; V36-E175 HydrophobicContact CG1-CB 4.09Å; V36-E175 HydrophobicContact CG2-CB 4.18Å; V36-E175 HydrophobicContact CG2-CG 4.1Å
37	R	60.1	Low	49.7	Very low	132 Å²	132	113.4 Å²	113.4	50%	0.498	56%	0.56	S	S	.	*	H	α-helix	trans	-67.7	-48.1	176.4	-177.9	176.4	175.8	172.8	-1.6	112.5	S35 I39 K40 I41 I98	S35-R37 PolarHBondContact O-N 2.78Å; S35-R37 VanDerWaalsContact O-N 3.13Å; R37-I39 VanDerWaalsContact C-N 3.33Å; R37-I39 PolarHBondContact O-N 3.34Å; R37-K40 WeakPolarHBondContact O-CB 3.25Å; R37-K40 PolarHBondContact O-N 2.89Å; R37-I41 PolarHBondContact O-N 3.28Å; R37-I98 WeakPolarHBondContact CD-O 3.31Å; R37-I98 HydrophobicContact CG-CG2 4.43Å; R37-I98 PolarHBondContact NE-O 3.47Å; R37-I98 PolarHBondContact NH1-O 3.09Å
38	E	63.8	Low	50.1	Low	71 Å²	71	115.4 Å²	115.4	33%	0.332	56%	0.564	S	S	.	*	H	α-helix	trans	-64.4	-37.4	179.5	-71.4	158.2	146.9	0	0	111.7	L34 S35 K40 I41 Q42	L34-E38 HydrophobicContact CB-CB 4.03Å; L34-E38 HydrophobicContact CD2-CB 4.02Å; L34-E38 HydrophobicContact CG-CB 4.48Å; S35-E38 VanDerWaalsContact CB-OE2 3.3Å; S35-E38 WeakPolarHBondContact CB-OE2 3.47Å; S35-E38 PolarHBondContact N-OE2 3.3Å; S35-E38 PolarHBondContact O-N 2.97Å; S35-E38 VanDerWaalsContact O-N 3.09Å; S35-E38 VanDerWaalsContact OG-CD 3.26Å; S35-E38 VanDerWaalsContact OG-CG 3.28Å; S35-E38 WeakPolarHBondContact OG-CG 3.28Å; S35-E38 PolarHBondContact OG-N 3.35Å; S35-E38 VanDerWaalsContact OG-N 3.16Å; S35-E38 PolarHBondContact OG-OE2 3.19Å; E38-K40 VanDerWaalsContact C-N 3.32Å; E38-K40 PolarHBondContact O-N 2.72Å; E38-I41 PolarHBondContact O-N 3.31Å; E38-Q42 PolarHBondContact O-N 3.14Å
39	I	57.4	Low	50.3	Low	15 Å²	15	117.3 Å²	117.3	8%	0.077	57%	0.566	C	S	.	*	H	α-helix	trans	-64.7	-35.6	175.5	-64.1	166.5	0	0	0	111.8	L34 S35 R37 R43	L34-I39 HydrophobicContact CB-CD1 4.24Å; L34-I39 HydrophobicContact CB-CG1 3.67Å; L34-I39 HydrophobicContact CD1-CG1 4.31Å; S35-I39 WeakPolarHBondContact O-CG1 3.48Å; S35-I39 PolarHBondContact O-N 2.95Å; R37-I39 VanDerWaalsContact C-N 3.33Å; R37-I39 PolarHBondContact O-N 3.34Å; I39-R43 PolarHBondContact O-N 2.84Å
40	K	52.1	Low	50.4	Low	53 Å²	53	116.7 Å²	116.7	23%	0.23	57%	0.565	C	S	.	*	H	α-helix	trans	-62.8	-47.2	177	-81	-175	175.1	-165.4	0	111.5	V36 R37 E38 S44 I98 L171 E174	V36-K40 WeakPolarHBondContact O-CG 3.45Å; V36-K40 PolarHBondContact O-N 2.68Å; R37-K40 WeakPolarHBondContact O-CB 3.25Å; R37-K40 PolarHBondContact O-N 2.89Å; E38-K40 VanDerWaalsContact C-N 3.32Å; E38-K40 PolarHBondContact O-N 2.72Å; K40-S44 PolarHBondContact O-N 3.19Å; K40-I98 HydrophobicContact CD-CD1 4.06Å; K40-I98 HydrophobicContact CD-CG1 4.46Å; K40-L171 VanDerWaalsContact NZ-CD2 3.25Å; K40-E174 VanDerWaalsContact CE-OE2 3.3Å; K40-E174 WeakPolarHBondContact CE-OE2 3.39Å; K40-E174 IonicContact NZ-OE2 2.66Å; K40-E174 PolarHBondContact NZ-OE2 2.96Å
41	I	54.6	Low	51.1	Low	99 Å²	99	109.1 Å²	109.1	51%	0.508	55%	0.546	S	S	.	.	H	α-helix	trans	-64.4	-45.2	-177.8	-64	169.2	0	0	0	110.6	R37 E38 R43 S44	R37-I41 PolarHBondContact O-N 3.28Å; E38-I41 PolarHBondContact O-N 3.31Å; I41-R43 VanDerWaalsContact C-N 3.28Å; I41-R43 PolarHBondContact O-N 2.96Å; I41-S44 PolarHBondContact O-OG 2.9Å
42	Q	50.9	Low	51.2	Low	111 Å²	111	106.3 Å²	106.3	52%	0.519	53%	0.532	S	S	.	.	H	α-helix	trans	-64.9	-29.6	-176.2	-167.9	175.6	14.8	0	0	113.6	L34 E38	L34-Q42 VanDerWaalsContact CD1-OE1 3.28Å; E38-Q42 PolarHBondContact O-N 3.14Å
43	R	52.3	Low	50.6	Low	156 Å²	156	103.2 Å²	103.2	59%	0.589	53%	0.53	S	S	*	.	H	α-helix	trans	-95.9	-12.4	-173.8	-71.8	-177.2	175.6	178.3	-1.6	114.9	I39 I41 E45	I39-R43 PolarHBondContact O-N 2.84Å; I41-R43 VanDerWaalsContact C-N 3.28Å; I41-R43 PolarHBondContact O-N 2.96Å; R43-E45 PolarHBondContact O-N 2.87Å
44	S	52.9	Low	50.5	Low	99 Å²	99	102.7 Å²	102.7	69%	0.692	54%	0.536	S	S	*	.	S	Bend	trans	-64	-15.9	169	39.6	0	0	0	0	112.5	K40 I41	K40-S44 PolarHBondContact O-N 3.19Å; I41-S44 PolarHBondContact O-OG 2.9Å
45	E	46.3	Very low	50.5	Low	147 Å²	147	106.4 Å²	106.4	69%	0.687	55%	0.545	S	S	*	.	S	Bend	trans	-87.2	-22.8	-175.2	-60.9	177.4	170.1	0	0	113.5	R43 G47	R43-E45 PolarHBondContact O-N 2.87Å; E45-G47 PolarHBondContact O-N 2.82Å
46	D	42	Very low	50.5	Low	138 Å²	138	109.5 Å²	109.5	74%	0.738	55%	0.554	S	S	*	*			trans	-101.5	71.8	-170.4	-65.5	-30.8	0	0	0	113.7
47	G	41.8	Very low	51.5	Low	77 Å²	77	112.3 Å²	112.3	79%	0.794	57%	0.574	S	S	*	*			trans	-98	129.9	-179.7	0	0	0	0	0	115.3	E45	E45-G47 PolarHBondContact O-N 2.82Å
48	N	39.2	Very low	52.1	Low	151 Å²	151	114.7 Å²	114.7	81%	0.807	58%	0.583	S	S	*	*			trans	-114.1	136.3	-178.8	-148.9	-5.1	0	0	0	113.5
49	K	39.9	Very low	52.5	Low	186 Å²	186	113 Å²	113	81%	0.809	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-81.6	-31.3	-161.7	-70.2	-178.7	178.5	179.6	0	116.8	A51	K49-A51 PolarHBondContact O-N 2.99Å
50	Y	35.7	Very low	53.6	Low	225 Å²	225	118.1 Å²	118.1	88%	0.882	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-79.3	-4.7	-167.4	-89.2	-88.7	0	0	0	116.3
51	A	47.4	Very low	55	Low	49 Å²	49	118.2 Å²	118.2	41%	0.405	61%	0.613	S	S	.	*	G	3₁₀ helix	trans	-95.6	8.3	-179.4	0	0	0	0	0	114.6	K49	K49-A51 PolarHBondContact O-N 2.99Å
52	A	45.2	Very low	56.2	Low	55 Å²	55	118.5 Å²	118.5	46%	0.455	62%	0.615	S	S	.	*	S	Bend	trans	-81.5	-37.8	-169.4	0	0	0	0	0	114.5	R55 H56	A52-R55 WeakPolarHBondContact O-CB 3.43Å; A52-R55 PolarHBondContact O-N 3.38Å; A52-H56 PolarHBondContact O-N 3.4Å
53	I	46.8	Very low	57.8	Low	139 Å²	139	120.7 Å²	120.7	71%	0.713	62%	0.619	S	S	*	*	H	α-helix	trans	-71	-49.4	-171.2	-62.2	171.5	0	0	0	111.7	R55 H56	I53-R55 PolarHBondContact O-N 3.47Å; I53-R55 VanDerWaalsContact O-N 3.13Å; I53-H56 PolarHBondContact O-N 3.48Å; I53-H56 VanDerWaalsContact O-N 3.07Å
54	T	52.6	Low	59.3	Low	107 Å²	107	120 Å²	120	66%	0.656	62%	0.62	S	S	*	*	H	α-helix	trans	-61.5	-23.3	176	-16.5	0	0	0	0	112.4	S57 R58	T54-S57 PolarHBondContact O-OG 3.5Å; T54-R58 WeakPolarHBondContact O-CB 3.34Å
55	R	59.5	Low	60.6	Low	154 Å²	154	117.8 Å²	117.8	58%	0.581	60%	0.602	S	S	*	*	H	α-helix	trans	-75.2	-32.9	178	-162.3	179.7	-68.9	137.7	-3.3	111.7	A52 I53 A59	A52-R55 WeakPolarHBondContact O-CB 3.43Å; A52-R55 PolarHBondContact O-N 3.38Å; I53-R55 PolarHBondContact O-N 3.47Å; I53-R55 VanDerWaalsContact O-N 3.13Å; R55-A59 VanDerWaalsContact O-CB 3.23Å; R55-A59 WeakPolarHBondContact O-CB 3.43Å; R55-A59 PolarHBondContact O-N 3.22Å
56	H	67.7	Low	62.2	Low	119 Å²	119	112.5 Å²	112.5	55%	0.551	58%	0.584	S	S	*	*	H	α-helix	trans	-71.7	-48.6	-178.2	-173.9	77.6	0	0	0	112.8	A52 I53 R58 A59 K60	A52-H56 PolarHBondContact O-N 3.4Å; I53-H56 PolarHBondContact O-N 3.48Å; I53-H56 VanDerWaalsContact O-N 3.07Å; H56-R58 VanDerWaalsContact C-N 3.33Å; H56-R58 PolarHBondContact O-N 2.91Å; H56-A59 WeakPolarHBondContact O-CB 3.46Å; H56-A59 PolarHBondContact O-N 2.85Å; H56-A59 VanDerWaalsContact O-N 3.16Å; H56-K60 PolarHBondContact O-N 2.95Å
57	S	73.7	Confident	64	Low	76 Å²	76	111.2 Å²	111.2	53%	0.531	58%	0.576	S	S	.	*	H	α-helix	trans	-60.3	-44.3	177.5	59.3	0	0	0	0	111.4	T54 A59 K60 A61	T54-S57 PolarHBondContact O-OG 3.5Å; S57-A59 PolarHBondContact O-N 3.33Å; S57-K60 PolarHBondContact O-N 3.4Å; S57-A61 PolarHBondContact O-N 3.02Å
58	R	71.7	Confident	66	Low	182 Å²	182	111.4 Å²	111.4	69%	0.687	57%	0.565	S	S	*	*	H	α-helix	trans	-60.3	-43.8	173.5	-175.1	176.5	177.8	169.2	1.7	112.1	T54 H56 A61 L62	T54-R58 WeakPolarHBondContact O-CB 3.34Å; H56-R58 VanDerWaalsContact C-N 3.33Å; H56-R58 PolarHBondContact O-N 2.91Å; R58-A61 PolarHBondContact O-N 3.37Å; R58-L62 HydrophobicContact CG-CD1 4.21Å; R58-L62 WeakPolarHBondContact O-CG 3.39Å; R58-L62 PolarHBondContact O-N 2.92Å
59	A	72.5	Confident	68	Low	35 Å²	35	108.7 Å²	108.7	29%	0.289	55%	0.55	S	S	.	*	H	α-helix	trans	-61.3	-45.1	177	0	0	0	0	0	111.6	R55 H56 S57 A61 L62 W63	R55-A59 VanDerWaalsContact O-CB 3.23Å; R55-A59 WeakPolarHBondContact O-CB 3.43Å; R55-A59 PolarHBondContact O-N 3.22Å; H56-A59 WeakPolarHBondContact O-CB 3.46Å; H56-A59 PolarHBondContact O-N 2.85Å; H56-A59 VanDerWaalsContact O-N 3.16Å; S57-A59 PolarHBondContact O-N 3.33Å; A59-A61 VanDerWaalsContact C-N 3.35Å; A59-A61 PolarHBondContact O-N 3.44Å; A59-L62 PolarHBondContact O-N 3.34Å; A59-W63 PolarHBondContact O-N 2.94Å
60	K	80.9	Confident	69.8	Low	123 Å²	123	105.5 Å²	105.5	54%	0.535	54%	0.541	S	S	.	.	H	α-helix	trans	-61.9	-41	178.1	-165	175	-173.8	174.3	0	112.1	H56 S57 W63 K64	H56-K60 PolarHBondContact O-N 2.95Å; S57-K60 PolarHBondContact O-N 3.4Å; K60-W63 PolarHBondContact O-N 3.43Å; K60-K64 WeakPolarHBondContact O-CG 3.46Å; K60-K64 PolarHBondContact O-N 2.92Å
61	A	80.7	Confident	71.8	Confident	54 Å²	54	99.3 Å²	99.3	45%	0.446	53%	0.53	S	S	.	.	H	α-helix	trans	-61.9	-46.5	174.4	0	0	0	0	0	111.7	S57 R58 A59 W63 K64 T65	S57-A61 PolarHBondContact O-N 3.02Å; R58-A61 PolarHBondContact O-N 3.37Å; A59-A61 VanDerWaalsContact C-N 3.35Å; A59-A61 PolarHBondContact O-N 3.44Å; A61-W63 VanDerWaalsContact C-N 3.34Å; A61-W63 PolarHBondContact O-N 3.31Å; A61-K64 PolarHBondContact O-N 2.79Å; A61-T65 PolarHBondContact O-N 3.47Å; A61-T65 PolarHBondContact O-OG1 2.94Å
62	L	80	Confident	73.4	Confident	105 Å²	105	101.2 Å²	101.2	55%	0.55	54%	0.541	S	S	.	.	H	α-helix	trans	-60.8	-39.9	176	-70.6	170.1	0	0	0	112.4	R58 A59 T65 A66	R58-L62 HydrophobicContact CG-CD1 4.21Å; R58-L62 WeakPolarHBondContact O-CG 3.39Å; R58-L62 PolarHBondContact O-N 2.92Å; A59-L62 PolarHBondContact O-N 3.34Å; L62-T65 PolarHBondContact O-N 3.41Å; L62-A66 WeakPolarHBondContact O-CB 3.44Å; L62-A66 PolarHBondContact O-N 3.49Å
63	W	84.7	Confident	74.8	Confident	157 Å²	157	102 Å²	102	60%	0.595	54%	0.542	S	S	*	.	H	α-helix	trans	-64.4	-40.3	175.5	-83.7	109.3	0	0	0	112.8	A59 K60 A61 A66 L67 R659	A59-W63 PolarHBondContact O-N 2.94Å; K60-W63 PolarHBondContact O-N 3.43Å; A61-W63 VanDerWaalsContact C-N 3.34Å; A61-W63 PolarHBondContact O-N 3.31Å; W63-A66 PolarHBondContact O-N 3.5Å; W63-L67 WeakPolarHBondContact O-CB 3.23Å; W63-L67 PolarHBondContact O-N 3.46Å; W63-R659 VanDerWaalsContact CH2-NH2 3.34Å
64	K	84.8	Confident	76.6	Confident	143 Å²	143	98.2 Å²	98.2	62%	0.622	54%	0.538	S	S	*	.	H	α-helix	trans	-62.9	-44.6	174.6	-73.6	-178.6	176.2	-171.2	0	111.5	K60 A61 L67 S68	K60-K64 WeakPolarHBondContact O-CG 3.46Å; K60-K64 PolarHBondContact O-N 2.92Å; A61-K64 PolarHBondContact O-N 2.79Å; K64-L67 PolarHBondContact O-N 2.82Å; K64-S68 WeakPolarHBondContact O-CB 3.36Å; K64-S68 PolarHBondContact O-N 3.14Å
65	T	80.1	Confident	78.3	Confident	52 Å²	52	95.2 Å²	95.2	32%	0.319	52%	0.518	S	S	.	.	H	α-helix	trans	-62.4	-45.4	175.6	-53.8	0	0	0	0	111.2	A61 L62 L67 S68 L69	A61-T65 PolarHBondContact O-N 3.47Å; A61-T65 PolarHBondContact O-OG1 2.94Å; L62-T65 PolarHBondContact O-N 3.41Å; T65-L67 PolarHBondContact O-N 2.99Å; T65-S68 PolarHBondContact O-N 2.97Å; T65-L69 HydrophobicContact CG2-CD1 4.16Å; T65-L69 WeakPolarHBondContact O-CG 3.43Å; T65-L69 PolarHBondContact O-N 3.44Å
66	A	79	Confident	79.7	Confident	35 Å²	35	90.4 Å²	90.4	29%	0.289	51%	0.506	S	S	.	.	H	α-helix	trans	-60.7	-44.6	177.4	0	0	0	0	0	111.9	L62 W63 L69 I70	L62-A66 WeakPolarHBondContact O-CB 3.44Å; L62-A66 PolarHBondContact O-N 3.49Å; W63-A66 PolarHBondContact O-N 3.5Å; A66-L69 PolarHBondContact O-N 3.27Å; A66-I70 VanDerWaalsContact O-CG1 3.25Å; A66-I70 WeakPolarHBondContact O-CG1 3.35Å; A66-I70 PolarHBondContact O-N 3.43Å
67	L	80.5	Confident	80.9	Confident	112 Å²	112	85.4 Å²	85.4	59%	0.586	48%	0.483	S	S	*	.	H	α-helix	trans	-63.6	-41.5	176.6	-177.8	63.6	0	0	0	112.1	W63 K64 T65 L69 I70 S71	W63-L67 WeakPolarHBondContact O-CB 3.23Å; W63-L67 PolarHBondContact O-N 3.46Å; K64-L67 PolarHBondContact O-N 2.82Å; T65-L67 PolarHBondContact O-N 2.99Å; L67-L69 VanDerWaalsContact C-N 3.32Å; L67-L69 PolarHBondContact O-N 2.85Å; L67-I70 PolarHBondContact O-N 3.48Å; L67-S71 VanDerWaalsContact O-CB 3.32Å; L67-S71 WeakPolarHBondContact O-CB 3.21Å; L67-S71 PolarHBondContact O-N 3.23Å; L67-S71 PolarHBondContact O-OG 3.07Å
68	S	83.9	Confident	81.7	Confident	80 Å²	80	87.8 Å²	87.8	56%	0.559	49%	0.485	S	S	*	.	H	α-helix	trans	-61.3	-42.3	174.7	-172.1	0	0	0	0	111.4	K64 T65 S71 S72	K64-S68 WeakPolarHBondContact O-CB 3.36Å; K64-S68 PolarHBondContact O-N 3.14Å; T65-S68 PolarHBondContact O-N 2.97Å; S68-S71 PolarHBondContact O-N 3.44Å; S68-S72 PolarHBondContact O-N 3.47Å; S68-S72 PolarHBondContact O-OG 3.41Å
69	L	79.7	Confident	82.8	Confident	94 Å²	94	86.5 Å²	86.5	49%	0.492	49%	0.485	S	S	.	.	H	α-helix	trans	-65	-47.7	177.8	-72.5	169.3	0	0	0	111.2	T65 A66 L67 S71 S72 C73	T65-L69 HydrophobicContact CG2-CD1 4.16Å; T65-L69 WeakPolarHBondContact O-CG 3.43Å; T65-L69 PolarHBondContact O-N 3.44Å; A66-L69 PolarHBondContact O-N 3.27Å; L67-L69 VanDerWaalsContact C-N 3.32Å; L67-L69 PolarHBondContact O-N 2.85Å; L69-S71 VanDerWaalsContact C-N 3.31Å; L69-S71 PolarHBondContact O-N 3.4Å; L69-S72 WeakPolarHBondContact CA-OG 3.34Å; L69-S72 PolarHBondContact O-N 3.32Å; L69-S72 VanDerWaalsContact O-N 3.16Å; L69-S72 PolarHBondContact O-OG 2.72Å; L69-C73 WeakPolarHBondContact O-CB 3.3Å; L69-C73 PolarHBondContact O-N 3.01Å; L69-C73 PolarHBondContact O-SG 3.28Å
70	I	78.8	Confident	83.9	Confident	119 Å²	119	88 Å²	88	61%	0.61	49%	0.485	S	S	*	.	H	α-helix	trans	-62.4	-40	177.4	-66.2	163.4	0	0	0	110.9	A66 L67 S72 C73	A66-I70 VanDerWaalsContact O-CG1 3.25Å; A66-I70 WeakPolarHBondContact O-CG1 3.35Å; A66-I70 PolarHBondContact O-N 3.43Å; L67-I70 PolarHBondContact O-N 3.48Å; I70-S72 VanDerWaalsContact C-N 3.25Å; I70-S72 PolarHBondContact O-N 3.41Å; I70-C73 CarbonylContact O-C 3.49Å; I70-C73 PolarHBondContact O-N 2.91Å
71	S	78	Confident	84.5	Confident	95 Å²	95	86.4 Å²	86.4	66%	0.664	48%	0.479	S	S	*	.	H	α-helix	trans	-68.4	-27.3	178.7	-54.2	0	0	0	0	112.3	L67 S68 L69	L67-S71 VanDerWaalsContact O-CB 3.32Å; L67-S71 WeakPolarHBondContact O-CB 3.21Å; L67-S71 PolarHBondContact O-N 3.23Å; L67-S71 PolarHBondContact O-OG 3.07Å; S68-S71 PolarHBondContact O-N 3.44Å; L69-S71 VanDerWaalsContact C-N 3.31Å; L69-S71 PolarHBondContact O-N 3.4Å
72	S	80.4	Confident	85.2	Confident	89 Å²	89	83.9 Å²	83.9	62%	0.622	46%	0.458	S	S	*	.	H	α-helix	trans	-83.7	-24.4	174.4	63	0	0	0	0	113.7	S68 L69 I70	S68-S72 PolarHBondContact O-N 3.47Å; S68-S72 PolarHBondContact O-OG 3.41Å; L69-S72 WeakPolarHBondContact CA-OG 3.34Å; L69-S72 PolarHBondContact O-N 3.32Å; L69-S72 VanDerWaalsContact O-N 3.16Å; L69-S72 PolarHBondContact O-OG 2.72Å; I70-S72 VanDerWaalsContact C-N 3.25Å; I70-S72 PolarHBondContact O-N 3.41Å
73	C	75.2	Confident	85.8	Confident	71 Å²	71	80.8 Å²	80.8	48%	0.48	44%	0.441	S	S	.	.	S	Bend	trans	-96.5	101.7	179.1	-62.2	0	0	0	0	109.5	L69 I70	L69-C73 WeakPolarHBondContact O-CB 3.3Å; L69-C73 PolarHBondContact O-N 3.01Å; L69-C73 PolarHBondContact O-SG 3.28Å; I70-C73 CarbonylContact O-C 3.49Å; I70-C73 PolarHBondContact O-N 2.91Å
74	G	83.2	Confident	86.3	Confident	61 Å²	61	80 Å²	80	63%	0.629	44%	0.444	S	S	*	.			trans	-64.1	175.7	170.2	0	0	0	0	0	112.8	P76	G74-P76 VanDerWaalsContact O-CD 3.25Å; G74-P76 WeakPolarHBondContact O-CD 3.31Å
75	D	88.2	Confident	86.8	Confident	44 Å²	44	75.3 Å²	75.3	24%	0.235	43%	0.425	C	S	.	.			trans	-67.1	114.2	174.9	177.3	-5.2	0	0	0	109.8	W77 E78 K128 N144	D75-W77 PolarHBondContact O-N 3.34Å; D75-W77 WeakPolarHBondContact OD1-CA 3.35Å; D75-W77 PolarHBondContact OD1-N 2.87Å; D75-E78 HydrophobicContact CB-CB 4.08Å; D75-E78 WeakPolarHBondContact O-CB 3.25Å; D75-E78 PolarHBondContact O-N 2.85Å; D75-E78 VanDerWaalsContact O-N 3.07Å; D75-E78 PolarHBondContact OD1-N 3.47Å; D75-K128 WeakPolarHBondContact OD2-CE 3.37Å; D75-K128 IonicContact OD2-NZ 3.07Å; D75-K128 PolarHBondContact OD2-NZ 3.02Å; D75-N144 PolarHBondContact OD1-ND2 2.97Å
76	P	89.1	Confident	87.6	Confident	52 Å²	52	77 Å²	77	34%	0.338	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-16.4	-177.5	26.5	-35.2	0	0	0	113.2	G74 F210	G74-P76 VanDerWaalsContact O-CD 3.25Å; G74-P76 WeakPolarHBondContact O-CD 3.31Å; P76-F210 HydrophobicContact CB-CE1 4.26Å; P76-F210 HydrophobicContact CG-CD1 4.18Å; P76-F210 HydrophobicContact CG-CE1 3.74Å
77	W	93.3	Very high	88.3	Confident	14 Å²	14	79.7 Å²	79.7	5%	0.053	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	8.9	179.7	-72	0.2	0	0	0	113.9	D75 K79 F80 L82 F116 R126 N144 H145 V146 F210	D75-W77 PolarHBondContact O-N 3.34Å; D75-W77 WeakPolarHBondContact OD1-CA 3.35Å; D75-W77 PolarHBondContact OD1-N 2.87Å; W77-K79 PolarHBondContact O-N 3.18Å; W77-K79 VanDerWaalsContact O-N 3.15Å; W77-F80 HydrophobicContact CB-CD2 3.82Å; W77-F80 HydrophobicContact CB-CE2 4.43Å; W77-F80 AromaticContact CD1-CE2 3.83Å; W77-F80 AromaticContact CG-CD2 3.96Å; W77-F80 HydrophobicContact CG-CD2 3.96Å; W77-F80 HydrophobicContact CG-CE2 4.2Å; W77-F80 WeakPolarHBondContact O-CB 3.21Å; W77-F80 WeakPolarHBondContact O-CD2 3.42Å; W77-F80 PolarHBondContact O-N 3.35Å; W77-L82 HydrophobicContact CB-CD1 4.25Å; W77-L82 HydrophobicContact CD2-CD1 4.35Å; W77-L82 HydrophobicContact CE3-CD1 3.55Å; W77-L82 HydrophobicContact CZ3-CD1 4.25Å; W77-F116 HydrophobicContact CZ2-CZ 4.3Å; W77-R126 HydrophobicContact CD2-CG 4.26Å; W77-R126 HydrophobicContact CE3-CB 4Å; W77-R126 HydrophobicContact CE3-CG 4.19Å; W77-R126 HydrophobicContact CH2-CB 4.03Å; W77-R126 HydrophobicContact CH2-CG 3.9Å; W77-R126 HydrophobicContact CZ2-CG 3.97Å; W77-R126 HydrophobicContact CZ3-CB 3.73Å; W77-R126 HydrophobicContact CZ3-CG 4.01Å; W77-N144 HydrophobicContact CD2-CB 4.28Å; W77-N144 HydrophobicContact CE3-CB 3.61Å; W77-N144 HydrophobicContact CZ3-CB 3.82Å; W77-H145 WeakPolarHBondContact CH2-O 3.24Å; W77-H145 WeakPolarHBondContact CZ3-O 3.48Å; W77-V146 HydrophobicContact CH2-CG2 3.84Å; W77-V146 HydrophobicContact CZ2-CG2 4.3Å; W77-F210 AromaticContact CE2-CD2 3.84Å; W77-F210 AromaticContact CE2-CE2 3.96Å; W77-F210 AromaticContact CE2-CG 3.94Å; W77-F210 HydrophobicContact CH2-CB 3.86Å; W77-F210 AromaticContact CH2-CD2 3.85Å; W77-F210 HydrophobicContact CH2-CD2 3.85Å; W77-F210 AromaticContact CH2-CG 3.93Å; W77-F210 HydrophobicContact CH2-CG 3.93Å; W77-F210 HydrophobicContact CZ2-CB 4.04Å; W77-F210 HydrophobicContact CZ2-CD1 4.26Å; W77-F210 AromaticContact CZ2-CD2 3.21Å; W77-F210 HydrophobicContact CZ2-CD2 3.21Å; W77-F210 AromaticContact CZ2-CE2 3.65Å; W77-F210 HydrophobicContact CZ2-CE2 3.65Å; W77-F210 AromaticContact CZ2-CG 3.56Å; W77-F210 HydrophobicContact CZ2-CG 3.56Å; W77-F210 HydrophobicContact CZ2-CZ 4.32Å; W77-F210 HydrophobicContact CZ3-CB 4.32Å; W77-F210 AromaticContact NE1-CE1 3.95Å; W77-F210 AromaticContact NE1-CE2 3.86Å; W77-F210 AromaticContact NE1-CZ 3.72Å
78	E	91.7	Very high	89.1	Confident	127 Å²	127	76.2 Å²	76.2	59%	0.593	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-49.7	-44.4	-179.9	-170.8	175.4	-176.1	0	0	112.6	D75 F80 H81	D75-E78 HydrophobicContact CB-CB 4.08Å; D75-E78 WeakPolarHBondContact O-CB 3.25Å; D75-E78 PolarHBondContact O-N 2.85Å; D75-E78 VanDerWaalsContact O-N 3.07Å; D75-E78 PolarHBondContact OD1-N 3.47Å; E78-F80 PolarHBondContact O-N 3.34Å; E78-H81 PolarHBondContact O-N 3.08Å
79	K	93.8	Very high	89.6	Confident	154 Å²	154	74.2 Å²	74.2	67%	0.67	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-61.2	-14.9	179.7	69.1	-176.9	177.4	-172.6	0	115.7	W77 H81	W77-K79 PolarHBondContact O-N 3.18Å; W77-K79 VanDerWaalsContact O-N 3.15Å; K79-H81 PolarHBondContact O-CD2 2.95Å; K79-H81 VanDerWaalsContact O-CD2 3.28Å
80	F	94.7	Very high	90.4	Very high	66 Å²	66	69.8 Å²	69.8	29%	0.289	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-90.1	-6.2	178.1	-59.2	-68.2	0	0	0	112.3	W77 E78 L82 R126	W77-F80 HydrophobicContact CB-CD2 3.82Å; W77-F80 HydrophobicContact CB-CE2 4.43Å; W77-F80 AromaticContact CD1-CE2 3.83Å; W77-F80 AromaticContact CG-CD2 3.96Å; W77-F80 HydrophobicContact CG-CD2 3.96Å; W77-F80 HydrophobicContact CG-CE2 4.2Å; W77-F80 WeakPolarHBondContact O-CB 3.21Å; W77-F80 WeakPolarHBondContact O-CD2 3.42Å; W77-F80 PolarHBondContact O-N 3.35Å; E78-F80 PolarHBondContact O-N 3.34Å; F80-L82 HydrophobicContact CB-CD2 3.95Å; F80-L82 HydrophobicContact CB-CG 4.06Å; F80-L82 PolarHBondContact O-N 2.7Å; F80-R126 VanDerWaalsContact CE2-NE 3.35Å; F80-R126 VanDerWaalsContact CZ-CZ 3.42Å
81	H	94.6	Very high	91.4	Very high	90 Å²	90	66.2 Å²	66.2	42%	0.417	37%	0.366	S	S	.	.			trans	53.9	37.6	175.6	-61.1	-86.6	0	0	0	113.5	E78 K79 Q83 E84	E78-H81 PolarHBondContact O-N 3.08Å; K79-H81 PolarHBondContact O-CD2 2.95Å; K79-H81 VanDerWaalsContact O-CD2 3.28Å; H81-Q83 PolarHBondContact O-N 3.05Å; H81-Q83 VanDerWaalsContact O-N 3.08Å; H81-E84 HydrophobicContact CB-CB 4.49Å; H81-E84 HydrophobicContact CB-CG 4.33Å; H81-E84 IonicContact CG-OE1 3.6Å; H81-E84 IonicContact ND1-OE1 2.62Å; H81-E84 PolarHBondContact ND1-OE1 3.44Å; H81-E84 WeakPolarHBondContact O-CB 3.35Å; H81-E84 PolarHBondContact O-N 3.15Å
82	L	95.2	Very high	92.3	Very high	1 Å²	1	62.6 Å²	62.6	1%	0.005	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-59.9	-25.7	-176	-57.9	179.1	0	0	0	112.7	W77 F80 E84 L85 K110 E112 R126 K128	W77-L82 HydrophobicContact CB-CD1 4.25Å; W77-L82 HydrophobicContact CD2-CD1 4.35Å; W77-L82 HydrophobicContact CE3-CD1 3.55Å; W77-L82 HydrophobicContact CZ3-CD1 4.25Å; F80-L82 HydrophobicContact CB-CD2 3.95Å; F80-L82 HydrophobicContact CB-CG 4.06Å; F80-L82 PolarHBondContact O-N 2.7Å; L82-E84 PolarHBondContact O-N 3.02Å; L82-L85 HydrophobicContact CB-CD1 4.44Å; L82-L85 HydrophobicContact CD2-CD1 3.8Å; L82-L85 WeakPolarHBondContact O-CB 3.11Å; L82-L85 PolarHBondContact O-N 2.99Å; L82-K110 WeakPolarHBondContact O-CD 3.35Å; L82-E112 HydrophobicContact CD2-CG 3.66Å; L82-R126 HydrophobicContact CD1-CB 3.87Å; L82-R126 HydrophobicContact CD2-CB 4.01Å; L82-K128 HydrophobicContact CB-CD 4.04Å; L82-K128 HydrophobicContact CB-CG 3.98Å; L82-K128 HydrophobicContact CD1-CG 4.15Å
83	Q	92.3	Very high	93.1	Very high	41 Å²	41	60 Å²	60	19%	0.192	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-65.3	-20	174.1	73.2	-73.2	-7.6	0	0	113.6	H81 K110 W139	H81-Q83 PolarHBondContact O-N 3.05Å; H81-Q83 VanDerWaalsContact O-N 3.08Å; Q83-K110 PolarHBondContact O-NZ 2.95Å; Q83-W139 HydrophobicContact CB-CB 3.71Å
84	E	94.5	Very high	94.1	Very high	140 Å²	140	59.4 Å²	59.4	65%	0.654	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-91	-13.2	-179.7	-65.3	167.3	-151.3	0	0	112.4	H81 L82	H81-E84 HydrophobicContact CB-CB 4.49Å; H81-E84 HydrophobicContact CB-CG 4.33Å; H81-E84 IonicContact CG-OE1 3.6Å; H81-E84 IonicContact ND1-OE1 2.62Å; H81-E84 PolarHBondContact ND1-OE1 3.44Å; H81-E84 WeakPolarHBondContact O-CB 3.35Å; H81-E84 PolarHBondContact O-N 3.15Å; L82-E84 PolarHBondContact O-N 3.02Å
85	L	96.3	Very high	94.6	Very high	45 Å²	45	58 Å²	58	24%	0.236	28%	0.278	C	S	.	.	S	Bend	trans	-63.1	155.4	177.5	-65	178.2	0	0	0	111.7	L82 E87 K110 E112	L82-L85 HydrophobicContact CB-CD1 4.44Å; L82-L85 HydrophobicContact CD2-CD1 3.8Å; L82-L85 WeakPolarHBondContact O-CB 3.11Å; L82-L85 PolarHBondContact O-N 2.99Å; L85-E87 PolarHBondContact O-N 3.2Å; L85-K110 HydrophobicContact CB-CB 4.2Å; L85-K110 HydrophobicContact CB-CD 4.47Å; L85-K110 WeakPolarHBondContact O-CD 3.4Å; L85-K110 WeakPolarHBondContact O-CE 3.44Å; L85-K110 PolarHBondContact O-NZ 3.13Å; L85-E112 HydrophobicContact CD1-CG 4.03Å
86	P	95.9	Very high	94.5	Very high	88 Å²	88	58.1 Å²	58.1	57%	0.571	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-60.7	138	173.3	26	-34.3	0	0	0	110.5
87	E	95	Very high	94.4	Very high	90 Å²	90	56.5 Å²	56.5	42%	0.421	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-76.5	137.1	173.2	-178.8	179.1	136.6	0	0	110.4	L85 H108 W139	L85-E87 PolarHBondContact O-N 3.2Å; E87-H108 HydrophobicContact CG-CB 4.22Å; E87-H108 IonicContact OE1-CE1 3.19Å; E87-H108 IonicContact OE1-CG 3.73Å; E87-H108 IonicContact OE1-ND1 3.56Å; E87-H108 PolarHBondContact OE1-ND1 3.13Å; E87-W139 HydrophobicContact CB-CZ2 4.37Å; E87-W139 HydrophobicContact CG-CH2 4.41Å; E87-W139 HydrophobicContact CG-CZ2 3.73Å; E87-W139 WeakPolarHBondContact OE2-CZ2 3.27Å; E87-W139 PolarHBondContact OE2-NE1 3.04Å
88	E	96.2	Very high	93.9	Very high	39 Å²	39	59 Å²	59	18%	0.182	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	138.9	177.6	-65.3	-175.8	-110.9	0	0	111.2	H108 V109 F196 R199	E88-H108 WeakPolarHBondContact O-CA 3.44Å; E88-V109 HydrophobicContact CB-CG2 4.39Å; E88-V109 PolarHBondContact N-O 3.14Å; E88-V109 PolarHBondContact O-N 2.82Å; E88-F196 HydrophobicContact CB-CD1 4.18Å; E88-F196 HydrophobicContact CB-CE1 4.01Å; E88-R199 VanDerWaalsContact CD-NH2 3.29Å; E88-R199 IonicContact OE1-CZ 3.55Å; E88-R199 IonicContact OE1-NE 3.73Å; E88-R199 IonicContact OE1-NH2 3.45Å; E88-R199 PolarHBondContact OE1-NH2 3.39Å; E88-R199 IonicContact OE2-CZ 2.7Å; E88-R199 VanDerWaalsContact OE2-CZ 3.28Å; E88-R199 IonicContact OE2-NE 2.68Å; E88-R199 PolarHBondContact OE2-NE 2.9Å; E88-R199 IonicContact OE2-NH2 2.77Å; E88-R199 PolarHBondContact OE2-NH2 2.95Å; E88-R199 VanDerWaalsContact OE2-NH2 3.17Å
89	T	95.6	Very high	93.4	Very high	39 Å²	39	59.4 Å²	59.4	24%	0.239	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	129	173.1	-50.5	0	0	0	0	110	I106 I197	T89-I106 HydrophobicContact CG2-CG2 3.49Å; T89-I106 VanDerWaalsContact CG2-CG2 3.49Å; T89-I197 HydrophobicContact CG2-CD1 4.32Å
90	A	97.1	Very high	93.1	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	148.7	176.4	0	0	0	0	0	110.7	V107 V109 L194 E195 F196	A90-V107 HydrophobicContact CB-CG2 4.25Å; A90-V107 PolarHBondContact N-O 3.07Å; A90-V107 WeakPolarHBondContact O-CG2 3.49Å; A90-V107 PolarHBondContact O-N 3.49Å; A90-V109 HydrophobicContact CB-CG2 4.3Å; A90-L194 HydrophobicContact CB-CB 4.44Å; A90-L194 HydrophobicContact CB-CD2 4.4Å; A90-E195 CarbonylContact C-O 3.59Å; A90-E195 VanDerWaalsContact CA-O 3.27Å; A90-E195 WeakPolarHBondContact CA-O 3.34Å; A90-E195 WeakPolarHBondContact CB-O 3.39Å; A90-F196 HydrophobicContact CB-CD1 4.41Å; A90-F196 HydrophobicContact CB-CG 4.5Å
91	K	98	Very high	92.9	Very high	45 Å²	45	57.1 Å²	57.1	20%	0.196	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	123.8	168.6	-175.9	168.8	178.7	174.6	0	108.7	Y93 E104 I106 L194 E195 I197	K91-Y93 HydrophobicContact CB-CE2 4.44Å; K91-Y93 HydrophobicContact CD-CE1 4.37Å; K91-Y93 HydrophobicContact CD-CE2 4.25Å; K91-Y93 WeakPolarHBondContact CD-OH 3.32Å; K91-Y93 WeakPolarHBondContact CE-OH 3.48Å; K91-Y93 HydrophobicContact CG-CE2 3.98Å; K91-E104 WeakPolarHBondContact CE-OE1 3.48Å; K91-E104 WeakPolarHBondContact CE-OE2 3.25Å; K91-E104 IonicContact NZ-OE1 2.74Å; K91-E104 PolarHBondContact NZ-OE1 2.77Å; K91-E104 IonicContact NZ-OE2 3.33Å; K91-E104 PolarHBondContact NZ-OE2 3.37Å; K91-I106 HydrophobicContact CB-CD1 4.05Å; K91-I106 HydrophobicContact CG-CD1 4.2Å; K91-L194 CarbonylContact O-C 3.58Å; K91-L194 WeakPolarHBondContact O-CA 3.48Å; K91-E195 HydrophobicContact CB-CB 4.38Å; K91-E195 PolarHBondContact N-O 3.41Å; K91-E195 PolarHBondContact O-N 3.47Å; K91-I197 HydrophobicContact CB-CG2 3.91Å
92	R	97.6	Very high	92.9	Very high	19 Å²	19	57 Å²	57	7%	0.072	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	133.5	-179.6	169	179.5	75.3	172.8	-5.9	109.5	R94 E104 D105 V107 N132 C192 V193 L194 E643	R92-R94 HydrophobicContact CG-CG 4.01Å; R92-E104 VanDerWaalsContact O-CA 3.29Å; R92-E104 WeakPolarHBondContact O-CA 3.01Å; R92-D105 WeakPolarHBondContact CB-OD1 3.4Å; R92-D105 WeakPolarHBondContact CG-OD1 3.42Å; R92-D105 IonicContact CZ-OD1 2.8Å; R92-D105 IonicContact CZ-OD2 2.68Å; R92-D105 VanDerWaalsContact CZ-OD2 3.29Å; R92-D105 PolarHBondContact N-O 3.02Å; R92-D105 IonicContact NE-OD1 2.58Å; R92-D105 PolarHBondContact NE-OD1 3.42Å; R92-D105 IonicContact NE-OD2 2.81Å; R92-D105 PolarHBondContact NE-OD2 3.44Å; R92-D105 IonicContact NH2-OD1 2.63Å; R92-D105 IonicContact NH2-OD2 3.82Å; R92-D105 PolarHBondContact NH2-OD2 3.03Å; R92-D105 PolarHBondContact O-N 2.86Å; R92-V107 HydrophobicContact CB-CB 4.48Å; R92-V107 HydrophobicContact CB-CG1 3.85Å; R92-V107 HydrophobicContact CB-CG2 3.77Å; R92-V107 HydrophobicContact CG-CG1 4.47Å; R92-N132 PolarHBondContact NH2-ND2 3Å; R92-N132 VanDerWaalsContact NH2-ND2 3.13Å; R92-C192 HydrophobicContact CG-CB 4.09Å; R92-V193 CarbonylContact C-O 3.53Å; R92-V193 WeakPolarHBondContact CA-O 3.34Å; R92-L194 HydrophobicContact CB-CD2 3.65Å; R92-L194 HydrophobicContact CG-CD2 4.09Å; R92-E643 IonicContact CZ-OE2 2.85Å; R92-E643 IonicContact NH1-OE2 3.46Å; R92-E643 PolarHBondContact NH1-OE2 3.44Å; R92-E643 IonicContact NH2-OE2 2.65Å; R92-E643 PolarHBondContact NH2-OE2 3.4Å
93	Y	98.4	Very high	92.8	Very high	33 Å²	33	58.7 Å²	58.7	13%	0.129	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	116.5	175.9	-59.7	-90.6	0	0	0	109.7	K91 I103 E104 F160 C192 V193 E195	K91-Y93 HydrophobicContact CB-CE2 4.44Å; K91-Y93 HydrophobicContact CD-CE1 4.37Å; K91-Y93 HydrophobicContact CD-CE2 4.25Å; K91-Y93 WeakPolarHBondContact CD-OH 3.32Å; K91-Y93 WeakPolarHBondContact CE-OH 3.48Å; K91-Y93 HydrophobicContact CG-CE2 3.98Å; Y93-I103 CarbonylContact C-O 3.49Å; Y93-I103 WeakPolarHBondContact CA-O 3.25Å; Y93-E104 HydrophobicContact CD1-CB 4.05Å; Y93-E104 HydrophobicContact CE1-CB 4.19Å; Y93-F160 AromaticContact CD1-CE1 3.94Å; Y93-F160 HydrophobicContact CD1-CE1 3.94Å; Y93-F160 HydrophobicContact CD1-CZ 4.46Å; Y93-F160 HydrophobicContact CD2-CE1 4.06Å; Y93-F160 HydrophobicContact CD2-CZ 4.06Å; Y93-F160 HydrophobicContact CE1-CE1 4.46Å; Y93-F160 HydrophobicContact CE2-CZ 4.26Å; Y93-F160 AromaticContact CG-CE1 3.7Å; Y93-F160 HydrophobicContact CG-CE1 3.7Å; Y93-F160 HydrophobicContact CG-CZ 4.16Å; Y93-C192 WeakPolarHBondContact O-CA 3.37Å; Y93-C192 VanDerWaalsContact O-CB 3.24Å; Y93-C192 WeakPolarHBondContact O-CB 3.23Å; Y93-V193 HydrophobicContact CD2-CB 4.24Å; Y93-V193 HydrophobicContact CD2-CG1 4.43Å; Y93-V193 PolarHBondContact N-O 2.94Å; Y93-V193 PolarHBondContact O-N 3.28Å; Y93-E195 HydrophobicContact CE2-CB 3.98Å; Y93-E195 PolarHBondContact OH-OE2 2.88Å
94	R	95	Very high	92.9	Very high	59 Å²	59	62.3 Å²	62.3	22%	0.223	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	132.1	178.3	-65.2	-173.9	-76.6	134.9	4.2	110.1	R92 W102 I103 D105 C192 A641	R92-R94 HydrophobicContact CG-CG 4.01Å; R94-W102 CarbonylContact O-C 3.56Å; R94-W102 WeakPolarHBondContact O-CA 3.18Å; R94-I103 HydrophobicContact CB-CB 4.5Å; R94-I103 PolarHBondContact N-O 3.26Å; R94-I103 PolarHBondContact O-N 2.87Å; R94-D105 IonicContact CZ-OD2 3.26Å; R94-D105 IonicContact NE-OD2 2.85Å; R94-D105 PolarHBondContact NE-OD2 3.44Å; R94-D105 IonicContact NH2-OD2 3.44Å; R94-D105 PolarHBondContact NH2-OD2 2.96Å; R94-C192 HydrophobicContact CG-CB 4.02Å; R94-A641 PolarHBondContact NH1-O 3.22Å
95	Y	94.7	Very high	92.8	Very high	32 Å²	32	56.2 Å²	56.2	13%	0.125	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	119.2	175.8	179.8	-112.1	0	0	0	111	A97 W102 R164 M167	Y95-A97 HydrophobicContact CD1-CB 4.2Å; Y95-A97 HydrophobicContact CE1-CB 3.88Å; Y95-A97 PolarHBondContact O-N 3.09Å; Y95-W102 HydrophobicContact CD2-CD2 4.03Å; Y95-W102 AromaticContact CD2-CE2 3.77Å; Y95-W102 HydrophobicContact CD2-CG 4.27Å; Y95-W102 HydrophobicContact CD2-CZ2 4.23Å; Y95-W102 AromaticContact CD2-NE1 3.83Å; Y95-W102 HydrophobicContact CG-CZ2 4.36Å; Y95-R164 HydrophobicContact CD1-CB 4.28Å; Y95-R164 HydrophobicContact CD1-CG 3.93Å; Y95-R164 HydrophobicContact CD2-CG 3.92Å; Y95-R164 HydrophobicContact CE1-CB 4.17Å; Y95-R164 HydrophobicContact CE1-CG 3.95Å; Y95-R164 HydrophobicContact CE2-CG 3.96Å; Y95-R164 HydrophobicContact CG-CG 3.9Å; Y95-M167 HydrophobicContact CD1-CB 3.89Å
96	N	86.3	Confident	92.7	Very high	46 Å²	46	57.7 Å²	57.7	25%	0.246	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	99	171.3	-174.9	-36.6	0	0	0	109.4	I98 R99 G100 K101 I103	N96-I98 PolarHBondContact O-N 2.82Å; N96-I98 WeakPolarHBondContact OD1-CB 3.24Å; N96-I98 PolarHBondContact OD1-N 3.07Å; N96-R99 HydrophobicContact CB-CB 4.31Å; N96-R99 PolarHBondContact O-N 3.11Å; N96-R99 PolarHBondContact OD1-N 3.39Å; N96-G100 WeakPolarHBondContact O-CA 3.35Å; N96-G100 PolarHBondContact O-N 2.96Å; N96-K101 PolarHBondContact N-O 3.47Å; N96-K101 PolarHBondContact O-N 2.68Å; N96-I103 HydrophobicContact CB-CD1 4.49Å
97	A	85.5	Confident	92.6	Very high	18 Å²	18	53.5 Å²	53.5	15%	0.149	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-21.1	-179.4	0	0	0	0	0	114.2	Y95 M167 L171	Y95-A97 HydrophobicContact CD1-CB 4.2Å; Y95-A97 HydrophobicContact CE1-CB 3.88Å; Y95-A97 PolarHBondContact O-N 3.09Å; A97-M167 HydrophobicContact CB-CB 4.22Å; A97-L171 HydrophobicContact CB-CD1 3.57Å; A97-L171 HydrophobicContact CB-CG 3.91Å
98	I	83.8	Confident	92.5	Very high	67 Å²	67	52.6 Å²	52.6	34%	0.344	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-48.1	176.2	-57	175.6	0	0	0	110.1	R37 K40 N96 L171	R37-I98 WeakPolarHBondContact CD-O 3.31Å; R37-I98 HydrophobicContact CG-CG2 4.43Å; R37-I98 PolarHBondContact NE-O 3.47Å; R37-I98 PolarHBondContact NH1-O 3.09Å; K40-I98 HydrophobicContact CD-CD1 4.06Å; K40-I98 HydrophobicContact CD-CG1 4.46Å; N96-I98 PolarHBondContact O-N 2.82Å; N96-I98 WeakPolarHBondContact OD1-CB 3.24Å; N96-I98 PolarHBondContact OD1-N 3.07Å; I98-L171 HydrophobicContact CG1-CD2 4.03Å
99	R	81.7	Confident	92.5	Very high	136 Å²	136	50.8 Å²	50.8	51%	0.513	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-20.6	-179.6	-64.1	-179.5	79.2	-177.2	3.4	112.5	N96 K101	N96-R99 HydrophobicContact CB-CB 4.31Å; N96-R99 PolarHBondContact O-N 3.11Å; N96-R99 PolarHBondContact OD1-N 3.39Å; R99-K101 VanDerWaalsContact C-N 3.28Å; R99-K101 HydrophobicContact CB-CB 4.32Å; R99-K101 HydrophobicContact CB-CG 4.36Å
100	G	85.9	Confident	92.5	Very high	44 Å²	44	50 Å²	50	45%	0.454	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	67	30.2	-172.1	0	0	0	0	0	112.4	N96	N96-G100 WeakPolarHBondContact O-CA 3.35Å; N96-G100 PolarHBondContact O-N 2.96Å
101	K	91.2	Very high	92.6	Very high	128 Å²	128	50.1 Å²	50.1	56%	0.557	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-124.6	147	-174.3	-69.4	-169.2	176.7	-171.6	0	111.2	N96 R99	N96-K101 PolarHBondContact N-O 3.47Å; N96-K101 PolarHBondContact O-N 2.68Å; R99-K101 VanDerWaalsContact C-N 3.28Å; R99-K101 HydrophobicContact CB-CB 4.32Å; R99-K101 HydrophobicContact CB-CG 4.36Å
102	W	95.8	Very high	92.6	Very high	87 Å²	87	49.4 Å²	49.4	33%	0.33	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	144.1	168.7	-71	95.5	0	0	0	110.4	R94 Y95 F160 V163 R164	R94-W102 CarbonylContact O-C 3.56Å; R94-W102 WeakPolarHBondContact O-CA 3.18Å; Y95-W102 HydrophobicContact CD2-CD2 4.03Å; Y95-W102 AromaticContact CD2-CE2 3.77Å; Y95-W102 HydrophobicContact CD2-CG 4.27Å; Y95-W102 HydrophobicContact CD2-CZ2 4.23Å; Y95-W102 AromaticContact CD2-NE1 3.83Å; Y95-W102 HydrophobicContact CG-CZ2 4.36Å; W102-F160 HydrophobicContact CD2-CD1 4.32Å; W102-F160 HydrophobicContact CE3-CD1 4.21Å; W102-F160 HydrophobicContact CH2-CB 3.91Å; W102-F160 AromaticContact CH2-CD1 3.49Å; W102-F160 HydrophobicContact CH2-CD1 3.49Å; W102-F160 VanDerWaalsContact CH2-CD1 3.49Å; W102-F160 HydrophobicContact CH2-CE1 4.46Å; W102-F160 HydrophobicContact CH2-CG 4.12Å; W102-F160 HydrophobicContact CZ2-CB 3.66Å; W102-F160 AromaticContact CZ2-CD1 3.61Å; W102-F160 HydrophobicContact CZ2-CD1 3.61Å; W102-F160 HydrophobicContact CZ2-CG 4.12Å; W102-F160 WeakPolarHBondContact CZ2-O 3.47Å; W102-F160 AromaticContact CZ3-CD1 3.81Å; W102-F160 HydrophobicContact CZ3-CD1 3.81Å; W102-F160 HydrophobicContact CZ3-CE1 4.38Å; W102-V163 HydrophobicContact CH2-CB 3.87Å; W102-V163 HydrophobicContact CH2-CG1 3.69Å; W102-V163 HydrophobicContact CZ3-CB 4.49Å; W102-V163 HydrophobicContact CZ3-CG1 3.92Å; W102-R164 HydrophobicContact CH2-CG 4.43Å; W102-R164 HydrophobicContact CZ2-CG 3.6Å
103	I	91.8	Very high	92.4	Very high	36 Å²	36	55 Å²	55	19%	0.185	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	135.7	173.5	-63.3	174.9	0	0	0	106	Y93 R94 N96 T642	Y93-I103 CarbonylContact C-O 3.49Å; Y93-I103 WeakPolarHBondContact CA-O 3.25Å; R94-I103 HydrophobicContact CB-CB 4.5Å; R94-I103 PolarHBondContact N-O 3.26Å; R94-I103 PolarHBondContact O-N 2.87Å; N96-I103 HydrophobicContact CB-CD1 4.49Å; I103-T642 HydrophobicContact CD1-CG2 4.03Å; I103-T642 HydrophobicContact CG2-CG2 3.32Å
104	E	94.6	Very high	92.3	Very high	118 Å²	118	57 Å²	57	55%	0.551	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.4	143.1	178.1	59.2	177.2	-132.2	0	0	110.9	K91 R92 Y93	K91-E104 WeakPolarHBondContact CE-OE1 3.48Å; K91-E104 WeakPolarHBondContact CE-OE2 3.25Å; K91-E104 IonicContact NZ-OE1 2.74Å; K91-E104 PolarHBondContact NZ-OE1 2.77Å; K91-E104 IonicContact NZ-OE2 3.33Å; K91-E104 PolarHBondContact NZ-OE2 3.37Å; R92-E104 VanDerWaalsContact O-CA 3.29Å; R92-E104 WeakPolarHBondContact O-CA 3.01Å; Y93-E104 HydrophobicContact CD1-CB 4.05Å; Y93-E104 HydrophobicContact CE1-CB 4.19Å
105	D	92.6	Very high	92.4	Very high	12 Å²	12	56.7 Å²	56.7	6%	0.064	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	162.4	-173.4	73.6	-6.1	0	0	0	109.2	R92 R94 D644	R92-D105 WeakPolarHBondContact CB-OD1 3.4Å; R92-D105 WeakPolarHBondContact CG-OD1 3.42Å; R92-D105 IonicContact CZ-OD1 2.8Å; R92-D105 IonicContact CZ-OD2 2.68Å; R92-D105 VanDerWaalsContact CZ-OD2 3.29Å; R92-D105 PolarHBondContact N-O 3.02Å; R92-D105 IonicContact NE-OD1 2.58Å; R92-D105 PolarHBondContact NE-OD1 3.42Å; R92-D105 IonicContact NE-OD2 2.81Å; R92-D105 PolarHBondContact NE-OD2 3.44Å; R92-D105 IonicContact NH2-OD1 2.63Å; R92-D105 IonicContact NH2-OD2 3.82Å; R92-D105 PolarHBondContact NH2-OD2 3.03Å; R92-D105 PolarHBondContact O-N 2.86Å; R94-D105 IonicContact CZ-OD2 3.26Å; R94-D105 IonicContact NE-OD2 2.85Å; R94-D105 PolarHBondContact NE-OD2 3.44Å; R94-D105 IonicContact NH2-OD2 3.44Å; R94-D105 PolarHBondContact NH2-OD2 2.96Å; D105-D644 WeakPolarHBondContact CA-OD2 3.4Å; D105-D644 HydrophobicContact CB-CB 4.22Å; D105-D644 WeakPolarHBondContact CB-OD2 3.48Å
106	I	94.1	Very high	92.5	Very high	75 Å²	75	58.4 Å²	58.4	39%	0.385	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	127	-176.1	-62.3	-62.3	0	0	0	109.6	T89 K91 D644	T89-I106 HydrophobicContact CG2-CG2 3.49Å; T89-I106 VanDerWaalsContact CG2-CG2 3.49Å; K91-I106 HydrophobicContact CB-CD1 4.05Å; K91-I106 HydrophobicContact CG-CD1 4.2Å; I106-D644 PolarHBondContact N-OD2 3.4Å
107	V	93.3	Very high	92.9	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	151.2	-176.1	-60.8	0	0	0	0	112.2	A90 R92 V109 L194	A90-V107 HydrophobicContact CB-CG2 4.25Å; A90-V107 PolarHBondContact N-O 3.07Å; A90-V107 WeakPolarHBondContact O-CG2 3.49Å; A90-V107 PolarHBondContact O-N 3.49Å; R92-V107 HydrophobicContact CB-CB 4.48Å; R92-V107 HydrophobicContact CB-CG1 3.85Å; R92-V107 HydrophobicContact CB-CG2 3.77Å; R92-V107 HydrophobicContact CG-CG1 4.47Å; V107-V109 HydrophobicContact CG2-CG1 4.18Å; V107-L194 HydrophobicContact CG2-CD2 3.66Å
108	H	93.2	Very high	93.3	Very high	72 Å²	72	69 Å²	69	33%	0.333	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	127.9	173	-64.1	-98.5	0	0	0	109.5	E87 E88 L130 W139	E87-H108 HydrophobicContact CG-CB 4.22Å; E87-H108 IonicContact OE1-CE1 3.19Å; E87-H108 IonicContact OE1-CG 3.73Å; E87-H108 IonicContact OE1-ND1 3.56Å; E87-H108 PolarHBondContact OE1-ND1 3.13Å; E88-H108 WeakPolarHBondContact O-CA 3.44Å; H108-L130 PolarHBondContact O-N 3.08Å; H108-W139 HydrophobicContact CB-CH2 4.26Å; H108-W139 HydrophobicContact CB-CZ2 4.25Å
109	V	95.8	Very high	93.5	Very high	1 Å²	1	68 Å²	68	1%	0.006	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	146.4	-176.8	-64.1	0	0	0	0	110.9	E88 A90 V107 K128 K129 L194 F196	E88-V109 HydrophobicContact CB-CG2 4.39Å; E88-V109 PolarHBondContact N-O 3.14Å; E88-V109 PolarHBondContact O-N 2.82Å; A90-V109 HydrophobicContact CB-CG2 4.3Å; V107-V109 HydrophobicContact CG2-CG1 4.18Å; V109-K128 WeakPolarHBondContact CA-O 3.32Å; V109-K129 HydrophobicContact CG1-CB 4.19Å; V109-K129 HydrophobicContact CG1-CG 4.01Å; V109-L194 HydrophobicContact CG1-CD1 4.08Å; V109-F196 HydrophobicContact CG2-CE1 3.54Å; V109-F196 HydrophobicContact CG2-CZ 3.71Å
110	K	97.2	Very high	93.9	Very high	22 Å²	22	66.6 Å²	66.6	10%	0.096	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	121.5	166.4	-73.7	-172.3	178.8	-148.5	0	107.5	L82 Q83 L85 A127 K128 W139	L82-K110 WeakPolarHBondContact O-CD 3.35Å; Q83-K110 PolarHBondContact O-NZ 2.95Å; L85-K110 HydrophobicContact CB-CB 4.2Å; L85-K110 HydrophobicContact CB-CD 4.47Å; L85-K110 WeakPolarHBondContact O-CD 3.4Å; L85-K110 WeakPolarHBondContact O-CE 3.44Å; L85-K110 PolarHBondContact O-NZ 3.13Å; K110-A127 CarbonylContact O-C 3.56Å; K110-A127 WeakPolarHBondContact O-CA 3.49Å; K110-K128 PolarHBondContact N-O 2.72Å; K110-K128 PolarHBondContact O-N 3.46Å; K110-W139 HydrophobicContact CB-CE3 4.28Å; K110-W139 HydrophobicContact CB-CH2 4.44Å; K110-W139 HydrophobicContact CB-CZ3 3.98Å; K110-W139 HydrophobicContact CD-CD2 3.63Å; K110-W139 HydrophobicContact CD-CE3 3.68Å; K110-W139 HydrophobicContact CD-CG 4.05Å; K110-W139 HydrophobicContact CD-CH2 4.38Å; K110-W139 HydrophobicContact CD-CZ2 4.34Å; K110-W139 HydrophobicContact CD-CZ3 4.06Å; K110-W139 VanDerWaalsContact CE-CD2 3.49Å; K110-W139 VanDerWaalsContact CE-CE2 3.41Å; K110-W139 HydrophobicContact CG-CD2 4.12Å; K110-W139 HydrophobicContact CG-CE3 3.84Å; K110-W139 HydrophobicContact CG-CH2 3.79Å; K110-W139 HydrophobicContact CG-CZ2 4.08Å; K110-W139 HydrophobicContact CG-CZ3 3.66Å
111	I	97.8	Very high	94.2	Very high	3 Å²	3	70 Å²	70	2%	0.015	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	139.5	-171.6	-174	172.3	0	0	0	110.6	F125 R126 A127 A147 F196 R199 Y205	I111-F125 HydrophobicContact CD1-CB 3.94Å; I111-F125 HydrophobicContact CD1-CG 4.38Å; I111-F125 HydrophobicContact CG1-CB 3.87Å; I111-R126 WeakPolarHBondContact CA-O 3.39Å; I111-A127 HydrophobicContact CB-CB 4.16Å; I111-A127 HydrophobicContact CG1-CB 4.15Å; I111-A147 HydrophobicContact CD1-CB 3.49Å; I111-A147 VanDerWaalsContact CD1-CB 3.49Å; I111-A147 HydrophobicContact CG1-CB 4.42Å; I111-F196 HydrophobicContact CD1-CE2 4.43Å; I111-F196 HydrophobicContact CD1-CZ 4.03Å; I111-F196 HydrophobicContact CG2-CE1 3.94Å; I111-F196 HydrophobicContact CG2-CZ 3.85Å; I111-R199 VanDerWaalsContact CG2-NH2 3.29Å; I111-Y205 HydrophobicContact CD1-CD1 4.35Å; I111-Y205 HydrophobicContact CD1-CE1 4.29Å
112	E	97.4	Very high	94.5	Very high	30 Å²	30	65.5 Å²	65.5	14%	0.14	35%	0.347	C	S	.	.			trans	-66	143.8	172.9	-74.9	-177.2	149.8	0	0	111.4	L82 L85 F125 R126	L82-E112 HydrophobicContact CD2-CG 3.66Å; L85-E112 HydrophobicContact CD1-CG 4.03Å; E112-F125 WeakPolarHBondContact O-CD1 3.36Å; E112-R126 HydrophobicContact CG-CB 4.2Å; E112-R126 PolarHBondContact N-O 3Å; E112-R126 IonicContact OE1-NH1 2.65Å; E112-R126 PolarHBondContact OE1-NH1 3.49Å; E112-R126 WeakPolarHBondContact OE2-CB 3.4Å; E112-R126 WeakPolarHBondContact OE2-CG 3.43Å; E112-R126 IonicContact OE2-CZ 3.57Å; E112-R126 IonicContact OE2-NH1 3.28Å; E112-R126 PolarHBondContact OE2-NH1 2.88Å
113	N	94.7	Very high	94.6	Very high	135 Å²	135	62.8 Å²	62.8	72%	0.722	34%	0.338	S	S	*	.	S	Bend	trans	-73.1	-28.1	176.8	-72.7	-32.3	0	0	0	113.2
114	S	96.4	Very high	94.8	Very high	75 Å²	75	62 Å²	62	52%	0.524	34%	0.335	S	S	.	.	S	Bend	trans	-107.2	138.4	-178.7	52.8	0	0	0	0	111.1
115	P	97.4	Very high	95	Very high	54 Å²	54	56.5 Å²	56.5	35%	0.351	31%	0.31	S	S	.	.			trans	-67.7	141.1	174.8	31	-36.1	0	0	0	110	E123 C124 F125	P115-E123 HydrophobicContact CB-CB 3.94Å; P115-E123 HydrophobicContact CB-CG 4.39Å; P115-E123 HydrophobicContact CG-CB 4.47Å; P115-E123 WeakPolarHBondContact CG-OE2 3.12Å; P115-C124 CarbonylContact C-O 3.59Å; P115-C124 WeakPolarHBondContact CA-O 3.44Å; P115-C124 WeakPolarHBondContact CB-O 3.34Å; P115-F125 HydrophobicContact CB-CD1 4.23Å; P115-F125 HydrophobicContact CB-CE1 3.87Å; P115-F125 HydrophobicContact CB-CE2 4.28Å; P115-F125 HydrophobicContact CB-CZ 3.87Å; P115-F125 HydrophobicContact CG-CE1 4.27Å; P115-F125 HydrophobicContact CG-CZ 4.32Å; P115-F125 VanDerWaalsContact N-CE1 3.31Å
116	F	96.1	Very high	95.3	Very high	67 Å²	67	57.7 Å²	57.7	29%	0.294	31%	0.313	S	S	.	.	S	Bend	trans	-94.2	-18.4	176.8	78	-86.8	0	0	0	113.2	W77 C124 R126 V146	W77-F116 HydrophobicContact CZ2-CZ 4.3Å; F116-C124 HydrophobicContact CD1-CB 4.28Å; F116-C124 WeakPolarHBondContact CD1-O 3.07Å; F116-C124 HydrophobicContact CE1-CB 3.74Å; F116-C124 HydrophobicContact CZ-CB 4.11Å; F116-C124 PolarHBondContact N-O 3.4Å; F116-R126 HydrophobicContact CB-CG 4.39Å; F116-R126 HydrophobicContact CD1-CB 4.49Å; F116-R126 HydrophobicContact CD1-CG 3.51Å; F116-R126 HydrophobicContact CE1-CG 3.87Å; F116-R126 HydrophobicContact CG-CG 3.95Å; F116-V146 HydrophobicContact CE1-CG1 4.32Å; F116-V146 HydrophobicContact CZ-CG2 4.37Å
117	N	94.7	Very high	95.5	Very high	102 Å²	102	54.2 Å²	54.2	55%	0.545	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	165.7	178	-153.5	-14	0	0	0	109.7	C124	N117-C124 HydrophobicContact CB-CB 4.43Å; N117-C124 PolarHBondContact O-N 3.39Å
118	R	93.6	Very high	95.6	Very high	185 Å²	185	54.3 Å²	54.3	70%	0.698	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.4	140.4	172.9	65.4	-178	-176.1	-175.8	1.2	111.1	R122 E123	R118-R122 CarbonylContact C-O 3.43Å; R118-R122 WeakPolarHBondContact CA-O 3.08Å; R118-E123 HydrophobicContact CB-CB 3.97Å
119	G	88.8	Confident	95.6	Very high	46 Å²	46	51.3 Å²	51.3	47%	0.474	28%	0.282	S	S	.	.			trans	-86.3	-163.5	165.7	0	0	0	0	0	111.5	M121 R122	G119-M121 VanDerWaalsContact C-N 3.35Å; G119-R122 PolarHBondContact N-O 3.26Å
120	A	89.1	Confident	95.1	Very high	106 Å²	106	52.3 Å²	52.3	88%	0.876	29%	0.287	S	S	*	.	S	Bend	trans	-68.5	-32.1	178.4	0	0	0	0	0	113.3
121	M	93.3	Very high	94.2	Very high	115 Å²	115	53.7 Å²	53.7	57%	0.567	30%	0.3	S	S	*	.	S	Bend	trans	-120.7	-23.6	-173.3	-59.3	-174.3	-63	0	0	114	G119 Y150 I151	G119-M121 VanDerWaalsContact C-N 3.35Å; M121-Y150 HydrophobicContact CB-CD1 4.39Å; M121-Y150 HydrophobicContact CB-CE1 4.31Å; M121-Y150 WeakPolarHBondContact O-CA 3.36Å; M121-I151 PolarHBondContact O-N 3.17Å
122	R	96.4	Very high	92.9	Very high	34 Å²	34	55.5 Å²	55.5	13%	0.128	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	142.4	-169.9	-70.2	173.1	-75	161.8	1.7	110.6	R118 G119 K148 R149 Y150 D262	R118-R122 CarbonylContact C-O 3.43Å; R118-R122 WeakPolarHBondContact CA-O 3.08Å; G119-R122 PolarHBondContact N-O 3.26Å; R122-K148 HydrophobicContact CB-CB 4.43Å; R122-R149 CarbonylContact C-O 3.5Å; R122-R149 WeakPolarHBondContact CA-O 3.32Å; R122-R149 WeakPolarHBondContact CB-O 3.48Å; R122-Y150 HydrophobicContact CG-CD1 3.91Å; R122-Y150 HydrophobicContact CG-CD2 4.39Å; R122-Y150 HydrophobicContact CG-CE1 4.09Å; R122-Y150 HydrophobicContact CG-CG 4.08Å; R122-D262 IonicContact CZ-OD1 3.6Å; R122-D262 VanDerWaalsContact CZ-OD1 3.26Å; R122-D262 IonicContact NH1-OD1 3.84Å; R122-D262 PolarHBondContact NH1-OD1 3.17Å; R122-D262 IonicContact NH2-OD1 2.77Å; R122-D262 PolarHBondContact NH2-OD1 3.12Å; R122-D262 IonicContact NH2-OD2 3.62Å; R122-D262 PolarHBondContact NH2-OD2 3.47Å
123	E	97.4	Very high	91.4	Very high	31 Å²	31	59.1 Å²	59.1	15%	0.145	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	148.5	171.3	56.8	-179.5	-176.3	0	0	110.9	P115 R118 F125 K148 R149 I151	P115-E123 HydrophobicContact CB-CB 3.94Å; P115-E123 HydrophobicContact CB-CG 4.39Å; P115-E123 HydrophobicContact CG-CB 4.47Å; P115-E123 WeakPolarHBondContact CG-OE2 3.12Å; R118-E123 HydrophobicContact CB-CB 3.97Å; E123-F125 HydrophobicContact CG-CE2 3.82Å; E123-F125 HydrophobicContact CG-CZ 4.04Å; E123-K148 WeakPolarHBondContact O-CA 3.43Å; E123-R149 HydrophobicContact CG-CG 3.86Å; E123-R149 PolarHBondContact N-O 2.74Å; E123-R149 PolarHBondContact O-N 2.72Å; E123-R149 IonicContact OE1-CZ 3.81Å; E123-R149 IonicContact OE1-NE 3.15Å; E123-R149 PolarHBondContact OE1-NE 3.38Å; E123-R149 IonicContact OE1-NH2 2.8Å; E123-R149 PolarHBondContact OE1-NH2 3.04Å; E123-I151 HydrophobicContact CB-CG1 4.33Å; E123-I151 HydrophobicContact CG-CG1 4.46Å
124	C	97.7	Very high	89.8	Confident	19 Å²	19	54.6 Å²	54.6	13%	0.128	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.7	-168.5	-59.6	0	0	0	0	110.9	P115 F116 N117 V146 A147	P115-C124 CarbonylContact C-O 3.59Å; P115-C124 WeakPolarHBondContact CA-O 3.44Å; P115-C124 WeakPolarHBondContact CB-O 3.34Å; F116-C124 HydrophobicContact CD1-CB 4.28Å; F116-C124 WeakPolarHBondContact CD1-O 3.07Å; F116-C124 HydrophobicContact CE1-CB 3.74Å; F116-C124 HydrophobicContact CZ-CB 4.11Å; F116-C124 PolarHBondContact N-O 3.4Å; N117-C124 HydrophobicContact CB-CB 4.43Å; N117-C124 PolarHBondContact O-N 3.39Å; C124-V146 HydrophobicContact CB-CG1 3.83Å; C124-A147 CarbonylContact C-O 3.59Å; C124-A147 WeakPolarHBondContact CA-O 3.41Å
125	F	98.3	Very high	88.2	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.009	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	143.5	179.1	-56.7	-98.8	0	0	0	109	I111 E112 P115 E123 A147 R149 Y205	I111-F125 HydrophobicContact CD1-CB 3.94Å; I111-F125 HydrophobicContact CD1-CG 4.38Å; I111-F125 HydrophobicContact CG1-CB 3.87Å; E112-F125 WeakPolarHBondContact O-CD1 3.36Å; P115-F125 HydrophobicContact CB-CD1 4.23Å; P115-F125 HydrophobicContact CB-CE1 3.87Å; P115-F125 HydrophobicContact CB-CE2 4.28Å; P115-F125 HydrophobicContact CB-CZ 3.87Å; P115-F125 HydrophobicContact CG-CE1 4.27Å; P115-F125 HydrophobicContact CG-CZ 4.32Å; P115-F125 VanDerWaalsContact N-CE1 3.31Å; E123-F125 HydrophobicContact CG-CE2 3.82Å; E123-F125 HydrophobicContact CG-CZ 4.04Å; F125-A147 HydrophobicContact CB-CB 4.31Å; F125-A147 PolarHBondContact N-O 3.37Å; F125-A147 PolarHBondContact O-N 3.48Å; F125-R149 HydrophobicContact CE2-CG 3.97Å; F125-Y205 HydrophobicContact CD2-CD1 4.16Å; F125-Y205 AromaticContact CD2-CE1 3.74Å; F125-Y205 HydrophobicContact CD2-CE1 3.74Å; F125-Y205 HydrophobicContact CE2-CD1 4.37Å; F125-Y205 AromaticContact CE2-CE1 3.69Å; F125-Y205 HydrophobicContact CE2-CE1 3.69Å; F125-Y205 HydrophobicContact CG-CE1 4.45Å; F125-Y205 HydrophobicContact CZ-CE1 4.32Å
126	R	98.1	Very high	86.8	Confident	38 Å²	38	58 Å²	58	14%	0.143	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	135.2	169.7	-58.8	-174.5	-173.2	87.4	0.3	108.4	W77 F80 L82 I111 E112 F116	W77-R126 HydrophobicContact CD2-CG 4.26Å; W77-R126 HydrophobicContact CE3-CB 4Å; W77-R126 HydrophobicContact CE3-CG 4.19Å; W77-R126 HydrophobicContact CH2-CB 4.03Å; W77-R126 HydrophobicContact CH2-CG 3.9Å; W77-R126 HydrophobicContact CZ2-CG 3.97Å; W77-R126 HydrophobicContact CZ3-CB 3.73Å; W77-R126 HydrophobicContact CZ3-CG 4.01Å; F80-R126 VanDerWaalsContact CE2-NE 3.35Å; F80-R126 VanDerWaalsContact CZ-CZ 3.42Å; L82-R126 HydrophobicContact CD1-CB 3.87Å; L82-R126 HydrophobicContact CD2-CB 4.01Å; I111-R126 WeakPolarHBondContact CA-O 3.39Å; E112-R126 HydrophobicContact CG-CB 4.2Å; E112-R126 PolarHBondContact N-O 3Å; E112-R126 IonicContact OE1-NH1 2.65Å; E112-R126 PolarHBondContact OE1-NH1 3.49Å; E112-R126 WeakPolarHBondContact OE2-CB 3.4Å; E112-R126 WeakPolarHBondContact OE2-CG 3.43Å; E112-R126 IonicContact OE2-CZ 3.57Å; E112-R126 IonicContact OE2-NH1 3.28Å; E112-R126 PolarHBondContact OE2-NH1 2.88Å; F116-R126 HydrophobicContact CB-CG 4.39Å; F116-R126 HydrophobicContact CD1-CB 4.49Å; F116-R126 HydrophobicContact CD1-CG 3.51Å; F116-R126 HydrophobicContact CE1-CG 3.87Å; F116-R126 HydrophobicContact CG-CG 3.95Å
127	A	97.8	Very high	86	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.008	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	151.6	174.4	0	0	0	0	0	110.8	K110 I111 H145 A147 L207	K110-A127 CarbonylContact O-C 3.56Å; K110-A127 WeakPolarHBondContact O-CA 3.49Å; I111-A127 HydrophobicContact CB-CB 4.16Å; I111-A127 HydrophobicContact CG1-CB 4.15Å; A127-H145 HydrophobicContact CB-CB 4.33Å; A127-H145 PolarHBondContact N-O 2.85Å; A127-H145 PolarHBondContact O-N 3.06Å; A127-A147 HydrophobicContact CB-CB 4.41Å; A127-L207 HydrophobicContact CB-CD1 4.33Å
128	K	96	Very high	85.6	Confident	2 Å²	2	57 Å²	57	1%	0.009	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	141.5	157.9	-74.9	-169	175.3	-116.8	0	108.3	D75 L82 V109 K110 W139 S140 A142 N144	D75-K128 WeakPolarHBondContact OD2-CE 3.37Å; D75-K128 IonicContact OD2-NZ 3.07Å; D75-K128 PolarHBondContact OD2-NZ 3.02Å; L82-K128 HydrophobicContact CB-CD 4.04Å; L82-K128 HydrophobicContact CB-CG 3.98Å; L82-K128 HydrophobicContact CD1-CG 4.15Å; V109-K128 WeakPolarHBondContact CA-O 3.32Å; K110-K128 PolarHBondContact N-O 2.72Å; K110-K128 PolarHBondContact O-N 3.46Å; K128-W139 HydrophobicContact CB-CE3 4.09Å; K128-W139 HydrophobicContact CB-CZ3 4.14Å; K128-W139 VanDerWaalsContact CD-O 3.25Å; K128-W139 WeakPolarHBondContact CD-O 3.32Å; K128-S140 PolarHBondContact NZ-O 3.17Å; K128-A142 HydrophobicContact CB-CB 4.28Å; K128-A142 HydrophobicContact CD-CB 4.26Å; K128-A142 PolarHBondContact NZ-O 3.01Å; K128-N144 VanDerWaalsContact CE-OD1 3.32Å; K128-N144 WeakPolarHBondContact CE-OD1 3.4Å
129	K	93	Very high	85.5	Confident	9 Å²	9	49 Å²	49	4%	0.039	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	128.1	172.2	-175.8	-166.8	171.2	-73	0	107.4	V109 N132 S143 L207 E643	V109-K129 HydrophobicContact CG1-CB 4.19Å; V109-K129 HydrophobicContact CG1-CG 4.01Å; K129-N132 PolarHBondContact NZ-OD1 2.85Å; K129-S143 PolarHBondContact N-O 3.32Å; K129-L207 HydrophobicContact CD-CD2 3.83Å; K129-E643 IonicContact NZ-OE2 3.53Å
130	L	85.1	Confident	85.4	Confident	22 Å²	22	50.1 Å²	50.1	12%	0.115	29%	0.289	C	S	.	.			trans	-66.4	146.1	170.9	-78.3	173.4	0	0	0	110.3	H108 N132 W139 A142	H108-L130 PolarHBondContact O-N 3.08Å; L130-N132 PolarHBondContact O-N 2.75Å; L130-W139 HydrophobicContact CB-CH2 4.32Å; L130-W139 HydrophobicContact CD1-CD2 4.04Å; L130-W139 HydrophobicContact CD1-CH2 3.85Å; L130-W139 HydrophobicContact CD1-CZ2 3.27Å; L130-W139 HydrophobicContact CD1-CZ3 4.43Å; L130-W139 HydrophobicContact CD2-CD2 4.03Å; L130-W139 HydrophobicContact CD2-CE3 4.2Å; L130-W139 HydrophobicContact CD2-CG 4.42Å; L130-W139 HydrophobicContact CG-CD2 3.82Å; L130-W139 HydrophobicContact CG-CE3 3.87Å; L130-W139 HydrophobicContact CG-CH2 3.62Å; L130-W139 HydrophobicContact CG-CZ2 3.55Å; L130-W139 HydrophobicContact CG-CZ3 3.77Å; L130-A142 HydrophobicContact CD2-CB 3.97Å
131	S	78	Confident	85.2	Confident	52 Å²	52	52.6 Å²	52.6	36%	0.364	28%	0.282	S	S	.	.			trans	-67	130.4	166.4	175.7	0	0	0	0	108.2	F133 S134	S131-F133 PolarHBondContact O-N 2.86Å; S131-F133 VanDerWaalsContact O-N 3.17Å; S131-F133 PolarHBondContact OG-N 2.93Å; S131-S134 WeakPolarHBondContact O-CB 3.41Å; S131-S134 PolarHBondContact O-N 2.94Å
132	N	70.5	Confident	85	Confident	40 Å²	40	47.5 Å²	47.5	21%	0.214	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-14.5	176.7	-60.8	19.4	0	0	0	111	R92 K129 L130 E643 D644	R92-N132 PolarHBondContact NH2-ND2 3Å; R92-N132 VanDerWaalsContact NH2-ND2 3.13Å; K129-N132 PolarHBondContact NZ-OD1 2.85Å; L130-N132 PolarHBondContact O-N 2.75Å; N132-E643 HydrophobicContact CB-CB 3.64Å; N132-E643 HydrophobicContact CB-CG 3.93Å; N132-E643 PolarHBondContact ND2-O 3.47Å; N132-D644 WeakPolarHBondContact CB-OD1 3.41Å; N132-D644 VanDerWaalsContact CG-OD1 3.25Å; N132-D644 VanDerWaalsContact ND2-CG 3.3Å; N132-D644 PolarHBondContact ND2-OD1 2.97Å; N132-D644 PolarHBondContact ND2-OD2 3.36Å
133	F	66.1	Low	84.7	Confident	106 Å²	106	48.8 Å²	48.8	47%	0.465	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-3.5	173.2	-55.6	-68.9	0	0	0	113.9	S131 E643	S131-F133 PolarHBondContact O-N 2.86Å; S131-F133 VanDerWaalsContact O-N 3.17Å; S131-F133 PolarHBondContact OG-N 2.93Å; F133-E643 HydrophobicContact CD1-CG 4.42Å; F133-E643 HydrophobicContact CD2-CG 3.68Å; F133-E643 WeakPolarHBondContact CD2-OE1 3.43Å; F133-E643 HydrophobicContact CE1-CG 3.89Å; F133-E643 HydrophobicContact CE2-CB 4.49Å; F133-E643 HydrophobicContact CE2-CG 3.08Å; F133-E643 WeakPolarHBondContact CE2-OE1 3.44Å; F133-E643 HydrophobicContact CG-CG 4.34Å; F133-E643 HydrophobicContact CZ-CB 4.32Å; F133-E643 HydrophobicContact CZ-CG 3.19Å
134	S	62.3	Low	84.5	Confident	41 Å²	41	48.5 Å²	48.5	29%	0.287	27%	0.272	S	S	.	.			trans	-94.5	115	-179.2	-171	0	0	0	0	110	S131 C136	S131-S134 WeakPolarHBondContact O-CB 3.41Å; S131-S134 PolarHBondContact O-N 2.94Å; S134-C136 VanDerWaalsContact C-N 3.29Å; S134-C136 PolarHBondContact OG-O 3.33Å; S134-C136 PolarHBondContact OG-SG 3.02Å
135	H	62.6	Low	84.5	Confident	128 Å²	128	48.2 Å²	48.2	59%	0.593	27%	0.268	S	S	*	.			trans	-79.8	-14	174.3	-64.7	-90.4	0	0	0	112.8	V655	H135-V655 WeakPolarHBondContact CD2-CG1 3.42Å; H135-V655 WeakPolarHBondContact CD2-CG2 3.41Å; H135-V655 WeakPolarHBondContact NE2-CG1 3.39Å; H135-V655 WeakPolarHBondContact NE2-CG2 3.37Å
136	C	67.1	Low	84.5	Confident	72 Å²	72	48.7 Å²	48.7	49%	0.486	27%	0.272	S	S	.	.	S	Bend	trans	-88	131.5	169	56.6	0	0	0	0	109.5	S134 D138	S134-C136 VanDerWaalsContact C-N 3.29Å; S134-C136 PolarHBondContact OG-O 3.33Å; S134-C136 PolarHBondContact OG-SG 3.02Å; C136-D138 HydrophobicContact CB-CB 4.24Å; C136-D138 PolarHBondContact O-N 2.86Å
137	S	80.9	Confident	84.5	Confident	90 Å²	90	46.9 Å²	46.9	63%	0.629	27%	0.265	S	S	*	.			trans	-72.1	47.1	165.9	-52.2	0	0	0	0	110.9	W139	S137-W139 VanDerWaalsContact C-N 3.25Å; S137-W139 VanDerWaalsContact O-CD1 3.27Å; S137-W139 PolarHBondContact O-N 3.41Å
138	D	85.6	Confident	84.5	Confident	58 Å²	58	47.5 Å²	47.5	31%	0.31	27%	0.267	S	S	.	.			trans	-79.8	78.1	179.6	-173.4	-0.2	0	0	0	109.9	C136 S140 H141 A142	C136-D138 HydrophobicContact CB-CB 4.24Å; C136-D138 PolarHBondContact O-N 2.86Å; D138-S140 PolarHBondContact O-N 3.38Å; D138-S140 WeakPolarHBondContact OD1-CB 3.37Å; D138-S140 PolarHBondContact OD1-N 2.93Å; D138-H141 VanDerWaalsContact CG-ND1 3.3Å; D138-H141 PolarHBondContact O-N 2.88Å; D138-H141 IonicContact OD1-CG 3.45Å; D138-H141 PolarHBondContact OD1-N 3.19Å; D138-H141 IonicContact OD1-ND1 2.72Å; D138-H141 PolarHBondContact OD1-ND1 3.34Å; D138-H141 IonicContact OD2-CE1 3.47Å; D138-H141 IonicContact OD2-CG 2.9Å; D138-H141 IonicContact OD2-ND1 2.97Å; D138-H141 PolarHBondContact OD2-ND1 2.9Å; D138-A142 PolarHBondContact O-N 3.37Å
139	W	90.8	Very high	84.5	Confident	18 Å²	18	51.3 Å²	51.3	7%	0.068	28%	0.282	C	S	.	.			trans	-66.3	-21.7	177.8	-73.1	104.6	0	0	0	113.2	Q83 E87 H108 K110 K128 L130 S137 A142	Q83-W139 HydrophobicContact CB-CB 3.71Å; E87-W139 HydrophobicContact CB-CZ2 4.37Å; E87-W139 HydrophobicContact CG-CH2 4.41Å; E87-W139 HydrophobicContact CG-CZ2 3.73Å; E87-W139 WeakPolarHBondContact OE2-CZ2 3.27Å; E87-W139 PolarHBondContact OE2-NE1 3.04Å; H108-W139 HydrophobicContact CB-CH2 4.26Å; H108-W139 HydrophobicContact CB-CZ2 4.25Å; K110-W139 HydrophobicContact CB-CE3 4.28Å; K110-W139 HydrophobicContact CB-CH2 4.44Å; K110-W139 HydrophobicContact CB-CZ3 3.98Å; K110-W139 HydrophobicContact CD-CD2 3.63Å; K110-W139 HydrophobicContact CD-CE3 3.68Å; K110-W139 HydrophobicContact CD-CG 4.05Å; K110-W139 HydrophobicContact CD-CH2 4.38Å; K110-W139 HydrophobicContact CD-CZ2 4.34Å; K110-W139 HydrophobicContact CD-CZ3 4.06Å; K110-W139 VanDerWaalsContact CE-CD2 3.49Å; K110-W139 VanDerWaalsContact CE-CE2 3.41Å; K110-W139 HydrophobicContact CG-CD2 4.12Å; K110-W139 HydrophobicContact CG-CE3 3.84Å; K110-W139 HydrophobicContact CG-CH2 3.79Å; K110-W139 HydrophobicContact CG-CZ2 4.08Å; K110-W139 HydrophobicContact CG-CZ3 3.66Å; K128-W139 HydrophobicContact CB-CE3 4.09Å; K128-W139 HydrophobicContact CB-CZ3 4.14Å; K128-W139 VanDerWaalsContact CD-O 3.25Å; K128-W139 WeakPolarHBondContact CD-O 3.32Å; L130-W139 HydrophobicContact CB-CH2 4.32Å; L130-W139 HydrophobicContact CD1-CD2 4.04Å; L130-W139 HydrophobicContact CD1-CH2 3.85Å; L130-W139 HydrophobicContact CD1-CZ2 3.27Å; L130-W139 HydrophobicContact CD1-CZ3 4.43Å; L130-W139 HydrophobicContact CD2-CD2 4.03Å; L130-W139 HydrophobicContact CD2-CE3 4.2Å; L130-W139 HydrophobicContact CD2-CG 4.42Å; L130-W139 HydrophobicContact CG-CD2 3.82Å; L130-W139 HydrophobicContact CG-CE3 3.87Å; L130-W139 HydrophobicContact CG-CH2 3.62Å; L130-W139 HydrophobicContact CG-CZ2 3.55Å; L130-W139 HydrophobicContact CG-CZ3 3.77Å; S137-W139 VanDerWaalsContact C-N 3.25Å; S137-W139 VanDerWaalsContact O-CD1 3.27Å; S137-W139 PolarHBondContact O-N 3.41Å; W139-A142 HydrophobicContact CE3-CB 4.14Å; W139-A142 PolarHBondContact O-N 3.28Å
140	S	87	Confident	84.8	Confident	69 Å²	69	52.3 Å²	52.3	48%	0.483	29%	0.286	S	S	.	.	S	Bend	trans	-64.6	-45	177.9	-57.6	0	0	0	0	110.3	K128 D138	K128-S140 PolarHBondContact NZ-O 3.17Å; D138-S140 PolarHBondContact O-N 3.38Å; D138-S140 WeakPolarHBondContact OD1-CB 3.37Å; D138-S140 PolarHBondContact OD1-N 2.93Å
141	H	84.7	Confident	85.3	Confident	157 Å²	157	55.1 Å²	55.1	73%	0.727	30%	0.3	S	S	*	.	S	Bend	trans	-94.2	4.8	178.8	-57.3	99.1	0	0	0	114.3	D138	D138-H141 VanDerWaalsContact CG-ND1 3.3Å; D138-H141 PolarHBondContact O-N 2.88Å; D138-H141 IonicContact OD1-CG 3.45Å; D138-H141 PolarHBondContact OD1-N 3.19Å; D138-H141 IonicContact OD1-ND1 2.72Å; D138-H141 PolarHBondContact OD1-ND1 3.34Å; D138-H141 IonicContact OD2-CE1 3.47Å; D138-H141 IonicContact OD2-CG 2.9Å; D138-H141 IonicContact OD2-ND1 2.97Å; D138-H141 PolarHBondContact OD2-ND1 2.9Å
142	A	88.8	Confident	86.2	Confident	9 Å²	9	60.2 Å²	60.2	7%	0.074	32%	0.318	C	S	.	.	S	Bend	trans	-64.9	143.7	176.9	0	0	0	0	0	111.9	K128 L130 D138 W139	K128-A142 HydrophobicContact CB-CB 4.28Å; K128-A142 HydrophobicContact CD-CB 4.26Å; K128-A142 PolarHBondContact NZ-O 3.01Å; L130-A142 HydrophobicContact CD2-CB 3.97Å; D138-A142 PolarHBondContact O-N 3.37Å; W139-A142 HydrophobicContact CE3-CB 4.14Å; W139-A142 PolarHBondContact O-N 3.28Å
143	S	89.8	Confident	87.3	Confident	61 Å²	61	67.8 Å²	67.8	43%	0.427	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	134.4	-175.6	-62.6	0	0	0	0	112.6	K129 H145	K129-S143 PolarHBondContact N-O 3.32Å; S143-H145 PolarHBondContact O-ND1 2.86Å
144	N	94.6	Very high	88.7	Confident	24 Å²	24	64.9 Å²	64.9	13%	0.128	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	131.5	173.6	-70.3	-28.6	0	0	0	111.5	D75 W77 K128 F210	D75-N144 PolarHBondContact OD1-ND2 2.97Å; W77-N144 HydrophobicContact CD2-CB 4.28Å; W77-N144 HydrophobicContact CE3-CB 3.61Å; W77-N144 HydrophobicContact CZ3-CB 3.82Å; K128-N144 VanDerWaalsContact CE-OD1 3.32Å; K128-N144 WeakPolarHBondContact CE-OD1 3.4Å; N144-F210 HydrophobicContact CB-CB 3.85Å; N144-F210 HydrophobicContact CB-CD1 4.44Å; N144-F210 HydrophobicContact CB-CG 4.5Å; N144-F210 PolarHBondContact O-N 3.03Å
145	H	97.1	Very high	90.3	Very high	13 Å²	13	69.2 Å²	69.2	6%	0.06	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	150	-179.7	-72.1	75.3	0	0	0	111	W77 A127 S143 L207 E208 H209	W77-H145 WeakPolarHBondContact CH2-O 3.24Å; W77-H145 WeakPolarHBondContact CZ3-O 3.48Å; A127-H145 HydrophobicContact CB-CB 4.33Å; A127-H145 PolarHBondContact N-O 2.85Å; A127-H145 PolarHBondContact O-N 3.06Å; S143-H145 PolarHBondContact O-ND1 2.86Å; H145-L207 HydrophobicContact CB-CD1 3.6Å; H145-L207 HydrophobicContact CB-CG 4.1Å; H145-E208 CarbonylContact C-O 3.55Å; H145-E208 WeakPolarHBondContact CA-O 3.43Å; H145-E208 WeakPolarHBondContact CB-O 3.45Å; H145-E208 PolarHBondContact CD2-O 3.03Å; H145-H209 AromaticContact CE1-CD2 3.93Å; H145-H209 AromaticContact CE1-NE2 3.76Å; H145-H209 AromaticContact NE2-CD2 3.83Å; H145-H209 AromaticContact NE2-CE1 3.62Å; H145-H209 AromaticContact NE2-ND1 3.92Å; H145-H209 AromaticContact NE2-NE2 3.57Å
146	V	97.5	Very high	92	Very high	13 Å²	13	68.3 Å²	68.3	8%	0.079	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	118.5	168.9	-179.9	0	0	0	0	107.5	W77 F116 C124 K148 E208 F210	W77-V146 HydrophobicContact CH2-CG2 3.84Å; W77-V146 HydrophobicContact CZ2-CG2 4.3Å; F116-V146 HydrophobicContact CE1-CG1 4.32Å; F116-V146 HydrophobicContact CZ-CG2 4.37Å; C124-V146 HydrophobicContact CB-CG1 3.83Å; V146-K148 HydrophobicContact CG1-CG 3.96Å; V146-E208 HydrophobicContact CB-CG 4.33Å; V146-E208 PolarHBondContact N-O 3.43Å; V146-E208 PolarHBondContact O-N 3.38Å; V146-E208 VanDerWaalsContact O-N 3.12Å; V146-F210 HydrophobicContact CG2-CB 4.29Å; V146-F210 HydrophobicContact CG2-CD2 4.06Å
147	A	98.2	Very high	93.3	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	135.3	168.1	0	0	0	0	0	109.1	I111 C124 F125 A127 Y205 H206 L207	I111-A147 HydrophobicContact CD1-CB 3.49Å; I111-A147 VanDerWaalsContact CD1-CB 3.49Å; I111-A147 HydrophobicContact CG1-CB 4.42Å; C124-A147 CarbonylContact C-O 3.59Å; C124-A147 WeakPolarHBondContact CA-O 3.41Å; F125-A147 HydrophobicContact CB-CB 4.31Å; F125-A147 PolarHBondContact N-O 3.37Å; F125-A147 PolarHBondContact O-N 3.48Å; A127-A147 HydrophobicContact CB-CB 4.41Å; A147-Y205 HydrophobicContact CB-CD1 4.07Å; A147-H206 CarbonylContact C-O 3.41Å; A147-H206 WeakPolarHBondContact CA-O 3.29Å; A147-L207 HydrophobicContact CB-CD1 4.11Å
148	K	98.1	Very high	94.1	Very high	14 Å²	14	66.8 Å²	66.8	6%	0.061	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	139.7	-179.7	-54.2	-179.2	-176.5	161.8	0	111.1	R122 E123 V146 Y205 H206 E208 D262	R122-K148 HydrophobicContact CB-CB 4.43Å; E123-K148 WeakPolarHBondContact O-CA 3.43Å; V146-K148 HydrophobicContact CG1-CG 3.96Å; K148-Y205 CarbonylContact O-C 3.6Å; K148-Y205 WeakPolarHBondContact O-CA 3.48Å; K148-H206 HydrophobicContact CB-CB 4.28Å; K148-H206 PolarHBondContact N-O 2.97Å; K148-H206 PolarHBondContact O-N 3.41Å; K148-E208 WeakPolarHBondContact CE-OE1 3.49Å; K148-E208 IonicContact NZ-OE1 2.92Å; K148-E208 PolarHBondContact NZ-OE1 3.42Å; K148-D262 IonicContact NZ-OD1 3.26Å; K148-D262 IonicContact NZ-OD2 2.93Å; K148-D262 PolarHBondContact NZ-OD2 3.19Å
149	R	97.3	Very high	94.6	Very high	81 Å²	81	65 Å²	65	31%	0.306	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	154.9	168.7	80.9	-173.9	176.7	-159.9	-2.2	110.9	R122 E123 F125 Y205	R122-R149 CarbonylContact C-O 3.5Å; R122-R149 WeakPolarHBondContact CA-O 3.32Å; R122-R149 WeakPolarHBondContact CB-O 3.48Å; E123-R149 HydrophobicContact CG-CG 3.86Å; E123-R149 PolarHBondContact N-O 2.74Å; E123-R149 PolarHBondContact O-N 2.72Å; E123-R149 IonicContact OE1-CZ 3.81Å; E123-R149 IonicContact OE1-NE 3.15Å; E123-R149 PolarHBondContact OE1-NE 3.38Å; E123-R149 IonicContact OE1-NH2 2.8Å; E123-R149 PolarHBondContact OE1-NH2 3.04Å; F125-R149 HydrophobicContact CE2-CG 3.97Å; R149-Y205 HydrophobicContact CB-CD1 3.86Å; R149-Y205 HydrophobicContact CB-CE1 3.9Å; R149-Y205 HydrophobicContact CB-CG 4.41Å; R149-Y205 HydrophobicContact CG-CE1 4.13Å; R149-Y205 PolarHBondContact NH1-OH 3.39Å
150	Y	97.9	Very high	95	Very high	31 Å²	31	66.2 Å²	66.2	12%	0.122	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	138.5	174.1	-79.3	-85.1	0	0	0	111.4	M121 R122 E152 V154 V158 Y159 D162 H206	M121-Y150 HydrophobicContact CB-CD1 4.39Å; M121-Y150 HydrophobicContact CB-CE1 4.31Å; M121-Y150 WeakPolarHBondContact O-CA 3.36Å; R122-Y150 HydrophobicContact CG-CD1 3.91Å; R122-Y150 HydrophobicContact CG-CD2 4.39Å; R122-Y150 HydrophobicContact CG-CE1 4.09Å; R122-Y150 HydrophobicContact CG-CG 4.08Å; Y150-E152 VanDerWaalsContact C-N 3.33Å; Y150-E152 VanDerWaalsContact CB-O 3.25Å; Y150-E152 WeakPolarHBondContact CB-O 3.44Å; Y150-V154 HydrophobicContact CD1-CG1 3.96Å; Y150-V154 HydrophobicContact CD1-CG2 4.45Å; Y150-V154 HydrophobicContact CD2-CG1 4.41Å; Y150-V154 HydrophobicContact CD2-CG2 3.42Å; Y150-V154 VanDerWaalsContact CD2-CG2 3.42Å; Y150-V154 HydrophobicContact CE1-CG1 4.46Å; Y150-V154 HydrophobicContact CE2-CG2 3.98Å; Y150-V154 HydrophobicContact CG-CB 4.48Å; Y150-V154 HydrophobicContact CG-CG1 3.92Å; Y150-V154 HydrophobicContact CG-CG2 3.68Å; Y150-V158 HydrophobicContact CE2-CG1 3.84Å; Y150-V158 WeakPolarHBondContact OH-CG1 3.21Å; Y150-Y159 HydrophobicContact CD2-CD2 4.34Å; Y150-Y159 AromaticContact CD2-CE1 4Å; Y150-Y159 HydrophobicContact CD2-CE1 4Å; Y150-Y159 AromaticContact CD2-CE2 3.82Å; Y150-Y159 HydrophobicContact CD2-CE2 3.82Å; Y150-Y159 AromaticContact CD2-CZ 3.62Å; Y150-Y159 HydrophobicContact CE2-CE2 4.48Å; Y150-Y159 PolarHBondContact N-OH 3.32Å; Y150-Y159 VanDerWaalsContact N-OH 3.09Å; Y150-D162 WeakPolarHBondContact CE2-OD2 3.44Å; Y150-D162 VanDerWaalsContact CZ-OD2 3.3Å; Y150-D162 VanDerWaalsContact OH-CG 3.29Å; Y150-D162 PolarHBondContact OH-OD1 2.65Å; Y150-D162 PolarHBondContact OH-OD2 2.71Å; Y150-H206 AromaticContact CE2-CE1 3.87Å
151	I	96.9	Very high	95.4	Very high	81 Å²	81	64.3 Å²	64.3	42%	0.415	31%	0.312	S	S	.	.	S	Bend	trans	-67.7	-39.8	176.8	-64.2	168.2	0	0	0	109.8	M121 E123	M121-I151 PolarHBondContact O-N 3.17Å; E123-I151 HydrophobicContact CB-CG1 4.33Å; E123-I151 HydrophobicContact CG-CG1 4.46Å
152	E	95.7	Very high	96	Very high	159 Å²	159	58.1 Å²	58.1	74%	0.743	29%	0.285	S	S	*	.	S	Bend	trans	-98.3	153	174.8	-64.3	-175.9	176	0	0	110.6	Y150 V154	Y150-E152 VanDerWaalsContact C-N 3.33Å; Y150-E152 VanDerWaalsContact CB-O 3.25Å; Y150-E152 WeakPolarHBondContact CB-O 3.44Å; E152-V154 PolarHBondContact O-N 2.68Å
153	K	94.7	Very high	96.4	Very high	198 Å²	198	57.7 Å²	57.7	86%	0.861	28%	0.281	S	S	*	.			trans	-69.4	116.9	177.9	-173.6	171.8	-176.8	166.6	0	109.6
154	V	95.9	Very high	96.8	Very high	46 Å²	46	59.6 Å²	59.6	28%	0.279	28%	0.279	S	S	.	.			trans	-113.1	163.7	174.8	-59.2	0	0	0	0	110.7	Y150 E152 V158 Y159	Y150-V154 HydrophobicContact CD1-CG1 3.96Å; Y150-V154 HydrophobicContact CD1-CG2 4.45Å; Y150-V154 HydrophobicContact CD2-CG1 4.41Å; Y150-V154 HydrophobicContact CD2-CG2 3.42Å; Y150-V154 VanDerWaalsContact CD2-CG2 3.42Å; Y150-V154 HydrophobicContact CE1-CG1 4.46Å; Y150-V154 HydrophobicContact CE2-CG2 3.98Å; Y150-V154 HydrophobicContact CG-CB 4.48Å; Y150-V154 HydrophobicContact CG-CG1 3.92Å; Y150-V154 HydrophobicContact CG-CG2 3.68Å; E152-V154 PolarHBondContact O-N 2.68Å; V154-V158 HydrophobicContact CB-CB 4.39Å; V154-V158 HydrophobicContact CB-CG2 4.32Å; V154-V158 HydrophobicContact CG2-CB 4.18Å; V154-V158 HydrophobicContact CG2-CG1 4.41Å; V154-Y159 HydrophobicContact CG2-CD2 4.14Å; V154-Y159 HydrophobicContact CG2-CE2 3.64Å
155	E	96.1	Very high	96.9	Very high	132 Å²	132	58.7 Å²	58.7	62%	0.617	27%	0.274	S	S	*	.			trans	-68	147.9	172.4	-64	-172.4	-172.7	0	0	111.5	H157 V158	E155-H157 WeakPolarHBondContact CB-ND1 3.48Å; E155-H157 PolarHBondContact O-N 2.87Å; E155-H157 IonicContact OE2-CE1 3.31Å; E155-H157 PolarHBondContact OE2-CE1 2.95Å; E155-H157 IonicContact OE2-ND1 2.82Å; E155-H157 PolarHBondContact OE2-ND1 3.08Å; E155-V158 HydrophobicContact CB-CG2 4.4Å; E155-V158 WeakPolarHBondContact O-CB 3.47Å; E155-V158 WeakPolarHBondContact O-CG2 3.05Å; E155-V158 PolarHBondContact O-N 2.81Å; E155-V158 VanDerWaalsContact O-N 3.11Å
156	N	96.5	Very high	96.9	Very high	109 Å²	109	58.4 Å²	58.4	58%	0.583	27%	0.273	S	S	*	.	H	α-helix	trans	-56.2	-38.7	-176.6	-71.9	2.3	0	0	0	112.7	V158 Y159 F160 L204	N156-V158 PolarHBondContact O-N 3.3Å; N156-V158 VanDerWaalsContact O-N 3.13Å; N156-Y159 WeakPolarHBondContact O-CB 3.11Å; N156-Y159 PolarHBondContact O-N 2.88Å; N156-Y159 VanDerWaalsContact O-N 3.11Å; N156-F160 VanDerWaalsContact O-CD2 3.28Å; N156-F160 WeakPolarHBondContact O-CD2 3.37Å; N156-L204 HydrophobicContact CB-CD1 3.83Å
157	H	95.8	Very high	96.9	Very high	96 Å²	96	58.9 Å²	58.9	44%	0.444	27%	0.274	S	S	.	.	H	α-helix	trans	-59	-27.8	-177.2	79.3	-95.7	0	0	0	112.9	E155 Y159 F160 D161	E155-H157 WeakPolarHBondContact CB-ND1 3.48Å; E155-H157 PolarHBondContact O-N 2.87Å; E155-H157 IonicContact OE2-CE1 3.31Å; E155-H157 PolarHBondContact OE2-CE1 2.95Å; E155-H157 IonicContact OE2-ND1 2.82Å; E155-H157 PolarHBondContact OE2-ND1 3.08Å; H157-Y159 VanDerWaalsContact C-N 3.31Å; H157-Y159 PolarHBondContact O-N 2.89Å; H157-F160 WeakPolarHBondContact O-CB 3.44Å; H157-F160 PolarHBondContact O-N 2.69Å; H157-F160 VanDerWaalsContact O-N 3.1Å; H157-D161 IonicContact CD2-OD2 3.22Å; H157-D161 PolarHBondContact O-N 3.17Å
158	V	96.3	Very high	96.7	Very high	34 Å²	34	60.1 Å²	60.1	21%	0.206	28%	0.281	C	S	.	.	H	α-helix	trans	-60.4	-40.9	178.4	-179.2	0	0	0	0	111	Y150 V154 E155 N156 F160 D161 D162	Y150-V158 HydrophobicContact CE2-CG1 3.84Å; Y150-V158 WeakPolarHBondContact OH-CG1 3.21Å; V154-V158 HydrophobicContact CB-CB 4.39Å; V154-V158 HydrophobicContact CB-CG2 4.32Å; V154-V158 HydrophobicContact CG2-CB 4.18Å; V154-V158 HydrophobicContact CG2-CG1 4.41Å; E155-V158 HydrophobicContact CB-CG2 4.4Å; E155-V158 WeakPolarHBondContact O-CB 3.47Å; E155-V158 WeakPolarHBondContact O-CG2 3.05Å; E155-V158 PolarHBondContact O-N 2.81Å; E155-V158 VanDerWaalsContact O-N 3.11Å; N156-V158 PolarHBondContact O-N 3.3Å; N156-V158 VanDerWaalsContact O-N 3.13Å; V158-F160 VanDerWaalsContact C-N 3.27Å; V158-F160 PolarHBondContact O-N 3.46Å; V158-D161 PolarHBondContact O-N 3Å; V158-D162 VanDerWaalsContact O-CG 3.27Å; V158-D162 PolarHBondContact O-N 2.78Å
159	Y	97.9	Very high	96.7	Very high	19 Å²	19	59.4 Å²	59.4	8%	0.075	28%	0.278	C	S	.	.	H	α-helix	trans	-59.5	-40.7	176.3	-76.6	-95.8	0	0	0	112	Y150 V154 N156 H157 V163 L204 H206	Y150-Y159 HydrophobicContact CD2-CD2 4.34Å; Y150-Y159 AromaticContact CD2-CE1 4Å; Y150-Y159 HydrophobicContact CD2-CE1 4Å; Y150-Y159 AromaticContact CD2-CE2 3.82Å; Y150-Y159 HydrophobicContact CD2-CE2 3.82Å; Y150-Y159 AromaticContact CD2-CZ 3.62Å; Y150-Y159 HydrophobicContact CE2-CE2 4.48Å; Y150-Y159 PolarHBondContact N-OH 3.32Å; Y150-Y159 VanDerWaalsContact N-OH 3.09Å; V154-Y159 HydrophobicContact CG2-CD2 4.14Å; V154-Y159 HydrophobicContact CG2-CE2 3.64Å; N156-Y159 WeakPolarHBondContact O-CB 3.11Å; N156-Y159 PolarHBondContact O-N 2.88Å; N156-Y159 VanDerWaalsContact O-N 3.11Å; H157-Y159 VanDerWaalsContact C-N 3.31Å; H157-Y159 PolarHBondContact O-N 2.89Å; Y159-V163 WeakPolarHBondContact O-CG2 3.49Å; Y159-V163 PolarHBondContact O-N 3.38Å; Y159-L204 HydrophobicContact CD1-CB 3.92Å; Y159-L204 HydrophobicContact CD2-CB 3.98Å; Y159-L204 HydrophobicContact CD2-CD1 3.99Å; Y159-L204 HydrophobicContact CE1-CB 4.01Å; Y159-L204 WeakPolarHBondContact CE1-O 3.18Å; Y159-L204 HydrophobicContact CE2-CB 4.05Å; Y159-L204 HydrophobicContact CG-CB 3.91Å; Y159-L204 HydrophobicContact CG-CD1 4.15Å; Y159-L204 PolarHBondContact OH-O 2.78Å; Y159-H206 WeakPolarHBondContact CA-NE2 3.43Å; Y159-H206 AromaticContact CD1-CD2 3.94Å; Y159-H206 AromaticContact CD1-CE1 3.6Å; Y159-H206 AromaticContact CD1-NE2 3.57Å; Y159-H206 PolarHBondContact O-NE2 2.88Å
160	F	97.6	Very high	96.6	Very high	44 Å²	44	56.3 Å²	56.3	19%	0.193	27%	0.267	C	S	.	.	H	α-helix	trans	-72.6	-36.7	179.5	-67.1	-94.2	0	0	0	111.4	Y93 W102 N156 H157 V158 V163 R164 V193 L204	Y93-F160 AromaticContact CD1-CE1 3.94Å; Y93-F160 HydrophobicContact CD1-CE1 3.94Å; Y93-F160 HydrophobicContact CD1-CZ 4.46Å; Y93-F160 HydrophobicContact CD2-CE1 4.06Å; Y93-F160 HydrophobicContact CD2-CZ 4.06Å; Y93-F160 HydrophobicContact CE1-CE1 4.46Å; Y93-F160 HydrophobicContact CE2-CZ 4.26Å; Y93-F160 AromaticContact CG-CE1 3.7Å; Y93-F160 HydrophobicContact CG-CE1 3.7Å; Y93-F160 HydrophobicContact CG-CZ 4.16Å; W102-F160 HydrophobicContact CD2-CD1 4.32Å; W102-F160 HydrophobicContact CE3-CD1 4.21Å; W102-F160 HydrophobicContact CH2-CB 3.91Å; W102-F160 AromaticContact CH2-CD1 3.49Å; W102-F160 HydrophobicContact CH2-CD1 3.49Å; W102-F160 VanDerWaalsContact CH2-CD1 3.49Å; W102-F160 HydrophobicContact CH2-CE1 4.46Å; W102-F160 HydrophobicContact CH2-CG 4.12Å; W102-F160 HydrophobicContact CZ2-CB 3.66Å; W102-F160 AromaticContact CZ2-CD1 3.61Å; W102-F160 HydrophobicContact CZ2-CD1 3.61Å; W102-F160 HydrophobicContact CZ2-CG 4.12Å; W102-F160 WeakPolarHBondContact CZ2-O 3.47Å; W102-F160 AromaticContact CZ3-CD1 3.81Å; W102-F160 HydrophobicContact CZ3-CD1 3.81Å; W102-F160 HydrophobicContact CZ3-CE1 4.38Å; N156-F160 VanDerWaalsContact O-CD2 3.28Å; N156-F160 WeakPolarHBondContact O-CD2 3.37Å; H157-F160 WeakPolarHBondContact O-CB 3.44Å; H157-F160 PolarHBondContact O-N 2.69Å; H157-F160 VanDerWaalsContact O-N 3.1Å; V158-F160 VanDerWaalsContact C-N 3.27Å; V158-F160 PolarHBondContact O-N 3.46Å; F160-V163 PolarHBondContact O-N 3.26Å; F160-R164 WeakPolarHBondContact O-CG 3.25Å; F160-R164 PolarHBondContact O-N 3.01Å; F160-V193 HydrophobicContact CD1-CG2 4.18Å; F160-V193 HydrophobicContact CE1-CB 4.46Å; F160-V193 HydrophobicContact CE1-CG2 4.3Å; F160-V193 HydrophobicContact CE2-CG1 4.47Å; F160-V193 HydrophobicContact CG-CG2 4.33Å; F160-V193 HydrophobicContact CZ-CG1 4.3Å; F160-L204 HydrophobicContact CE2-CD1 3.99Å
161	D	96.3	Very high	96.3	Very high	29 Å²	29	56 Å²	56	16%	0.155	27%	0.267	C	S	.	.	H	α-helix	trans	-63.4	-42.2	176.7	-74.2	4.4	0	0	0	112.1	H157 V158 R164 L165	H157-D161 IonicContact CD2-OD2 3.22Å; H157-D161 PolarHBondContact O-N 3.17Å; V158-D161 PolarHBondContact O-N 3Å; D161-R164 PolarHBondContact O-N 2.91Å; D161-R164 IonicContact OD1-CZ 3.29Å; D161-R164 IonicContact OD1-NE 2.91Å; D161-R164 IonicContact OD1-NH2 2.65Å; D161-R164 PolarHBondContact OD1-NH2 2.9Å; D161-L165 WeakPolarHBondContact O-CB 3.38Å; D161-L165 PolarHBondContact O-N 3.34Å
162	D	96.9	Very high	96.2	Very high	28 Å²	28	53.6 Å²	53.6	15%	0.15	25%	0.253	C	S	.	.	H	α-helix	trans	-63.1	-43.1	176.3	-64.5	-30.6	0	0	0	112	Y150 V158 L165 Q166 H206	Y150-D162 WeakPolarHBondContact CE2-OD2 3.44Å; Y150-D162 VanDerWaalsContact CZ-OD2 3.3Å; Y150-D162 VanDerWaalsContact OH-CG 3.29Å; Y150-D162 PolarHBondContact OH-OD1 2.65Å; Y150-D162 PolarHBondContact OH-OD2 2.71Å; V158-D162 VanDerWaalsContact O-CG 3.27Å; V158-D162 PolarHBondContact O-N 2.78Å; D162-L165 WeakPolarHBondContact O-CB 3.48Å; D162-L165 PolarHBondContact O-N 2.64Å; D162-Q166 WeakPolarHBondContact O-CB 3.27Å; D162-Q166 PolarHBondContact O-N 3.4Å; D162-H206 IonicContact OD2-CE1 2.72Å; D162-H206 PolarHBondContact OD2-CE1 3.27Å; D162-H206 IonicContact OD2-NE2 2.6Å; D162-H206 PolarHBondContact OD2-NE2 2.83Å
163	V	97.7	Very high	96	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.9	-42.8	176.6	169.3	0	0	0	0	110.3	W102 Y159 F160 L165 Q166 M167 T191 V193	W102-V163 HydrophobicContact CH2-CB 3.87Å; W102-V163 HydrophobicContact CH2-CG1 3.69Å; W102-V163 HydrophobicContact CZ3-CB 4.49Å; W102-V163 HydrophobicContact CZ3-CG1 3.92Å; Y159-V163 WeakPolarHBondContact O-CG2 3.49Å; Y159-V163 PolarHBondContact O-N 3.38Å; F160-V163 PolarHBondContact O-N 3.26Å; V163-L165 VanDerWaalsContact C-N 3.34Å; V163-L165 PolarHBondContact O-N 3.4Å; V163-Q166 PolarHBondContact O-N 3.01Å; V163-M167 HydrophobicContact CG1-CG 4.15Å; V163-M167 VanDerWaalsContact O-CB 3.29Å; V163-M167 WeakPolarHBondContact O-CB 3.42Å; V163-M167 WeakPolarHBondContact O-CG 3.47Å; V163-M167 PolarHBondContact O-N 3.07Å; V163-T191 HydrophobicContact CB-CG2 4.29Å; V163-T191 HydrophobicContact CG1-CG2 4.31Å; V163-T191 HydrophobicContact CG2-CG2 3.98Å; V163-V193 HydrophobicContact CB-CG2 4.44Å; V163-V193 HydrophobicContact CG2-CG2 3.7Å
164	R	97.2	Very high	95.7	Very high	100 Å²	100	39.3 Å²	39.3	38%	0.377	19%	0.189	S	C	.	.	H	α-helix	trans	-57.9	-47.3	173.7	-73.5	-169.7	-72.5	177.2	-4.9	111.5	Y95 W102 F160 D161 M167 D168	Y95-R164 HydrophobicContact CD1-CB 4.28Å; Y95-R164 HydrophobicContact CD1-CG 3.93Å; Y95-R164 HydrophobicContact CD2-CG 3.92Å; Y95-R164 HydrophobicContact CE1-CB 4.17Å; Y95-R164 HydrophobicContact CE1-CG 3.95Å; Y95-R164 HydrophobicContact CE2-CG 3.96Å; Y95-R164 HydrophobicContact CG-CG 3.9Å; W102-R164 HydrophobicContact CH2-CG 4.43Å; W102-R164 HydrophobicContact CZ2-CG 3.6Å; F160-R164 WeakPolarHBondContact O-CG 3.25Å; F160-R164 PolarHBondContact O-N 3.01Å; D161-R164 PolarHBondContact O-N 2.91Å; D161-R164 IonicContact OD1-CZ 3.29Å; D161-R164 IonicContact OD1-NE 2.91Å; D161-R164 IonicContact OD1-NH2 2.65Å; D161-R164 PolarHBondContact OD1-NH2 2.9Å; R164-M167 PolarHBondContact O-N 3.01Å; R164-D168 WeakPolarHBondContact O-CB 3.45Å; R164-D168 VanDerWaalsContact O-CG 3.28Å; R164-D168 PolarHBondContact O-N 3.26Å
165	L	97.5	Very high	95.4	Very high	5 Å²	5	37.1 Å²	37.1	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-55.2	-57.2	177.1	-170.3	175.4	0	0	0	110.9	D161 D162 V163 M167 D168 A169 P263 I265 Y273	D161-L165 WeakPolarHBondContact O-CB 3.38Å; D161-L165 PolarHBondContact O-N 3.34Å; D162-L165 WeakPolarHBondContact O-CB 3.48Å; D162-L165 PolarHBondContact O-N 2.64Å; V163-L165 VanDerWaalsContact C-N 3.34Å; V163-L165 PolarHBondContact O-N 3.4Å; L165-M167 VanDerWaalsContact C-N 3.32Å; L165-M167 PolarHBondContact O-N 3.16Å; L165-D168 PolarHBondContact O-N 3.22Å; L165-A169 WeakPolarHBondContact O-CB 3.48Å; L165-A169 PolarHBondContact O-N 3.43Å; L165-P263 HydrophobicContact CD2-CG 4.05Å; L165-P263 WeakPolarHBondContact CD2-O 3.36Å; L165-I265 HydrophobicContact CD2-CD1 4.14Å; L165-I265 HydrophobicContact CD2-CG1 3.83Å; L165-I265 HydrophobicContact CG-CB 4.43Å; L165-I265 HydrophobicContact CG-CD1 4.26Å; L165-I265 HydrophobicContact CG-CG1 4.13Å; L165-Y273 HydrophobicContact CB-CD1 3.64Å; L165-Y273 HydrophobicContact CB-CE1 4.36Å; L165-Y273 HydrophobicContact CB-CG 4.37Å; L165-Y273 HydrophobicContact CD1-CG 4.48Å; L165-Y273 HydrophobicContact CG-CD1 3.81Å; L165-Y273 HydrophobicContact CG-CG 4.1Å
166	Q	97.8	Very high	95.1	Very high	7 Å²	7	30.9 Å²	30.9	3%	0.033	15%	0.146	C	C	.	.	H	α-helix	trans	-64.5	-38.1	-174.2	-178.9	164.1	-21.5	0	0	112	D162 V163 A169 K170 I188 S189 T191 T261 P263	D162-Q166 WeakPolarHBondContact O-CB 3.27Å; D162-Q166 PolarHBondContact O-N 3.4Å; V163-Q166 PolarHBondContact O-N 3.01Å; Q166-A169 PolarHBondContact O-N 3.43Å; Q166-K170 PolarHBondContact O-N 3.46Å; Q166-I188 HydrophobicContact CG-CG2 3.68Å; Q166-S189 PolarHBondContact NE2-O 3.49Å; Q166-T191 HydrophobicContact CB-CG2 3.72Å; Q166-T191 VanDerWaalsContact CD-CG2 3.43Å; Q166-T191 HydrophobicContact CG-CG2 3.74Å; Q166-T261 PolarHBondContact NE2-OG1 3.39Å; Q166-P263 HydrophobicContact CG-CG 4.39Å
167	M	97	Very high	94.8	Very high	23 Å²	23	26.7 Å²	26.7	11%	0.113	13%	0.126	C	C	.	.	H	α-helix	trans	-72.8	-34.5	177.7	-65.1	-54.7	-63	0	0	112.7	Y95 A97 V163 R164 L165 K170 L171 Q190	Y95-M167 HydrophobicContact CD1-CB 3.89Å; A97-M167 HydrophobicContact CB-CB 4.22Å; V163-M167 HydrophobicContact CG1-CG 4.15Å; V163-M167 VanDerWaalsContact O-CB 3.29Å; V163-M167 WeakPolarHBondContact O-CB 3.42Å; V163-M167 WeakPolarHBondContact O-CG 3.47Å; V163-M167 PolarHBondContact O-N 3.07Å; R164-M167 PolarHBondContact O-N 3.01Å; L165-M167 VanDerWaalsContact C-N 3.32Å; L165-M167 PolarHBondContact O-N 3.16Å; M167-K170 HydrophobicContact CE-CD 4.13Å; M167-K170 WeakPolarHBondContact O-CB 3.38Å; M167-K170 PolarHBondContact O-N 3.46Å; M167-L171 PolarHBondContact O-N 3.47Å; M167-Q190 HydrophobicContact CE-CB 4.46Å; M167-Q190 HydrophobicContact CE-CG 4.07Å; M167-Q190 HydrophobicContact SD-CB 4.19Å; M167-Q190 HydrophobicContact SD-CG 4.33Å
168	D	94.1	Very high	94.4	Very high	26 Å²	26	25.9 Å²	25.9	14%	0.139	12%	0.119	C	C	.	.	H	α-helix	trans	-66.3	-41.7	169.8	-76.7	-10	0	0	0	111	R164 L165 K170 L171 W172 I265 Y273	R164-D168 WeakPolarHBondContact O-CB 3.45Å; R164-D168 VanDerWaalsContact O-CG 3.28Å; R164-D168 PolarHBondContact O-N 3.26Å; L165-D168 PolarHBondContact O-N 3.22Å; D168-K170 VanDerWaalsContact C-N 3.29Å; D168-K170 PolarHBondContact O-N 2.93Å; D168-L171 WeakPolarHBondContact O-CB 3.29Å; D168-L171 PolarHBondContact O-N 3.26Å; D168-W172 PolarHBondContact O-N 3.42Å; D168-I265 HydrophobicContact CB-CD1 4.22Å; D168-Y273 HydrophobicContact CB-CE1 4.4Å; D168-Y273 WeakPolarHBondContact OD2-CE1 3.07Å; D168-Y273 PolarHBondContact OD2-OH 3.3Å
169	A	96.8	Very high	93.7	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61.8	-37.6	174.6	0	0	0	0	0	111.6	L165 Q166 L171 W172 G173 I188 V250 P263 I265	L165-A169 WeakPolarHBondContact O-CB 3.48Å; L165-A169 PolarHBondContact O-N 3.43Å; Q166-A169 PolarHBondContact O-N 3.43Å; A169-L171 VanDerWaalsContact C-N 3.29Å; A169-L171 PolarHBondContact O-N 2.88Å; A169-W172 WeakPolarHBondContact O-CA 3.47Å; A169-W172 VanDerWaalsContact O-CB 3.28Å; A169-W172 WeakPolarHBondContact O-CB 3.32Å; A169-W172 PolarHBondContact O-N 3.48Å; A169-G173 PolarHBondContact O-N 3.42Å; A169-I188 VanDerWaalsContact C-CD1 3.42Å; A169-I188 HydrophobicContact CB-CD1 3.82Å; A169-I188 VanDerWaalsContact O-CD1 3.26Å; A169-I188 WeakPolarHBondContact O-CD1 3.32Å; A169-V250 HydrophobicContact CB-CG1 3.96Å; A169-P263 HydrophobicContact CB-CB 4.12Å; A169-P263 HydrophobicContact CB-CG 3.44Å; A169-P263 VanDerWaalsContact CB-CG 3.44Å; A169-I265 HydrophobicContact CB-CD1 4.27Å
170	K	96.2	Very high	93.1	Very high	16 Å²	16	31.1 Å²	31.1	7%	0.07	15%	0.153	C	C	.	.	H	α-helix	trans	-55.9	-41.8	173.5	-176.7	-179.2	-179.7	65.3	0	112.4	Q166 M167 D168 W172 G173 E174 D187 I188 Q190	Q166-K170 PolarHBondContact O-N 3.46Å; M167-K170 HydrophobicContact CE-CD 4.13Å; M167-K170 WeakPolarHBondContact O-CB 3.38Å; M167-K170 PolarHBondContact O-N 3.46Å; D168-K170 VanDerWaalsContact C-N 3.29Å; D168-K170 PolarHBondContact O-N 2.93Å; K170-W172 PolarHBondContact O-N 3.32Å; K170-G173 WeakPolarHBondContact O-CA 3.47Å; K170-G173 PolarHBondContact O-N 2.85Å; K170-E174 PolarHBondContact O-N 3.48Å; K170-D187 IonicContact NZ-OD1 3.43Å; K170-D187 PolarHBondContact NZ-OD1 2.86Å; K170-D187 IonicContact NZ-OD2 3.56Å; K170-D187 PolarHBondContact NZ-OD2 3.22Å; K170-I188 HydrophobicContact CB-CB 4.07Å; K170-I188 HydrophobicContact CB-CG2 4.39Å; K170-I188 WeakPolarHBondContact CD-O 3.46Å; K170-I188 HydrophobicContact CG-CB 4.42Å; K170-I188 PolarHBondContact NZ-O 3.49Å; K170-Q190 HydrophobicContact CD-CG 3.85Å
171	L	91.6	Very high	92.5	Very high	25 Å²	25	31.2 Å²	31.2	13%	0.131	16%	0.158	C	C	.	.	H	α-helix	trans	-60.1	-33.1	175.2	-64.8	-175.6	0	0	0	112.7	V36 K40 A97 I98 M167 D168 A169 E175	V36-L171 HydrophobicContact CG1-CB 4.38Å; K40-L171 VanDerWaalsContact NZ-CD2 3.25Å; A97-L171 HydrophobicContact CB-CD1 3.57Å; A97-L171 HydrophobicContact CB-CG 3.91Å; I98-L171 HydrophobicContact CG1-CD2 4.03Å; M167-L171 PolarHBondContact O-N 3.47Å; D168-L171 WeakPolarHBondContact O-CB 3.29Å; D168-L171 PolarHBondContact O-N 3.26Å; A169-L171 VanDerWaalsContact C-N 3.29Å; A169-L171 PolarHBondContact O-N 2.88Å; L171-E175 PolarHBondContact O-N 2.88Å
172	W	94	Very high	92	Very high	30 Å²	30	29.9 Å²	29.9	11%	0.114	15%	0.151	C	C	.	.	H	α-helix	trans	-69.4	-40	172.7	-71.4	106.2	0	0	0	112.4	V36 D168 A169 K170 E174 E175 Y176 F236 T240 R243 L248 V250	V36-W172 HydrophobicContact CG2-CE3 4.17Å; V36-W172 HydrophobicContact CG2-CH2 4Å; V36-W172 HydrophobicContact CG2-CZ2 4.38Å; V36-W172 HydrophobicContact CG2-CZ3 3.89Å; D168-W172 PolarHBondContact O-N 3.42Å; A169-W172 WeakPolarHBondContact O-CA 3.47Å; A169-W172 VanDerWaalsContact O-CB 3.28Å; A169-W172 WeakPolarHBondContact O-CB 3.32Å; A169-W172 PolarHBondContact O-N 3.48Å; K170-W172 PolarHBondContact O-N 3.32Å; W172-E174 VanDerWaalsContact C-N 3.31Å; W172-E174 PolarHBondContact O-N 2.94Å; W172-E175 PolarHBondContact O-N 3.44Å; W172-Y176 WeakPolarHBondContact O-CB 3.43Å; W172-Y176 PolarHBondContact O-N 3.23Å; W172-F236 HydrophobicContact CB-CE2 4.26Å; W172-F236 HydrophobicContact CB-CZ 4.08Å; W172-T240 HydrophobicContact CB-CG2 3.81Å; W172-T240 HydrophobicContact CD2-CG2 4.19Å; W172-T240 HydrophobicContact CE3-CG2 4.14Å; W172-T240 HydrophobicContact CG-CG2 4.08Å; W172-R243 HydrophobicContact CZ3-CB 3.84Å; W172-R243 HydrophobicContact CZ3-CG 3.83Å; W172-L248 HydrophobicContact CD2-CD1 4.49Å; W172-L248 HydrophobicContact CZ2-CD1 3.79Å; W172-L248 HydrophobicContact CZ2-CD2 3.99Å; W172-L248 HydrophobicContact CZ2-CG 4.21Å; W172-V250 HydrophobicContact CB-CG2 4.12Å; W172-V250 HydrophobicContact CG-CG2 3.94Å
173	G	91.7	Very high	91.3	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-56.1	-45.5	172.3	0	0	0	0	0	112	A169 K170 Y176 S177	A169-G173 PolarHBondContact O-N 3.42Å; K170-G173 WeakPolarHBondContact O-CA 3.47Å; K170-G173 PolarHBondContact O-N 2.85Å; G173-Y176 PolarHBondContact O-N 2.74Å; G173-S177 WeakPolarHBondContact O-CB 3.33Å; G173-S177 PolarHBondContact O-N 2.92Å; G173-S177 PolarHBondContact O-OG 3.45Å
174	E	89.3	Confident	90.8	Very high	57 Å²	57	38.5 Å²	38.5	27%	0.266	20%	0.197	S	C	.	.	H	α-helix	trans	-63.9	-43.5	175	-65.4	174.3	-172.9	0	0	112.7	K40 K170 W172 Y176 S177 R178	K40-E174 VanDerWaalsContact CE-OE2 3.3Å; K40-E174 WeakPolarHBondContact CE-OE2 3.39Å; K40-E174 IonicContact NZ-OE2 2.66Å; K40-E174 PolarHBondContact NZ-OE2 2.96Å; K170-E174 PolarHBondContact O-N 3.48Å; W172-E174 VanDerWaalsContact C-N 3.31Å; W172-E174 PolarHBondContact O-N 2.94Å; E174-Y176 VanDerWaalsContact C-N 3.33Å; E174-Y176 PolarHBondContact O-N 2.72Å; E174-S177 PolarHBondContact O-N 2.74Å; E174-R178 WeakPolarHBondContact O-CG 3.25Å; E174-R178 PolarHBondContact O-N 2.89Å; E174-R178 IonicContact OE2-NH2 3.63Å; E174-R178 PolarHBondContact OE2-NH2 3.36Å
175	E	89.1	Confident	90.6	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.5	-35.1	178.7	176.9	59.2	-168.2	0	0	112.3	V36 L171 W172 R178 Q179 F239 R243	V36-E175 HydrophobicContact CG1-CB 4.09Å; V36-E175 HydrophobicContact CG2-CB 4.18Å; V36-E175 HydrophobicContact CG2-CG 4.1Å; L171-E175 PolarHBondContact O-N 2.88Å; W172-E175 PolarHBondContact O-N 3.44Å; E175-R178 IonicContact OE2-CZ 3.21Å; E175-R178 IonicContact OE2-NH1 2.7Å; E175-R178 PolarHBondContact OE2-NH1 2.64Å; E175-Q179 PolarHBondContact O-NE2 2.8Å; E175-Q179 PolarHBondContact OE1-NE2 2.77Å; E175-F239 HydrophobicContact CG-CE1 4.05Å; E175-F239 HydrophobicContact CG-CZ 3.95Å; E175-R243 HydrophobicContact CG-CG 4.3Å; E175-R243 IonicContact OE1-CZ 2.99Å; E175-R243 VanDerWaalsContact OE1-CZ 3.31Å; E175-R243 IonicContact OE1-NE 2.94Å; E175-R243 PolarHBondContact OE1-NE 3.03Å; E175-R243 IonicContact OE1-NH2 3.86Å; E175-R243 PolarHBondContact OE1-NH2 3.01Å
176	Y	90.6	Very high	90.4	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.7	-48.5	170.1	178.1	-88.9	0	0	0	111.1	W172 G173 E174 R178 Q179 A182 V186 T232 F236 F239 L299	W172-Y176 WeakPolarHBondContact O-CB 3.43Å; W172-Y176 PolarHBondContact O-N 3.23Å; G173-Y176 PolarHBondContact O-N 2.74Å; E174-Y176 VanDerWaalsContact C-N 3.33Å; E174-Y176 PolarHBondContact O-N 2.72Å; Y176-R178 PolarHBondContact O-N 2.72Å; Y176-Q179 WeakPolarHBondContact O-CB 3.34Å; Y176-Q179 WeakPolarHBondContact O-CG 3.39Å; Y176-Q179 PolarHBondContact O-N 3.22Å; Y176-A182 HydrophobicContact CD1-CB 4.15Å; Y176-A182 HydrophobicContact CE1-CB 3.7Å; Y176-V186 HydrophobicContact CD1-CG1 4.03Å; Y176-V186 HydrophobicContact CD1-CG2 3.68Å; Y176-V186 HydrophobicContact CE1-CG1 3.9Å; Y176-V186 HydrophobicContact CE1-CG2 4.4Å; Y176-V186 HydrophobicContact CG-CG2 4.33Å; Y176-T232 HydrophobicContact CE1-CG2 4.29Å; Y176-F236 HydrophobicContact CD1-CD2 4.4Å; Y176-F236 HydrophobicContact CD2-CB 4.27Å; Y176-F236 AromaticContact CD2-CD2 3.9Å; Y176-F236 HydrophobicContact CD2-CD2 3.9Å; Y176-F236 HydrophobicContact CE2-CB 4.22Å; Y176-F236 AromaticContact CG-CD2 3.76Å; Y176-F236 HydrophobicContact CG-CD2 3.76Å; Y176-F239 HydrophobicContact CD2-CB 3.93Å; Y176-F239 AromaticContact CD2-CD1 3.79Å; Y176-F239 HydrophobicContact CD2-CD1 3.79Å; Y176-F239 HydrophobicContact CD2-CD2 4.35Å; Y176-F239 HydrophobicContact CD2-CE1 4.39Å; Y176-F239 AromaticContact CD2-CG 3.76Å; Y176-F239 HydrophobicContact CD2-CG 3.76Å; Y176-F239 HydrophobicContact CE2-CB 4.31Å; Y176-F239 HydrophobicContact CG-CD1 4.39Å; Y176-L299 HydrophobicContact CD2-CD1 4.3Å; Y176-L299 HydrophobicContact CE2-CD1 3.48Å; Y176-L299 VanDerWaalsContact CE2-CD1 3.48Å
177	S	89.7	Confident	90.3	Very high	21 Å²	21	41.5 Å²	41.5	15%	0.147	22%	0.216	C	C	.	.	H	α-helix	trans	-62	-25.5	-180	-73.8	0	0	0	0	113.2	G173 E174 Q179 K185 V186	G173-S177 WeakPolarHBondContact O-CB 3.33Å; G173-S177 PolarHBondContact O-N 2.92Å; G173-S177 PolarHBondContact O-OG 3.45Å; E174-S177 PolarHBondContact O-N 2.74Å; S177-Q179 VanDerWaalsContact C-N 3.29Å; S177-Q179 PolarHBondContact O-N 3.16Å; S177-K185 VanDerWaalsContact O-CD 3.23Å; S177-K185 WeakPolarHBondContact O-CD 3.24Å; S177-K185 WeakPolarHBondContact O-CE 3.33Å; S177-K185 PolarHBondContact O-NZ 3.26Å; S177-V186 PolarHBondContact OG-N 3.07Å; S177-V186 PolarHBondContact OG-O 2.9Å
178	R	86.3	Confident	90.2	Very high	79 Å²	79	40.4 Å²	40.4	30%	0.298	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-18.4	172.6	-75.3	176.4	-134	139.5	5.8	114.2	E174 E175 Y176 P180	E174-R178 WeakPolarHBondContact O-CG 3.25Å; E174-R178 PolarHBondContact O-N 2.89Å; E174-R178 IonicContact OE2-NH2 3.63Å; E174-R178 PolarHBondContact OE2-NH2 3.36Å; E175-R178 IonicContact OE2-CZ 3.21Å; E175-R178 IonicContact OE2-NH1 2.7Å; E175-R178 PolarHBondContact OE2-NH1 2.64Å; Y176-R178 PolarHBondContact O-N 2.72Å; R178-P180 WeakPolarHBondContact O-CD 3.19Å
179	Q	82.5	Confident	90.3	Very high	39 Å²	39	39.6 Å²	39.6	18%	0.182	21%	0.207	C	C	.	.			trans	-67.5	125.6	179.4	-55.8	-50.6	-49	0	0	110	E175 Y176 S177 S181 A182 K185 F239 L299	E175-Q179 PolarHBondContact O-NE2 2.8Å; E175-Q179 PolarHBondContact OE1-NE2 2.77Å; Y176-Q179 WeakPolarHBondContact O-CB 3.34Å; Y176-Q179 WeakPolarHBondContact O-CG 3.39Å; Y176-Q179 PolarHBondContact O-N 3.22Å; S177-Q179 VanDerWaalsContact C-N 3.29Å; S177-Q179 PolarHBondContact O-N 3.16Å; Q179-S181 PolarHBondContact O-N 2.77Å; Q179-A182 HydrophobicContact CB-CB 4.17Å; Q179-A182 WeakPolarHBondContact O-CB 3.29Å; Q179-A182 PolarHBondContact O-N 2.88Å; Q179-A182 VanDerWaalsContact O-N 3.08Å; Q179-K185 PolarHBondContact O-NZ 2.99Å; Q179-K185 VanDerWaalsContact O-NZ 3.14Å; Q179-F239 HydrophobicContact CG-CD2 4.44Å; Q179-F239 HydrophobicContact CG-CE2 3.58Å; Q179-F239 HydrophobicContact CG-CZ 3.85Å; Q179-L299 HydrophobicContact CB-CD2 3.62Å; Q179-L299 HydrophobicContact CG-CD2 3.79Å
180	P	84.5	Confident	90.2	Very high	125 Å²	125	45 Å²	45	81%	0.812	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-32.9	177.6	-25.8	35.3	0	0	0	112.7	R178 A182	R178-P180 WeakPolarHBondContact O-CD 3.19Å; P180-A182 VanDerWaalsContact C-N 3.29Å; P180-A182 PolarHBondContact O-N 3.46Å
181	S	85.1	Confident	90.2	Very high	45 Å²	45	44.8 Å²	44.8	32%	0.315	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-3.7	178.5	56	0	0	0	0	114.6	Q179 P183 A298 L299	Q179-S181 PolarHBondContact O-N 2.77Å; S181-P183 WeakPolarHBondContact O-CD 3.42Å; S181-A298 WeakPolarHBondContact CB-O 3.4Å; S181-A298 PolarHBondContact OG-O 3.03Å; S181-L299 WeakPolarHBondContact OG-CD2 3.03Å
182	A	85.5	Confident	90.5	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.008	23%	0.23	C	C	.	.			trans	-82.9	103.4	170.8	0	0	0	0	0	109.8	Y176 Q179 P180 K185	Y176-A182 HydrophobicContact CD1-CB 4.15Å; Y176-A182 HydrophobicContact CE1-CB 3.7Å; Q179-A182 HydrophobicContact CB-CB 4.17Å; Q179-A182 WeakPolarHBondContact O-CB 3.29Å; Q179-A182 PolarHBondContact O-N 2.88Å; Q179-A182 VanDerWaalsContact O-N 3.08Å; P180-A182 VanDerWaalsContact C-N 3.29Å; P180-A182 PolarHBondContact O-N 3.46Å; A182-K185 PolarHBondContact O-NZ 3.25Å
183	P	82.4	Confident	90.7	Very high	95 Å²	95	42.7 Å²	42.7	62%	0.617	22%	0.224	S	C	*	.	S	Bend	trans	-71.7	-33.4	-173.5	29.7	-35.4	0	0	0	112.2	S181 L295	S181-P183 WeakPolarHBondContact O-CD 3.42Å; P183-L295 HydrophobicContact CG-CD2 3.66Å
184	K	88.5	Confident	91.1	Very high	114 Å²	114	42.8 Å²	42.8	50%	0.496	23%	0.225	S	C	.	.	S	Bend	trans	-107.8	128.5	176.1	-65.9	-176.9	178.5	-174.4	0	108.3
185	K	91.2	Very high	91.5	Very high	108 Å²	108	41.7 Å²	41.7	47%	0.47	22%	0.22	S	C	.	.			trans	-82.1	142.7	173.5	-52.3	-47.8	-177	-173.3	0	108.7	S177 Q179 A182 N258	S177-K185 VanDerWaalsContact O-CD 3.23Å; S177-K185 WeakPolarHBondContact O-CD 3.24Å; S177-K185 WeakPolarHBondContact O-CE 3.33Å; S177-K185 PolarHBondContact O-NZ 3.26Å; Q179-K185 PolarHBondContact O-NZ 2.99Å; Q179-K185 VanDerWaalsContact O-NZ 3.14Å; A182-K185 PolarHBondContact O-NZ 3.25Å; K185-N258 VanDerWaalsContact O-CB 3.31Å; K185-N258 WeakPolarHBondContact O-CB 3.33Å
186	V	93.4	Very high	91.9	Very high	7 Å²	7	41.8 Å²	41.8	4%	0.042	22%	0.22	C	C	.	.			trans	-118	151.5	-179.2	-49.5	0	0	0	0	108.6	Y176 S177 T232 F236 N258 W260	Y176-V186 HydrophobicContact CD1-CG1 4.03Å; Y176-V186 HydrophobicContact CD1-CG2 3.68Å; Y176-V186 HydrophobicContact CE1-CG1 3.9Å; Y176-V186 HydrophobicContact CE1-CG2 4.4Å; Y176-V186 HydrophobicContact CG-CG2 4.33Å; S177-V186 PolarHBondContact OG-N 3.07Å; S177-V186 PolarHBondContact OG-O 2.9Å; V186-T232 HydrophobicContact CG1-CG2 3.58Å; V186-F236 HydrophobicContact CG2-CD2 4.26Å; V186-F236 HydrophobicContact CG2-CE2 4.46Å; V186-N258 WeakPolarHBondContact CA-O 3.23Å; V186-N258 HydrophobicContact CG1-CB 4.27Å; V186-W260 HydrophobicContact CB-CE3 4.26Å; V186-W260 HydrophobicContact CB-CH2 3.75Å; V186-W260 HydrophobicContact CB-CZ2 4.25Å; V186-W260 HydrophobicContact CB-CZ3 3.74Å; V186-W260 HydrophobicContact CG1-CH2 3.49Å; V186-W260 VanDerWaalsContact CG1-CH2 3.49Å; V186-W260 HydrophobicContact CG1-CZ2 3.88Å; V186-W260 HydrophobicContact CG1-CZ3 4.01Å; V186-W260 HydrophobicContact CG2-CE3 4.48Å; V186-W260 HydrophobicContact CG2-CH2 4.12Å; V186-W260 HydrophobicContact CG2-CZ3 3.78Å
187	D	96.4	Very high	92.2	Very high	61 Å²	61	44.4 Å²	44.4	33%	0.326	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	156.2	170.3	-162.4	17.8	0	0	0	110.5	K170 N258 L259 W260	K170-D187 IonicContact NZ-OD1 3.43Å; K170-D187 PolarHBondContact NZ-OD1 2.86Å; K170-D187 IonicContact NZ-OD2 3.56Å; K170-D187 PolarHBondContact NZ-OD2 3.22Å; D187-N258 PolarHBondContact N-O 2.97Å; D187-L259 HydrophobicContact CB-CD1 4.03Å; D187-L259 WeakPolarHBondContact O-CA 3.49Å; D187-W260 PolarHBondContact O-N 3.49Å
188	I	95.8	Very high	92.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130	171.9	-68.6	158.7	0	0	0	107.7	Q166 A169 K170 Q190 F236 W260 P263	Q166-I188 HydrophobicContact CG-CG2 3.68Å; A169-I188 VanDerWaalsContact C-CD1 3.42Å; A169-I188 HydrophobicContact CB-CD1 3.82Å; A169-I188 VanDerWaalsContact O-CD1 3.26Å; A169-I188 WeakPolarHBondContact O-CD1 3.32Å; K170-I188 HydrophobicContact CB-CB 4.07Å; K170-I188 HydrophobicContact CB-CG2 4.39Å; K170-I188 WeakPolarHBondContact CD-O 3.46Å; K170-I188 HydrophobicContact CG-CB 4.42Å; K170-I188 PolarHBondContact NZ-O 3.49Å; I188-Q190 PolarHBondContact O-N 3.27Å; I188-F236 HydrophobicContact CD1-CZ 4.39Å; I188-W260 CarbonylContact C-O 3.54Å; I188-W260 WeakPolarHBondContact CA-O 3.46Å; I188-W260 HydrophobicContact CG1-CB 4.12Å; I188-W260 HydrophobicContact CG1-CE3 4.31Å; I188-P263 HydrophobicContact CD1-CG 4.4Å; I188-P263 HydrophobicContact CG2-CG 4.35Å
189	S	95.2	Very high	93.1	Very high	8 Å²	8	48 Å²	48	6%	0.056	25%	0.253	C	S	.	.			trans	-54.2	135.5	179.8	-172.4	0	0	0	0	110.2	Q166 W260	Q166-S189 PolarHBondContact NE2-O 3.49Å; S189-W260 PolarHBondContact N-O 3.33Å
190	Q	95.1	Very high	93.7	Very high	115 Å²	115	51.8 Å²	51.8	54%	0.537	28%	0.282	S	S	.	.			trans	-70.7	141.9	171.5	-66.4	-175.3	-15.2	0	0	109.4	M167 K170 I188 E208	M167-Q190 HydrophobicContact CE-CB 4.46Å; M167-Q190 HydrophobicContact CE-CG 4.07Å; M167-Q190 HydrophobicContact SD-CB 4.19Å; M167-Q190 HydrophobicContact SD-CG 4.33Å; K170-Q190 HydrophobicContact CD-CG 3.85Å; I188-Q190 PolarHBondContact O-N 3.27Å; Q190-E208 WeakPolarHBondContact O-CB 3.41Å
191	T	97	Very high	94.2	Very high	11 Å²	11	54.3 Å²	54.3	7%	0.067	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	152.7	177.5	-174.6	0	0	0	0	109.8	V163 Q166 L207	V163-T191 HydrophobicContact CB-CG2 4.29Å; V163-T191 HydrophobicContact CG1-CG2 4.31Å; V163-T191 HydrophobicContact CG2-CG2 3.98Å; Q166-T191 HydrophobicContact CB-CG2 3.72Å; Q166-T191 VanDerWaalsContact CD-CG2 3.43Å; Q166-T191 HydrophobicContact CG-CG2 3.74Å; T191-L207 WeakPolarHBondContact CA-O 3.38Å
192	C	97.8	Very high	94.8	Very high	11 Å²	11	57.5 Å²	57.5	7%	0.074	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	164.7	178.2	60.4	0	0	0	0	110.3	R92 Y93 R94 H206 L207	R92-C192 HydrophobicContact CG-CB 4.09Å; Y93-C192 WeakPolarHBondContact O-CA 3.37Å; Y93-C192 VanDerWaalsContact O-CB 3.24Å; Y93-C192 WeakPolarHBondContact O-CB 3.23Å; R94-C192 HydrophobicContact CG-CB 4.02Å; C192-H206 CarbonylContact O-C 3.56Å; C192-H206 VanDerWaalsContact O-CA 3.29Å; C192-H206 WeakPolarHBondContact O-CA 3.49Å; C192-L207 PolarHBondContact N-O 2.86Å; C192-L207 PolarHBondContact O-N 2.91Å; C192-L207 PolarHBondContact SG-O 2.93Å
193	V	98.6	Very high	95.3	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	132.9	171.5	-173.7	0	0	0	0	108.6	R92 Y93 F160 V163 L204 Y205	R92-V193 CarbonylContact C-O 3.53Å; R92-V193 WeakPolarHBondContact CA-O 3.34Å; Y93-V193 HydrophobicContact CD2-CB 4.24Å; Y93-V193 HydrophobicContact CD2-CG1 4.43Å; Y93-V193 PolarHBondContact N-O 2.94Å; Y93-V193 PolarHBondContact O-N 3.28Å; F160-V193 HydrophobicContact CD1-CG2 4.18Å; F160-V193 HydrophobicContact CE1-CB 4.46Å; F160-V193 HydrophobicContact CE1-CG2 4.3Å; F160-V193 HydrophobicContact CE2-CG1 4.47Å; F160-V193 HydrophobicContact CG-CG2 4.33Å; F160-V193 HydrophobicContact CZ-CG1 4.3Å; V163-V193 HydrophobicContact CB-CG2 4.44Å; V163-V193 HydrophobicContact CG2-CG2 3.7Å; V193-L204 HydrophobicContact CG1-CB 4.17Å; V193-L204 HydrophobicContact CG1-CD1 4.3Å; V193-L204 HydrophobicContact CG1-CD2 4Å; V193-L204 HydrophobicContact CG1-CG 4.38Å; V193-Y205 CarbonylContact C-O 3.41Å; V193-Y205 WeakPolarHBondContact CA-O 3.46Å
194	L	98.4	Very high	96.1	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	130.3	165.8	-66.6	-175	0	0	0	109.8	A90 K91 R92 V107 V109 F196 L204 Y205 L207	A90-L194 HydrophobicContact CB-CB 4.44Å; A90-L194 HydrophobicContact CB-CD2 4.4Å; K91-L194 CarbonylContact O-C 3.58Å; K91-L194 WeakPolarHBondContact O-CA 3.48Å; R92-L194 HydrophobicContact CB-CD2 3.65Å; R92-L194 HydrophobicContact CG-CD2 4.09Å; V107-L194 HydrophobicContact CG2-CD2 3.66Å; V109-L194 HydrophobicContact CG1-CD1 4.08Å; L194-F196 HydrophobicContact CB-CE2 4.38Å; L194-F196 HydrophobicContact CD1-CE2 4.44Å; L194-L204 CarbonylContact O-C 3.48Å; L194-L204 VanDerWaalsContact O-CA 3.26Å; L194-L204 WeakPolarHBondContact O-CA 3.23Å; L194-Y205 PolarHBondContact N-O 2.84Å; L194-Y205 PolarHBondContact O-N 3.33Å; L194-L207 HydrophobicContact CD1-CB 3.82Å; L194-L207 HydrophobicContact CD1-CD1 3.81Å; L194-L207 HydrophobicContact CD1-CD2 3.93Å; L194-L207 HydrophobicContact CD1-CG 4.04Å; L194-L207 HydrophobicContact CD2-CD2 4.29Å; L194-L207 HydrophobicContact CG-CB 3.79Å; L194-L207 HydrophobicContact CG-CD2 4.24Å; L194-L207 HydrophobicContact CG-CG 4.44Å
195	E	98.5	Very high	96.6	Very high	35 Å²	35	50 Å²	50	16%	0.164	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	114.9	167.4	-177.6	-179.5	169.7	0	0	109.3	A90 K91 Y93 I197 K202 L204	A90-E195 CarbonylContact C-O 3.59Å; A90-E195 VanDerWaalsContact CA-O 3.27Å; A90-E195 WeakPolarHBondContact CA-O 3.34Å; A90-E195 WeakPolarHBondContact CB-O 3.39Å; K91-E195 HydrophobicContact CB-CB 4.38Å; K91-E195 PolarHBondContact N-O 3.41Å; K91-E195 PolarHBondContact O-N 3.47Å; Y93-E195 HydrophobicContact CE2-CB 3.98Å; Y93-E195 PolarHBondContact OH-OE2 2.88Å; E195-I197 VanDerWaalsContact C-N 3.32Å; E195-I197 HydrophobicContact CG-CG2 4.18Å; E195-I197 PolarHBondContact O-N 3.38Å; E195-K202 HydrophobicContact CG-CB 4.07Å; E195-K202 VanDerWaalsContact OE1-CD 3.29Å; E195-K202 WeakPolarHBondContact OE1-CD 3.38Å; E195-L204 HydrophobicContact CB-CD2 3.56Å; E195-L204 HydrophobicContact CG-CD2 3.8Å
196	F	98.1	Very high	96.9	Very high	2 Å²	2	45 Å²	45	1%	0.009	23%	0.23	C	C	.	.			trans	-78.8	83.4	175.3	-75.2	-96.2	0	0	0	110.2	E88 A90 V109 I111 L194 N198 R199 P203 Y205	E88-F196 HydrophobicContact CB-CD1 4.18Å; E88-F196 HydrophobicContact CB-CE1 4.01Å; A90-F196 HydrophobicContact CB-CD1 4.41Å; A90-F196 HydrophobicContact CB-CG 4.5Å; V109-F196 HydrophobicContact CG2-CE1 3.54Å; V109-F196 HydrophobicContact CG2-CZ 3.71Å; I111-F196 HydrophobicContact CD1-CE2 4.43Å; I111-F196 HydrophobicContact CD1-CZ 4.03Å; I111-F196 HydrophobicContact CG2-CE1 3.94Å; I111-F196 HydrophobicContact CG2-CZ 3.85Å; L194-F196 HydrophobicContact CB-CE2 4.38Å; L194-F196 HydrophobicContact CD1-CE2 4.44Å; F196-N198 PolarHBondContact O-N 3.26Å; F196-N198 VanDerWaalsContact O-N 3.08Å; F196-R199 HydrophobicContact CB-CB 4Å; F196-R199 HydrophobicContact CB-CG 3.85Å; F196-R199 HydrophobicContact CD1-CG 4.5Å; F196-R199 HydrophobicContact CG-CG 4.47Å; F196-R199 PolarHBondContact O-N 3.43Å; F196-P203 HydrophobicContact CB-CG 4.26Å; F196-P203 PolarHBondContact N-O 3.4Å; F196-Y205 AromaticContact CD2-CD2 3.56Å; F196-Y205 HydrophobicContact CD2-CD2 3.56Å; F196-Y205 AromaticContact CD2-CE2 3.73Å; F196-Y205 HydrophobicContact CD2-CE2 3.73Å; F196-Y205 AromaticContact CE2-CD2 3.43Å; F196-Y205 HydrophobicContact CE2-CD2 3.43Å; F196-Y205 VanDerWaalsContact CE2-CD2 3.43Å; F196-Y205 AromaticContact CE2-CE2 3.77Å; F196-Y205 HydrophobicContact CE2-CE2 3.77Å; F196-Y205 HydrophobicContact CE2-CG 4.09Å
197	I	97.1	Very high	97.1	Very high	55 Å²	55	44.8 Å²	44.8	28%	0.282	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-26.4	-172.4	57.2	173.9	0	0	0	114.7	T89 K91 E195	T89-I197 HydrophobicContact CG2-CD1 4.32Å; K91-I197 HydrophobicContact CB-CG2 3.91Å; E195-I197 VanDerWaalsContact C-N 3.32Å; E195-I197 HydrophobicContact CG-CG2 4.18Å; E195-I197 PolarHBondContact O-N 3.38Å
198	N	97.3	Very high	97.1	Very high	126 Å²	126	42.5 Å²	42.5	67%	0.674	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-7.7	-178.1	-64.7	-29.4	0	0	0	113.5	F196	F196-N198 PolarHBondContact O-N 3.26Å; F196-N198 VanDerWaalsContact O-N 3.08Å
199	R	96.7	Very high	97.1	Very high	49 Å²	49	47 Å²	47	19%	0.185	24%	0.237	C	C	.	.	S	Bend	trans	-86.5	149.7	176.5	-73.2	-176	-179.5	-173.3	-7.8	110.7	E88 I111 F196 E201 K202 P203	E88-R199 VanDerWaalsContact CD-NH2 3.29Å; E88-R199 IonicContact OE1-CZ 3.55Å; E88-R199 IonicContact OE1-NE 3.73Å; E88-R199 IonicContact OE1-NH2 3.45Å; E88-R199 PolarHBondContact OE1-NH2 3.39Å; E88-R199 IonicContact OE2-CZ 2.7Å; E88-R199 VanDerWaalsContact OE2-CZ 3.28Å; E88-R199 IonicContact OE2-NE 2.68Å; E88-R199 PolarHBondContact OE2-NE 2.9Å; E88-R199 IonicContact OE2-NH2 2.77Å; E88-R199 PolarHBondContact OE2-NH2 2.95Å; E88-R199 VanDerWaalsContact OE2-NH2 3.17Å; I111-R199 VanDerWaalsContact CG2-NH2 3.29Å; F196-R199 HydrophobicContact CB-CB 4Å; F196-R199 HydrophobicContact CB-CG 3.85Å; F196-R199 HydrophobicContact CD1-CG 4.5Å; F196-R199 HydrophobicContact CG-CG 4.47Å; F196-R199 PolarHBondContact O-N 3.43Å; R199-E201 PolarHBondContact O-N 3.33Å; R199-K202 PolarHBondContact O-N 2.93Å; R199-K202 VanDerWaalsContact O-N 3.11Å; R199-P203 HydrophobicContact CB-CG 4.11Å
200	P	95.6	Very high	97	Very high	119 Å²	119	49.4 Å²	49.4	77%	0.773	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.5	140.5	169.7	-23.2	33.2	0	0	0	111.2	K202 P203	P200-K202 PolarHBondContact O-N 3.42Å; P200-K202 VanDerWaalsContact O-N 3.1Å; P200-P203 WeakPolarHBondContact O-CD 3.45Å
201	E	94.3	Very high	96.9	Very high	177 Å²	177	45.5 Å²	45.5	83%	0.827	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.6	-1.2	-176.3	-50.3	-170.1	162	0	0	116.4	R199	R199-E201 PolarHBondContact O-N 3.33Å
202	K	97.2	Very high	96.6	Very high	113 Å²	113	50.9 Å²	50.9	49%	0.491	25%	0.254	S	S	.	.			trans	48.3	59.9	-179.8	-55.4	-174.7	-177.8	-177.1	0	112.6	E195 R199 P200	E195-K202 HydrophobicContact CG-CB 4.07Å; E195-K202 VanDerWaalsContact OE1-CD 3.29Å; E195-K202 WeakPolarHBondContact OE1-CD 3.38Å; R199-K202 PolarHBondContact O-N 2.93Å; R199-K202 VanDerWaalsContact O-N 3.11Å; P200-K202 PolarHBondContact O-N 3.42Å; P200-K202 VanDerWaalsContact O-N 3.1Å
203	P	97.4	Very high	96.2	Very high	37 Å²	37	52.9 Å²	52.9	24%	0.24	28%	0.276	C	S	.	.			trans	-63.9	143.7	-171.9	28.5	-35.9	0	0	0	111.7	F196 R199 P200 Y205	F196-P203 HydrophobicContact CB-CG 4.26Å; F196-P203 PolarHBondContact N-O 3.4Å; R199-P203 HydrophobicContact CB-CG 4.11Å; P200-P203 WeakPolarHBondContact O-CD 3.45Å; P203-Y205 HydrophobicContact CB-CE2 3.98Å; P203-Y205 HydrophobicContact CG-CE2 4.1Å
204	L	98.4	Very high	95.8	Very high	10 Å²	10	58.2 Å²	58.2	5%	0.052	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	143.9	177.3	-58.8	-176.2	0	0	0	111.8	N156 Y159 F160 V193 L194 E195	N156-L204 HydrophobicContact CB-CD1 3.83Å; Y159-L204 HydrophobicContact CD1-CB 3.92Å; Y159-L204 HydrophobicContact CD2-CB 3.98Å; Y159-L204 HydrophobicContact CD2-CD1 3.99Å; Y159-L204 HydrophobicContact CE1-CB 4.01Å; Y159-L204 WeakPolarHBondContact CE1-O 3.18Å; Y159-L204 HydrophobicContact CE2-CB 4.05Å; Y159-L204 HydrophobicContact CG-CB 3.91Å; Y159-L204 HydrophobicContact CG-CD1 4.15Å; Y159-L204 PolarHBondContact OH-O 2.78Å; F160-L204 HydrophobicContact CE2-CD1 3.99Å; V193-L204 HydrophobicContact CG1-CB 4.17Å; V193-L204 HydrophobicContact CG1-CD1 4.3Å; V193-L204 HydrophobicContact CG1-CD2 4Å; V193-L204 HydrophobicContact CG1-CG 4.38Å; L194-L204 CarbonylContact O-C 3.48Å; L194-L204 VanDerWaalsContact O-CA 3.26Å; L194-L204 WeakPolarHBondContact O-CA 3.23Å; E195-L204 HydrophobicContact CB-CD2 3.56Å; E195-L204 HydrophobicContact CG-CD2 3.8Å
205	Y	98.6	Very high	95.5	Very high	4 Å²	4	63.9 Å²	63.9	2%	0.016	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	146.1	171.7	-66.4	-106.9	0	0	0	109.5	I111 F125 A147 K148 R149 V193 L194 F196 P203	I111-Y205 HydrophobicContact CD1-CD1 4.35Å; I111-Y205 HydrophobicContact CD1-CE1 4.29Å; F125-Y205 HydrophobicContact CD2-CD1 4.16Å; F125-Y205 AromaticContact CD2-CE1 3.74Å; F125-Y205 HydrophobicContact CD2-CE1 3.74Å; F125-Y205 HydrophobicContact CE2-CD1 4.37Å; F125-Y205 AromaticContact CE2-CE1 3.69Å; F125-Y205 HydrophobicContact CE2-CE1 3.69Å; F125-Y205 HydrophobicContact CG-CE1 4.45Å; F125-Y205 HydrophobicContact CZ-CE1 4.32Å; A147-Y205 HydrophobicContact CB-CD1 4.07Å; K148-Y205 CarbonylContact O-C 3.6Å; K148-Y205 WeakPolarHBondContact O-CA 3.48Å; R149-Y205 HydrophobicContact CB-CD1 3.86Å; R149-Y205 HydrophobicContact CB-CE1 3.9Å; R149-Y205 HydrophobicContact CB-CG 4.41Å; R149-Y205 HydrophobicContact CG-CE1 4.13Å; R149-Y205 PolarHBondContact NH1-OH 3.39Å; V193-Y205 CarbonylContact C-O 3.41Å; V193-Y205 WeakPolarHBondContact CA-O 3.46Å; L194-Y205 PolarHBondContact N-O 2.84Å; L194-Y205 PolarHBondContact O-N 3.33Å; F196-Y205 AromaticContact CD2-CD2 3.56Å; F196-Y205 HydrophobicContact CD2-CD2 3.56Å; F196-Y205 AromaticContact CD2-CE2 3.73Å; F196-Y205 HydrophobicContact CD2-CE2 3.73Å; F196-Y205 AromaticContact CE2-CD2 3.43Å; F196-Y205 HydrophobicContact CE2-CD2 3.43Å; F196-Y205 VanDerWaalsContact CE2-CD2 3.43Å; F196-Y205 AromaticContact CE2-CE2 3.77Å; F196-Y205 HydrophobicContact CE2-CE2 3.77Å; F196-Y205 HydrophobicContact CE2-CG 4.09Å; P203-Y205 HydrophobicContact CB-CE2 3.98Å; P203-Y205 HydrophobicContact CG-CE2 4.1Å
206	H	98.4	Very high	95.2	Very high	4 Å²	4	66 Å²	66	2%	0.019	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	139.4	157.4	-57	120.8	0	0	0	109	A147 K148 Y150 Y159 D162 C192	A147-H206 CarbonylContact C-O 3.41Å; A147-H206 WeakPolarHBondContact CA-O 3.29Å; K148-H206 HydrophobicContact CB-CB 4.28Å; K148-H206 PolarHBondContact N-O 2.97Å; K148-H206 PolarHBondContact O-N 3.41Å; Y150-H206 AromaticContact CE2-CE1 3.87Å; Y159-H206 WeakPolarHBondContact CA-NE2 3.43Å; Y159-H206 AromaticContact CD1-CD2 3.94Å; Y159-H206 AromaticContact CD1-CE1 3.6Å; Y159-H206 AromaticContact CD1-NE2 3.57Å; Y159-H206 PolarHBondContact O-NE2 2.88Å; D162-H206 IonicContact OD2-CE1 2.72Å; D162-H206 PolarHBondContact OD2-CE1 3.27Å; D162-H206 IonicContact OD2-NE2 2.6Å; D162-H206 PolarHBondContact OD2-NE2 2.83Å; C192-H206 CarbonylContact O-C 3.56Å; C192-H206 VanDerWaalsContact O-CA 3.29Å; C192-H206 WeakPolarHBondContact O-CA 3.49Å
207	L	98.1	Very high	95	Very high	3 Å²	3	69.4 Å²	69.4	2%	0.016	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	126.9	173.8	-174.7	86.7	0	0	0	110.1	A127 K129 H145 A147 T191 C192 L194	A127-L207 HydrophobicContact CB-CD1 4.33Å; K129-L207 HydrophobicContact CD-CD2 3.83Å; H145-L207 HydrophobicContact CB-CD1 3.6Å; H145-L207 HydrophobicContact CB-CG 4.1Å; A147-L207 HydrophobicContact CB-CD1 4.11Å; T191-L207 WeakPolarHBondContact CA-O 3.38Å; C192-L207 PolarHBondContact N-O 2.86Å; C192-L207 PolarHBondContact O-N 2.91Å; C192-L207 PolarHBondContact SG-O 2.93Å; L194-L207 HydrophobicContact CD1-CB 3.82Å; L194-L207 HydrophobicContact CD1-CD1 3.81Å; L194-L207 HydrophobicContact CD1-CD2 3.93Å; L194-L207 HydrophobicContact CD1-CG 4.04Å; L194-L207 HydrophobicContact CD2-CD2 4.29Å; L194-L207 HydrophobicContact CG-CB 3.79Å; L194-L207 HydrophobicContact CG-CD2 4.24Å; L194-L207 HydrophobicContact CG-CG 4.44Å
208	E	96.2	Very high	94.9	Very high	13 Å²	13	67.1 Å²	67.1	6%	0.061	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	164.1	174.2	61.7	173.1	176.2	0	0	111	H145 V146 K148 Q190 T261	H145-E208 CarbonylContact C-O 3.55Å; H145-E208 WeakPolarHBondContact CA-O 3.43Å; H145-E208 WeakPolarHBondContact CB-O 3.45Å; H145-E208 PolarHBondContact CD2-O 3.03Å; V146-E208 HydrophobicContact CB-CG 4.33Å; V146-E208 PolarHBondContact N-O 3.43Å; V146-E208 PolarHBondContact O-N 3.38Å; V146-E208 VanDerWaalsContact O-N 3.12Å; K148-E208 WeakPolarHBondContact CE-OE1 3.49Å; K148-E208 IonicContact NZ-OE1 2.92Å; K148-E208 PolarHBondContact NZ-OE1 3.42Å; Q190-E208 WeakPolarHBondContact O-CB 3.41Å; E208-T261 PolarHBondContact OE1-OG1 3.39Å; E208-T261 WeakPolarHBondContact OE2-CB 3.27Å; E208-T261 PolarHBondContact OE2-OG1 2.83Å
209	H	94.6	Very high	94.8	Very high	93 Å²	93	61.2 Å²	61.2	43%	0.431	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	144.4	175	-75.3	82.2	0	0	0	111.1	H145 I211	H145-H209 AromaticContact CE1-CD2 3.93Å; H145-H209 AromaticContact CE1-NE2 3.76Å; H145-H209 AromaticContact NE2-CD2 3.83Å; H145-H209 AromaticContact NE2-CE1 3.62Å; H145-H209 AromaticContact NE2-ND1 3.92Å; H145-H209 AromaticContact NE2-NE2 3.57Å; H209-I211 PolarHBondContact O-N 3.04Å
210	F	94.7	Very high	94.7	Very high	60 Å²	60	59.1 Å²	59.1	26%	0.263	30%	0.302	S	S	.	.			trans	-65.8	130.5	168.3	173.7	-113.6	0	0	0	110.1	P76 W77 N144 V146 E212	P76-F210 HydrophobicContact CB-CE1 4.26Å; P76-F210 HydrophobicContact CG-CD1 4.18Å; P76-F210 HydrophobicContact CG-CE1 3.74Å; W77-F210 AromaticContact CE2-CD2 3.84Å; W77-F210 AromaticContact CE2-CE2 3.96Å; W77-F210 AromaticContact CE2-CG 3.94Å; W77-F210 HydrophobicContact CH2-CB 3.86Å; W77-F210 AromaticContact CH2-CD2 3.85Å; W77-F210 HydrophobicContact CH2-CD2 3.85Å; W77-F210 AromaticContact CH2-CG 3.93Å; W77-F210 HydrophobicContact CH2-CG 3.93Å; W77-F210 HydrophobicContact CZ2-CB 4.04Å; W77-F210 HydrophobicContact CZ2-CD1 4.26Å; W77-F210 AromaticContact CZ2-CD2 3.21Å; W77-F210 HydrophobicContact CZ2-CD2 3.21Å; W77-F210 AromaticContact CZ2-CE2 3.65Å; W77-F210 HydrophobicContact CZ2-CE2 3.65Å; W77-F210 AromaticContact CZ2-CG 3.56Å; W77-F210 HydrophobicContact CZ2-CG 3.56Å; W77-F210 HydrophobicContact CZ2-CZ 4.32Å; W77-F210 HydrophobicContact CZ3-CB 4.32Å; W77-F210 AromaticContact NE1-CE1 3.95Å; W77-F210 AromaticContact NE1-CE2 3.86Å; W77-F210 AromaticContact NE1-CZ 3.72Å; N144-F210 HydrophobicContact CB-CB 3.85Å; N144-F210 HydrophobicContact CB-CD1 4.44Å; N144-F210 HydrophobicContact CB-CG 4.5Å; N144-F210 PolarHBondContact O-N 3.03Å; V146-F210 HydrophobicContact CG2-CB 4.29Å; V146-F210 HydrophobicContact CG2-CD2 4.06Å; F210-E212 HydrophobicContact CE1-CB 3.92Å; F210-E212 HydrophobicContact CE1-CG 4.45Å; F210-E212 HydrophobicContact CZ-CB 4.44Å
211	I	92.8	Very high	94.5	Very high	33 Å²	33	55.5 Å²	55.5	17%	0.169	28%	0.276	C	S	.	.			trans	-106.4	111.4	175.7	-52.7	167.6	0	0	0	107.8	H209 V256 L259	H209-I211 PolarHBondContact O-N 3.04Å; I211-V256 HydrophobicContact CB-CG2 4.32Å; I211-V256 HydrophobicContact CG2-CB 3.62Å; I211-V256 HydrophobicContact CG2-CG2 3.61Å; I211-L259 HydrophobicContact CD1-CD2 4.03Å; I211-L259 HydrophobicContact CD1-CG 3.94Å; I211-L259 HydrophobicContact CG1-CD2 3.9Å; I211-L259 HydrophobicContact CG1-CG 4.37Å; I211-L259 HydrophobicContact CG2-CD2 3.88Å; I211-L259 HydrophobicContact CG2-CG 4.45Å
212	E	89.1	Confident	94.2	Very high	123 Å²	123	50.3 Å²	50.3	58%	0.575	26%	0.259	S	S	*	.			trans	-72.2	136.4	176	-173.4	176.8	-168.6	0	0	111.3	F210 V256	F210-E212 HydrophobicContact CE1-CB 3.92Å; F210-E212 HydrophobicContact CE1-CG 4.45Å; F210-E212 HydrophobicContact CZ-CB 4.44Å; E212-V256 WeakPolarHBondContact O-CG1 3.29Å
213	G	90.2	Very high	93.5	Very high	53 Å²	53	45.6 Å²	45.6	55%	0.546	24%	0.243	S	C	.	.	S	Bend	trans	125.4	-173.2	173	0	0	0	0	0	113.8	Y215	G213-Y215 PolarHBondContact O-N 3.24Å
214	T	90	Very high	93	Very high	113 Å²	113	48.9 Å²	48.9	69%	0.693	25%	0.253	S	S	*	.			trans	-79.3	108.8	-175.5	-53.5	0	0	0	0	110.9	R216	T214-R216 PolarHBondContact O-N 3.34Å
215	Y	91.8	Very high	92.4	Very high	120 Å²	120	50.2 Å²	50.2	47%	0.471	26%	0.262	S	S	.	.			trans	-64.2	131.6	174.6	-172.7	-86.8	0	0	0	111.1	G213 Q254 T261	G213-Y215 PolarHBondContact O-N 3.24Å; Y215-Q254 HydrophobicContact CE1-CB 4.23Å; Y215-Q254 WeakPolarHBondContact OH-CG 3.41Å; Y215-Q254 PolarHBondContact OH-OE1 3.38Å; Y215-Q254 VanDerWaalsContact OH-OE1 3.07Å; Y215-T261 HydrophobicContact CE2-CG2 4.03Å
216	R	92.8	Very high	91.8	Very high	80 Å²	80	51 Å²	51	30%	0.302	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	139	178.8	-170.1	168.4	-173.9	176.4	6	112.1	T214 Y218 D226 Q254 G255	T214-R216 PolarHBondContact O-N 3.34Å; R216-Y218 HydrophobicContact CB-CE1 4.17Å; R216-Y218 HydrophobicContact CG-CD1 4.34Å; R216-Y218 HydrophobicContact CG-CE1 3.94Å; R216-Y218 WeakPolarHBondContact O-CE2 3.39Å; R216-D226 IonicContact CZ-OD1 3.52Å; R216-D226 IonicContact CZ-OD2 3.9Å; R216-D226 IonicContact NE-OD1 3.29Å; R216-D226 PolarHBondContact NE-OD1 3.22Å; R216-D226 VanDerWaalsContact NE-OD1 3.09Å; R216-D226 IonicContact NE-OD2 2.94Å; R216-D226 PolarHBondContact NE-OD2 2.71Å; R216-D226 IonicContact NH2-OD1 2.66Å; R216-D226 PolarHBondContact NH2-OD1 3.19Å; R216-D226 IonicContact NH2-OD2 3.6Å; R216-D226 PolarHBondContact NH2-OD2 3.3Å; R216-Q254 CarbonylContact O-C 3.57Å; R216-Q254 VanDerWaalsContact O-CA 3.25Å; R216-Q254 WeakPolarHBondContact O-CA 3.14Å; R216-G255 PolarHBondContact N-O 3.48Å; R216-G255 PolarHBondContact O-N 2.94Å
217	K	94.6	Very high	90.9	Very high	73 Å²	73	58.3 Å²	58.3	32%	0.317	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	120	174	-176.3	166.3	-170.9	138	0	109.8	N219 F224 D226 D252 Q254	K217-N219 WeakPolarHBondContact CE-O 3.48Å; K217-N219 WeakPolarHBondContact CG-O 3.27Å; K217-F224 HydrophobicContact CG-CE1 4.41Å; K217-D226 WeakPolarHBondContact O-CB 3.47Å; K217-D252 WeakPolarHBondContact CE-OD1 3.24Å; K217-D252 IonicContact NZ-OD1 3.99Å; K217-D252 PolarHBondContact NZ-OD1 3.26Å; K217-D252 IonicContact NZ-OD2 3.21Å; K217-D252 PolarHBondContact NZ-OD2 3.4Å; K217-Q254 HydrophobicContact CB-CB 4.09Å; K217-Q254 HydrophobicContact CG-CB 4.17Å
218	Y	95.3	Very high	89.9	Confident	7 Å²	7	64.3 Å²	64.3	3%	0.027	34%	0.337	C	S	.	.			trans	-96.8	-35.2	-173.2	-55.9	-74.9	0	0	0	113.1	R216 D226 R230 P233 Q234 I253 G257 W260	R216-Y218 HydrophobicContact CB-CE1 4.17Å; R216-Y218 HydrophobicContact CG-CD1 4.34Å; R216-Y218 HydrophobicContact CG-CE1 3.94Å; R216-Y218 WeakPolarHBondContact O-CE2 3.39Å; Y218-D226 PolarHBondContact O-N 3.19Å; Y218-R230 HydrophobicContact CD1-CB 4.38Å; Y218-R230 VanDerWaalsContact CE1-CZ 3.43Å; Y218-R230 VanDerWaalsContact CZ-CZ 3.45Å; Y218-R230 PolarHBondContact OH-NH1 3.02Å; Y218-P233 HydrophobicContact CD1-CG 3.87Å; Y218-P233 HydrophobicContact CD2-CB 4.21Å; Y218-P233 HydrophobicContact CD2-CG 3.71Å; Y218-P233 HydrophobicContact CE1-CG 4.49Å; Y218-P233 HydrophobicContact CE2-CG 4.38Å; Y218-P233 HydrophobicContact CG-CB 3.9Å; Y218-P233 HydrophobicContact CG-CG 3.44Å; Y218-P233 VanDerWaalsContact CG-CG 3.44Å; Y218-Q234 PolarHBondContact O-NE2 3.4Å; Y218-I253 WeakPolarHBondContact CB-O 3.07Å; Y218-I253 HydrophobicContact CD2-CG2 4.16Å; Y218-I253 WeakPolarHBondContact CD2-O 3.48Å; Y218-I253 PolarHBondContact N-O 3Å; Y218-G257 PolarHBondContact OH-O 2.97Å; Y218-W260 AromaticContact CE2-NE1 3.83Å
219	N	95.2	Very high	89	Confident	1 Å²	1	66 Å²	66	1%	0.005	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-146.8	175.4	169.4	64.4	37.7	0	0	0	110.5	K217 F224 Q234 S237 D252 I253	K217-N219 WeakPolarHBondContact CE-O 3.48Å; K217-N219 WeakPolarHBondContact CG-O 3.27Å; N219-F224 CarbonylContact C-O 3.48Å; N219-F224 WeakPolarHBondContact CA-O 3.17Å; N219-Q234 PolarHBondContact ND2-OE1 3.22Å; N219-S237 PolarHBondContact ND2-OG 2.85Å; N219-D252 PolarHBondContact OD1-N 3.46Å; N219-I253 PolarHBondContact N-O 3.31Å; N219-I253 PolarHBondContact OD1-N 3.41Å
220	S	94.1	Very high	88.7	Confident	6 Å²	6	64.6 Å²	64.6	4%	0.042	34%	0.341	C	S	.	.			trans	-128.4	171.3	176.1	73.6	0	0	0	0	112.9	S222 G223 F224 D252	S220-S222 PolarHBondContact O-N 3.41Å; S220-S222 PolarHBondContact OG-N 2.88Å; S220-S222 VanDerWaalsContact OG-N 3.16Å; S220-S222 PolarHBondContact OG-OG 3.04Å; S220-G223 PolarHBondContact OG-N 3.21Å; S220-F224 PolarHBondContact N-O 3.44Å; S220-F224 VanDerWaalsContact OG-CB 3.27Å; S220-F224 WeakPolarHBondContact OG-CB 3.39Å; S220-F224 PolarHBondContact OG-N 3.43Å; S220-D252 VanDerWaalsContact CA-OD1 3.28Å; S220-D252 WeakPolarHBondContact CA-OD1 3.45Å
221	N	91	Very high	88.7	Confident	43 Å²	43	65.1 Å²	65.1	23%	0.23	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-9.5	170.2	69.5	-12.2	0	0	0	115.2	V251 Q264 H266	N221-V251 HydrophobicContact CB-CG2 4.01Å; N221-Q264 HydrophobicContact CB-CB 4.1Å; N221-Q264 HydrophobicContact CB-CG 3.99Å; N221-H266 PolarHBondContact O-NE2 3.42Å
222	S	87.2	Confident	88.8	Confident	68 Å²	68	64 Å²	64	48%	0.476	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.6	11.8	-174	55.6	0	0	0	0	114.6	S220	S220-S222 PolarHBondContact O-N 3.41Å; S220-S222 PolarHBondContact OG-N 2.88Å; S220-S222 VanDerWaalsContact OG-N 3.16Å; S220-S222 PolarHBondContact OG-OG 3.04Å
223	G	82.4	Confident	89.2	Confident	14 Å²	14	58.1 Å²	58.1	14%	0.144	31%	0.314	C	S	.	.	S	Bend	trans	98	-0.4	175.2	0	0	0	0	0	115.5	S220 V225 T289	S220-G223 PolarHBondContact OG-N 3.21Å; G223-V225 PolarHBondContact O-N 3.39Å; G223-T289 WeakPolarHBondContact O-CG2 2.98Å; G223-T289 PolarHBondContact O-OG1 3.13Å
224	F	88.5	Confident	89.4	Confident	106 Å²	106	55.8 Å²	55.8	47%	0.465	29%	0.289	S	S	.	.			trans	-61	137.4	166.6	167.6	-89.9	0	0	0	111.1	K217 N219 S220	K217-F224 HydrophobicContact CG-CE1 4.41Å; N219-F224 CarbonylContact C-O 3.48Å; N219-F224 WeakPolarHBondContact CA-O 3.17Å; S220-F224 PolarHBondContact N-O 3.44Å; S220-F224 VanDerWaalsContact OG-CB 3.27Å; S220-F224 WeakPolarHBondContact OG-CB 3.39Å; S220-F224 PolarHBondContact OG-N 3.43Å
225	V	84.7	Confident	89.7	Confident	37 Å²	37	50.4 Å²	50.4	22%	0.224	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-132	134.5	174.8	173.9	0	0	0	0	107.9	G223	G223-V225 PolarHBondContact O-N 3.39Å
226	D	86.5	Confident	90	Very high	21 Å²	21	44.7 Å²	44.7	11%	0.112	23%	0.233	C	C	.	.			trans	-63.5	146.4	176.7	170.6	72.7	0	0	0	112.7	R216 K217 Y218 L228 S229	R216-D226 IonicContact CZ-OD1 3.52Å; R216-D226 IonicContact CZ-OD2 3.9Å; R216-D226 IonicContact NE-OD1 3.29Å; R216-D226 PolarHBondContact NE-OD1 3.22Å; R216-D226 VanDerWaalsContact NE-OD1 3.09Å; R216-D226 IonicContact NE-OD2 2.94Å; R216-D226 PolarHBondContact NE-OD2 2.71Å; R216-D226 IonicContact NH2-OD1 2.66Å; R216-D226 PolarHBondContact NH2-OD1 3.19Å; R216-D226 IonicContact NH2-OD2 3.6Å; R216-D226 PolarHBondContact NH2-OD2 3.3Å; K217-D226 WeakPolarHBondContact O-CB 3.47Å; Y218-D226 PolarHBondContact O-N 3.19Å; D226-L228 VanDerWaalsContact C-N 3.33Å; D226-L228 PolarHBondContact O-N 3.41Å; D226-L228 PolarHBondContact OD2-N 3Å; D226-S229 VanDerWaalsContact O-CA 3.28Å; D226-S229 WeakPolarHBondContact O-CA 3.36Å; D226-S229 PolarHBondContact O-N 3.24Å
227	D	78.4	Confident	90.2	Very high	157 Å²	157	40.9 Å²	40.9	84%	0.84	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-34.7	-173.1	-66	-32.7	0	0	0	113.6	S229	D227-S229 PolarHBondContact O-N 3.4Å
228	L	78.1	Confident	90.3	Very high	129 Å²	129	37.4 Å²	37.4	68%	0.675	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-8.1	174.9	-62.5	-178.1	0	0	0	112.3	D226 R230	D226-L228 VanDerWaalsContact C-N 3.33Å; D226-L228 PolarHBondContact O-N 3.41Å; D226-L228 PolarHBondContact OD2-N 3Å; L228-R230 VanDerWaalsContact C-N 3.3Å; L228-R230 PolarHBondContact O-N 3.14Å; L228-R230 VanDerWaalsContact O-N 3.08Å
229	S	76.3	Confident	90.4	Very high	50 Å²	50	37.4 Å²	37.4	35%	0.35	20%	0.204	S	C	.	.			trans	35.3	56.2	176.2	-177.2	0	0	0	0	113.7	D226 D227 N231	D226-S229 VanDerWaalsContact O-CA 3.28Å; D226-S229 WeakPolarHBondContact O-CA 3.36Å; D226-S229 PolarHBondContact O-N 3.24Å; D227-S229 PolarHBondContact O-N 3.4Å; S229-N231 PolarHBondContact O-N 3.48Å
230	R	90	Very high	90.3	Very high	63 Å²	63	37.4 Å²	37.4	24%	0.238	20%	0.204	C	C	.	.			trans	-55.5	134.3	-176.3	-160.9	178.3	76.5	-157.7	-1	111.2	Y218 L228 T232 P233 G257 N258	Y218-R230 HydrophobicContact CD1-CB 4.38Å; Y218-R230 VanDerWaalsContact CE1-CZ 3.43Å; Y218-R230 VanDerWaalsContact CZ-CZ 3.45Å; Y218-R230 PolarHBondContact OH-NH1 3.02Å; L228-R230 VanDerWaalsContact C-N 3.3Å; L228-R230 PolarHBondContact O-N 3.14Å; L228-R230 VanDerWaalsContact O-N 3.08Å; R230-T232 PolarHBondContact O-N 3.28Å; R230-P233 HydrophobicContact CB-CG 4.49Å; R230-P233 WeakPolarHBondContact O-CD 3.33Å; R230-G257 PolarHBondContact NH1-O 2.87Å; R230-G257 PolarHBondContact NH2-O 3.2Å; R230-N258 PolarHBondContact NH2-OD1 3.45Å
231	N	93.6	Very high	90.4	Very high	71 Å²	71	37.9 Å²	37.9	38%	0.38	21%	0.205	S	C	.	.	H	α-helix	trans	-60.4	-43.7	-172.8	-69.3	-25.2	0	0	0	114.3	S229 Q234 A235 N293 L295	S229-N231 PolarHBondContact O-N 3.48Å; N231-Q234 PolarHBondContact O-N 3.49Å; N231-A235 VanDerWaalsContact O-CB 3.27Å; N231-A235 WeakPolarHBondContact O-CB 3.34Å; N231-A235 PolarHBondContact O-N 2.97Å; N231-N293 WeakPolarHBondContact CA-ND2 3.16Å; N231-N293 HydrophobicContact CB-CB 4.36Å; N231-N293 PolarHBondContact O-ND2 3.39Å; N231-N293 VanDerWaalsContact OD1-CB 3.28Å; N231-N293 WeakPolarHBondContact OD1-CB 3.28Å; N231-L295 HydrophobicContact CB-CD1 3.77Å; N231-L295 HydrophobicContact CB-CG 4.16Å
232	T	95.3	Very high	90.5	Very high	8 Å²	8	36.8 Å²	36.8	5%	0.049	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-51.8	-171.1	-57.4	0	0	0	0	113.8	Y176 V186 R230 Q234 A235 F236 W260 L295	Y176-T232 HydrophobicContact CE1-CG2 4.29Å; V186-T232 HydrophobicContact CG1-CG2 3.58Å; R230-T232 PolarHBondContact O-N 3.28Å; T232-Q234 PolarHBondContact O-N 2.91Å; T232-A235 PolarHBondContact O-N 2.78Å; T232-F236 WeakPolarHBondContact O-CB 3.2Å; T232-F236 PolarHBondContact O-N 3.28Å; T232-W260 HydrophobicContact CG2-CH2 4.36Å; T232-W260 HydrophobicContact CG2-CZ2 4.33Å; T232-L295 WeakPolarHBondContact OG1-CD1 3.18Å
233	P	96.7	Very high	90.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-56.1	-43.8	175.7	-27.7	34.8	0	0	0	114.2	Y218 R230 F236 S237 I253 W260	Y218-P233 HydrophobicContact CD1-CG 3.87Å; Y218-P233 HydrophobicContact CD2-CB 4.21Å; Y218-P233 HydrophobicContact CD2-CG 3.71Å; Y218-P233 HydrophobicContact CE1-CG 4.49Å; Y218-P233 HydrophobicContact CE2-CG 4.38Å; Y218-P233 HydrophobicContact CG-CB 3.9Å; Y218-P233 HydrophobicContact CG-CG 3.44Å; Y218-P233 VanDerWaalsContact CG-CG 3.44Å; R230-P233 HydrophobicContact CB-CG 4.49Å; R230-P233 WeakPolarHBondContact O-CD 3.33Å; P233-F236 PolarHBondContact O-N 3.1Å; P233-S237 PolarHBondContact O-N 3.11Å; P233-S237 VanDerWaalsContact O-N 3.09Å; P233-S237 PolarHBondContact O-OG 2.82Å; P233-I253 HydrophobicContact CB-CB 4.19Å; P233-I253 HydrophobicContact CB-CG2 3.84Å; P233-I253 HydrophobicContact CG-CG2 4.4Å; P233-W260 HydrophobicContact CB-CZ2 4.33Å; P233-W260 HydrophobicContact CG-CZ2 3.98Å
234	Q	95.3	Very high	90.9	Very high	5 Å²	5	37.7 Å²	37.7	2%	0.023	19%	0.19	C	C	.	.	H	α-helix	trans	-69.2	-43	-179.1	-58.4	-56.1	-16.5	0	0	111.9	Y218 N219 N231 T232 F236 S237 H238	Y218-Q234 PolarHBondContact O-NE2 3.4Å; N219-Q234 PolarHBondContact ND2-OE1 3.22Å; N231-Q234 PolarHBondContact O-N 3.49Å; T232-Q234 PolarHBondContact O-N 2.91Å; Q234-F236 VanDerWaalsContact C-N 3.31Å; Q234-F236 PolarHBondContact O-N 3.22Å; Q234-S237 PolarHBondContact O-N 2.85Å; Q234-H238 PolarHBondContact O-N 2.97Å; Q234-H238 VanDerWaalsContact O-N 3.08Å
235	A	95.8	Very high	90.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-66.5	-33.6	176.1	0	0	0	0	0	112.1	N231 T232 F239 L295 L299	N231-A235 VanDerWaalsContact O-CB 3.27Å; N231-A235 WeakPolarHBondContact O-CB 3.34Å; N231-A235 PolarHBondContact O-N 2.97Å; T232-A235 PolarHBondContact O-N 2.78Å; A235-F239 WeakPolarHBondContact O-CB 3.05Å; A235-F239 PolarHBondContact O-N 2.77Å; A235-L295 HydrophobicContact CB-CB 3.61Å; A235-L295 HydrophobicContact CB-CD1 4.33Å; A235-L299 HydrophobicContact CB-CD1 4.39Å
236	F	97.8	Very high	91.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.4	-52.2	173.4	169.8	-102.3	0	0	0	111.5	W172 Y176 V186 I188 T232 P233 Q234 H238 F239 T240 V250 I253 W260	W172-F236 HydrophobicContact CB-CE2 4.26Å; W172-F236 HydrophobicContact CB-CZ 4.08Å; Y176-F236 HydrophobicContact CD1-CD2 4.4Å; Y176-F236 HydrophobicContact CD2-CB 4.27Å; Y176-F236 AromaticContact CD2-CD2 3.9Å; Y176-F236 HydrophobicContact CD2-CD2 3.9Å; Y176-F236 HydrophobicContact CE2-CB 4.22Å; Y176-F236 AromaticContact CG-CD2 3.76Å; Y176-F236 HydrophobicContact CG-CD2 3.76Å; V186-F236 HydrophobicContact CG2-CD2 4.26Å; V186-F236 HydrophobicContact CG2-CE2 4.46Å; I188-F236 HydrophobicContact CD1-CZ 4.39Å; T232-F236 WeakPolarHBondContact O-CB 3.2Å; T232-F236 PolarHBondContact O-N 3.28Å; P233-F236 PolarHBondContact O-N 3.1Å; Q234-F236 VanDerWaalsContact C-N 3.31Å; Q234-F236 PolarHBondContact O-N 3.22Å; F236-H238 PolarHBondContact O-N 2.76Å; F236-F239 WeakPolarHBondContact O-CB 3.36Å; F236-F239 PolarHBondContact O-N 2.82Å; F236-F239 VanDerWaalsContact O-N 3.12Å; F236-T240 HydrophobicContact CD2-CG2 4.3Å; F236-T240 HydrophobicContact CE1-CG2 4.16Å; F236-T240 HydrophobicContact CE2-CG2 3.81Å; F236-T240 HydrophobicContact CZ-CG2 3.75Å; F236-T240 WeakPolarHBondContact O-CG2 3.34Å; F236-T240 PolarHBondContact O-N 2.94Å; F236-V250 HydrophobicContact CE1-CB 3.87Å; F236-V250 HydrophobicContact CE1-CG1 3.75Å; F236-V250 HydrophobicContact CZ-CB 4.23Å; F236-V250 HydrophobicContact CZ-CG1 4.19Å; F236-I253 HydrophobicContact CD1-CD1 3.64Å; F236-I253 HydrophobicContact CD1-CG1 4.13Å; F236-I253 HydrophobicContact CE1-CD1 3.56Å; F236-W260 HydrophobicContact CB-CH2 3.77Å; F236-W260 HydrophobicContact CB-CZ3 4.01Å; F236-W260 HydrophobicContact CD1-CE3 4.31Å; F236-W260 HydrophobicContact CD1-CH2 4.04Å; F236-W260 AromaticContact CD1-CZ3 3.45Å; F236-W260 HydrophobicContact CD1-CZ3 3.45Å; F236-W260 VanDerWaalsContact CD1-CZ3 3.45Å; F236-W260 HydrophobicContact CD2-CH2 4.47Å; F236-W260 AromaticContact CD2-CZ3 3.97Å; F236-W260 HydrophobicContact CD2-CZ3 3.97Å; F236-W260 HydrophobicContact CE1-CE3 4.36Å; F236-W260 AromaticContact CE1-CZ3 3.83Å; F236-W260 HydrophobicContact CE1-CZ3 3.83Å; F236-W260 HydrophobicContact CE2-CZ3 4.33Å; F236-W260 AromaticContact CG-CH2 3.83Å; F236-W260 HydrophobicContact CG-CH2 3.83Å; F236-W260 AromaticContact CG-CZ3 3.51Å; F236-W260 HydrophobicContact CG-CZ3 3.51Å; F236-W260 HydrophobicContact CZ-CZ3 4.26Å
237	S	97.7	Very high	91.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-56.6	-49.5	177.5	-68.1	0	0	0	0	111.2	N219 P233 Q234 F239 T240 F241 I249 V250	N219-S237 PolarHBondContact ND2-OG 2.85Å; P233-S237 PolarHBondContact O-N 3.11Å; P233-S237 VanDerWaalsContact O-N 3.09Å; P233-S237 PolarHBondContact O-OG 2.82Å; Q234-S237 PolarHBondContact O-N 2.85Å; S237-F239 VanDerWaalsContact C-N 3.34Å; S237-F239 PolarHBondContact O-N 3.42Å; S237-T240 PolarHBondContact O-N 3.22Å; S237-T240 PolarHBondContact O-OG1 2.65Å; S237-F241 PolarHBondContact O-N 2.8Å; S237-I249 WeakPolarHBondContact O-CG1 3.32Å; S237-V250 WeakPolarHBondContact CA-O 3.46Å; S237-V250 WeakPolarHBondContact CB-O 3.47Å; S237-V250 PolarHBondContact OG-O 2.87Å
238	H	96.3	Very high	92.3	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59	-42	175.2	-173.2	-172	0	0	0	112.6	Q234 F236 T240 F241 E242 F286 F287 H290 C292 L301 S302	Q234-H238 PolarHBondContact O-N 2.97Å; Q234-H238 VanDerWaalsContact O-N 3.08Å; F236-H238 PolarHBondContact O-N 2.76Å; H238-T240 VanDerWaalsContact C-N 3.35Å; H238-T240 PolarHBondContact O-N 3.13Å; H238-F241 WeakPolarHBondContact O-CB 3.18Å; H238-F241 PolarHBondContact O-N 3.21Å; H238-E242 IonicContact CD2-OE1 3.81Å; H238-E242 IonicContact NE2-OE1 3.53Å; H238-E242 PolarHBondContact O-N 2.7Å; H238-E242 VanDerWaalsContact O-N 3.11Å; H238-F286 HydrophobicContact CB-CE1 4.41Å; H238-F287 AromaticContact CD2-CE1 3.66Å; H238-F287 AromaticContact CD2-CZ 3.86Å; H238-H290 AromaticContact CG-NE2 3.57Å; H238-H290 AromaticContact ND1-CD2 3.91Å; H238-H290 AromaticContact ND1-NE2 3.12Å; H238-H290 PolarHBondContact ND1-NE2 2.79Å; H238-H290 VanDerWaalsContact ND1-NE2 3.12Å; H238-C292 VanDerWaalsContact CE1-SG 3.53Å; H238-L301 HydrophobicContact CB-CD1 3.94Å; H238-S302 PolarHBondContact CE1-O 2.71Å; H238-S302 PolarHBondContact NE2-O 3.46Å
239	F	96.9	Very high	93.1	Very high	7 Å²	7	31.9 Å²	31.9	3%	0.031	16%	0.155	C	C	.	.	H	α-helix	trans	-57.7	-45.6	176.6	169.3	-92.3	0	0	0	111.9	E175 Y176 Q179 A235 F236 S237 F241 E242 R243 L299 L301	E175-F239 HydrophobicContact CG-CE1 4.05Å; E175-F239 HydrophobicContact CG-CZ 3.95Å; Y176-F239 HydrophobicContact CD2-CB 3.93Å; Y176-F239 AromaticContact CD2-CD1 3.79Å; Y176-F239 HydrophobicContact CD2-CD1 3.79Å; Y176-F239 HydrophobicContact CD2-CD2 4.35Å; Y176-F239 HydrophobicContact CD2-CE1 4.39Å; Y176-F239 AromaticContact CD2-CG 3.76Å; Y176-F239 HydrophobicContact CD2-CG 3.76Å; Y176-F239 HydrophobicContact CE2-CB 4.31Å; Y176-F239 HydrophobicContact CG-CD1 4.39Å; Q179-F239 HydrophobicContact CG-CD2 4.44Å; Q179-F239 HydrophobicContact CG-CE2 3.58Å; Q179-F239 HydrophobicContact CG-CZ 3.85Å; A235-F239 WeakPolarHBondContact O-CB 3.05Å; A235-F239 PolarHBondContact O-N 2.77Å; F236-F239 WeakPolarHBondContact O-CB 3.36Å; F236-F239 PolarHBondContact O-N 2.82Å; F236-F239 VanDerWaalsContact O-N 3.12Å; S237-F239 VanDerWaalsContact C-N 3.34Å; S237-F239 PolarHBondContact O-N 3.42Å; F239-F241 VanDerWaalsContact C-N 3.26Å; F239-F241 PolarHBondContact O-N 2.92Å; F239-E242 PolarHBondContact O-N 2.99Å; F239-R243 HydrophobicContact CD1-CB 4.47Å; F239-R243 HydrophobicContact CE1-CB 4.15Å; F239-R243 HydrophobicContact CE1-CG 4.17Å; F239-R243 HydrophobicContact CE2-CB 4.32Å; F239-R243 HydrophobicContact CE2-CG 4.33Å; F239-R243 HydrophobicContact CZ-CB 4.08Å; F239-R243 HydrophobicContact CZ-CG 3.83Å; F239-R243 WeakPolarHBondContact O-CB 3.48Å; F239-R243 PolarHBondContact O-N 3.03Å; F239-L299 HydrophobicContact CD2-CD2 4.35Å; F239-L301 HydrophobicContact CB-CD1 4.04Å; F239-L301 HydrophobicContact CB-CD2 4.37Å; F239-L301 HydrophobicContact CD2-CD2 4.14Å
240	T	94.8	Very high	94.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.6	-34.5	179.8	64.8	0	0	0	0	112.5	W172 F236 S237 H238 S244 V250	W172-T240 HydrophobicContact CB-CG2 3.81Å; W172-T240 HydrophobicContact CD2-CG2 4.19Å; W172-T240 HydrophobicContact CE3-CG2 4.14Å; W172-T240 HydrophobicContact CG-CG2 4.08Å; F236-T240 HydrophobicContact CD2-CG2 4.3Å; F236-T240 HydrophobicContact CE1-CG2 4.16Å; F236-T240 HydrophobicContact CE2-CG2 3.81Å; F236-T240 HydrophobicContact CZ-CG2 3.75Å; F236-T240 WeakPolarHBondContact O-CG2 3.34Å; F236-T240 PolarHBondContact O-N 2.94Å; S237-T240 PolarHBondContact O-N 3.22Å; S237-T240 PolarHBondContact O-OG1 2.65Å; H238-T240 VanDerWaalsContact C-N 3.35Å; H238-T240 PolarHBondContact O-N 3.13Å; T240-S244 WeakPolarHBondContact O-CB 3.11Å; T240-S244 PolarHBondContact O-N 3.09Å; T240-S244 PolarHBondContact O-OG 2.99Å; T240-V250 HydrophobicContact CG2-CB 3.97Å; T240-V250 HydrophobicContact CG2-CG2 3.74Å; T240-V250 PolarHBondContact OG1-N 3.09Å
241	F	95.1	Very high	94.5	Very high	16 Å²	16	26.5 Å²	26.5	7%	0.07	13%	0.127	C	C	.	.	H	α-helix	trans	-63.9	-53.3	173.6	-179	-99	0	0	0	112.5	S237 H238 F239 R243 S244 H246 L248 I249 M283 F287	S237-F241 PolarHBondContact O-N 2.8Å; H238-F241 WeakPolarHBondContact O-CB 3.18Å; H238-F241 PolarHBondContact O-N 3.21Å; F239-F241 VanDerWaalsContact C-N 3.26Å; F239-F241 PolarHBondContact O-N 2.92Å; F241-R243 PolarHBondContact O-N 2.96Å; F241-S244 PolarHBondContact O-OG 2.92Å; F241-S244 VanDerWaalsContact O-OG 3.07Å; F241-H246 AromaticContact CD1-CD2 3.55Å; F241-H246 HydrophobicContact CD2-CB 4.49Å; F241-H246 HydrophobicContact CE1-CB 4.02Å; F241-H246 AromaticContact CE1-CD2 3.18Å; F241-H246 WeakPolarHBondContact CE1-CD2 3.46Å; F241-H246 AromaticContact CE1-CG 3.61Å; F241-H246 AromaticContact CE1-NE2 3.71Å; F241-H246 HydrophobicContact CE2-CB 3.78Å; F241-H246 HydrophobicContact CZ-CB 3.51Å; F241-H246 AromaticContact CZ-CD2 3.67Å; F241-H246 AromaticContact CZ-CG 3.61Å; F241-H246 WeakPolarHBondContact O-CA 3.46Å; F241-H246 PolarHBondContact O-N 2.98Å; F241-L248 VanDerWaalsContact CA-O 3.27Å; F241-L248 WeakPolarHBondContact CA-O 3.46Å; F241-I249 HydrophobicContact CB-CB 4.2Å; F241-I249 HydrophobicContact CB-CD1 4.16Å; F241-I249 HydrophobicContact CB-CG1 4.11Å; F241-I249 HydrophobicContact CD2-CB 4.37Å; F241-M283 HydrophobicContact CD2-SD 4.47Å; F241-M283 HydrophobicContact CE2-SD 4.09Å; F241-F287 HydrophobicContact CB-CE2 4.28Å; F241-F287 HydrophobicContact CB-CZ 4.01Å; F241-F287 AromaticContact CD1-CE2 3.62Å; F241-F287 HydrophobicContact CD1-CE2 3.62Å; F241-F287 AromaticContact CD1-CZ 3.42Å; F241-F287 HydrophobicContact CD1-CZ 3.42Å; F241-F287 VanDerWaalsContact CD1-CZ 3.42Å; F241-F287 AromaticContact CD2-CE2 3.87Å; F241-F287 HydrophobicContact CD2-CE2 3.87Å; F241-F287 HydrophobicContact CD2-CZ 4.37Å; F241-F287 AromaticContact CE1-CE2 3.78Å; F241-F287 HydrophobicContact CE1-CE2 3.78Å; F241-F287 AromaticContact CE1-CZ 3.89Å; F241-F287 HydrophobicContact CE1-CZ 3.89Å; F241-F287 HydrophobicContact CE2-CE2 4.04Å; F241-F287 AromaticContact CG-CE2 3.65Å; F241-F287 HydrophobicContact CG-CE2 3.65Å; F241-F287 AromaticContact CG-CZ 3.67Å; F241-F287 HydrophobicContact CG-CZ 3.67Å; F241-F287 AromaticContact CZ-CE2 3.98Å; F241-F287 HydrophobicContact CZ-CE2 3.98Å
242	E	93.4	Very high	94.7	Very high	21 Å²	21	24.2 Å²	24.2	10%	0.098	12%	0.115	C	C	.	.	H	α-helix	trans	-66.4	-38.6	-179.3	-68	-55.5	149.1	0	0	112.8	K33 H238 F239 G245 H246 L301	K33-E242 PolarHBondContact NZ-O 2.73Å; H238-E242 IonicContact CD2-OE1 3.81Å; H238-E242 IonicContact NE2-OE1 3.53Å; H238-E242 PolarHBondContact O-N 2.7Å; H238-E242 VanDerWaalsContact O-N 3.11Å; F239-E242 PolarHBondContact O-N 2.99Å; E242-G245 PolarHBondContact O-N 3.38Å; E242-H246 IonicContact OE1-NE2 3.57Å; E242-H246 IonicContact OE2-CD2 3.68Å; E242-H246 IonicContact OE2-CE1 3.94Å; E242-H246 IonicContact OE2-NE2 2.86Å; E242-H246 PolarHBondContact OE2-NE2 2.88Å; E242-L301 HydrophobicContact CB-CD2 4.01Å; E242-L301 HydrophobicContact CG-CB 4.21Å; E242-L301 HydrophobicContact CG-CD2 4.1Å
243	R	90.7	Very high	94.8	Very high	81 Å²	81	23.9 Å²	23.9	31%	0.306	11%	0.113	S	C	.	.	H	α-helix	trans	-73.8	-34.1	-176.5	-165.4	67.2	169.9	152	1.5	111.9	W172 E175 F239 F241 G245	W172-R243 HydrophobicContact CZ3-CB 3.84Å; W172-R243 HydrophobicContact CZ3-CG 3.83Å; E175-R243 HydrophobicContact CG-CG 4.3Å; E175-R243 IonicContact OE1-CZ 2.99Å; E175-R243 VanDerWaalsContact OE1-CZ 3.31Å; E175-R243 IonicContact OE1-NE 2.94Å; E175-R243 PolarHBondContact OE1-NE 3.03Å; E175-R243 IonicContact OE1-NH2 3.86Å; E175-R243 PolarHBondContact OE1-NH2 3.01Å; F239-R243 HydrophobicContact CD1-CB 4.47Å; F239-R243 HydrophobicContact CE1-CB 4.15Å; F239-R243 HydrophobicContact CE1-CG 4.17Å; F239-R243 HydrophobicContact CE2-CB 4.32Å; F239-R243 HydrophobicContact CE2-CG 4.33Å; F239-R243 HydrophobicContact CZ-CB 4.08Å; F239-R243 HydrophobicContact CZ-CG 3.83Å; F239-R243 WeakPolarHBondContact O-CB 3.48Å; F239-R243 PolarHBondContact O-N 3.03Å; F241-R243 PolarHBondContact O-N 2.96Å; R243-G245 PolarHBondContact O-N 2.95Å
244	S	86.7	Confident	94.7	Very high	20 Å²	20	24.7 Å²	24.7	14%	0.14	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-4.3	173.5	73.3	0	0	0	0	114.2	T240 F241 R247 L248	T240-S244 WeakPolarHBondContact O-CB 3.11Å; T240-S244 PolarHBondContact O-N 3.09Å; T240-S244 PolarHBondContact O-OG 2.99Å; F241-S244 PolarHBondContact O-OG 2.92Å; F241-S244 VanDerWaalsContact O-OG 3.07Å; S244-R247 PolarHBondContact OG-N 3.27Å; S244-L248 PolarHBondContact OG-N 3.09Å; S244-L248 VanDerWaalsContact OG-N 3.15Å; S244-L248 PolarHBondContact OG-O 3.28Å
245	G	88.5	Confident	94.7	Very high	34 Å²	34	24.5 Å²	24.5	35%	0.351	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.9	40.9	-172.7	0	0	0	0	0	111.7	E242 R243 R247	E242-G245 PolarHBondContact O-N 3.38Å; R243-G245 PolarHBondContact O-N 2.95Å; G245-R247 PolarHBondContact O-N 3.19Å
246	H	90.9	Very high	94.6	Very high	96 Å²	96	26 Å²	26	44%	0.444	13%	0.125	S	C	.	.	S	Bend	trans	65.7	17.4	176.7	-45.6	160.5	0	0	0	113.9	F241 E242	F241-H246 AromaticContact CD1-CD2 3.55Å; F241-H246 HydrophobicContact CD2-CB 4.49Å; F241-H246 HydrophobicContact CE1-CB 4.02Å; F241-H246 AromaticContact CE1-CD2 3.18Å; F241-H246 WeakPolarHBondContact CE1-CD2 3.46Å; F241-H246 AromaticContact CE1-CG 3.61Å; F241-H246 AromaticContact CE1-NE2 3.71Å; F241-H246 HydrophobicContact CE2-CB 3.78Å; F241-H246 HydrophobicContact CZ-CB 3.51Å; F241-H246 AromaticContact CZ-CD2 3.67Å; F241-H246 AromaticContact CZ-CG 3.61Å; F241-H246 WeakPolarHBondContact O-CA 3.46Å; F241-H246 PolarHBondContact O-N 2.98Å; E242-H246 IonicContact OE1-NE2 3.57Å; E242-H246 IonicContact OE2-CD2 3.68Å; E242-H246 IonicContact OE2-CE1 3.94Å; E242-H246 IonicContact OE2-NE2 2.86Å; E242-H246 PolarHBondContact OE2-NE2 2.88Å
247	R	91.9	Very high	94.4	Very high	173 Å²	173	27.5 Å²	27.5	65%	0.653	14%	0.14	S	C	*	.	S	Bend	trans	-86.1	-26.7	-178.5	-67.4	-175.9	176.8	-137.9	-1.5	113.1	S244 G245 F268	S244-R247 PolarHBondContact OG-N 3.27Å; G245-R247 PolarHBondContact O-N 3.19Å; R247-F268 HydrophobicContact CB-CD1 4.37Å; R247-F268 PolarHBondContact O-N 3.11Å
248	L	96.2	Very high	94.3	Very high	25 Å²	25	29.7 Å²	29.7	13%	0.131	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	165.6	178.4	64.2	79.6	0	0	0	111.6	W172 F241 S244 V250 I265 H266 T267	W172-L248 HydrophobicContact CD2-CD1 4.49Å; W172-L248 HydrophobicContact CZ2-CD1 3.79Å; W172-L248 HydrophobicContact CZ2-CD2 3.99Å; W172-L248 HydrophobicContact CZ2-CG 4.21Å; F241-L248 VanDerWaalsContact CA-O 3.27Å; F241-L248 WeakPolarHBondContact CA-O 3.46Å; S244-L248 PolarHBondContact OG-N 3.09Å; S244-L248 VanDerWaalsContact OG-N 3.15Å; S244-L248 PolarHBondContact OG-O 3.28Å; L248-V250 HydrophobicContact CD1-CG2 4.4Å; L248-I265 HydrophobicContact CB-CG2 4.1Å; L248-H266 CarbonylContact C-O 3.52Å; L248-H266 WeakPolarHBondContact CA-O 3.19Å; L248-H266 WeakPolarHBondContact CB-O 3.34Å; L248-T267 HydrophobicContact CB-CG2 4.4Å
249	I	96.1	Very high	94.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	139.6	168.2	-171.5	173.4	0	0	0	109.4	S237 F241 V251 I265 H266 M283 F286 F287	S237-I249 WeakPolarHBondContact O-CG1 3.32Å; F241-I249 HydrophobicContact CB-CB 4.2Å; F241-I249 HydrophobicContact CB-CD1 4.16Å; F241-I249 HydrophobicContact CB-CG1 4.11Å; F241-I249 HydrophobicContact CD2-CB 4.37Å; I249-V251 HydrophobicContact CD1-CG1 4.04Å; I249-V251 HydrophobicContact CG1-CG1 3.95Å; I249-V251 HydrophobicContact CG2-CG1 4.16Å; I249-I265 WeakPolarHBondContact O-CA 3.22Å; I249-H266 HydrophobicContact CG2-CB 3.76Å; I249-H266 PolarHBondContact N-O 3.38Å; I249-H266 PolarHBondContact O-N 3.47Å; I249-M283 HydrophobicContact CB-CG 4.46Å; I249-M283 HydrophobicContact CG2-CB 4.4Å; I249-M283 HydrophobicContact CG2-CE 4.43Å; I249-M283 HydrophobicContact CG2-CG 3.55Å; I249-F286 HydrophobicContact CD1-CB 4.22Å; I249-F286 HydrophobicContact CD1-CD1 3.32Å; I249-F286 HydrophobicContact CD1-CD2 4.33Å; I249-F286 HydrophobicContact CD1-CE1 3.72Å; I249-F286 HydrophobicContact CD1-CG 3.68Å; I249-F286 HydrophobicContact CD1-CZ 4.39Å; I249-F287 HydrophobicContact CD1-CE2 4.32Å
250	V	98.4	Very high	94.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	122.7	172.9	-171.7	0	0	0	0	109	A169 W172 F236 S237 T240 L248 I253 P263 I265	A169-V250 HydrophobicContact CB-CG1 3.96Å; W172-V250 HydrophobicContact CB-CG2 4.12Å; W172-V250 HydrophobicContact CG-CG2 3.94Å; F236-V250 HydrophobicContact CE1-CB 3.87Å; F236-V250 HydrophobicContact CE1-CG1 3.75Å; F236-V250 HydrophobicContact CZ-CB 4.23Å; F236-V250 HydrophobicContact CZ-CG1 4.19Å; S237-V250 WeakPolarHBondContact CA-O 3.46Å; S237-V250 WeakPolarHBondContact CB-O 3.47Å; S237-V250 PolarHBondContact OG-O 2.87Å; T240-V250 HydrophobicContact CG2-CB 3.97Å; T240-V250 HydrophobicContact CG2-CG2 3.74Å; T240-V250 PolarHBondContact OG1-N 3.09Å; L248-V250 HydrophobicContact CD1-CG2 4.4Å; V250-I253 HydrophobicContact CG1-CD1 4.12Å; V250-P263 HydrophobicContact CG1-CB 3.94Å; V250-I265 HydrophobicContact CG2-CG1 4.25Å
251	V	97.3	Very high	94.4	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	-168.3	-176.9	-62.8	0	0	0	0	109.9	N221 I249 I253 P263 Q264 F286	N221-V251 HydrophobicContact CB-CG2 4.01Å; I249-V251 HydrophobicContact CD1-CG1 4.04Å; I249-V251 HydrophobicContact CG1-CG1 3.95Å; I249-V251 HydrophobicContact CG2-CG1 4.16Å; V251-I253 VanDerWaalsContact C-N 3.27Å; V251-I253 PolarHBondContact O-N 3.38Å; V251-P263 WeakPolarHBondContact O-CA 3.38Å; V251-Q264 HydrophobicContact CG2-CB 4.12Å; V251-Q264 HydrophobicContact CG2-CG 4.5Å; V251-Q264 WeakPolarHBondContact CG2-O 3.44Å; V251-Q264 PolarHBondContact N-O 2.88Å; V251-Q264 PolarHBondContact O-N 3.34Å; V251-F286 HydrophobicContact CG1-CB 4.45Å; V251-F286 HydrophobicContact CG1-CD2 3.98Å; V251-F286 HydrophobicContact CG1-CG 4.32Å
252	D	96.6	Very high	94.4	Very high	22 Å²	22	32.9 Å²	32.9	12%	0.118	17%	0.17	C	C	.	.			trans	57.4	42.3	-171.6	-140.7	45.4	0	0	0	112	K217 N219 S220 Q254 Q264	K217-D252 WeakPolarHBondContact CE-OD1 3.24Å; K217-D252 IonicContact NZ-OD1 3.99Å; K217-D252 PolarHBondContact NZ-OD1 3.26Å; K217-D252 IonicContact NZ-OD2 3.21Å; K217-D252 PolarHBondContact NZ-OD2 3.4Å; N219-D252 PolarHBondContact OD1-N 3.46Å; S220-D252 VanDerWaalsContact CA-OD1 3.28Å; S220-D252 WeakPolarHBondContact CA-OD1 3.45Å; D252-Q254 WeakPolarHBondContact O-CG 3.35Å; D252-Q254 PolarHBondContact O-N 3.18Å; D252-Q254 PolarHBondContact OD2-NE2 3.29Å; D252-Q264 HydrophobicContact CB-CB 3.91Å
253	I	97.7	Very high	94.6	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.01	17%	0.168	C	C	.	.			trans	-73.5	112.9	-176.9	-51.3	-54.7	0	0	0	109.1	Y218 N219 P233 F236 V250 V251 W260	Y218-I253 WeakPolarHBondContact CB-O 3.07Å; Y218-I253 HydrophobicContact CD2-CG2 4.16Å; Y218-I253 WeakPolarHBondContact CD2-O 3.48Å; Y218-I253 PolarHBondContact N-O 3Å; N219-I253 PolarHBondContact N-O 3.31Å; N219-I253 PolarHBondContact OD1-N 3.41Å; P233-I253 HydrophobicContact CB-CB 4.19Å; P233-I253 HydrophobicContact CB-CG2 3.84Å; P233-I253 HydrophobicContact CG-CG2 4.4Å; F236-I253 HydrophobicContact CD1-CD1 3.64Å; F236-I253 HydrophobicContact CD1-CG1 4.13Å; F236-I253 HydrophobicContact CE1-CD1 3.56Å; V250-I253 HydrophobicContact CG1-CD1 4.12Å; V251-I253 VanDerWaalsContact C-N 3.27Å; V251-I253 PolarHBondContact O-N 3.38Å; I253-W260 HydrophobicContact CD1-CE3 4.48Å; I253-W260 HydrophobicContact CG2-CD2 3.32Å; I253-W260 HydrophobicContact CG2-CE3 3.65Å; I253-W260 HydrophobicContact CG2-CG 3.75Å; I253-W260 HydrophobicContact CG2-CH2 3.99Å; I253-W260 HydrophobicContact CG2-CZ2 3.72Å; I253-W260 HydrophobicContact CG2-CZ3 3.97Å
254	Q	95.5	Very high	94.9	Very high	17 Å²	17	29.6 Å²	29.6	8%	0.079	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	152.2	-176.1	59.6	-160.8	-21.1	0	0	111.4	Y215 R216 K217 D252 W260 T261 D262	Y215-Q254 HydrophobicContact CE1-CB 4.23Å; Y215-Q254 WeakPolarHBondContact OH-CG 3.41Å; Y215-Q254 PolarHBondContact OH-OE1 3.38Å; Y215-Q254 VanDerWaalsContact OH-OE1 3.07Å; R216-Q254 CarbonylContact O-C 3.57Å; R216-Q254 VanDerWaalsContact O-CA 3.25Å; R216-Q254 WeakPolarHBondContact O-CA 3.14Å; K217-Q254 HydrophobicContact CB-CB 4.09Å; K217-Q254 HydrophobicContact CG-CB 4.17Å; D252-Q254 WeakPolarHBondContact O-CG 3.35Å; D252-Q254 PolarHBondContact O-N 3.18Å; D252-Q254 PolarHBondContact OD2-NE2 3.29Å; Q254-W260 CarbonylContact O-C 3.57Å; Q254-W260 WeakPolarHBondContact O-CA 3.26Å; Q254-W260 VanDerWaalsContact O-CB 3.29Å; Q254-W260 WeakPolarHBondContact O-CB 3.29Å; Q254-T261 VanDerWaalsContact CG-O 3.27Å; Q254-T261 WeakPolarHBondContact CG-O 3.26Å; Q254-T261 PolarHBondContact O-N 3.35Å; Q254-D262 PolarHBondContact NE2-O 3.05Å
255	G	95.2	Very high	95.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	146.3	-155.2	-179.3	0	0	0	0	0	112.5	R216	R216-G255 PolarHBondContact N-O 3.48Å; R216-G255 PolarHBondContact O-N 2.94Å
256	V	93.6	Very high	95.8	Very high	31 Å²	31	27 Å²	27	19%	0.188	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	120.3	-177.9	-175.3	0	0	0	0	109.8	I211 E212 N258 L259	I211-V256 HydrophobicContact CB-CG2 4.32Å; I211-V256 HydrophobicContact CG2-CB 3.62Å; I211-V256 HydrophobicContact CG2-CG2 3.61Å; E212-V256 WeakPolarHBondContact O-CG1 3.29Å; V256-N258 PolarHBondContact O-N 2.71Å; V256-N258 VanDerWaalsContact O-N 3.13Å; V256-L259 PolarHBondContact N-O 2.93Å; V256-L259 PolarHBondContact O-N 3.04Å
257	G	93.8	Very high	96	Very high	32 Å²	32	22.9 Å²	22.9	33%	0.33	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	-120.9	-177.2	0	0	0	0	0	111.4	Y218 R230 W260	Y218-G257 PolarHBondContact OH-O 2.97Å; R230-G257 PolarHBondContact NH1-O 2.87Å; R230-G257 PolarHBondContact NH2-O 3.2Å; G257-W260 PolarHBondContact O-NE1 2.96Å
258	N	95.2	Very high	96.1	Very high	47 Å²	47	20.4 Å²	20.4	25%	0.251	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	7.5	178.9	-53.6	-48.8	0	0	0	113.8	K185 V186 D187 R230 V256	K185-N258 VanDerWaalsContact O-CB 3.31Å; K185-N258 WeakPolarHBondContact O-CB 3.33Å; V186-N258 WeakPolarHBondContact CA-O 3.23Å; V186-N258 HydrophobicContact CG1-CB 4.27Å; D187-N258 PolarHBondContact N-O 2.97Å; R230-N258 PolarHBondContact NH2-OD1 3.45Å; V256-N258 PolarHBondContact O-N 2.71Å; V256-N258 VanDerWaalsContact O-N 3.13Å
259	L	96.2	Very high	95.9	Very high	61 Å²	61	22.6 Å²	22.6	32%	0.319	12%	0.123	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	113.3	171.8	-178.5	59.7	0	0	0	108.6	D187 I211 V256	D187-L259 HydrophobicContact CB-CD1 4.03Å; D187-L259 WeakPolarHBondContact O-CA 3.49Å; I211-L259 HydrophobicContact CD1-CD2 4.03Å; I211-L259 HydrophobicContact CD1-CG 3.94Å; I211-L259 HydrophobicContact CG1-CD2 3.9Å; I211-L259 HydrophobicContact CG1-CG 4.37Å; I211-L259 HydrophobicContact CG2-CD2 3.88Å; I211-L259 HydrophobicContact CG2-CG 4.45Å; V256-L259 PolarHBondContact N-O 2.93Å; V256-L259 PolarHBondContact O-N 3.04Å
260	W	97.7	Very high	95.8	Very high	3 Å²	3	24.2 Å²	24.2	1%	0.011	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	162.1	-171.3	-56.1	-34.5	0	0	0	112.4	V186 D187 I188 S189 Y218 T232 P233 F236 I253 Q254 G257	V186-W260 HydrophobicContact CB-CE3 4.26Å; V186-W260 HydrophobicContact CB-CH2 3.75Å; V186-W260 HydrophobicContact CB-CZ2 4.25Å; V186-W260 HydrophobicContact CB-CZ3 3.74Å; V186-W260 HydrophobicContact CG1-CH2 3.49Å; V186-W260 VanDerWaalsContact CG1-CH2 3.49Å; V186-W260 HydrophobicContact CG1-CZ2 3.88Å; V186-W260 HydrophobicContact CG1-CZ3 4.01Å; V186-W260 HydrophobicContact CG2-CE3 4.48Å; V186-W260 HydrophobicContact CG2-CH2 4.12Å; V186-W260 HydrophobicContact CG2-CZ3 3.78Å; D187-W260 PolarHBondContact O-N 3.49Å; I188-W260 CarbonylContact C-O 3.54Å; I188-W260 WeakPolarHBondContact CA-O 3.46Å; I188-W260 HydrophobicContact CG1-CB 4.12Å; I188-W260 HydrophobicContact CG1-CE3 4.31Å; S189-W260 PolarHBondContact N-O 3.33Å; Y218-W260 AromaticContact CE2-NE1 3.83Å; T232-W260 HydrophobicContact CG2-CH2 4.36Å; T232-W260 HydrophobicContact CG2-CZ2 4.33Å; P233-W260 HydrophobicContact CB-CZ2 4.33Å; P233-W260 HydrophobicContact CG-CZ2 3.98Å; F236-W260 HydrophobicContact CB-CH2 3.77Å; F236-W260 HydrophobicContact CB-CZ3 4.01Å; F236-W260 HydrophobicContact CD1-CE3 4.31Å; F236-W260 HydrophobicContact CD1-CH2 4.04Å; F236-W260 AromaticContact CD1-CZ3 3.45Å; F236-W260 HydrophobicContact CD1-CZ3 3.45Å; F236-W260 VanDerWaalsContact CD1-CZ3 3.45Å; F236-W260 HydrophobicContact CD2-CH2 4.47Å; F236-W260 AromaticContact CD2-CZ3 3.97Å; F236-W260 HydrophobicContact CD2-CZ3 3.97Å; F236-W260 HydrophobicContact CE1-CE3 4.36Å; F236-W260 AromaticContact CE1-CZ3 3.83Å; F236-W260 HydrophobicContact CE1-CZ3 3.83Å; F236-W260 HydrophobicContact CE2-CZ3 4.33Å; F236-W260 AromaticContact CG-CH2 3.83Å; F236-W260 HydrophobicContact CG-CH2 3.83Å; F236-W260 AromaticContact CG-CZ3 3.51Å; F236-W260 HydrophobicContact CG-CZ3 3.51Å; F236-W260 HydrophobicContact CZ-CZ3 4.26Å; I253-W260 HydrophobicContact CD1-CE3 4.48Å; I253-W260 HydrophobicContact CG2-CD2 3.32Å; I253-W260 HydrophobicContact CG2-CE3 3.65Å; I253-W260 HydrophobicContact CG2-CG 3.75Å; I253-W260 HydrophobicContact CG2-CH2 3.99Å; I253-W260 HydrophobicContact CG2-CZ2 3.72Å; I253-W260 HydrophobicContact CG2-CZ3 3.97Å; Q254-W260 CarbonylContact O-C 3.57Å; Q254-W260 WeakPolarHBondContact O-CA 3.26Å; Q254-W260 VanDerWaalsContact O-CB 3.29Å; Q254-W260 WeakPolarHBondContact O-CB 3.29Å; G257-W260 PolarHBondContact O-NE1 2.96Å
261	T	96.1	Very high	95.4	Very high	5 Å²	5	32.9 Å²	32.9	3%	0.031	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	161.9	176.1	-176.9	0	0	0	0	110	Q166 E208 Y215 Q254	Q166-T261 PolarHBondContact NE2-OG1 3.39Å; E208-T261 PolarHBondContact OE1-OG1 3.39Å; E208-T261 WeakPolarHBondContact OE2-CB 3.27Å; E208-T261 PolarHBondContact OE2-OG1 2.83Å; Y215-T261 HydrophobicContact CE2-CG2 4.03Å; Q254-T261 VanDerWaalsContact CG-O 3.27Å; Q254-T261 WeakPolarHBondContact CG-O 3.26Å; Q254-T261 PolarHBondContact O-N 3.35Å
262	D	94.5	Very high	95.1	Very high	20 Å²	20	35.4 Å²	35.4	11%	0.107	20%	0.195	C	C	.	.	S	Bend	trans	50.2	51.4	176.7	-62.3	-47.8	0	0	0	114.6	R122 K148 Q254	R122-D262 IonicContact CZ-OD1 3.6Å; R122-D262 VanDerWaalsContact CZ-OD1 3.26Å; R122-D262 IonicContact NH1-OD1 3.84Å; R122-D262 PolarHBondContact NH1-OD1 3.17Å; R122-D262 IonicContact NH2-OD1 2.77Å; R122-D262 PolarHBondContact NH2-OD1 3.12Å; R122-D262 IonicContact NH2-OD2 3.62Å; R122-D262 PolarHBondContact NH2-OD2 3.47Å; K148-D262 IonicContact NZ-OD1 3.26Å; K148-D262 IonicContact NZ-OD2 2.93Å; K148-D262 PolarHBondContact NZ-OD2 3.19Å; Q254-D262 PolarHBondContact NE2-O 3.05Å
263	P	97.3	Very high	94.9	Very high	10 Å²	10	36.7 Å²	36.7	7%	0.065	20%	0.199	C	C	.	.			trans	-70.4	168.3	173.5	32.7	-34.8	0	0	0	111.2	L165 Q166 A169 I188 V250 V251	L165-P263 HydrophobicContact CD2-CG 4.05Å; L165-P263 WeakPolarHBondContact CD2-O 3.36Å; Q166-P263 HydrophobicContact CG-CG 4.39Å; A169-P263 HydrophobicContact CB-CB 4.12Å; A169-P263 HydrophobicContact CB-CG 3.44Å; A169-P263 VanDerWaalsContact CB-CG 3.44Å; I188-P263 HydrophobicContact CD1-CG 4.4Å; I188-P263 HydrophobicContact CG2-CG 4.35Å; V250-P263 HydrophobicContact CG1-CB 3.94Å; V251-P263 WeakPolarHBondContact O-CA 3.38Å
264	Q	97.4	Very high	94.5	Very high	23 Å²	23	38.4 Å²	38.4	11%	0.107	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	142.7	166.8	-178.9	62.8	55	0	0	110	N221 V251 D252 Y273 G276	N221-Q264 HydrophobicContact CB-CB 4.1Å; N221-Q264 HydrophobicContact CB-CG 3.99Å; V251-Q264 HydrophobicContact CG2-CB 4.12Å; V251-Q264 HydrophobicContact CG2-CG 4.5Å; V251-Q264 WeakPolarHBondContact CG2-O 3.44Å; V251-Q264 PolarHBondContact N-O 2.88Å; V251-Q264 PolarHBondContact O-N 3.34Å; D252-Q264 HydrophobicContact CB-CB 3.91Å; Q264-Y273 PolarHBondContact NE2-O 3.24Å; Q264-Y273 VanDerWaalsContact NE2-O 3.1Å; Q264-G276 WeakPolarHBondContact CG-O 3.37Å
265	I	98	Very high	94.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	127	171.7	-61.1	176.7	0	0	0	109	L165 D168 A169 L248 I249 V250 T267 Y273	L165-I265 HydrophobicContact CD2-CD1 4.14Å; L165-I265 HydrophobicContact CD2-CG1 3.83Å; L165-I265 HydrophobicContact CG-CB 4.43Å; L165-I265 HydrophobicContact CG-CD1 4.26Å; L165-I265 HydrophobicContact CG-CG1 4.13Å; D168-I265 HydrophobicContact CB-CD1 4.22Å; A169-I265 HydrophobicContact CB-CD1 4.27Å; L248-I265 HydrophobicContact CB-CG2 4.1Å; I249-I265 WeakPolarHBondContact O-CA 3.22Å; V250-I265 HydrophobicContact CG2-CG1 4.25Å; I265-T267 HydrophobicContact CG2-CG2 4.03Å; I265-Y273 HydrophobicContact CB-CD2 3.79Å; I265-Y273 HydrophobicContact CB-CE2 4.13Å; I265-Y273 HydrophobicContact CB-CG 4.13Å; I265-Y273 HydrophobicContact CD1-CD1 4.43Å; I265-Y273 HydrophobicContact CD1-CD2 4.46Å; I265-Y273 HydrophobicContact CD1-CE1 4.11Å; I265-Y273 HydrophobicContact CD1-CE2 4.15Å; I265-Y273 HydrophobicContact CG2-CD2 3.73Å; I265-Y273 HydrophobicContact CG2-CE2 3.74Å
266	H	97.2	Very high	94.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	134	163.5	-62.1	-48	0	0	0	109.5	N221 L248 I249 G276 N277 L278 G282 M283	N221-H266 PolarHBondContact O-NE2 3.42Å; L248-H266 CarbonylContact C-O 3.52Å; L248-H266 WeakPolarHBondContact CA-O 3.19Å; L248-H266 WeakPolarHBondContact CB-O 3.34Å; I249-H266 HydrophobicContact CG2-CB 3.76Å; I249-H266 PolarHBondContact N-O 3.38Å; I249-H266 PolarHBondContact O-N 3.47Å; H266-G276 PolarHBondContact CE1-O 3.01Å; H266-N277 VanDerWaalsContact CA-OD1 3.25Å; H266-N277 WeakPolarHBondContact CA-OD1 3.29Å; H266-L278 PolarHBondContact CE1-N 3Å; H266-L278 VanDerWaalsContact CE1-N 3.33Å; H266-L278 PolarHBondContact ND1-N 3.25Å; H266-G282 WeakPolarHBondContact NE2-CA 3.35Å; H266-M283 HydrophobicContact CB-CE 4.2Å; H266-M283 HydrophobicContact CB-CG 4.18Å; H266-M283 WeakPolarHBondContact O-CE 3.42Å
267	T	95	Very high	94.2	Very high	10 Å²	10	45.6 Å²	45.6	6%	0.061	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	152.8	177.7	62.6	0	0	0	0	111.3	L248 I265 N269 G270 Y273 N277 G279	L248-T267 HydrophobicContact CB-CG2 4.4Å; I265-T267 HydrophobicContact CG2-CG2 4.03Å; T267-N269 PolarHBondContact O-N 3.41Å; T267-N269 PolarHBondContact OG1-OD1 3.4Å; T267-G270 PolarHBondContact O-N 3.04Å; T267-G270 PolarHBondContact OG1-N 3.1Å; T267-Y273 HydrophobicContact CG2-CD2 3.73Å; T267-Y273 HydrophobicContact CG2-CE2 3.72Å; T267-N277 PolarHBondContact N-OD1 2.91Å; T267-N277 PolarHBondContact OG1-ND2 3.15Å; T267-G279 WeakPolarHBondContact O-CA 3.24Å
268	F	93.1	Very high	94.2	Very high	121 Å²	121	47 Å²	47	53%	0.531	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-29.5	-178.1	78.7	-81.6	0	0	0	113.5	R247	R247-F268 HydrophobicContact CB-CD1 4.37Å; R247-F268 PolarHBondContact O-N 3.11Å
269	N	92.5	Very high	94.2	Very high	71 Å²	71	45 Å²	45	38%	0.38	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-13.2	179.4	64.7	5	0	0	0	114	T267 K271	T267-N269 PolarHBondContact O-N 3.41Å; T267-N269 PolarHBondContact OG1-OD1 3.4Å; N269-K271 WeakPolarHBondContact O-CG 3.44Å; N269-K271 PolarHBondContact O-N 2.86Å; N269-K271 PolarHBondContact OD1-N 2.62Å
270	G	93.1	Very high	94.1	Very high	33 Å²	33	47.8 Å²	47.8	34%	0.34	26%	0.263	S	S	.	.	S	Bend	trans	63.4	18.7	-178.6	0	0	0	0	0	115.7	T267	T267-G270 PolarHBondContact O-N 3.04Å; T267-G270 PolarHBondContact OG1-N 3.1Å
271	K	91.4	Very high	94	Very high	182 Å²	182	56.3 Å²	56.3	79%	0.791	30%	0.295	S	S	*	.			trans	-106.5	-2.6	-169.8	-72.2	-176.9	-178.8	-173.3	0	115.6	N269	N269-K271 WeakPolarHBondContact O-CG 3.44Å; N269-K271 PolarHBondContact O-N 2.86Å; N269-K271 PolarHBondContact OD1-N 2.62Å
272	S	90.2	Very high	93.9	Very high	53 Å²	53	56.1 Å²	56.1	37%	0.371	29%	0.294	S	S	.	.	S	Bend	trans	-122.4	163.4	-173.4	-54.8	0	0	0	0	110.6	G274 N277	S272-G274 PolarHBondContact O-N 2.9Å; S272-N277 VanDerWaalsContact O-CB 3.25Å; S272-N277 WeakPolarHBondContact O-CB 3.21Å; S272-N277 PolarHBondContact O-ND2 3.41Å
273	Y	91.8	Very high	93.9	Very high	50 Å²	50	55.7 Å²	55.7	20%	0.196	29%	0.292	C	S	.	.	S	Bend	trans	65	34.2	172	-50	-68.2	0	0	0	115.4	L165 D168 Q264 I265 T267	L165-Y273 HydrophobicContact CB-CD1 3.64Å; L165-Y273 HydrophobicContact CB-CE1 4.36Å; L165-Y273 HydrophobicContact CB-CG 4.37Å; L165-Y273 HydrophobicContact CD1-CG 4.48Å; L165-Y273 HydrophobicContact CG-CD1 3.81Å; L165-Y273 HydrophobicContact CG-CG 4.1Å; D168-Y273 HydrophobicContact CB-CE1 4.4Å; D168-Y273 WeakPolarHBondContact OD2-CE1 3.07Å; D168-Y273 PolarHBondContact OD2-OH 3.3Å; Q264-Y273 PolarHBondContact NE2-O 3.24Å; Q264-Y273 VanDerWaalsContact NE2-O 3.1Å; I265-Y273 HydrophobicContact CB-CD2 3.79Å; I265-Y273 HydrophobicContact CB-CE2 4.13Å; I265-Y273 HydrophobicContact CB-CG 4.13Å; I265-Y273 HydrophobicContact CD1-CD1 4.43Å; I265-Y273 HydrophobicContact CD1-CD2 4.46Å; I265-Y273 HydrophobicContact CD1-CE1 4.11Å; I265-Y273 HydrophobicContact CD1-CE2 4.15Å; I265-Y273 HydrophobicContact CG2-CD2 3.73Å; I265-Y273 HydrophobicContact CG2-CE2 3.74Å; T267-Y273 HydrophobicContact CG2-CD2 3.73Å; T267-Y273 HydrophobicContact CG2-CE2 3.72Å
274	G	89.5	Confident	93.6	Very high	38 Å²	38	57.7 Å²	57.7	39%	0.392	31%	0.309	S	S	.	.			trans	70.2	-176.1	171.7	0	0	0	0	0	115.8	S272 G276 N277	S272-G274 PolarHBondContact O-N 2.9Å; G274-G276 PolarHBondContact O-N 3.45Å; G274-G276 VanDerWaalsContact O-N 3.17Å; G274-N277 WeakPolarHBondContact O-CB 3.41Å; G274-N277 PolarHBondContact O-N 3.34Å; G274-N277 VanDerWaalsContact O-N 3.09Å
275	D	90.6	Very high	93.4	Very high	165 Å²	165	59.2 Å²	59.2	88%	0.882	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-17.9	-173	-67.2	-20.3	0	0	0	114	N277	D275-N277 PolarHBondContact O-N 3.47Å
276	G	91.5	Very high	93.2	Very high	20 Å²	20	59.4 Å²	59.4	21%	0.206	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-13	173.7	0	0	0	0	0	113.8	Q264 H266 G274 L278	Q264-G276 WeakPolarHBondContact CG-O 3.37Å; H266-G276 PolarHBondContact CE1-O 3.01Å; G274-G276 PolarHBondContact O-N 3.45Å; G274-G276 VanDerWaalsContact O-N 3.17Å; G276-L278 PolarHBondContact O-N 3.06Å
277	N	95.5	Very high	93	Very high	13 Å²	13	59.5 Å²	59.5	7%	0.07	32%	0.319	C	S	.	.			trans	-80	99.3	175.8	-177.8	0	0	0	0	111.3	H266 T267 S272 G274 D275 G279	H266-N277 VanDerWaalsContact CA-OD1 3.25Å; H266-N277 WeakPolarHBondContact CA-OD1 3.29Å; T267-N277 PolarHBondContact N-OD1 2.91Å; T267-N277 PolarHBondContact OG1-ND2 3.15Å; S272-N277 VanDerWaalsContact O-CB 3.25Å; S272-N277 WeakPolarHBondContact O-CB 3.21Å; S272-N277 PolarHBondContact O-ND2 3.41Å; G274-N277 WeakPolarHBondContact O-CB 3.41Å; G274-N277 PolarHBondContact O-N 3.34Å; G274-N277 VanDerWaalsContact O-N 3.09Å; D275-N277 PolarHBondContact O-N 3.47Å; N277-G279 PolarHBondContact O-N 2.93Å; N277-G279 WeakPolarHBondContact OD1-CA 3.47Å; N277-G279 PolarHBondContact OD1-N 3.32Å
278	L	95	Very high	92.8	Very high	62 Å²	62	62.9 Å²	62.9	33%	0.325	33%	0.331	S	S	.	.			trans	-84.8	7.7	176.6	-55.6	-179.5	0	0	0	112.8	H266 G276 R281 G282 L285	H266-L278 PolarHBondContact CE1-N 3Å; H266-L278 VanDerWaalsContact CE1-N 3.33Å; H266-L278 PolarHBondContact ND1-N 3.25Å; G276-L278 PolarHBondContact O-N 3.06Å; L278-R281 WeakPolarHBondContact O-CB 3.32Å; L278-R281 PolarHBondContact O-N 3.44Å; L278-G282 PolarHBondContact O-N 3.39Å; L278-G282 VanDerWaalsContact O-N 3.16Å; L278-L285 HydrophobicContact CD1-CD1 4.37Å
279	G	94.5	Very high	92.6	Very high	4 Å²	4	59 Å²	59	4%	0.041	32%	0.317	C	S	.	.	H	α-helix	trans	51.4	-136.5	-178.6	0	0	0	0	0	114.5	T267 N277 R281 G282 M283	T267-G279 WeakPolarHBondContact O-CA 3.24Å; N277-G279 PolarHBondContact O-N 2.93Å; N277-G279 WeakPolarHBondContact OD1-CA 3.47Å; N277-G279 PolarHBondContact OD1-N 3.32Å; G279-R281 PolarHBondContact O-N 2.92Å; G279-G282 PolarHBondContact O-N 3.16Å; G279-M283 PolarHBondContact O-N 3.05Å; G279-M283 VanDerWaalsContact O-N 3.1Å
280	I	95.1	Very high	92.6	Very high	121 Å²	121	56.1 Å²	56.1	62%	0.621	30%	0.302	S	S	*	.	H	α-helix	trans	-59.6	-28.2	178.8	60.2	173.5	0	0	0	113.2	M283 A284	I280-M283 HydrophobicContact CG2-SD 4.48Å; I280-M283 PolarHBondContact O-N 3.43Å; I280-A284 WeakPolarHBondContact O-CB 3.37Å; I280-A284 PolarHBondContact O-N 3.01Å
281	R	94.2	Very high	92.3	Very high	181 Å²	181	58.8 Å²	58.8	68%	0.683	30%	0.301	S	S	*	.	H	α-helix	trans	-67.3	-43.6	175.6	177.5	-176.1	175.7	-170.6	-1.8	110.3	L278 G279 M283 A284 L285	L278-R281 WeakPolarHBondContact O-CB 3.32Å; L278-R281 PolarHBondContact O-N 3.44Å; G279-R281 PolarHBondContact O-N 2.92Å; R281-M283 VanDerWaalsContact C-N 3.35Å; R281-A284 PolarHBondContact O-N 2.7Å; R281-L285 HydrophobicContact CG-CD1 4.31Å; R281-L285 VanDerWaalsContact O-CG 3.31Å; R281-L285 WeakPolarHBondContact O-CG 3.44Å; R281-L285 PolarHBondContact O-N 2.64Å
282	G	94.4	Very high	92.4	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-61.3	-42.3	174.6	0	0	0	0	0	112.7	H266 L278 G279 L285 F286	H266-G282 WeakPolarHBondContact NE2-CA 3.35Å; L278-G282 PolarHBondContact O-N 3.39Å; L278-G282 VanDerWaalsContact O-N 3.16Å; G279-G282 PolarHBondContact O-N 3.16Å; G282-L285 PolarHBondContact O-N 3.49Å; G282-F286 PolarHBondContact O-N 3.15Å; G282-F286 VanDerWaalsContact O-N 3.07Å
283	M	93.8	Very high	92.4	Very high	11 Å²	11	50.7 Å²	50.7	5%	0.054	27%	0.266	C	S	.	.	H	α-helix	trans	-59.6	-47.2	173.8	-64	172.1	-174.6	0	0	111.8	F241 I249 H266 G279 I280 R281 L285 F286 F287	F241-M283 HydrophobicContact CD2-SD 4.47Å; F241-M283 HydrophobicContact CE2-SD 4.09Å; I249-M283 HydrophobicContact CB-CG 4.46Å; I249-M283 HydrophobicContact CG2-CB 4.4Å; I249-M283 HydrophobicContact CG2-CE 4.43Å; I249-M283 HydrophobicContact CG2-CG 3.55Å; H266-M283 HydrophobicContact CB-CE 4.2Å; H266-M283 HydrophobicContact CB-CG 4.18Å; H266-M283 WeakPolarHBondContact O-CE 3.42Å; G279-M283 PolarHBondContact O-N 3.05Å; G279-M283 VanDerWaalsContact O-N 3.1Å; I280-M283 HydrophobicContact CG2-SD 4.48Å; I280-M283 PolarHBondContact O-N 3.43Å; R281-M283 VanDerWaalsContact C-N 3.35Å; M283-L285 PolarHBondContact O-N 3.02Å; M283-F286 PolarHBondContact O-N 3.03Å; M283-F287 VanDerWaalsContact O-CD2 3.28Å; M283-F287 WeakPolarHBondContact O-CD2 3.29Å; M283-F287 PolarHBondContact O-N 2.8Å; M283-F287 VanDerWaalsContact O-N 3.08Å
284	A	92.2	Very high	92.5	Very high	52 Å²	52	52.5 Å²	52.5	43%	0.43	28%	0.284	S	S	.	.	H	α-helix	trans	-62.6	-41.2	178.5	0	0	0	0	0	112.1	I280 R281 F286 F287 Y288	I280-A284 WeakPolarHBondContact O-CB 3.37Å; I280-A284 PolarHBondContact O-N 3.01Å; R281-A284 PolarHBondContact O-N 2.7Å; A284-F286 PolarHBondContact O-N 2.78Å; A284-F287 PolarHBondContact O-N 2.79Å; A284-Y288 WeakPolarHBondContact O-CB 3.39Å; A284-Y288 PolarHBondContact O-N 2.78Å
285	L	93.5	Very high	92.7	Very high	55 Å²	55	51.7 Å²	51.7	29%	0.288	27%	0.271	S	S	.	.	H	α-helix	trans	-61.9	-41.8	176.5	-73	170.5	0	0	0	112.2	L278 R281 G282 M283 T289	L278-L285 HydrophobicContact CD1-CD1 4.37Å; R281-L285 HydrophobicContact CG-CD1 4.31Å; R281-L285 VanDerWaalsContact O-CG 3.31Å; R281-L285 WeakPolarHBondContact O-CG 3.44Å; R281-L285 PolarHBondContact O-N 2.64Å; G282-L285 PolarHBondContact O-N 3.49Å; M283-L285 PolarHBondContact O-N 3.02Å; L285-T289 PolarHBondContact O-OG1 3.45Å
286	F	94.1	Very high	92.8	Very high	5 Å²	5	43.9 Å²	43.9	2%	0.022	23%	0.229	C	C	.	.	H	α-helix	trans	-58.8	-52.5	173.5	173.4	-93.5	0	0	0	111	H238 I249 V251 G282 M283 A284 Y288 T289 H290	H238-F286 HydrophobicContact CB-CE1 4.41Å; I249-F286 HydrophobicContact CD1-CB 4.22Å; I249-F286 HydrophobicContact CD1-CD1 3.32Å; I249-F286 HydrophobicContact CD1-CD2 4.33Å; I249-F286 HydrophobicContact CD1-CE1 3.72Å; I249-F286 HydrophobicContact CD1-CG 3.68Å; I249-F286 HydrophobicContact CD1-CZ 4.39Å; V251-F286 HydrophobicContact CG1-CB 4.45Å; V251-F286 HydrophobicContact CG1-CD2 3.98Å; V251-F286 HydrophobicContact CG1-CG 4.32Å; G282-F286 PolarHBondContact O-N 3.15Å; G282-F286 VanDerWaalsContact O-N 3.07Å; M283-F286 PolarHBondContact O-N 3.03Å; A284-F286 PolarHBondContact O-N 2.78Å; F286-Y288 VanDerWaalsContact C-N 3.33Å; F286-Y288 PolarHBondContact O-N 2.76Å; F286-T289 PolarHBondContact O-N 3.12Å; F286-T289 PolarHBondContact O-OG1 2.78Å; F286-H290 HydrophobicContact CD1-CB 4.2Å; F286-H290 HydrophobicContact CE1-CB 3.78Å; F286-H290 AromaticContact CE1-CG 3.76Å; F286-H290 HydrophobicContact CZ-CB 4.02Å; F286-H290 AromaticContact CZ-CG 3.86Å; F286-H290 AromaticContact CZ-ND1 3.79Å; F286-H290 VanDerWaalsContact O-CB 3.32Å; F286-H290 WeakPolarHBondContact O-CB 3.13Å; F286-H290 PolarHBondContact O-N 2.9Å
287	F	92.6	Very high	92.9	Very high	1 Å²	1	48.6 Å²	48.6	0%	0.004	25%	0.249	C	C	.	.	H	α-helix	trans	-69.2	-27.9	-176.6	-77.8	-65	0	0	0	114.2	H238 F241 I249 M283 A284 T289 H290 F304	H238-F287 AromaticContact CD2-CE1 3.66Å; H238-F287 AromaticContact CD2-CZ 3.86Å; F241-F287 HydrophobicContact CB-CE2 4.28Å; F241-F287 HydrophobicContact CB-CZ 4.01Å; F241-F287 AromaticContact CD1-CE2 3.62Å; F241-F287 HydrophobicContact CD1-CE2 3.62Å; F241-F287 AromaticContact CD1-CZ 3.42Å; F241-F287 HydrophobicContact CD1-CZ 3.42Å; F241-F287 VanDerWaalsContact CD1-CZ 3.42Å; F241-F287 AromaticContact CD2-CE2 3.87Å; F241-F287 HydrophobicContact CD2-CE2 3.87Å; F241-F287 HydrophobicContact CD2-CZ 4.37Å; F241-F287 AromaticContact CE1-CE2 3.78Å; F241-F287 HydrophobicContact CE1-CE2 3.78Å; F241-F287 AromaticContact CE1-CZ 3.89Å; F241-F287 HydrophobicContact CE1-CZ 3.89Å; F241-F287 HydrophobicContact CE2-CE2 4.04Å; F241-F287 AromaticContact CG-CE2 3.65Å; F241-F287 HydrophobicContact CG-CE2 3.65Å; F241-F287 AromaticContact CG-CZ 3.67Å; F241-F287 HydrophobicContact CG-CZ 3.67Å; F241-F287 AromaticContact CZ-CE2 3.98Å; F241-F287 HydrophobicContact CZ-CE2 3.98Å; I249-F287 HydrophobicContact CD1-CE2 4.32Å; M283-F287 VanDerWaalsContact O-CD2 3.28Å; M283-F287 WeakPolarHBondContact O-CD2 3.29Å; M283-F287 PolarHBondContact O-N 2.8Å; M283-F287 VanDerWaalsContact O-N 3.08Å; A284-F287 PolarHBondContact O-N 2.79Å; F287-T289 PolarHBondContact O-N 2.84Å; F287-H290 HydrophobicContact CD1-CB 4.39Å; F287-H290 PolarHBondContact O-N 3.03Å; F287-F304 HydrophobicContact CB-CB 4.26Å; F287-F304 HydrophobicContact CB-CD1 3.65Å; F287-F304 HydrophobicContact CB-CD2 4.12Å; F287-F304 HydrophobicContact CB-CE1 3.96Å; F287-F304 HydrophobicContact CB-CE2 4.4Å; F287-F304 HydrophobicContact CB-CG 3.74Å; F287-F304 HydrophobicContact CB-CZ 4.32Å; F287-F304 HydrophobicContact CD1-CB 3.4Å; F287-F304 HydrophobicContact CD1-CD1 4.38Å; F287-F304 AromaticContact CD1-CD2 3.87Å; F287-F304 HydrophobicContact CD1-CD2 3.87Å; F287-F304 AromaticContact CD1-CG 3.63Å; F287-F304 HydrophobicContact CD1-CG 3.63Å; F287-F304 AromaticContact CD2-CD2 3.67Å; F287-F304 HydrophobicContact CD2-CD2 3.67Å; F287-F304 AromaticContact CD2-CE2 3.86Å; F287-F304 HydrophobicContact CD2-CE2 3.86Å; F287-F304 HydrophobicContact CD2-CG 4.13Å; F287-F304 HydrophobicContact CD2-CZ 4.45Å; F287-F304 HydrophobicContact CE1-CB 3.86Å; F287-F304 HydrophobicContact CE1-CD2 4.18Å; F287-F304 HydrophobicContact CE1-CG 4.26Å; F287-F304 AromaticContact CE2-CD2 4Å; F287-F304 HydrophobicContact CE2-CD2 4Å; F287-F304 HydrophobicContact CE2-CE2 4.34Å; F287-F304 HydrophobicContact CG-CB 3.9Å; F287-F304 HydrophobicContact CG-CD1 4.03Å; F287-F304 AromaticContact CG-CD2 3.61Å; F287-F304 HydrophobicContact CG-CD2 3.61Å; F287-F304 HydrophobicContact CG-CE1 4.48Å; F287-F304 HydrophobicContact CG-CE2 4.11Å; F287-F304 AromaticContact CG-CG 3.56Å; F287-F304 HydrophobicContact CG-CG 3.56Å; F287-F304 HydrophobicContact CZ-CD2 4.24Å
288	Y	90.8	Very high	92.8	Very high	82 Å²	82	50.4 Å²	50.4	32%	0.322	27%	0.265	S	S	.	.	H	α-helix	trans	-56.5	-42	172.2	-179	-106.4	0	0	0	111.3	A284 F286 R291 E310	A284-Y288 WeakPolarHBondContact O-CB 3.39Å; A284-Y288 PolarHBondContact O-N 2.78Å; F286-Y288 VanDerWaalsContact C-N 3.33Å; F286-Y288 PolarHBondContact O-N 2.76Å; Y288-R291 PolarHBondContact O-NH1 2.79Å; Y288-R291 PolarHBondContact O-NH2 2.76Å; Y288-E310 HydrophobicContact CD2-CB 4.35Å; Y288-E310 HydrophobicContact CD2-CG 4.38Å; Y288-E310 HydrophobicContact CE2-CB 4.06Å; Y288-E310 HydrophobicContact CE2-CG 4.01Å
289	T	89.4	Confident	92.6	Very high	39 Å²	39	48.3 Å²	48.3	24%	0.239	25%	0.254	C	S	.	.	H	α-helix	trans	-93.1	-19.9	180	55.1	0	0	0	0	114.9	G223 L285 F286 F287	G223-T289 WeakPolarHBondContact O-CG2 2.98Å; G223-T289 PolarHBondContact O-OG1 3.13Å; L285-T289 PolarHBondContact O-OG1 3.45Å; F286-T289 PolarHBondContact O-N 3.12Å; F286-T289 PolarHBondContact O-OG1 2.78Å; F287-T289 PolarHBondContact O-N 2.84Å
290	H	91.8	Very high	92.5	Very high	10 Å²	10	53.3 Å²	53.3	5%	0.046	29%	0.289	C	S	.	.			trans	-72.7	136.2	-177.3	179.1	61.2	0	0	0	112	H238 F286 F287	H238-H290 AromaticContact CG-NE2 3.57Å; H238-H290 AromaticContact ND1-CD2 3.91Å; H238-H290 AromaticContact ND1-NE2 3.12Å; H238-H290 PolarHBondContact ND1-NE2 2.79Å; H238-H290 VanDerWaalsContact ND1-NE2 3.12Å; F286-H290 HydrophobicContact CD1-CB 4.2Å; F286-H290 HydrophobicContact CE1-CB 3.78Å; F286-H290 AromaticContact CE1-CG 3.76Å; F286-H290 HydrophobicContact CZ-CB 4.02Å; F286-H290 AromaticContact CZ-CG 3.86Å; F286-H290 AromaticContact CZ-ND1 3.79Å; F286-H290 VanDerWaalsContact O-CB 3.32Å; F286-H290 WeakPolarHBondContact O-CB 3.13Å; F286-H290 PolarHBondContact O-N 2.9Å; F287-H290 HydrophobicContact CD1-CB 4.39Å; F287-H290 PolarHBondContact O-N 3.03Å
291	R	87.3	Confident	92.4	Very high	89 Å²	89	48.3 Å²	48.3	34%	0.336	26%	0.263	S	S	.	.			trans	-123.8	124.8	168.4	-61.3	-64.8	174	-94.6	4.8	107.8	Y288 N293 L306 T314	Y288-R291 PolarHBondContact O-NH1 2.79Å; Y288-R291 PolarHBondContact O-NH2 2.76Å; R291-N293 PolarHBondContact O-N 3.06Å; R291-L306 VanDerWaalsContact NH1-CD1 3.26Å; R291-T314 VanDerWaalsContact NH2-CG2 3.32Å; R291-T314 PolarHBondContact NH2-OG1 3.4Å
292	C	92.2	Very high	92.3	Very high	50 Å²	50	43.1 Å²	43.1	34%	0.338	25%	0.254	S	S	.	.			trans	-55.2	125.4	177.9	-72.3	0	0	0	0	109.6	H238 C296	H238-C292 VanDerWaalsContact CE1-SG 3.53Å; C292-C296 HydrophobicContact CB-CB 3.94Å
293	N	91.7	Very high	92.1	Very high	15 Å²	15	47.1 Å²	47.1	8%	0.08	28%	0.281	C	S	.	.			trans	-105.1	176	177.8	66.6	51.6	0	0	0	110	N231 R291 L295 C296 L297	N231-N293 WeakPolarHBondContact CA-ND2 3.16Å; N231-N293 HydrophobicContact CB-CB 4.36Å; N231-N293 PolarHBondContact O-ND2 3.39Å; N231-N293 VanDerWaalsContact OD1-CB 3.28Å; N231-N293 WeakPolarHBondContact OD1-CB 3.28Å; R291-N293 PolarHBondContact O-N 3.06Å; N293-L295 PolarHBondContact O-N 3.36Å; N293-L295 WeakPolarHBondContact OD1-CA 3.36Å; N293-L295 VanDerWaalsContact OD1-CB 3.28Å; N293-L295 WeakPolarHBondContact OD1-CB 3.36Å; N293-L295 PolarHBondContact OD1-N 3Å; N293-C296 WeakPolarHBondContact O-CB 3.45Å; N293-C296 PolarHBondContact O-N 3.44Å; N293-C296 PolarHBondContact OD1-N 3.02Å; N293-L297 PolarHBondContact O-N 2.88Å
294	P	93.3	Very high	91.8	Very high	89 Å²	89	50.6 Å²	50.6	58%	0.578	30%	0.295	S	S	*	.	H	α-helix	trans	-56	-27.2	-178.5	-28.9	37	0	0	0	114.8	L297 A298	P294-L297 PolarHBondContact O-N 2.98Å; P294-A298 WeakPolarHBondContact O-CB 3.39Å; P294-A298 PolarHBondContact O-N 3.07Å
295	L	93.7	Very high	91.5	Very high	21 Å²	21	55 Å²	55	11%	0.11	31%	0.311	C	S	.	.	H	α-helix	trans	-72.7	-36.7	175.5	-61.3	178.9	0	0	0	111.9	P183 N231 T232 A235 N293 L297 A298 L299	P183-L295 HydrophobicContact CG-CD2 3.66Å; N231-L295 HydrophobicContact CB-CD1 3.77Å; N231-L295 HydrophobicContact CB-CG 4.16Å; T232-L295 WeakPolarHBondContact OG1-CD1 3.18Å; A235-L295 HydrophobicContact CB-CB 3.61Å; A235-L295 HydrophobicContact CB-CD1 4.33Å; N293-L295 PolarHBondContact O-N 3.36Å; N293-L295 WeakPolarHBondContact OD1-CA 3.36Å; N293-L295 VanDerWaalsContact OD1-CB 3.28Å; N293-L295 WeakPolarHBondContact OD1-CB 3.36Å; N293-L295 PolarHBondContact OD1-N 3Å; L295-L297 PolarHBondContact O-N 3.17Å; L295-A298 PolarHBondContact O-N 2.62Å; L295-L299 VanDerWaalsContact O-CB 3.26Å; L295-L299 WeakPolarHBondContact O-CB 3.5Å; L295-L299 WeakPolarHBondContact O-CD1 3.43Å; L295-L299 VanDerWaalsContact O-CG 3.24Å; L295-L299 WeakPolarHBondContact O-CG 3.27Å; L295-L299 PolarHBondContact O-N 3.27Å
296	C	92.9	Very high	90.9	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-58	-42.4	172.7	-62.2	0	0	0	0	110.8	C292 N293 L299 S300 L301	C292-C296 HydrophobicContact CB-CB 3.94Å; N293-C296 WeakPolarHBondContact O-CB 3.45Å; N293-C296 PolarHBondContact O-N 3.44Å; N293-C296 PolarHBondContact OD1-N 3.02Å; C296-L299 PolarHBondContact O-N 2.95Å; C296-S300 PolarHBondContact O-N 2.92Å; C296-L301 HydrophobicContact CB-CB 4.41Å; C296-L301 HydrophobicContact CB-CD1 4.22Å; C296-L301 WeakPolarHBondContact O-CB 3.48Å; C296-L301 WeakPolarHBondContact O-CG 3.5Å; C296-L301 PolarHBondContact O-N 3.49Å
297	L	92.7	Very high	90.4	Very high	120 Å²	120	56.1 Å²	56.1	63%	0.628	32%	0.322	S	S	*	.	H	α-helix	trans	-66.9	-45.6	176.1	-63.3	174.5	0	0	0	111.8	N293 P294 L295 L299 S300	N293-L297 PolarHBondContact O-N 2.88Å; P294-L297 PolarHBondContact O-N 2.98Å; L295-L297 PolarHBondContact O-N 3.17Å; L297-L299 PolarHBondContact O-N 3.37Å; L297-S300 PolarHBondContact O-N 3.37Å
298	A	92.9	Very high	89.8	Confident	50 Å²	50	62.4 Å²	62.4	41%	0.413	35%	0.354	S	S	.	.	H	α-helix	trans	-65.3	-27.4	178.4	0	0	0	0	0	113.3	S181 P294 L295 S300	S181-A298 WeakPolarHBondContact CB-O 3.4Å; S181-A298 PolarHBondContact OG-O 3.03Å; P294-A298 WeakPolarHBondContact O-CB 3.39Å; P294-A298 PolarHBondContact O-N 3.07Å; L295-A298 PolarHBondContact O-N 2.62Å; A298-S300 VanDerWaalsContact C-N 3.27Å
299	L	91.5	Very high	89.4	Confident	19 Å²	19	62.5 Å²	62.5	10%	0.099	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	2.6	173.4	-70.6	163	0	0	0	112.7	Y176 Q179 S181 A235 F239 L295 C296 L297 L301	Y176-L299 HydrophobicContact CD2-CD1 4.3Å; Y176-L299 HydrophobicContact CE2-CD1 3.48Å; Y176-L299 VanDerWaalsContact CE2-CD1 3.48Å; Q179-L299 HydrophobicContact CB-CD2 3.62Å; Q179-L299 HydrophobicContact CG-CD2 3.79Å; S181-L299 WeakPolarHBondContact OG-CD2 3.03Å; A235-L299 HydrophobicContact CB-CD1 4.39Å; F239-L299 HydrophobicContact CD2-CD2 4.35Å; L295-L299 VanDerWaalsContact O-CB 3.26Å; L295-L299 WeakPolarHBondContact O-CB 3.5Å; L295-L299 WeakPolarHBondContact O-CD1 3.43Å; L295-L299 VanDerWaalsContact O-CG 3.24Å; L295-L299 WeakPolarHBondContact O-CG 3.27Å; L295-L299 PolarHBondContact O-N 3.27Å; C296-L299 PolarHBondContact O-N 2.95Å; L297-L299 PolarHBondContact O-N 3.37Å; L299-L301 HydrophobicContact CB-CD1 4.23Å; L299-L301 HydrophobicContact CB-CD2 4.02Å; L299-L301 HydrophobicContact CB-CG 3.74Å; L299-L301 HydrophobicContact CD1-CD1 4.42Å; L299-L301 PolarHBondContact O-N 3.41Å
300	S	93.3	Very high	89	Confident	109 Å²	109	63.9 Å²	63.9	76%	0.762	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	39.7	-177.4	-56.2	0	0	0	0	113	C296 L297 A298	C296-S300 PolarHBondContact O-N 2.92Å; L297-S300 PolarHBondContact O-N 3.37Å; A298-S300 VanDerWaalsContact C-N 3.27Å
301	L	93	Very high	88.3	Confident	15 Å²	15	68.7 Å²	68.7	8%	0.079	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-81	132.6	178.3	-53.4	-176.4	0	0	0	110.4	H238 F239 E242 C296 L299 P303	H238-L301 HydrophobicContact CB-CD1 3.94Å; F239-L301 HydrophobicContact CB-CD1 4.04Å; F239-L301 HydrophobicContact CB-CD2 4.37Å; F239-L301 HydrophobicContact CD2-CD2 4.14Å; E242-L301 HydrophobicContact CB-CD2 4.01Å; E242-L301 HydrophobicContact CG-CB 4.21Å; E242-L301 HydrophobicContact CG-CD2 4.1Å; C296-L301 HydrophobicContact CB-CB 4.41Å; C296-L301 HydrophobicContact CB-CD1 4.22Å; C296-L301 WeakPolarHBondContact O-CB 3.48Å; C296-L301 WeakPolarHBondContact O-CG 3.5Å; C296-L301 PolarHBondContact O-N 3.49Å; L299-L301 HydrophobicContact CB-CD1 4.23Å; L299-L301 HydrophobicContact CB-CD2 4.02Å; L299-L301 HydrophobicContact CB-CG 3.74Å; L299-L301 HydrophobicContact CD1-CD1 4.42Å; L299-L301 PolarHBondContact O-N 3.41Å; L301-P303 WeakPolarHBondContact O-CD 3.3Å
302	S	91.3	Very high	87.8	Confident	72 Å²	72	70.3 Å²	70.3	50%	0.503	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-64.4	127.1	174.3	-65.3	0	0	0	0	110.5	H238	H238-S302 PolarHBondContact CE1-O 2.71Å; H238-S302 PolarHBondContact NE2-O 3.46Å
303	P	90.2	Very high	86.5	Confident	86 Å²	86	70.2 Å²	70.2	56%	0.558	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-59.5	141.6	171.4	-22.4	33.7	0	0	0	111.1	L301	L301-P303 WeakPolarHBondContact O-CD 3.3Å
304	F	87.8	Confident	84.7	Confident	83 Å²	83	70.1 Å²	70.1	36%	0.364	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-78	131.8	174.1	-168	-90.5	0	0	0	110.4	F287 L306	F287-F304 HydrophobicContact CB-CB 4.26Å; F287-F304 HydrophobicContact CB-CD1 3.65Å; F287-F304 HydrophobicContact CB-CD2 4.12Å; F287-F304 HydrophobicContact CB-CE1 3.96Å; F287-F304 HydrophobicContact CB-CE2 4.4Å; F287-F304 HydrophobicContact CB-CG 3.74Å; F287-F304 HydrophobicContact CB-CZ 4.32Å; F287-F304 HydrophobicContact CD1-CB 3.4Å; F287-F304 HydrophobicContact CD1-CD1 4.38Å; F287-F304 AromaticContact CD1-CD2 3.87Å; F287-F304 HydrophobicContact CD1-CD2 3.87Å; F287-F304 AromaticContact CD1-CG 3.63Å; F287-F304 HydrophobicContact CD1-CG 3.63Å; F287-F304 AromaticContact CD2-CD2 3.67Å; F287-F304 HydrophobicContact CD2-CD2 3.67Å; F287-F304 AromaticContact CD2-CE2 3.86Å; F287-F304 HydrophobicContact CD2-CE2 3.86Å; F287-F304 HydrophobicContact CD2-CG 4.13Å; F287-F304 HydrophobicContact CD2-CZ 4.45Å; F287-F304 HydrophobicContact CE1-CB 3.86Å; F287-F304 HydrophobicContact CE1-CD2 4.18Å; F287-F304 HydrophobicContact CE1-CG 4.26Å; F287-F304 AromaticContact CE2-CD2 4Å; F287-F304 HydrophobicContact CE2-CD2 4Å; F287-F304 HydrophobicContact CE2-CE2 4.34Å; F287-F304 HydrophobicContact CG-CB 3.9Å; F287-F304 HydrophobicContact CG-CD1 4.03Å; F287-F304 AromaticContact CG-CD2 3.61Å; F287-F304 HydrophobicContact CG-CD2 3.61Å; F287-F304 HydrophobicContact CG-CE1 4.48Å; F287-F304 HydrophobicContact CG-CE2 4.11Å; F287-F304 AromaticContact CG-CG 3.56Å; F287-F304 HydrophobicContact CG-CG 3.56Å; F287-F304 HydrophobicContact CZ-CD2 4.24Å; F304-L306 HydrophobicContact CD1-CD2 3.91Å; F304-L306 HydrophobicContact CD1-CG 4.2Å; F304-L306 HydrophobicContact CE1-CD2 4.15Å; F304-L306 PolarHBondContact O-N 3.21Å
305	D	84.9	Confident	82.7	Confident	144 Å²	144	70.1 Å²	70.1	77%	0.77	41%	0.406	S	S	*	.			trans	-75.2	95.2	-178	-73.9	-29.5	0	0	0	111.2
306	L	82.4	Confident	80.6	Confident	18 Å²	18	75.2 Å²	75.2	9%	0.094	43%	0.433	C	S	.	.			trans	-90.2	136	169.6	-65.9	173.2	0	0	0	111.2	R291 F304 K311	R291-L306 VanDerWaalsContact NH1-CD1 3.26Å; F304-L306 HydrophobicContact CD1-CD2 3.91Å; F304-L306 HydrophobicContact CD1-CG 4.2Å; F304-L306 HydrophobicContact CE1-CD2 4.15Å; F304-L306 PolarHBondContact O-N 3.21Å; L306-K311 HydrophobicContact CB-CD 4.45Å; L306-K311 HydrophobicContact CB-CG 3.78Å; L306-K311 WeakPolarHBondContact O-CE 3.42Å; L306-K311 PolarHBondContact O-NZ 3.29Å
307	P	82.3	Confident	78.1	Confident	66 Å²	66	77 Å²	77	43%	0.429	45%	0.445	S	S	.	.			trans	-54.4	149.2	167.3	-23	32.3	0	0	0	111.8	S309 E310 K311	P307-S309 PolarHBondContact O-N 3.22Å; P307-E310 HydrophobicContact CB-CG 4.42Å; P307-E310 HydrophobicContact CG-CG 4.36Å; P307-E310 PolarHBondContact O-N 3.12Å; P307-K311 PolarHBondContact O-N 3.48Å
308	I	80.9	Confident	75.5	Confident	133 Å²	133	76.5 Å²	76.5	68%	0.682	44%	0.439	S	S	*	.	H	α-helix	trans	-55.3	-39.4	-180	-62.8	169.1	0	0	0	111.2	E310 K311 L312	I308-E310 VanDerWaalsContact C-N 3.3Å; I308-E310 PolarHBondContact O-N 3.28Å; I308-K311 PolarHBondContact O-N 3.18Å; I308-L312 HydrophobicContact CG2-CD1 3.95Å; I308-L312 HydrophobicContact CG2-CG 4.4Å; I308-L312 VanDerWaalsContact O-CG 3.3Å; I308-L312 WeakPolarHBondContact O-CG 3.34Å; I308-L312 PolarHBondContact O-N 3.33Å
309	S	81.9	Confident	73	Confident	84 Å²	84	79.8 Å²	79.8	59%	0.587	45%	0.449	S	S	*	.	H	α-helix	trans	-61	-34.8	176.7	53.1	0	0	0	0	113.6	P307 S313	P307-S309 PolarHBondContact O-N 3.22Å; S309-S313 WeakPolarHBondContact O-CB 3.25Å; S309-S313 PolarHBondContact O-N 3.4Å; S309-S313 PolarHBondContact O-OG 2.92Å
310	E	80.2	Confident	70.3	Confident	68 Å²	68	82.8 Å²	82.8	32%	0.318	47%	0.472	S	S	.	.	H	α-helix	trans	-79.6	-36.4	178.3	-66.5	-173.5	-178.3	0	0	111.6	Y288 P307 I308 L312 S313	Y288-E310 HydrophobicContact CD2-CB 4.35Å; Y288-E310 HydrophobicContact CD2-CG 4.38Å; Y288-E310 HydrophobicContact CE2-CB 4.06Å; Y288-E310 HydrophobicContact CE2-CG 4.01Å; P307-E310 HydrophobicContact CB-CG 4.42Å; P307-E310 HydrophobicContact CG-CG 4.36Å; P307-E310 PolarHBondContact O-N 3.12Å; I308-E310 VanDerWaalsContact C-N 3.3Å; I308-E310 PolarHBondContact O-N 3.28Å; E310-L312 PolarHBondContact O-N 3.43Å; E310-S313 WeakPolarHBondContact CA-OG 3.49Å; E310-S313 PolarHBondContact O-N 3.02Å; E310-S313 PolarHBondContact O-OG 3.2Å
311	K	77.1	Confident	67.5	Low	112 Å²	112	84.1 Å²	84.1	49%	0.487	47%	0.468	S	S	.	.	H	α-helix	trans	-58.2	-37	171.6	-70.1	175.5	172.9	164.4	0	111.6	L306 P307 I308 T314	L306-K311 HydrophobicContact CB-CD 4.45Å; L306-K311 HydrophobicContact CB-CG 3.78Å; L306-K311 WeakPolarHBondContact O-CE 3.42Å; L306-K311 PolarHBondContact O-NZ 3.29Å; P307-K311 PolarHBondContact O-N 3.48Å; I308-K311 PolarHBondContact O-N 3.18Å; K311-T314 PolarHBondContact O-OG1 3Å
312	L	76.9	Confident	64.5	Low	122 Å²	122	90.9 Å²	90.9	64%	0.639	50%	0.496	S	S	*	.	H	α-helix	trans	-82.4	-23.2	-179.2	-67	173.1	0	0	0	114.7	I308 E310 S317	I308-L312 HydrophobicContact CG2-CD1 3.95Å; I308-L312 HydrophobicContact CG2-CG 4.4Å; I308-L312 VanDerWaalsContact O-CG 3.3Å; I308-L312 WeakPolarHBondContact O-CG 3.34Å; I308-L312 PolarHBondContact O-N 3.33Å; E310-L312 PolarHBondContact O-N 3.43Å; L312-S317 PolarHBondContact O-OG 3.14Å
313	S	64.9	Low	61.7	Low	49 Å²	49	91.3 Å²	91.3	34%	0.343	50%	0.504	S	S	.	.	H	α-helix	trans	-93	-7.2	-169.1	47.1	0	0	0	0	116.1	S309 E310	S309-S313 WeakPolarHBondContact O-CB 3.25Å; S309-S313 PolarHBondContact O-N 3.4Å; S309-S313 PolarHBondContact O-OG 2.92Å; E310-S313 WeakPolarHBondContact CA-OG 3.49Å; E310-S313 PolarHBondContact O-N 3.02Å; E310-S313 PolarHBondContact O-OG 3.2Å
314	T	54.5	Low	59.1	Low	13 Å²	13	95 Å²	95	8%	0.08	51%	0.514	C	S	.	.	S	Bend	trans	-65.1	143.1	178.8	10.2	0	0	0	0	113.3	R291 K311 L316 S317	R291-T314 VanDerWaalsContact NH2-CG2 3.32Å; R291-T314 PolarHBondContact NH2-OG1 3.4Å; K311-T314 PolarHBondContact O-OG1 3Å; T314-L316 PolarHBondContact O-N 3.1Å; T314-S317 PolarHBondContact O-N 3.4Å; T314-S317 PolarHBondContact O-OG 3.27Å
315	P	51.9	Low	56.4	Low	89 Å²	89	98 Å²	98	58%	0.578	53%	0.534	S	S	*	.	H	α-helix	trans	-54.4	-26.9	-176.4	-26.5	33.9	0	0	0	116.1	S317 Q318 L319	P315-S317 VanDerWaalsContact C-N 3.32Å; P315-S317 PolarHBondContact O-N 3.22Å; P315-Q318 PolarHBondContact O-N 3.1Å; P315-Q318 VanDerWaalsContact O-N 3.16Å; P315-L319 PolarHBondContact O-N 2.64Å
316	L	48.4	Very low	53.7	Low	128 Å²	128	97.7 Å²	97.7	67%	0.67	53%	0.532	S	S	*	.	H	α-helix	trans	-66.2	-28.5	176.1	-84.3	158.4	0	0	0	113.4	T314	T314-L316 PolarHBondContact O-N 3.1Å
317	S	42.3	Very low	51.1	Low	36 Å²	36	104.7 Å²	104.7	25%	0.252	56%	0.564	S	S	.	*	H	α-helix	trans	-75.4	-30	172	64.8	0	0	0	0	111.8	L312 T314 P315 L319 S320 M321	L312-S317 PolarHBondContact O-OG 3.14Å; T314-S317 PolarHBondContact O-N 3.4Å; T314-S317 PolarHBondContact O-OG 3.27Å; P315-S317 VanDerWaalsContact C-N 3.32Å; P315-S317 PolarHBondContact O-N 3.22Å; S317-L319 VanDerWaalsContact C-N 3.29Å; S317-L319 PolarHBondContact O-N 2.91Å; S317-S320 PolarHBondContact O-N 2.97Å; S317-M321 WeakPolarHBondContact O-CG 3.48Å; S317-M321 PolarHBondContact O-N 3.2Å
318	Q	36.6	Very low	48.3	Very low	110 Å²	110	108.8 Å²	108.8	51%	0.514	59%	0.589	S	S	.	*	H	α-helix	trans	-72.5	-22.2	177.1	-63.9	-173.7	-4.1	0	0	112.9	P315 K322	P315-Q318 PolarHBondContact O-N 3.1Å; P315-Q318 VanDerWaalsContact O-N 3.16Å; Q318-K322 WeakPolarHBondContact O-CB 3.41Å; Q318-K322 VanDerWaalsContact O-CG 3.26Å; Q318-K322 WeakPolarHBondContact O-CG 3.14Å; Q318-K322 PolarHBondContact O-N 3.41Å
319	L	40.8	Very low	45.7	Very low	119 Å²	119	110.6 Å²	110.6	62%	0.623	59%	0.594	S	S	*	*	H	α-helix	trans	-75.9	-33.5	169.7	-73.6	165.7	0	0	0	112	P315 S317	P315-L319 PolarHBondContact O-N 2.64Å; S317-L319 VanDerWaalsContact C-N 3.29Å; S317-L319 PolarHBondContact O-N 2.91Å
320	S	34.2	Very low	42.8	Very low	82 Å²	82	113.9 Å²	113.9	57%	0.573	61%	0.605	S	S	*	*	H	α-helix	trans	-70.6	-41.6	173.8	-173.3	0	0	0	0	112	S317 K322 A323	S317-S320 PolarHBondContact O-N 2.97Å; S320-K322 PolarHBondContact O-N 3.35Å; S320-A323 PolarHBondContact O-N 3.07Å
321	M	34.5	Very low	40.3	Very low	138 Å²	138	118.6 Å²	118.6	68%	0.68	63%	0.631	S	S	*	*	H	α-helix	trans	-75.8	-22.4	-178.6	-70.2	-85.7	158.6	0	0	114	S317 A323	S317-M321 WeakPolarHBondContact O-CG 3.48Å; S317-M321 PolarHBondContact O-N 3.2Å; M321-A323 VanDerWaalsContact C-N 3.26Å; M321-A323 PolarHBondContact O-N 2.8Å
322	K	30.8	Very low	37.7	Very low	156 Å²	156	120.6 Å²	120.6	68%	0.678	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	-7.6	175.9	-80.5	179.1	179.1	178.3	0	113.9	Q318 S320	Q318-K322 WeakPolarHBondContact O-CB 3.41Å; Q318-K322 VanDerWaalsContact O-CG 3.26Å; Q318-K322 WeakPolarHBondContact O-CG 3.14Å; Q318-K322 PolarHBondContact O-N 3.41Å; S320-K322 PolarHBondContact O-N 3.35Å
323	A	33.4	Very low	35.2	Very low	81 Å²	81	118 Å²	118	67%	0.669	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-17	174.7	0	0	0	0	0	113.1	S320 M321	S320-A323 PolarHBondContact O-N 3.07Å; M321-A323 VanDerWaalsContact C-N 3.26Å; M321-A323 PolarHBondContact O-N 2.8Å
324	E	34.6	Very low	33.4	Very low	165 Å²	165	123.7 Å²	123.7	77%	0.771	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	-12.4	-174	-66.7	-170.6	167.9	0	0	114.8	N326	E324-N326 PolarHBondContact O-N 3.07Å
325	D	31.7	Very low	31.9	Very low	144 Å²	144	127.3 Å²	127.3	77%	0.77	70%	0.701	S	S	*	*	S	Bend	trans	-100.2	66.6	173	-82.8	-22.2	0	0	0	111.1
326	N	28.4	Very low	30.7	Very low	138 Å²	138	129.7 Å²	129.7	74%	0.738	71%	0.708	S	S	*	*	S	Bend	trans	-152.9	100.6	155.9	-91.2	-32.9	0	0	0	110.7	E324	E324-N326 PolarHBondContact O-N 3.07Å
327	Q	26.3	Very low	29.7	Very low	165 Å²	165	131.2 Å²	131.2	77%	0.771	72%	0.717	S	S	*	*			trans	74.8	86.6	150.3	-56.1	-177.1	-3.3	0	0	118	E329	Q327-E329 VanDerWaalsContact C-N 3.28Å; Q327-E329 PolarHBondContact O-N 3.35Å
328	T	25	Very low	28.9	Very low	153 Å²	153	136.4 Å²	136.4	94%	0.939	74%	0.742	S	S	*	*			trans	-76	80.9	141.4	36.1	0	0	0	0	109.5
329	E	26.5	Very low	28.3	Very low	170 Å²	170	139.3 Å²	139.3	79%	0.794	76%	0.761	S	S	*	*			trans	-108.6	123.7	156	-79	-166.8	171.5	0	0	109.4	Q327	Q327-E329 VanDerWaalsContact C-N 3.28Å; Q327-E329 PolarHBondContact O-N 3.35Å
330	N	21.2	Very low	27.6	Very low	153 Å²	153	140 Å²	140	82%	0.818	77%	0.77	S	S	*	*			trans	-47.2	131.9	175.1	-69.1	-59.3	0	0	0	113
331	I	27.5	Very low	27.1	Very low	167 Å²	167	144.4 Å²	144.4	86%	0.856	78%	0.782	S	S	*	*			trans	-143.2	116	134.8	-61.9	-171.5	0	0	0	109.2
332	D	22.3	Very low	26.8	Very low	155 Å²	155	145.4 Å²	145.4	83%	0.829	79%	0.789	S	S	*	*			trans	-62.7	140.6	163.9	-72.3	-58	0	0	0	112.1
333	G	24.2	Very low	26.5	Very low	68 Å²	68	143.6 Å²	143.6	70%	0.701	80%	0.796	S	S	*	*			trans	109.7	134.3	144	0	0	0	0	0	117.8
334	I	26.7	Very low	26.2	Very low	167 Å²	167	143 Å²	143	86%	0.856	80%	0.798	S	S	*	*			trans	104.6	103.6	160.7	-55.2	175.1	0	0	0	115.7
335	S	23.6	Very low	25.9	Very low	90 Å²	90	141.4 Å²	141.4	63%	0.629	80%	0.799	S	S	*	*			trans	-38.1	130.9	151.6	50.4	0	0	0	0	114.7
336	D	25.3	Very low	25.7	Very low	139 Å²	139	140.3 Å²	140.3	74%	0.743	80%	0.798	S	S	*	*				173.9	147.4	107.7	-92.7	-27.7	0	0	0	109.8	N338	D336-N338 PolarHBondContact O-N 3.13Å
337	N	27.7	Very low	25.6	Very low	160 Å²	160	138.1 Å²	138.1	86%	0.856	80%	0.798	S	S	*	*			trans	-44	106	177.8	-66.2	-43.5	0	0	0	112.4
338	N	26.3	Very low	25.6	Very low	144 Å²	144	137.3 Å²	137.3	77%	0.77	80%	0.798	S	S	*	*			trans	-133.4	111.9	157.6	-84.6	-37.8	0	0	0	108.1	D336 V340	D336-N338 PolarHBondContact O-N 3.13Å; N338-V340 VanDerWaalsContact C-N 3.34Å; N338-V340 PolarHBondContact O-N 3.32Å
339	N	24.4	Very low	25.6	Very low	171 Å²	171	134.5 Å²	134.5	91%	0.914	78%	0.782	S	S	*	*			trans	-52.3	97.2	166.4	-74.2	-38.7	0	0	0	108.7	E341	N339-E341 VanDerWaalsContact C-N 3.29Å; N339-E341 PolarHBondContact O-N 3.41Å; N339-E341 VanDerWaalsContact O-N 3.1Å
340	V	25.4	Very low	25.8	Very low	133 Å²	133	131.1 Å²	131.1	81%	0.806	78%	0.784	S	S	*	*			trans	-77.4	95.6	161.6	179.5	0	0	0	0	105.7	N338 L342	N338-V340 VanDerWaalsContact C-N 3.34Å; N338-V340 PolarHBondContact O-N 3.32Å; V340-L342 PolarHBondContact O-N 3.4Å
341	E	23.8	Very low	26.3	Very low	176 Å²	176	128.5 Å²	128.5	82%	0.822	78%	0.777	S	S	*	*			trans	-50.2	103.8	170.6	-164.9	170.1	-159.2	0	0	108.8	N339 S343	N339-E341 VanDerWaalsContact C-N 3.29Å; N339-E341 PolarHBondContact O-N 3.41Å; N339-E341 VanDerWaalsContact O-N 3.1Å; E341-S343 PolarHBondContact O-N 3.15Å
342	L	27.3	Very low	26.5	Very low	158 Å²	158	130.9 Å²	130.9	83%	0.827	78%	0.775	S	S	*	*			trans	-69.7	84.6	173.6	-169	69.6	0	0	0	107.7	V340 G344	V340-L342 PolarHBondContact O-N 3.4Å; L342-G344 PolarHBondContact O-N 3.2Å
343	S	25.7	Very low	26.8	Very low	119 Å²	119	134.2 Å²	134.2	83%	0.832	78%	0.776	S	S	*	*	S	Bend	trans	-54.9	115.7	174.2	173.1	0	0	0	0	109.8	E341	E341-S343 PolarHBondContact O-N 3.15Å
344	G	26.5	Very low	27.1	Very low	69 Å²	69	137.7 Å²	137.7	71%	0.711	78%	0.779	S	S	*	*			trans	132.9	18.1	176.3	0	0	0	0	0	115.6	L342 V346	L342-G344 PolarHBondContact O-N 3.2Å; G344-V346 PolarHBondContact O-N 2.9Å; G344-V346 VanDerWaalsContact O-N 3.15Å
345	T	28.1	Very low	27.4	Very low	130 Å²	130	139.8 Å²	139.8	80%	0.798	78%	0.776	S	S	*	*			trans	-74.5	103.3	162.5	-58.9	0	0	0	0	108.2	A347	T345-A347 PolarHBondContact O-N 3.44Å; T345-A347 VanDerWaalsContact O-N 3.14Å
346	V	28.5	Very low	27.8	Very low	122 Å²	122	145.7 Å²	145.7	74%	0.739	79%	0.786	S	S	*	*			trans	-45.8	118	168	175.4	0	0	0	0	108.7	G344 I348	G344-V346 PolarHBondContact O-N 2.9Å; G344-V346 VanDerWaalsContact O-N 3.15Å; V346-I348 PolarHBondContact O-N 3.09Å
347	A	25.4	Very low	28	Very low	91 Å²	91	142.2 Å²	142.2	75%	0.752	78%	0.782	S	S	*	*			trans	-60.6	108	174.4	0	0	0	0	0	108.7	T345 P349	T345-A347 PolarHBondContact O-N 3.44Å; T345-A347 VanDerWaalsContact O-N 3.14Å; A347-P349 WeakPolarHBondContact O-CD 2.99Å
348	I	26.4	Very low	28.1	Very low	149 Å²	149	142 Å²	142	76%	0.764	78%	0.78	S	S	*	*			trans	-76.2	117.5	167.5	-62.4	173	0	0	0	106.2	V346 A350	V346-I348 PolarHBondContact O-N 3.09Å; I348-A350 PolarHBondContact O-N 2.78Å
349	P	24.7	Very low	28.1	Very low	94 Å²	94	144.6 Å²	144.6	61%	0.61	78%	0.779	S	S	*	*			trans	-57	134.8	-179.6	-22.6	32.3	0	0	0	111	A347 S351	A347-P349 WeakPolarHBondContact O-CD 2.99Å; P349-S351 PolarHBondContact O-N 2.87Å
350	A	30.5	Very low	28.2	Very low	99 Å²	99	147.4 Å²	147.4	82%	0.818	78%	0.776	S	S	*	*	G	3₁₀ helix	trans	-63.1	-11.1	-174.5	0	0	0	0	0	114.4	I348 R352	I348-A350 PolarHBondContact O-N 2.78Å; A350-R352 VanDerWaalsContact C-N 3.35Å; A350-R352 PolarHBondContact O-N 3.17Å
351	S	32.5	Very low	28.3	Very low	97 Å²	97	149 Å²	149	68%	0.678	78%	0.779	S	S	*	*	G	3₁₀ helix	trans	-82.6	3.1	-174.8	64.6	0	0	0	0	115.7	P349	P349-S351 PolarHBondContact O-N 2.87Å
352	R	31.4	Very low	28.6	Very low	218 Å²	218	146.3 Å²	146.3	82%	0.823	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-131.2	43.6	178.7	-66.7	-163	-174.4	-169	4.1	115.3	A350 D354	A350-R352 VanDerWaalsContact C-N 3.35Å; A350-R352 PolarHBondContact O-N 3.17Å; R352-D354 PolarHBondContact O-N 2.8Å; R352-D354 VanDerWaalsContact O-N 3.14Å
353	R	27.5	Very low	28.5	Very low	224 Å²	224	142.5 Å²	142.5	85%	0.845	76%	0.762	S	S	*	*			trans	-81.8	57.9	157.4	-79.9	-175.5	178.6	151.4	0.9	110.7	R355	R353-R355 VanDerWaalsContact C-N 3.33Å; R353-R355 PolarHBondContact O-N 3.03Å; R353-R355 VanDerWaalsContact O-N 3.14Å
354	D	30.9	Very low	28.5	Very low	141 Å²	141	145.8 Å²	145.8	75%	0.754	76%	0.764	S	S	*	*			trans	-86.9	83.5	168.2	-146.4	-6.3	0	0	0	108.8	R352 Y356	R352-D354 PolarHBondContact O-N 2.8Å; R352-D354 VanDerWaalsContact O-N 3.14Å; D354-Y356 PolarHBondContact O-N 2.81Å; D354-Y356 VanDerWaalsContact O-N 3.1Å
355	R	33	Very low	28.5	Very low	212 Å²	212	149.4 Å²	149.4	80%	0.8	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	11.4	-170	-127.2	-176.3	-154.4	179	6.1	114.2	R353	R353-R355 VanDerWaalsContact C-N 3.33Å; R353-R355 PolarHBondContact O-N 3.03Å; R353-R355 VanDerWaalsContact O-N 3.14Å
356	Y	32.2	Very low	28.4	Very low	214 Å²	214	150.8 Å²	150.8	84%	0.839	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.1	-1.2	-176	-83.3	-82.1	0	0	0	116.3	D354	D354-Y356 PolarHBondContact O-N 2.81Å; D354-Y356 VanDerWaalsContact O-N 3.1Å
357	G	30.4	Very low	28.1	Very low	65 Å²	65	152.9 Å²	152.9	67%	0.67	78%	0.775	S	S	*	*	S	Bend	trans	-89.4	-31.3	177.4	0	0	0	0	0	116
358	I	28.3	Very low	28.2	Very low	155 Å²	155	153.3 Å²	153.3	80%	0.795	77%	0.772	S	S	*	*	S	Bend	trans	-95	-16.4	-168.1	-67.4	171.2	0	0	0	113.1
359	R	26.2	Very low	28.1	Very low	200 Å²	200	151.5 Å²	151.5	76%	0.755	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-7.8	178.3	-100.6	-173.9	179.2	-148.7	-0.9	115.4	L361 S363	R359-L361 VanDerWaalsContact C-N 3.32Å; R359-L361 PolarHBondContact O-N 2.63Å; R359-S363 PolarHBondContact O-OG 3.07Å
360	R	28.3	Very low	28.2	Very low	229 Å²	229	158.3 Å²	158.3	86%	0.864	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-10	-179.3	-151.8	174	-164.6	-179.5	5.4	114.5
361	L	26.7	Very low	27.9	Very low	166 Å²	166	161.2 Å²	161.2	87%	0.869	79%	0.79	S	S	*	*	S	Bend	trans	-120	5.5	-177.9	-69.3	175.3	0	0	0	115.2	R359	R359-L361 VanDerWaalsContact C-N 3.32Å; R359-L361 PolarHBondContact O-N 2.63Å
362	V	28.9	Very low	27.5	Very low	120 Å²	120	164.4 Å²	164.4	73%	0.727	80%	0.798	S	S	*	*	S	Bend	trans	-136.9	35.2	177	-157.9	0	0	0	0	111.9
363	S	25.5	Very low	27	Very low	79 Å²	79	165.4 Å²	165.4	55%	0.552	80%	0.802	S	S	*	*			trans	-135.5	53.8	177.9	-58.6	0	0	0	0	111.5	R359	R359-S363 PolarHBondContact O-OG 3.07Å
364	E	27.1	Very low	26.9	Very low	188 Å²	188	163.5 Å²	163.5	88%	0.879	80%	0.803	S	S	*	*	S	Bend	trans	-116.8	4.1	158.3	-77.4	-172.8	170.7	0	0	112.7
365	N	25	Very low	26.7	Very low	144 Å²	144	164.9 Å²	164.9	77%	0.77	81%	0.81	S	S	*	*	S	Bend	trans	-137.7	110.3	171.5	-74.6	-52.1	0	0	0	109
366	I	27.7	Very low	26.3	Very low	159 Å²	159	159.1 Å²	159.1	82%	0.815	81%	0.808	S	S	*	*			trans	143.6	94.1	153.1	-70	154.2	0	0	0	108.4	S368	I366-S368 PolarHBondContact O-N 2.58Å
367	D	21.4	Very low	25.9	Very low	167 Å²	167	156.7 Å²	156.7	89%	0.893	81%	0.81	S	S	*	*			trans	-52.6	120.2	150.8	-93.7	-37.3	0	0	0	109.8
368	S	26.9	Very low	25.7	Very low	100 Å²	100	163.2 Å²	163.2	70%	0.699	82%	0.819	S	S	*	*			trans	-174.6	119.8	132.5	63.2	0	0	0	0	109.5	I366 Y370	I366-S368 PolarHBondContact O-N 2.58Å; S368-Y370 PolarHBondContact O-N 3.45Å
369	S	24.4	Very low	25.6	Very low	111 Å²	111	164.6 Å²	164.6	78%	0.776	82%	0.822	S	S	*	*			trans	-36.8	125.2	166.9	54	0	0	0	0	114.5
370	Y	26.4	Very low	25.4	Very low	237 Å²	237	162.4 Å²	162.4	93%	0.929	83%	0.826	S	S	*	*			trans	-152.7	133.4	146.5	-119.1	-86.5	0	0	0	110.2	S368	S368-Y370 PolarHBondContact O-N 3.45Å
371	D	24.4	Very low	25.2	Very low	159 Å²	159	158.4 Å²	158.4	85%	0.85	82%	0.821	S	S	*	*			trans	-65.7	141.4	-158.7	-80.8	-56.5	0	0	0	116.4
372	L	24.1	Very low	25.2	Very low	164 Å²	164	158.2 Å²	158.2	86%	0.859	82%	0.821	S	S	*	*			trans	-79.7	112.4	160.4	-77	156.3	0	0	0	108.9
373	R	22.3	Very low	25.1	Very low	240 Å²	240	159.5 Å²	159.5	91%	0.906	83%	0.83	S	S	*	*			trans	-171.9	140.9	152.1	-101.4	150	-173.8	-147.8	0.8	109.6
374	E	25.2	Very low	25.4	Very low	183 Å²	183	159.8 Å²	159.8	86%	0.855	83%	0.832	S	S	*	*	S	Bend	trans	81.3	83.7	-177.2	-59.1	-165.5	161.4	0	0	117
375	N	27.2	Very low	25.4	Very low	170 Å²	170	155.7 Å²	155.7	91%	0.909	82%	0.823	S	S	*	*				-177.4	62.1	124.3	-94.2	-29.9	0	0	0	110.1
376	A	24.1	Very low	25.6	Very low	92 Å²	92	157 Å²	157	76%	0.76	83%	0.83	S	S	*	*			trans	-96.9	94.2	159.7	0	0	0	0	0	106.2
377	N	23.6	Very low	25.8	Very low	162 Å²	162	156.6 Å²	156.6	87%	0.866	82%	0.823	S	S	*	*			trans	172.4	74.2	158.3	-86.8	-21.2	0	0	0	110.6
378	K	25.6	Very low	26.2	Very low	202 Å²	202	153 Å²	153	88%	0.878	81%	0.807	S	S	*	*			trans	-179.3	71.6	152.2	-109.5	178.4	178.1	-178.1	0	109.5
379	H	25.9	Very low	26.4	Very low	184 Å²	184	152.6 Å²	152.6	85%	0.852	80%	0.797	S	S	*	*			trans	-128.7	96	163.3	-82.3	-63.6	0	0	0	106.2
380	N	22.6	Very low	26.8	Very low	155 Å²	155	151.3 Å²	151.3	83%	0.829	79%	0.786	S	S	*	*	S	Bend	trans	-165	124.4	153.8	-88.4	-27.1	0	0	0	107.5
381	N	25.1	Very low	27	Very low	145 Å²	145	143.1 Å²	143.1	78%	0.775	76%	0.764	S	S	*	*			trans	70.3	83.1	167.3	-55	-13.8	0	0	0	117.2
382	D	26.8	Very low	27.5	Very low	161 Å²	161	141.1 Å²	141.1	86%	0.861	75%	0.753	S	S	*	*			trans	-136.4	83.3	146.8	-92.6	-31.7	0	0	0	108.8	S384	D382-S384 PolarHBondContact O-N 2.56Å; D382-S384 VanDerWaalsContact O-N 3.15Å
383	T	25	Very low	28.1	Very low	148 Å²	148	142 Å²	142	91%	0.908	75%	0.75	S	S	*	*			trans	-76.6	73.7	158.1	43.3	0	0	0	0	107.9
384	S	31.8	Very low	28.2	Very low	85 Å²	85	135.6 Å²	135.6	59%	0.594	74%	0.738	S	S	*	*			trans	-87	116.5	169.9	74.1	0	0	0	0	108.7	D382 D386	D382-S384 PolarHBondContact O-N 2.56Å; D382-S384 VanDerWaalsContact O-N 3.15Å; S384-D386 PolarHBondContact O-N 3.36Å
385	S	28.7	Very low	28.6	Very low	101 Å²	101	134.9 Å²	134.9	71%	0.706	73%	0.734	S	S	*	*			trans	-51.5	127.3	176	51.2	0	0	0	0	112.5	F387	S385-F387 PolarHBondContact O-N 2.81Å
386	D	29.5	Very low	28.5	Very low	171 Å²	171	132 Å²	132	91%	0.914	73%	0.727	S	S	*	*			trans	-68.4	51.9	171.4	-73.1	-42.8	0	0	0	112.8	S384	S384-D386 PolarHBondContact O-N 3.36Å
387	F	30.9	Very low	28.5	Very low	151 Å²	151	135.3 Å²	135.3	66%	0.662	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-95.8	132.2	176.5	-133.4	-92.3	0	0	0	109.9	S385	S385-F387 PolarHBondContact O-N 2.81Å
388	V	29	Very low	28.5	Very low	91 Å²	91	133.2 Å²	133.2	55%	0.552	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-91	123.8	171.1	178.1	0	0	0	0	107.2	D392	V388-D392 HydrophobicContact CG1-CB 4.16Å
389	D	31.3	Very low	28.5	Very low	92 Å²	92	129.7 Å²	129.7	49%	0.492	72%	0.72	S	S	.	*	P	Polyproline II helix	trans	-70.9	131.9	-179.4	-168.2	-29.5	0	0	0	110.2	S391 D392	D389-S391 PolarHBondContact O-N 2.94Å; D389-S391 VanDerWaalsContact O-N 3.07Å; D389-S391 PolarHBondContact OD1-N 3.37Å; D389-S391 PolarHBondContact OD1-OG 3.27Å; D389-S391 VanDerWaalsContact OD1-OG 3.06Å; D389-S391 PolarHBondContact OD2-OG 3.14Å; D389-D392 VanDerWaalsContact O-CB 3.3Å; D389-D392 WeakPolarHBondContact O-CB 3.44Å; D389-D392 PolarHBondContact O-N 3.34Å
390	P	34	Very low	28.4	Very low	85 Å²	85	126.5 Å²	126.5	55%	0.552	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-49.9	-26	171.5	-29.1	35.6	0	0	0	115.1	D392 F393	P390-D392 PolarHBondContact O-N 3.01Å; P390-F393 WeakPolarHBondContact O-CB 3.42Å; P390-F393 PolarHBondContact O-N 2.94Å; P390-F393 VanDerWaalsContact O-N 3.14Å
391	S	31.1	Very low	28.5	Very low	65 Å²	65	124.7 Å²	124.7	46%	0.455	72%	0.715	S	S	.	*	G	3₁₀ helix	trans	-65	-18.8	173.6	57.5	0	0	0	0	113.9	D389 F393 V394	D389-S391 PolarHBondContact O-N 2.94Å; D389-S391 VanDerWaalsContact O-N 3.07Å; D389-S391 PolarHBondContact OD1-N 3.37Å; D389-S391 PolarHBondContact OD1-OG 3.27Å; D389-S391 VanDerWaalsContact OD1-OG 3.06Å; D389-S391 PolarHBondContact OD2-OG 3.14Å; S391-F393 PolarHBondContact O-N 3.39Å; S391-V394 CarbonylContact O-C 3.51Å; S391-V394 PolarHBondContact O-N 3.47Å
392	D	34.7	Very low	28.6	Very low	117 Å²	117	123.4 Å²	123.4	63%	0.626	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-68	-11.8	173.2	-74.4	-13	0	0	0	112.9	V388 D389 P390	V388-D392 HydrophobicContact CG1-CB 4.16Å; D389-D392 VanDerWaalsContact O-CB 3.3Å; D389-D392 WeakPolarHBondContact O-CB 3.44Å; D389-D392 PolarHBondContact O-N 3.34Å; P390-D392 PolarHBondContact O-N 3.01Å
393	F	35.6	Very low	28.5	Very low	181 Å²	181	125.4 Å²	125.4	79%	0.794	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-86	-13.2	169.8	-72.4	-87.3	0	0	0	113.2	P390 S391	P390-F393 WeakPolarHBondContact O-CB 3.42Å; P390-F393 PolarHBondContact O-N 2.94Å; P390-F393 VanDerWaalsContact O-N 3.14Å; S391-F393 PolarHBondContact O-N 3.39Å
394	V	25.5	Very low	28.7	Very low	107 Å²	107	126.3 Å²	126.3	65%	0.648	71%	0.714	S	S	*	*			trans	-116.3	73	-174.6	-161.8	0	0	0	0	108.9	S391 S396	S391-V394 CarbonylContact O-C 3.51Å; S391-V394 PolarHBondContact O-N 3.47Å; V394-S396 PolarHBondContact O-N 2.8Å
395	E	32.6	Very low	28.6	Very low	167 Å²	167	127.8 Å²	127.8	78%	0.78	72%	0.722	S	S	*	*			trans	-71.4	125.3	169.8	-163.8	166.9	-161.1	0	0	109	H397	E395-H397 PolarHBondContact O-N 3.46Å
396	S	24.2	Very low	28.5	Very low	110 Å²	110	133 Å²	133	77%	0.769	73%	0.732	S	S	*	*			trans	-61.6	125.1	-173.7	33.8	0	0	0	0	111.6	V394 S398	V394-S396 PolarHBondContact O-N 2.8Å; S396-S398 PolarHBondContact O-N 2.88Å
397	H	26.1	Very low	28.4	Very low	162 Å²	162	132.9 Å²	132.9	75%	0.75	73%	0.731	S	S	*	*			trans	-75.8	112.3	-175.6	-59.6	-55.5	0	0	0	111.8	E395 V399	E395-H397 PolarHBondContact O-N 3.46Å; H397-V399 PolarHBondContact O-N 3.4Å
398	S	23.6	Very low	28.2	Very low	118 Å²	118	131.5 Å²	131.5	83%	0.825	74%	0.736	S	S	*	*			trans	-71.9	115.4	157.3	-49.9	0	0	0	0	108.5	S396	S396-S398 PolarHBondContact O-N 2.88Å
399	V	24.4	Very low	28.2	Very low	128 Å²	128	132.5 Å²	132.5	78%	0.776	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-59.6	134.6	-179.9	-171.3	0	0	0	0	110.2	H397 S401	H397-V399 PolarHBondContact O-N 3.4Å; V399-S401 PolarHBondContact O-N 3.38Å
400	P	24.7	Very low	27.9	Very low	117 Å²	117	139.6 Å²	139.6	76%	0.76	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-65.8	129.3	-176.9	-18.4	30.8	0	0	0	112.1
401	S	24.1	Very low	27.5	Very low	117 Å²	117	140.3 Å²	140.3	82%	0.818	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-68.2	127.1	172.2	-73	0	0	0	0	110.5	V399 K403	V399-S401 PolarHBondContact O-N 3.38Å; S401-K403 PolarHBondContact O-N 3.06Å
402	P	26.2	Very low	27.4	Very low	117 Å²	117	143.3 Å²	143.3	76%	0.76	79%	0.793	S	S	*	*			trans	-85.1	112.6	-178.5	31.8	-28.9	0	0	0	109
403	K	25.3	Very low	26.8	Very low	203 Å²	203	144 Å²	144	88%	0.883	80%	0.801	S	S	*	*			trans	169.1	98.8	151.8	-93.5	154.5	-170.5	-175.8	0	109.9	S401	S401-K403 PolarHBondContact O-N 3.06Å
404	L	29.9	Very low	26.4	Very low	167 Å²	167	141 Å²	141	87%	0.874	80%	0.802	S	S	*	*			trans	-140	121.3	151.8	-91.4	169.9	0	0	0	108.9
405	P	29.2	Very low	26.4	Very low	117 Å²	117	141.3 Å²	141.3	76%	0.76	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-82.1	146.2	-179.2	31.9	-31	0	0	0	111.5
406	F	27.6	Very low	25.9	Very low	210 Å²	210	144.9 Å²	144.9	92%	0.921	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-49.2	134.4	177.9	-79.9	-95.4	0	0	0	113
407	L	27.5	Very low	25.8	Very low	169 Å²	169	148.6 Å²	148.6	89%	0.885	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-59.5	134.4	175.2	-71.5	165.5	0	0	0	111.1
408	P	26	Very low	25.8	Very low	121 Å²	121	147.9 Å²	147.9	79%	0.786	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-76.7	135	-178	27.1	-29.6	0	0	0	112.3	R410	P408-R410 PolarHBondContact O-N 2.8Å
409	S	28.4	Very low	25.9	Very low	113 Å²	113	150.4 Å²	150.4	79%	0.79	82%	0.821	S	S	*	*	S	Bend	trans	-73.8	84.2	174.7	58.4	0	0	0	0	111.1
410	R	26.3	Very low	25.7	Very low	240 Å²	240	152.3 Å²	152.3	91%	0.906	83%	0.826	S	S	*	*			trans	-174.6	122.8	151	-103.7	156.8	-169.3	-128.5	3.6	110.6	P408	P408-R410 PolarHBondContact O-N 2.8Å
411	S	25.2	Very low	25.6	Very low	101 Å²	101	155.1 Å²	155.1	71%	0.706	83%	0.829	S	S	*	*			trans	-65.1	131.6	173.3	46.1	0	0	0	0	111	V413	S411-V413 PolarHBondContact O-N 3.23Å; S411-V413 VanDerWaalsContact O-N 3.14Å
412	P	28.1	Very low	25.6	Very low	128 Å²	128	158.6 Å²	158.6	83%	0.831	83%	0.829	S	S	*	*			trans	-84.2	91.5	172	31.6	-28.2	0	0	0	108.8	S414	P412-S414 PolarHBondContact O-N 3.03Å
413	V	23	Very low	25.3	Very low	131 Å²	131	159.4 Å²	159.4	79%	0.794	83%	0.832	S	S	*	*			trans	-78.4	101	154.4	179.1	0	0	0	0	106	S411	S411-V413 PolarHBondContact O-N 3.23Å; S411-V413 VanDerWaalsContact O-N 3.14Å
414	S	27.5	Very low	25.2	Very low	117 Å²	117	156.3 Å²	156.3	82%	0.818	83%	0.825	S	S	*	*			trans	-117.2	127.9	162.5	-165.8	0	0	0	0	109.8	P412	P412-S414 PolarHBondContact O-N 3.03Å
415	C	23.8	Very low	24.8	Very low	115 Å²	115	156.6 Å²	156.6	78%	0.777	82%	0.822	S	S	*	*			trans	-65.7	138.4	-162.5	-69.5	0	0	0	0	113.9	K417	C415-K417 PolarHBondContact O-N 2.99Å
416	R	22.3	Very low	24.6	Very low	242 Å²	242	159 Å²	159	91%	0.913	83%	0.827	S	S	*	*			trans	-52.2	123.3	151.9	-69.9	174.6	173.6	158.7	-2.3	109.7
417	K	23.8	Very low	24.3	Very low	188 Å²	188	155.1 Å²	155.1	82%	0.817	82%	0.815	S	S	*	*			trans	-167.7	117.5	142.8	-103.9	165	-170.8	-177.4	0	110.2	C415	C415-K417 PolarHBondContact O-N 2.99Å
418	N	24.3	Very low	23.9	Very low	146 Å²	146	153.5 Å²	153.5	78%	0.781	81%	0.808	S	S	*	*			trans	63.8	99	150.3	-54.8	-16.1	0	0	0	118.7
419	I	26	Very low	23.7	Very low	171 Å²	171	156.2 Å²	156.2	88%	0.877	81%	0.81	S	S	*	*				-140.9	93.4	124.3	-78.5	125	0	0	0	106.1
420	L	20.4	Very low	23.4	Very low	168 Å²	168	157.6 Å²	157.6	88%	0.88	81%	0.808	S	S	*	*			trans	-103.9	141.5	153.2	-114.9	130.6	0	0	0	104.5
421	Q	23.5	Very low	23.3	Very low	177 Å²	177	150.6 Å²	150.6	83%	0.827	80%	0.796	S	S	*	*			trans	90.2	92.2	-176.4	-54.1	179.2	8.8	0	0	115.2
422	K	23.6	Very low	23	Very low	190 Å²	190	153 Å²	153	83%	0.826	80%	0.801	S	S	*	*				-164.9	106.7	106	-99.4	175.1	-178.4	-173.4	0	109.4
423	T	19.6	Very low	22.9	Very low	133 Å²	133	154.2 Å²	154.2	82%	0.816	81%	0.806	S	S	*	*			trans	-66.2	117.3	152.4	42.6	0	0	0	0	107.6
424	D	24.1	Very low	22.9	Very low	138 Å²	138	153.8 Å²	153.8	74%	0.738	80%	0.803	S	S	*	*			trans	-128.6	116.9	153.1	-82.7	-42.2	0	0	0	107.7
425	Q	20.9	Very low	22.6	Very low	174 Å²	174	155.5 Å²	155.5	81%	0.813	80%	0.803	S	S	*	*			trans	-65.2	128.3	169.1	-64.1	169.8	1.8	0	0	107.9
426	I	25.3	Very low	22.5	Very low	168 Å²	168	157.7 Å²	157.7	86%	0.862	81%	0.807	S	S	*	*			trans	-119.3	108.7	155.5	-62.8	179.9	0	0	0	106.1
427	N	21.1	Very low	22.3	Very low	127 Å²	127	149.6 Å²	149.6	68%	0.679	80%	0.798	S	S	*	*			trans	-66.4	149.6	173.5	-78.2	-28.2	0	0	0	111.9
428	D	19.2	Very low	22.3	Very low	135 Å²	135	150.4 Å²	150.4	72%	0.722	80%	0.802	S	S	*	*			trans	-1.4	128.9	142.1	-63.6	-41.2	0	0	0	118
429	H	22.1	Very low	22.1	Very low	179 Å²	179	152.7 Å²	152.7	83%	0.829	81%	0.807	S	S	*	*				-179	149.8	114.8	-93.9	-44.8	0	0	0	114
430	N	22.5	Very low	22	Very low	141 Å²	141	150 Å²	150	75%	0.754	80%	0.804	S	S	*	*			trans	92.9	98.6	164.3	-62.7	-22.5	0	0	0	117.1
431	S	22.4	Very low	21.9	Very low	93 Å²	93	147.5 Å²	147.5	65%	0.65	80%	0.796	S	S	*	*				84.2	110.2	54.8	81.2	0	0	0	0	114.4
432	N	19.8	Very low	21.9	Very low	153 Å²	153	149 Å²	149	82%	0.818	80%	0.799	S	S	*	*			trans	40.6	110.8	140.6	-62.1	-22	0	0	0	119.7
433	V	26.3	Very low	21.7	Very low	153 Å²	153	149.9 Å²	149.9	93%	0.927	80%	0.799	S	S	*	*			trans	-119.4	128.2	143	178.7	0	0	0	0	109
434	V	22.7	Very low	21.8	Very low	121 Å²	121	150.3 Å²	150.3	73%	0.733	80%	0.796	S	S	*	*			trans	-86.4	146.5	-163.6	162.8	0	0	0	0	112.1
435	N	20.3	Very low	21.6	Very low	153 Å²	153	148.5 Å²	148.5	82%	0.818	79%	0.79	S	S	*	*			trans	-41.1	133	162.9	-70.6	-34.5	0	0	0	114
436	N	21.8	Very low	21.6	Very low	162 Å²	162	146.9 Å²	146.9	87%	0.866	79%	0.787	S	S	*	*			trans	-117.1	101.7	156.2	-97.1	-23.6	0	0	0	109.2
437	G	19.7	Very low	21.4	Very low	71 Å²	71	144.8 Å²	144.8	73%	0.732	78%	0.783	S	S	*	*			trans	-81.6	133.9	158.7	0	0	0	0	0	110
438	K	23.4	Very low	21.5	Very low	205 Å²	205	145.5 Å²	145.5	89%	0.891	79%	0.792	S	S	*	*			trans	-136.9	110.5	157.3	-81.6	-173.1	178.9	174.4	0	109.6
439	H	20.2	Very low	21.5	Very low	194 Å²	194	144.6 Å²	144.6	90%	0.898	79%	0.792	S	S	*	*			trans	-57.5	142.5	158.5	-78.1	-85.5	0	0	0	111.2
440	S	22.7	Very low	21.4	Very low	116 Å²	116	142.9 Å²	142.9	81%	0.811	79%	0.794	S	S	*	*				-175	128.2	112.3	-156	0	0	0	0	111.5
441	T	18.8	Very low	21.4	Very low	114 Å²	114	139.8 Å²	139.8	70%	0.699	80%	0.795	S	S	*	*			trans	-70.1	138.4	170.3	21.4	0	0	0	0	112.3
442	K	23.2	Very low	21.2	Very low	208 Å²	208	142.9 Å²	142.9	90%	0.904	80%	0.804	S	S	*	*			trans	-147.5	119.2	145.3	-81.6	-165.6	178.7	172	0	111.5
443	Y	19.8	Very low	21.4	Very low	210 Å²	210	143.6 Å²	143.6	82%	0.824	81%	0.808	S	S	*	*			trans	-61.7	146.9	160.5	-75	-102.6	0	0	0	110.4
444	N	21.6	Very low	21.1	Very low	141 Å²	141	142.8 Å²	142.8	75%	0.754	80%	0.797	S	S	*	*				169.3	148.9	84	-138.8	10.4	0	0	0	112.6
445	T	19.1	Very low	21.1	Very low	100 Å²	100	144.1 Å²	144.1	61%	0.613	80%	0.8	S	S	*	*			trans	-51.5	153	174	50.1	0	0	0	0	116.9
446	N	22.2	Very low	21.1	Very low	140 Å²	140	143 Å²	143	75%	0.749	79%	0.794	S	S	*	*				-176.4	113.7	111.3	-85	-10.9	0	0	0	113
447	T	19.8	Very low	21.3	Very low	124 Å²	124	142.3 Å²	142.3	76%	0.761	79%	0.79	S	S	*	*				23.3	126.5	129.5	27.9	0	0	0	0	120.7
448	T	23.5	Very low	21.4	Very low	143 Å²	143	146.4 Å²	146.4	88%	0.877	80%	0.796	S	S	*	*			trans	-139.8	118.1	145.6	-10.1	0	0	0	0	110.1
449	T	19.1	Very low	21.4	Very low	116 Å²	116	141 Å²	141	71%	0.712	79%	0.79	S	S	*	*			trans	-69.5	157.3	168.2	33.7	0	0	0	0	112.7
450	T	20.8	Very low	21.5	Very low	143 Å²	143	143.2 Å²	143.2	88%	0.877	79%	0.79	S	S	*	*			trans	127.2	135	140.1	56.4	0	0	0	0	115.1
451	G	21.6	Very low	21.6	Very low	76 Å²	76	144.6 Å²	144.6	78%	0.784	79%	0.794	S	S	*	*			trans	134.4	72.3	149.2	0	0	0	0	0	117
452	N	19	Very low	21.7	Very low	157 Å²	157	146.7 Å²	146.7	84%	0.84	80%	0.8	S	S	*	*			trans	-57	143	151.9	-77.7	-25.1	0	0	0	110.1
453	N	23.3	Very low	21.9	Very low	168 Å²	168	144.3 Å²	144.3	90%	0.898	80%	0.798	S	S	*	*			trans	-154.3	125.4	145.7	-104	-18.1	0	0	0	112.6
454	I	19.7	Very low	22.1	Very low	137 Å²	137	142 Å²	142	70%	0.703	80%	0.799	S	S	*	*			trans	-85.8	145.8	167.7	-69.9	160.9	0	0	0	107.6
455	N	23.6	Very low	22.1	Very low	149 Å²	149	142.9 Å²	142.9	80%	0.797	80%	0.802	S	S	*	*			trans	-177.6	111	148.1	-86	-24	0	0	0	107.6
456	N	19.6	Very low	22.2	Very low	129 Å²	129	147.9 Å²	147.9	69%	0.69	82%	0.816	S	S	*	*				57	116.2	81.9	-77.4	-10.9	0	0	0	115.1
457	N	25.9	Very low	22.2	Very low	147 Å²	147	143.7 Å²	143.7	79%	0.786	81%	0.805	S	S	*	*				176.7	115.4	121.8	-83.3	-16.6	0	0	0	112.9
458	D	22.4	Very low	22.4	Very low	157 Å²	157	144.2 Å²	144.2	84%	0.84	81%	0.811	S	S	*	*				33.2	127.1	129.3	-59.9	-29.1	0	0	0	122.3
459	A	24.4	Very low	22.3	Very low	93 Å²	93	145.1 Å²	145.1	77%	0.769	81%	0.809	S	S	*	*				164.5	117.1	96.5	0	0	0	0	0	113.9
460	R	21.6	Very low	22.3	Very low	240 Å²	240	144.5 Å²	144.5	91%	0.906	81%	0.809	S	S	*	*			trans	35.2	121.4	142.3	-59.9	-177.2	-178.3	-177.8	0.6	121.1
461	T	25.4	Very low	22.5	Very low	144 Å²	144	145.7 Å²	145.7	88%	0.883	81%	0.809	S	S	*	*				-167.2	133.8	109.3	34.6	0	0	0	0	110.6
462	N	21.2	Very low	22.5	Very low	158 Å²	158	149.5 Å²	149.5	85%	0.845	81%	0.806	S	S	*	*			trans	-67.9	133.7	177.2	-66	-37.1	0	0	0	111.1
463	D	26.7	Very low	22.8	Very low	159 Å²	159	148.2 Å²	148.2	85%	0.85	80%	0.799	S	S	*	*			trans	-152.5	137.1	142.3	-95.5	-30.5	0	0	0	110.6	I465	D463-I465 PolarHBondContact O-N 3.31Å
464	L	22.8	Very low	22.9	Very low	161 Å²	161	146.5 Å²	146.5	84%	0.843	79%	0.79	S	S	*	*			trans	-76.9	105.7	-164.9	-67.2	153	0	0	0	110.9
465	I	22.8	Very low	22.9	Very low	160 Å²	160	144.4 Å²	144.4	82%	0.821	79%	0.788	S	S	*	*			trans	-109.9	105.9	161.7	-62.6	-179.7	0	0	0	107.9	D463 G467	D463-I465 PolarHBondContact O-N 3.31Å; I465-G467 VanDerWaalsContact C-N 3.34Å; I465-G467 PolarHBondContact O-N 3.01Å
466	F	21.8	Very low	23.1	Very low	205 Å²	205	144.8 Å²	144.8	90%	0.899	79%	0.79	S	S	*	*			trans	-64.9	92.9	162.1	-89.7	-91.8	0	0	0	108.8
467	G	20.6	Very low	23.3	Very low	52 Å²	52	145.3 Å²	145.3	54%	0.536	79%	0.792	S	S	.	*	P	Polyproline II helix	trans	-93.6	142	163.4	0	0	0	0	0	110.4	I465	I465-G467 VanDerWaalsContact C-N 3.34Å; I465-G467 PolarHBondContact O-N 3.01Å
468	P	24.8	Very low	23.2	Very low	135 Å²	135	143.4 Å²	143.4	88%	0.877	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-66.7	146.1	-178.9	27.8	-32.5	0	0	0	111.8
469	I	21.5	Very low	23.1	Very low	162 Å²	162	139.7 Å²	139.7	83%	0.831	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-59.2	129.2	-167.4	-68.8	154.1	0	0	0	112.5	L471	I469-L471 PolarHBondContact O-N 3.42Å
470	S	19.6	Very low	22.9	Very low	102 Å²	102	143.3 Å²	143.3	71%	0.713	79%	0.794	S	S	*	*			trans	-68	113.9	171.7	-159.6	0	0	0	0	110.3	H472	S470-H472 PolarHBondContact O-N 3.29Å
471	L	24.4	Very low	22.8	Very low	169 Å²	169	137.3 Å²	137.3	89%	0.885	79%	0.789	S	S	*	*			trans	-84.6	96.5	163.2	-95.3	155.6	0	0	0	108.3	I469	I469-L471 PolarHBondContact O-N 3.42Å
472	H	21.6	Very low	22.5	Very low	155 Å²	155	139.8 Å²	139.8	72%	0.718	79%	0.788	S	S	*	*			trans	-53.9	127.6	158.4	-103.2	-82.8	0	0	0	110.3	S470	S470-H472 PolarHBondContact O-N 3.29Å
473	N	26.2	Very low	22.5	Very low	131 Å²	131	140.5 Å²	140.5	70%	0.701	79%	0.791	S	S	*	*				173.9	121.2	115.3	-89.2	-23.6	0	0	0	114
474	N	24	Very low	22.2	Very low	132 Å²	132	136.1 Å²	136.1	71%	0.706	78%	0.784	S	S	*	*			trans	57.6	103.4	133.9	-58.9	-11.4	0	0	0	120.9
475	S	20.8	Very low	22.7	Very low	93 Å²	93	134.7 Å²	134.7	65%	0.65	78%	0.784	S	S	*	*				-7	152	128.3	56.1	0	0	0	0	119.9
476	N	27.3	Very low	22.7	Very low	156 Å²	156	132.7 Å²	132.7	83%	0.834	79%	0.785	S	S	*	*			trans	99.4	137.4	166.8	-54	-15.3	0	0	0	112.1
477	D	24.3	Very low	22.6	Very low	140 Å²	140	133 Å²	133	75%	0.749	79%	0.786	S	S	*	*			cis	-173.4	151.7	-1.1	171.9	19.2	0	0	0	104.6
478	S	23.9	Very low	22.6	Very low	108 Å²	108	133.7 Å²	133.7	76%	0.755	79%	0.793	S	S	*	*			trans	-57.2	127.3	166.8	35.3	0	0	0	0	112.8
479	G	20.1	Very low	22.4	Very low	78 Å²	78	132.1 Å²	132.1	80%	0.804	79%	0.786	S	S	*	*			trans	-179.6	116.8	171.5	0	0	0	0	0	114.6
480	I	20.8	Very low	22.3	Very low	169 Å²	169	129.4 Å²	129.4	87%	0.867	78%	0.776	S	S	*	*			trans	-71.1	137.9	173.7	-68.7	155.9	0	0	0	110.8
481	S	19.1	Very low	22.4	Very low	114 Å²	114	133.1 Å²	133.1	80%	0.797	78%	0.78	S	S	*	*			trans	-172.3	138.1	132.8	52.9	0	0	0	0	113.4
482	F	18.1	Very low	22.1	Very low	197 Å²	197	133.9 Å²	133.9	86%	0.864	78%	0.776	S	S	*	*			trans	-84.6	131.6	161.9	-83.1	-106.1	0	0	0	108.5
483	D	21.7	Very low	22	Very low	172 Å²	172	131 Å²	131	92%	0.92	78%	0.779	S	S	*	*			trans	180	153.2	132.5	-101.5	-25.1	0	0	0	112.6
484	G	20.3	Very low	21.8	Very low	68 Å²	68	134.1 Å²	134.1	70%	0.701	79%	0.789	S	S	*	*			trans	-72.3	-159.4	-168	0	0	0	0	0	118.5
485	P	33.2	Very low	21.5	Very low	130 Å²	130	137.6 Å²	137.6	84%	0.844	80%	0.798	S	S	*	*				-99.3	157.3	-129.2	36.9	-36	0	0	0	115
486	S	22.9	Very low	21.5	Very low	119 Å²	119	137.9 Å²	137.9	83%	0.832	80%	0.8	S	S	*	*			trans	-128.9	112.9	164.6	-164.5	0	0	0	0	110.5
487	F	19.2	Very low	21.2	Very low	211 Å²	211	137.5 Å²	137.5	93%	0.925	80%	0.797	S	S	*	*			trans	-69.4	125.9	159.8	-93.8	-98.8	0	0	0	108.6
488	G	21.1	Very low	21.2	Very low	66 Å²	66	137.3 Å²	137.3	68%	0.68	80%	0.795	S	S	*	*			trans	-158.5	73.8	-177.8	0	0	0	0	0	113.6
489	S	20.4	Very low	21.2	Very low	103 Å²	103	136.9 Å²	136.9	72%	0.72	79%	0.792	S	S	*	*			trans	46.4	112.2	133.4	-178.8	0	0	0	0	120.8
490	V	19.4	Very low	21.4	Very low	104 Å²	104	140.2 Å²	140.2	63%	0.63	79%	0.791	S	S	*	*				65.5	117.5	125.9	-173.2	0	0	0	0	117.7
491	F	20.9	Very low	21.8	Very low	181 Å²	181	138.1 Å²	138.1	79%	0.794	79%	0.789	S	S	*	*				-172.8	119.5	105.8	-96	-68.8	0	0	0	113.1
492	K	19.6	Very low	22.1	Very low	185 Å²	185	135.6 Å²	135.6	80%	0.804	78%	0.781	S	S	*	*			trans	48.1	117.6	137.8	-93.9	176.6	172.5	173.8	0	121.4
493	A	18.8	Very low	22.5	Very low	95 Å²	95	132.8 Å²	132.8	79%	0.785	78%	0.784	S	S	*	*			trans	-41.1	129.7	145.5	0	0	0	0	0	113.7
494	Q	21.6	Very low	22.6	Very low	196 Å²	196	132.4 Å²	132.4	92%	0.916	78%	0.782	S	S	*	*			trans	-97.9	111	156.3	-86.9	177.3	-43.2	0	0	108.8
495	K	17.9	Very low	23.3	Very low	205 Å²	205	134.4 Å²	134.4	89%	0.891	78%	0.782	S	S	*	*			trans	-105	119.2	160.8	-114.2	-175.2	178.6	-179	0	106.5
496	S	21	Very low	22.8	Very low	98 Å²	98	135 Å²	135	69%	0.685	78%	0.783	S	S	*	*			trans	161	136.4	164.7	52.4	0	0	0	0	107.3
497	L	21.8	Very low	22.8	Very low	148 Å²	148	135.1 Å²	135.1	78%	0.775	78%	0.783	S	S	*	*			cis	-178	153.8	24.1	-113.5	159.7	0	0	0	106.8
498	I	23.7	Very low	22.8	Very low	137 Å²	137	129.2 Å²	129.2	70%	0.703	77%	0.768	S	S	*	*			trans	92	95.3	144.2	-64.4	161.7	0	0	0	119.6
499	S	22.8	Very low	22.8	Very low	98 Å²	98	132.6 Å²	132.6	69%	0.685	77%	0.77	S	S	*	*				52	120	123.3	66	0	0	0	0	123.7
500	D	24.2	Very low	22.9	Very low	149 Å²	149	134.8 Å²	134.8	80%	0.797	77%	0.773	S	S	*	*				15.1	157.4	115.4	-105.3	-10	0	0	0	120.2
501	P	30.1	Very low	23	Very low	125 Å²	125	135.8 Å²	135.8	81%	0.812	78%	0.775	S	S	*	*			cis	-140.1	160.7	23.5	36	-15.1	0	0	0	117.3
502	G	26	Very low	23	Very low	61 Å²	61	135.7 Å²	135.7	63%	0.629	78%	0.777	S	S	*	*			trans	-167.8	85.8	168.5	0	0	0	0	0	115
503	C	25.4	Very low	23.1	Very low	137 Å²	137	132.4 Å²	132.4	93%	0.926	78%	0.777	S	S	*	*			trans	88.4	127	146.4	-45.9	0	0	0	0	119.3
504	D	24.5	Very low	23.2	Very low	164 Å²	164	136.1 Å²	136.1	88%	0.877	78%	0.784	S	S	*	*			trans	-72.8	169.9	-164.4	-85	-48.5	0	0	0	118.7
505	P	34.1	Very low	23.3	Very low	111 Å²	111	131.9 Å²	131.9	72%	0.721	78%	0.776	S	S	*	*			trans	-102.7	149.8	-169.7	38.4	-29.3	0	0	0	113.9
506	V	23.7	Very low	23.6	Very low	141 Å²	141	130.1 Å²	130.1	86%	0.855	77%	0.77	S	S	*	*			trans	-144.3	126.4	162.3	-175.3	0	0	0	0	111.8
507	C	22.1	Very low	23.6	Very low	122 Å²	122	132.3 Å²	132.3	82%	0.824	77%	0.774	S	S	*	*			trans	66.7	106.6	158.7	-87.1	0	0	0	0	121.7
508	S	18.9	Very low	23.7	Very low	87 Å²	87	133 Å²	133	61%	0.608	78%	0.778	S	S	*	*			trans	-58.7	164.1	139.7	53.7	0	0	0	0	114.2
509	D	21.4	Very low	23.6	Very low	138 Å²	138	130.8 Å²	130.8	74%	0.738	78%	0.775	S	S	*	*			trans	98.7	126.8	147.9	-56.4	-42.1	0	0	0	120.3
510	L	22.6	Very low	23.7	Very low	149 Å²	149	132.4 Å²	132.4	78%	0.78	78%	0.781	S	S	*	*			trans	102.8	107.4	145.8	-69	145.3	0	0	0	120.2
511	D	21.3	Very low	23.8	Very low	124 Å²	124	134 Å²	134	66%	0.663	78%	0.783	S	S	*	*				74.5	111.7	123	-72.7	-8.8	0	0	0	122.6
512	Q	20.9	Very low	23.6	Very low	180 Å²	180	135.1 Å²	135.1	84%	0.841	78%	0.783	S	S	*	*				21.7	106.7	115.6	-59.4	-176.6	16.7	0	0	116.6
513	S	22.6	Very low	23.7	Very low	116 Å²	116	138 Å²	138	81%	0.811	79%	0.793	S	S	*	*				175.7	134	115.1	42.9	0	0	0	0	112.1
514	N	20.4	Very low	24.1	Very low	172 Å²	172	140.5 Å²	140.5	92%	0.92	79%	0.791	S	S	*	*			trans	-54.3	129.3	165.9	-75.8	-49.1	0	0	0	111.6
515	S	24.3	Very low	24.4	Very low	107 Å²	107	141.3 Å²	141.3	75%	0.748	79%	0.79	S	S	*	*			trans	-148.4	114.5	149.5	56.4	0	0	0	0	111.5
516	H	23.4	Very low	24.5	Very low	168 Å²	168	142 Å²	142	78%	0.778	79%	0.786	S	S	*	*			trans	28.2	114.2	145.6	-72.1	-78.3	0	0	0	120.3
517	L	21.4	Very low	25.6	Very low	145 Å²	145	138.6 Å²	138.6	76%	0.759	77%	0.769	S	S	*	*				51.5	112.2	125.9	-62.9	166.8	0	0	0	117.6
518	N	24.4	Very low	26.6	Very low	162 Å²	162	141.1 Å²	141.1	87%	0.866	77%	0.766	S	S	*	*				-151.7	110.1	123.1	-94	-29.8	0	0	0	111.3
519	S	21.5	Very low	27.6	Very low	91 Å²	91	143.5 Å²	143.5	64%	0.636	77%	0.768	S	S	*	*			trans	23.7	143.9	138.8	58.9	0	0	0	0	121.8
520	T	23.9	Very low	28.8	Very low	132 Å²	132	138.4 Å²	138.4	81%	0.81	75%	0.745	S	S	*	*			trans	89.5	124.7	154.8	42.2	0	0	0	0	118.1
521	E	27.3	Very low	30	Very low	181 Å²	181	137 Å²	137	85%	0.846	73%	0.734	S	S	*	*			trans	80.4	76.9	172.6	-54.2	-172.1	178	0	0	116.3
522	N	25.9	Very low	31	Very low	150 Å²	150	133.9 Å²	133.9	80%	0.802	72%	0.717	S	S	*	*			trans	-170.3	85.2	142	-91.6	-27.4	0	0	0	109.5
523	S	28.1	Very low	32.2	Very low	120 Å²	120	127.1 Å²	127.1	84%	0.839	69%	0.686	S	S	*	*			trans	-123	65.3	166.6	-59.3	0	0	0	0	108.1
524	Q	33.9	Very low	33.4	Very low	191 Å²	191	126.7 Å²	126.7	89%	0.893	67%	0.671	S	S	*	*			trans	-173.4	69.1	166.5	-105.1	166.2	32.7	0	0	109.8
525	Q	31.3	Very low	34.6	Very low	180 Å²	180	122.8 Å²	122.8	84%	0.841	65%	0.646	S	S	*	*			trans	-147.4	84.9	161.5	-116.5	171	-1.8	0	0	107.2
526	L	35.9	Very low	35.4	Very low	125 Å²	125	118.5 Å²	118.5	65%	0.654	61%	0.614	S	S	*	*			trans	-57.8	138.1	160	-85.9	145.5	0	0	0	106.8	K528 A530 E531	L526-K528 PolarHBondContact O-N 3.5Å; L526-A530 HydrophobicContact CB-CB 4.25Å; L526-A530 HydrophobicContact CD2-CB 3.73Å; L526-E531 HydrophobicContact CB-CG 4.23Å
527	S	46.3	Very low	36.3	Very low	70 Å²	70	114.4 Å²	114.4	49%	0.49	59%	0.592	S	S	.	*			trans	-55.3	144	176.2	67.7	0	0	0	0	108.9	E529 A530 E531	S527-E529 CarbonylContact O-C 3.6Å; S527-E529 PolarHBondContact O-N 2.99Å; S527-A530 WeakPolarHBondContact O-CA 3.08Å; S527-A530 WeakPolarHBondContact O-CB 3.44Å; S527-A530 PolarHBondContact O-N 3.42Å; S527-A530 PolarHBondContact OG-N 2.87Å; S527-E531 PolarHBondContact O-N 3.49Å; S527-E531 VanDerWaalsContact O-N 3.1Å
528	K	44	Very low	37.3	Very low	175 Å²	175	110.6 Å²	110.6	76%	0.761	58%	0.577	S	S	*	*	H	α-helix	trans	-49.7	-30.8	176.7	-77.6	-177	174.6	-179.2	0	112.5	L526 L532	L526-K528 PolarHBondContact O-N 3.5Å; K528-L532 WeakPolarHBondContact O-CB 3.46Å; K528-L532 WeakPolarHBondContact O-CG 3.22Å; K528-L532 PolarHBondContact O-N 3Å
529	E	39.4	Very low	38.1	Very low	138 Å²	138	107.3 Å²	107.3	65%	0.645	56%	0.557	S	S	*	*	H	α-helix	trans	-63.3	-46.4	172.7	-175.2	177.5	-174.5	0	0	112.7	S527 L532 I533	S527-E529 CarbonylContact O-C 3.6Å; S527-E529 PolarHBondContact O-N 2.99Å; E529-L532 PolarHBondContact O-N 3.13Å; E529-I533 HydrophobicContact CG-CD1 4.04Å; E529-I533 VanDerWaalsContact O-CG1 3.25Å; E529-I533 WeakPolarHBondContact O-CG1 3.35Å; E529-I533 PolarHBondContact O-N 2.85Å
530	A	45.5	Very low	39.1	Very low	31 Å²	31	103.8 Å²	103.8	26%	0.256	53%	0.53	S	S	.	.	H	α-helix	trans	-65.3	-38.6	176.3	0	0	0	0	0	112.5	L526 S527 I533 E534	L526-A530 HydrophobicContact CB-CB 4.25Å; L526-A530 HydrophobicContact CD2-CB 3.73Å; S527-A530 WeakPolarHBondContact O-CA 3.08Å; S527-A530 WeakPolarHBondContact O-CB 3.44Å; S527-A530 PolarHBondContact O-N 3.42Å; S527-A530 PolarHBondContact OG-N 2.87Å; A530-I533 PolarHBondContact O-N 2.65Å; A530-E534 WeakPolarHBondContact O-CB 3.44Å; A530-E534 PolarHBondContact O-N 3.2Å
531	E	48.3	Very low	39.7	Very low	119 Å²	119	98.9 Å²	98.9	56%	0.556	50%	0.503	S	S	*	.	H	α-helix	trans	-62	-42.7	172.6	-74.9	-175.2	166	0	0	111.9	L526 S527 E534 F535	L526-E531 HydrophobicContact CB-CG 4.23Å; S527-E531 PolarHBondContact O-N 3.49Å; S527-E531 VanDerWaalsContact O-N 3.1Å; E531-E534 PolarHBondContact O-N 3.16Å; E531-F535 VanDerWaalsContact O-CB 3.28Å; E531-F535 WeakPolarHBondContact O-CB 3.46Å; E531-F535 PolarHBondContact O-N 2.98Å
532	L	42.1	Very low	40	Very low	58 Å²	58	92.5 Å²	92.5	30%	0.304	49%	0.486	S	S	.	.	H	α-helix	trans	-64.9	-43.4	176.3	-85.3	161.2	0	0	0	112.1	K528 E529 E534 F535 F536 L574	K528-L532 WeakPolarHBondContact O-CB 3.46Å; K528-L532 WeakPolarHBondContact O-CG 3.22Å; K528-L532 PolarHBondContact O-N 3Å; E529-L532 PolarHBondContact O-N 3.13Å; L532-E534 VanDerWaalsContact C-N 3.32Å; L532-E534 PolarHBondContact O-N 3.08Å; L532-F535 PolarHBondContact O-N 3.36Å; L532-F536 HydrophobicContact CD2-CE2 4.21Å; L532-F536 WeakPolarHBondContact O-CD2 3.48Å; L532-F536 PolarHBondContact O-N 3.29Å; L532-L574 HydrophobicContact CD2-CD2 3.81Å
533	I	45.8	Very low	40.8	Very low	38 Å²	38	89.5 Å²	89.5	20%	0.195	47%	0.467	C	S	.	.	H	α-helix	trans	-58.8	-45.1	175.9	-70.9	164.9	0	0	0	110.4	E529 A530 F536 R537 A577	E529-I533 HydrophobicContact CG-CD1 4.04Å; E529-I533 VanDerWaalsContact O-CG1 3.25Å; E529-I533 WeakPolarHBondContact O-CG1 3.35Å; E529-I533 PolarHBondContact O-N 2.85Å; A530-I533 PolarHBondContact O-N 2.65Å; I533-F536 PolarHBondContact O-N 3.07Å; I533-R537 WeakPolarHBondContact O-CG 3.5Å; I533-R537 PolarHBondContact O-N 3.38Å; I533-A577 HydrophobicContact CG1-CB 4.23Å
534	E	49.4	Very low	41.6	Very low	107 Å²	107	86.9 Å²	86.9	50%	0.5	44%	0.438	S	S	.	.	H	α-helix	trans	-71	-36.7	179.8	-164.6	58.2	-152.4	0	0	112.4	A530 E531 L532 F536 R537 S538	A530-E534 WeakPolarHBondContact O-CB 3.44Å; A530-E534 PolarHBondContact O-N 3.2Å; E531-E534 PolarHBondContact O-N 3.16Å; L532-E534 VanDerWaalsContact C-N 3.32Å; L532-E534 PolarHBondContact O-N 3.08Å; E534-F536 VanDerWaalsContact C-N 3.34Å; E534-F536 PolarHBondContact O-N 3.39Å; E534-R537 PolarHBondContact O-N 3.34Å; E534-R537 WeakPolarHBondContact OE2-CD 3.39Å; E534-R537 IonicContact OE2-NH1 3.28Å; E534-R537 PolarHBondContact OE2-NH1 3.13Å; E534-S538 PolarHBondContact O-N 3.11Å; E534-S538 PolarHBondContact O-OG 2.52Å
535	F	45	Very low	42.1	Very low	90 Å²	90	80 Å²	80	40%	0.395	41%	0.411	S	S	.	.	H	α-helix	trans	-59.8	-43.1	171.5	176.7	-95.6	0	0	0	111.7	E531 L532 S538 H539	E531-F535 VanDerWaalsContact O-CB 3.28Å; E531-F535 WeakPolarHBondContact O-CB 3.46Å; E531-F535 PolarHBondContact O-N 2.98Å; L532-F535 PolarHBondContact O-N 3.36Å; F535-S538 WeakPolarHBondContact CA-OG 3.47Å; F535-S538 PolarHBondContact O-N 3.18Å; F535-S538 PolarHBondContact O-OG 3.46Å; F535-H539 AromaticContact CD2-ND1 3.97Å; F535-H539 AromaticContact CE2-ND1 3.96Å; F535-H539 WeakPolarHBondContact O-CB 3.47Å; F535-H539 PolarHBondContact O-N 3.39Å; F535-H539 VanDerWaalsContact O-N 3.08Å; F535-H539 PolarHBondContact O-ND1 3.32Å
536	F	39.9	Very low	42.6	Very low	17 Å²	17	72.6 Å²	72.6	8%	0.075	38%	0.379	C	S	.	.	H	α-helix	trans	-72.3	-38.8	176.6	-83.4	-68.5	0	0	0	113.3	L532 I533 E534 S538 H539 Q540 H543 L574 A577	L532-F536 HydrophobicContact CD2-CE2 4.21Å; L532-F536 WeakPolarHBondContact O-CD2 3.48Å; L532-F536 PolarHBondContact O-N 3.29Å; I533-F536 PolarHBondContact O-N 3.07Å; E534-F536 VanDerWaalsContact C-N 3.34Å; E534-F536 PolarHBondContact O-N 3.39Å; F536-S538 VanDerWaalsContact C-N 3.27Å; F536-S538 PolarHBondContact O-N 3.11Å; F536-H539 CarbonylContact O-C 3.48Å; F536-H539 PolarHBondContact O-N 3.22Å; F536-H539 VanDerWaalsContact O-N 3.13Å; F536-Q540 WeakPolarHBondContact O-CA 3.48Å; F536-Q540 WeakPolarHBondContact O-CG 3.37Å; F536-Q540 PolarHBondContact O-N 3.1Å; F536-H543 HydrophobicContact CE1-CB 4.47Å; F536-L574 HydrophobicContact CE2-CB 4.01Å; F536-L574 HydrophobicContact CE2-CD2 3.42Å; F536-L574 VanDerWaalsContact CE2-CD2 3.42Å; F536-L574 HydrophobicContact CE2-CG 4.22Å; F536-L574 HydrophobicContact CZ-CB 3.76Å; F536-L574 HydrophobicContact CZ-CD1 4.31Å; F536-L574 HydrophobicContact CZ-CD2 3.56Å; F536-L574 HydrophobicContact CZ-CG 4.02Å; F536-A577 HydrophobicContact CD2-CB 4.22Å
537	R	43.2	Very low	43.1	Very low	83 Å²	83	67 Å²	67	31%	0.313	35%	0.35	S	S	.	.	H	α-helix	trans	-54.5	-45.6	171.5	-82.7	178.1	177.6	165.3	-3.3	111.4	I533 E534 H539 A581 S653	I533-R537 WeakPolarHBondContact O-CG 3.5Å; I533-R537 PolarHBondContact O-N 3.38Å; E534-R537 PolarHBondContact O-N 3.34Å; E534-R537 WeakPolarHBondContact OE2-CD 3.39Å; E534-R537 IonicContact OE2-NH1 3.28Å; E534-R537 PolarHBondContact OE2-NH1 3.13Å; R537-H539 VanDerWaalsContact C-N 3.35Å; R537-H539 PolarHBondContact O-N 3.01Å; R537-A581 HydrophobicContact CG-CB 4.02Å; R537-S653 WeakPolarHBondContact CD-O 3.14Å; R537-S653 VanDerWaalsContact CZ-CB 3.48Å; R537-S653 PolarHBondContact NE-O 3.16Å; R537-S653 PolarHBondContact NH2-OG 3.09Å
538	S	42	Very low	43.3	Very low	64 Å²	64	65.9 Å²	65.9	45%	0.448	34%	0.339	S	S	.	.	H	α-helix	trans	-70.5	-27	178.5	52	0	0	0	0	113.7	E534 F535 F536	E534-S538 PolarHBondContact O-N 3.11Å; E534-S538 PolarHBondContact O-OG 2.52Å; F535-S538 WeakPolarHBondContact CA-OG 3.47Å; F535-S538 PolarHBondContact O-N 3.18Å; F535-S538 PolarHBondContact O-OG 3.46Å; F536-S538 VanDerWaalsContact C-N 3.27Å; F536-S538 PolarHBondContact O-N 3.11Å
539	H	40.7	Very low	43.3	Very low	93 Å²	93	58.9 Å²	58.9	43%	0.431	31%	0.314	S	S	.	.	H	α-helix	trans	-118.7	21.5	-171.1	-65.5	80.3	0	0	0	115.6	F535 F536 R537 A541 G542	F535-H539 AromaticContact CD2-ND1 3.97Å; F535-H539 AromaticContact CE2-ND1 3.96Å; F535-H539 WeakPolarHBondContact O-CB 3.47Å; F535-H539 PolarHBondContact O-N 3.39Å; F535-H539 VanDerWaalsContact O-N 3.08Å; F535-H539 PolarHBondContact O-ND1 3.32Å; F536-H539 CarbonylContact O-C 3.48Å; F536-H539 PolarHBondContact O-N 3.22Å; F536-H539 VanDerWaalsContact O-N 3.13Å; R537-H539 VanDerWaalsContact C-N 3.35Å; R537-H539 PolarHBondContact O-N 3.01Å; H539-A541 PolarHBondContact O-N 3.38Å; H539-G542 PolarHBondContact O-N 2.91Å
540	Q	43	Very low	43.7	Very low	17 Å²	17	52.5 Å²	52.5	8%	0.079	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-42.5	-23.7	-170.6	-89.8	-175.4	-1.5	0	0	117.3	F536 R544 A581 V655	F536-Q540 WeakPolarHBondContact O-CA 3.48Å; F536-Q540 WeakPolarHBondContact O-CG 3.37Å; F536-Q540 PolarHBondContact O-N 3.1Å; Q540-R544 VanDerWaalsContact O-CZ 3.22Å; Q540-R544 PolarHBondContact O-NE 3.33Å; Q540-R544 PolarHBondContact O-NH2 2.94Å; Q540-A581 PolarHBondContact NE2-O 3.07Å; Q540-V655 VanDerWaalsContact CD-O 3.27Å; Q540-V655 PolarHBondContact NE2-O 3.13Å; Q540-V655 VanDerWaalsContact NE2-O 3.11Å; Q540-V655 PolarHBondContact OE1-O 2.75Å
541	A	37.9	Very low	43.9	Very low	30 Å²	30	51.5 Å²	51.5	25%	0.248	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-0.6	-176.4	0	0	0	0	0	116.2	H539 R659	H539-A541 PolarHBondContact O-N 3.38Å; A541-R659 HydrophobicContact CB-CB 4.1Å; A541-R659 PolarHBondContact O-NH1 3.04Å
542	G	33.3	Very low	44	Very low	46 Å²	46	51.8 Å²	51.8	47%	0.474	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-29	-169	0	0	0	0	0	116.7	H539	H539-G542 PolarHBondContact O-N 2.91Å
543	H	41.1	Very low	44	Very low	87 Å²	87	51.6 Å²	51.6	40%	0.403	29%	0.288	S	S	.	.	S	Bend	trans	-127.3	8.7	-163.3	-80.3	-79.2	0	0	0	115.7	F536 S545 S546 S547	F536-H543 HydrophobicContact CE1-CB 4.47Å; H543-S545 PolarHBondContact O-N 3.3Å; H543-S546 WeakPolarHBondContact CA-OG 3.5Å; H543-S546 PolarHBondContact ND1-OG 3.44Å; H543-S546 PolarHBondContact O-N 3.31Å; H543-S546 PolarHBondContact O-OG 2.91Å; H543-S547 PolarHBondContact O-N 2.89Å; H543-S547 PolarHBondContact O-OG 2.9Å
544	R	45.4	Very low	43.8	Very low	66 Å²	66	53.5 Å²	53.5	25%	0.249	31%	0.309	C	S	.	.	H	α-helix	trans	-60.6	-43.7	-176	-63.8	-176.5	-149.6	174.9	5.7	113.9	Q540 S547 I548 D583 R657	Q540-R544 VanDerWaalsContact O-CZ 3.22Å; Q540-R544 PolarHBondContact O-NE 3.33Å; Q540-R544 PolarHBondContact O-NH2 2.94Å; R544-S547 PolarHBondContact O-N 3.28Å; R544-I548 PolarHBondContact O-N 2.97Å; R544-D583 VanDerWaalsContact CD-OD2 3.23Å; R544-D583 WeakPolarHBondContact CD-OD2 3.43Å; R544-D583 IonicContact CZ-OD2 3.17Å; R544-D583 IonicContact NE-OD2 3.75Å; R544-D583 PolarHBondContact NE-OD2 2.85Å; R544-R657 PolarHBondContact NH2-O 3.01Å
545	S	44.2	Very low	43.3	Very low	46 Å²	46	51.6 Å²	51.6	32%	0.322	30%	0.302	S	S	.	.	H	α-helix	trans	-70.2	-30.9	-179	47.3	0	0	0	0	113	H543 A549	H543-S545 PolarHBondContact O-N 3.3Å; S545-A549 VanDerWaalsContact O-CB 3.26Å; S545-A549 WeakPolarHBondContact O-CB 3.44Å; S545-A549 PolarHBondContact O-N 3.4Å; S545-A549 VanDerWaalsContact O-N 3.15Å
546	S	41.9	Very low	43	Very low	24 Å²	24	49.8 Å²	49.8	17%	0.168	30%	0.299	C	S	.	.	H	α-helix	trans	-69.4	-37.1	176.6	40.4	0	0	0	0	112.7	H543 A550	H543-S546 WeakPolarHBondContact CA-OG 3.5Å; H543-S546 PolarHBondContact ND1-OG 3.44Å; H543-S546 PolarHBondContact O-N 3.31Å; H543-S546 PolarHBondContact O-OG 2.91Å; S546-A550 WeakPolarHBondContact O-CB 3.35Å; S546-A550 PolarHBondContact O-N 2.89Å
547	S	47.6	Very low	43.1	Very low	7 Å²	7	54.5 Å²	54.5	5%	0.049	33%	0.329	C	S	.	.	H	α-helix	trans	-71.6	-42.6	-179	-50	0	0	0	0	112.4	H543 R544 A550 L551	H543-S547 PolarHBondContact O-N 2.89Å; H543-S547 PolarHBondContact O-OG 2.9Å; R544-S547 PolarHBondContact O-N 3.28Å; S547-A550 PolarHBondContact O-N 3.42Å; S547-L551 PolarHBondContact O-N 2.77Å; S547-L551 VanDerWaalsContact O-N 3.13Å
548	I	49.2	Very low	43.1	Very low	47 Å²	47	54 Å²	54	24%	0.241	33%	0.331	C	S	.	.	H	α-helix	trans	-65.5	-42.4	175.8	-65.8	172.6	0	0	0	110.6	R544 A550 L551 H552 I575 Y589	R544-I548 PolarHBondContact O-N 2.97Å; I548-A550 VanDerWaalsContact C-N 3.32Å; I548-A550 PolarHBondContact O-N 2.86Å; I548-L551 PolarHBondContact O-N 3.31Å; I548-H552 PolarHBondContact O-CD2 3.49Å; I548-H552 PolarHBondContact O-N 3.39Å; I548-I575 HydrophobicContact CG1-CD1 3.99Å; I548-Y589 HydrophobicContact CG1-CD2 4.45Å; I548-Y589 HydrophobicContact CG2-CE2 4.26Å
549	A	45.4	Very low	43.2	Very low	29 Å²	29	53 Å²	53	24%	0.24	32%	0.321	C	S	.	.	H	α-helix	trans	-62.7	-38	177.1	0	0	0	0	0	112.7	S545 I558	S545-A549 VanDerWaalsContact O-CB 3.26Å; S545-A549 WeakPolarHBondContact O-CB 3.44Å; S545-A549 PolarHBondContact O-N 3.4Å; S545-A549 VanDerWaalsContact O-N 3.15Å; A549-I558 HydrophobicContact CB-CD1 3.52Å
550	A	46.6	Very low	43.2	Very low	3 Å²	3	51.7 Å²	51.7	3%	0.025	33%	0.333	C	S	.	.	H	α-helix	trans	-64.1	-39.1	173.9	0	0	0	0	0	112.8	S546 S547 I548 G553 L559	S546-A550 WeakPolarHBondContact O-CB 3.35Å; S546-A550 PolarHBondContact O-N 2.89Å; S547-A550 PolarHBondContact O-N 3.42Å; I548-A550 VanDerWaalsContact C-N 3.32Å; I548-A550 PolarHBondContact O-N 2.86Å; A550-G553 PolarHBondContact O-N 3.35Å; A550-L559 HydrophobicContact CB-CD1 3.45Å; A550-L559 VanDerWaalsContact CB-CD1 3.45Å; A550-L559 HydrophobicContact CB-CG 3.87Å
551	L	49.7	Very low	43.4	Very low	11 Å²	11	53 Å²	53	6%	0.058	34%	0.34	C	S	.	.	H	α-helix	trans	-66.1	-36.5	179.4	-82.6	165.6	0	0	0	113.9	S547 I548 G553 R568 F572 I575 Y589	S547-L551 PolarHBondContact O-N 2.77Å; S547-L551 VanDerWaalsContact O-N 3.13Å; I548-L551 PolarHBondContact O-N 3.31Å; L551-G553 PolarHBondContact O-N 3.23Å; L551-R568 HydrophobicContact CD2-CG 4.29Å; L551-F572 HydrophobicContact CD2-CB 3.89Å; L551-I575 HydrophobicContact CD1-CB 4.14Å; L551-I575 HydrophobicContact CD1-CD1 4.03Å; L551-I575 HydrophobicContact CD1-CG2 3.77Å; L551-Y589 HydrophobicContact CD1-CE1 3.66Å
552	H	50.8	Low	44	Very low	124 Å²	124	57.3 Å²	57.3	57%	0.574	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	1.9	177.7	-74	-69.8	0	0	0	113.7	I548 A554	I548-H552 PolarHBondContact O-CD2 3.49Å; I548-H552 PolarHBondContact O-N 3.39Å; H552-A554 PolarHBondContact O-N 3.42Å
553	G	41.8	Very low	45.2	Very low	54 Å²	54	58.5 Å²	58.5	56%	0.557	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	6.9	179.3	0	0	0	0	0	114.4	A550 L551 D555	A550-G553 PolarHBondContact O-N 3.35Å; L551-G553 PolarHBondContact O-N 3.23Å; G553-D555 VanDerWaalsContact C-N 3.31Å; G553-D555 PolarHBondContact O-N 2.94Å
554	A	42.8	Very low	46	Very low	78 Å²	78	58.2 Å²	58.2	65%	0.645	37%	0.367	S	S	*	.	S	Bend	trans	-82.7	-4.9	-174.3	0	0	0	0	0	113.6	H552	H552-A554 PolarHBondContact O-N 3.42Å
555	D	37.6	Very low	46.7	Very low	67 Å²	67	59.9 Å²	59.9	36%	0.358	38%	0.38	S	S	.	.			trans	-160.8	84.9	-179	-108.4	-33.1	0	0	0	111.8	G553 V557 I558	G553-D555 VanDerWaalsContact C-N 3.31Å; G553-D555 PolarHBondContact O-N 2.94Å; D555-V557 PolarHBondContact O-N 2.92Å; D555-V557 VanDerWaalsContact O-N 3.14Å; D555-I558 HydrophobicContact CB-CB 4.3Å; D555-I558 HydrophobicContact CB-CD1 3.53Å; D555-I558 HydrophobicContact CB-CG1 3.74Å; D555-I558 PolarHBondContact O-N 3.19Å
556	T	39	Very low	47.5	Very low	53 Å²	53	62.7 Å²	62.7	33%	0.325	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-19.4	163.9	49.4	0	0	0	0	111.9	I558 P564	T556-I558 PolarHBondContact O-N 3.34Å; T556-P564 HydrophobicContact CG2-CB 4.27Å; T556-P564 HydrophobicContact CG2-CG 3.97Å
557	V	42.4	Very low	48.1	Very low	116 Å²	116	61.7 Å²	61.7	70%	0.703	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-24.4	179.8	-172	0	0	0	0	112.9	D555	D555-V557 PolarHBondContact O-N 2.92Å; D555-V557 VanDerWaalsContact O-N 3.14Å
558	I	43.7	Very low	48.9	Very low	71 Å²	71	66.2 Å²	66.2	36%	0.364	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-33.7	-176.4	-75.4	171.3	0	0	0	112.9	A549 D555 T556	A549-I558 HydrophobicContact CB-CD1 3.52Å; D555-I558 HydrophobicContact CB-CB 4.3Å; D555-I558 HydrophobicContact CB-CD1 3.53Å; D555-I558 HydrophobicContact CB-CG1 3.74Å; D555-I558 PolarHBondContact O-N 3.19Å; T556-I558 PolarHBondContact O-N 3.34Å
559	L	42.5	Very low	49.8	Very low	44 Å²	44	65.5 Å²	65.5	23%	0.23	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-11.3	-179.5	-67.8	179	0	0	0	113.7	A550 L561 H570 L574	A550-L559 HydrophobicContact CB-CD1 3.45Å; A550-L559 VanDerWaalsContact CB-CD1 3.45Å; A550-L559 HydrophobicContact CB-CG 3.87Å; L559-L561 HydrophobicContact CB-CD1 4.28Å; L559-L561 HydrophobicContact CB-CG 4.33Å; L559-L561 HydrophobicContact CD1-CD1 4.5Å; L559-L561 PolarHBondContact O-N 3.19Å; L559-H570 HydrophobicContact CD1-CB 4.31Å; L559-L574 HydrophobicContact CD2-CD1 4.39Å
560	G	42.4	Very low	50.7	Low	66 Å²	66	67.6 Å²	67.6	68%	0.68	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	18.3	-176	0	0	0	0	0	113.8
561	L	46.4	Very low	51.7	Low	44 Å²	44	67.4 Å²	67.4	23%	0.23	40%	0.402	C	S	.	.			trans	-97.4	130.3	176.8	-67.2	171.6	0	0	0	109.3	L559 D563 E566 H570	L559-L561 HydrophobicContact CB-CD1 4.28Å; L559-L561 HydrophobicContact CB-CG 4.33Å; L559-L561 HydrophobicContact CD1-CD1 4.5Å; L559-L561 PolarHBondContact O-N 3.19Å; L561-D563 VanDerWaalsContact C-N 3.33Å; L561-D563 PolarHBondContact O-N 3.39Å; L561-E566 HydrophobicContact CD1-CG 4.47Å; L561-H570 HydrophobicContact CD1-CB 4.04Å
562	P	51.4	Low	52.8	Low	121 Å²	121	68.6 Å²	68.6	79%	0.786	41%	0.407	S	S	*	.	S	Bend	trans	-72.2	-23.3	-172.5	26.5	-32.6	0	0	0	113.9
563	D	58.3	Low	53.8	Low	71 Å²	71	65 Å²	65	38%	0.38	40%	0.399	S	S	.	.			trans	-102.5	127.7	-175.5	-179	43.9	0	0	0	112.7	L561 L565 E566 S567	L561-D563 VanDerWaalsContact C-N 3.33Å; L561-D563 PolarHBondContact O-N 3.39Å; D563-L565 VanDerWaalsContact C-N 3.29Å; D563-L565 PolarHBondContact O-N 2.88Å; D563-L565 VanDerWaalsContact OD2-CB 3.25Å; D563-L565 WeakPolarHBondContact OD2-CB 3.28Å; D563-L565 PolarHBondContact OD2-N 3.42Å; D563-E566 HydrophobicContact CB-CB 4Å; D563-E566 PolarHBondContact O-N 2.93Å; D563-E566 PolarHBondContact OD2-N 3.01Å; D563-S567 WeakPolarHBondContact O-CB 3.37Å; D563-S567 PolarHBondContact O-N 3.17Å; D563-S567 PolarHBondContact O-OG 3.09Å
564	P	57.2	Low	55.4	Low	80 Å²	80	63.2 Å²	63.2	52%	0.519	38%	0.376	S	S	.	.	H	α-helix	trans	-59.3	-34.5	175.2	-25.3	33.5	0	0	0	114.3	T556 R568	T556-P564 HydrophobicContact CG2-CB 4.27Å; T556-P564 HydrophobicContact CG2-CG 3.97Å; P564-R568 WeakPolarHBondContact O-CB 3.46Å; P564-R568 PolarHBondContact O-N 3.29Å
565	L	59.4	Low	56.9	Low	102 Å²	102	59.8 Å²	59.8	53%	0.534	35%	0.347	S	S	.	.	H	α-helix	trans	-70.5	-47.2	-179.2	-156.9	87.7	0	0	0	110.4	D563 S567 R568 A569	D563-L565 VanDerWaalsContact C-N 3.29Å; D563-L565 PolarHBondContact O-N 2.88Å; D563-L565 VanDerWaalsContact OD2-CB 3.25Å; D563-L565 WeakPolarHBondContact OD2-CB 3.28Å; D563-L565 PolarHBondContact OD2-N 3.42Å; L565-S567 VanDerWaalsContact C-N 3.31Å; L565-S567 PolarHBondContact O-N 3.39Å; L565-R568 PolarHBondContact O-N 3.39Å; L565-A569 WeakPolarHBondContact O-CB 3.45Å; L565-A569 PolarHBondContact O-N 3.38Å
566	E	60.6	Low	58.9	Low	104 Å²	104	57.9 Å²	57.9	49%	0.486	34%	0.339	S	S	.	.	H	α-helix	trans	-61	-39.5	174.7	-162.9	176.6	-161.9	0	0	111.9	L561 D563 R568 A569 H570	L561-E566 HydrophobicContact CD1-CG 4.47Å; D563-E566 HydrophobicContact CB-CB 4Å; D563-E566 PolarHBondContact O-N 2.93Å; D563-E566 PolarHBondContact OD2-N 3.01Å; E566-R568 PolarHBondContact O-N 3.44Å; E566-A569 PolarHBondContact O-N 3.1Å; E566-H570 VanDerWaalsContact O-CB 3.24Å; E566-H570 WeakPolarHBondContact O-CB 3.41Å; E566-H570 PolarHBondContact O-N 2.81Å
567	S	56.3	Low	60.6	Low	4 Å²	4	56 Å²	56	3%	0.028	33%	0.329	C	S	.	.	H	α-helix	trans	-62.7	-41	175.2	-61.8	0	0	0	0	112.5	D563 L565 G571	D563-S567 WeakPolarHBondContact O-CB 3.37Å; D563-S567 PolarHBondContact O-N 3.17Å; D563-S567 PolarHBondContact O-OG 3.09Å; L565-S567 VanDerWaalsContact C-N 3.31Å; L565-S567 PolarHBondContact O-N 3.39Å; S567-G571 PolarHBondContact O-N 2.65Å
568	R	63.9	Low	62.1	Low	101 Å²	101	51.1 Å²	51.1	38%	0.381	30%	0.3	S	S	.	.	H	α-helix	trans	-69.7	-43.4	177	-172.3	174.7	-179.8	165.1	0.2	111.5	L551 P564 L565 E566 H570 G571 F572 E598 Y600	L551-R568 HydrophobicContact CD2-CG 4.29Å; P564-R568 WeakPolarHBondContact O-CB 3.46Å; P564-R568 PolarHBondContact O-N 3.29Å; L565-R568 PolarHBondContact O-N 3.39Å; E566-R568 PolarHBondContact O-N 3.44Å; R568-H570 VanDerWaalsContact C-N 3.35Å; R568-G571 PolarHBondContact O-N 3.21Å; R568-F572 WeakPolarHBondContact O-CB 3.49Å; R568-F572 PolarHBondContact O-N 2.79Å; R568-E598 PolarHBondContact NH2-O 3.08Å; R568-Y600 HydrophobicContact CG-CD2 4.07Å; R568-Y600 HydrophobicContact CG-CG 4.36Å
569	A	66.9	Low	63.8	Low	32 Å²	32	47.7 Å²	47.7	26%	0.264	28%	0.283	S	S	.	.	H	α-helix	trans	-60.4	-45.7	175.7	0	0	0	0	0	111.3	L565 E566 F572 A573 Y600	L565-A569 WeakPolarHBondContact O-CB 3.45Å; L565-A569 PolarHBondContact O-N 3.38Å; E566-A569 PolarHBondContact O-N 3.1Å; A569-F572 PolarHBondContact O-N 3.4Å; A569-A573 PolarHBondContact O-N 2.71Å; A569-Y600 HydrophobicContact CB-CD1 4.47Å; A569-Y600 HydrophobicContact CB-CE1 3.62Å
570	H	64.8	Low	65.4	Low	73 Å²	73	48.8 Å²	48.8	34%	0.338	29%	0.294	S	S	.	.	H	α-helix	trans	-62.8	-48.6	175.8	-171.5	-105	0	0	0	111	L559 L561 E566 R568 F572 A573 L574	L559-H570 HydrophobicContact CD1-CB 4.31Å; L561-H570 HydrophobicContact CD1-CB 4.04Å; E566-H570 VanDerWaalsContact O-CB 3.24Å; E566-H570 WeakPolarHBondContact O-CB 3.41Å; E566-H570 PolarHBondContact O-N 2.81Å; R568-H570 VanDerWaalsContact C-N 3.35Å; H570-F572 VanDerWaalsContact C-N 3.26Å; H570-F572 PolarHBondContact O-N 3.09Å; H570-A573 PolarHBondContact O-N 3.24Å; H570-A573 VanDerWaalsContact O-N 3.14Å; H570-L574 VanDerWaalsContact O-CG 3.3Å; H570-L574 WeakPolarHBondContact O-CG 3.46Å; H570-L574 PolarHBondContact O-N 2.99Å
571	G	67.1	Low	67	Low	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-55.3	-40.1	175.5	0	0	0	0	0	113.3	S567 R568 L574 I575	S567-G571 PolarHBondContact O-N 2.65Å; R568-G571 PolarHBondContact O-N 3.21Å; G571-L574 PolarHBondContact O-N 3.46Å; G571-I575 PolarHBondContact O-N 3.27Å
572	F	73.6	Confident	68.3	Low	35 Å²	35	43.6 Å²	43.6	15%	0.154	25%	0.251	C	S	.	.	H	α-helix	trans	-67.6	-41.7	177	-172	-96.8	0	0	0	112.4	L551 R568 A569 H570 L574 I575 S576 L590 Y600	L551-F572 HydrophobicContact CD2-CB 3.89Å; R568-F572 WeakPolarHBondContact O-CB 3.49Å; R568-F572 PolarHBondContact O-N 2.79Å; A569-F572 PolarHBondContact O-N 3.4Å; H570-F572 VanDerWaalsContact C-N 3.26Å; H570-F572 PolarHBondContact O-N 3.09Å; F572-L574 VanDerWaalsContact C-N 3.34Å; F572-L574 PolarHBondContact O-N 3.04Å; F572-I575 WeakPolarHBondContact O-CG2 3.4Å; F572-I575 PolarHBondContact O-N 3.3Å; F572-S576 VanDerWaalsContact O-CB 3.31Å; F572-S576 WeakPolarHBondContact O-CB 3.27Å; F572-S576 PolarHBondContact O-N 3.19Å; F572-S576 PolarHBondContact O-OG 2.7Å; F572-L590 HydrophobicContact CD2-CD2 4.42Å; F572-L590 HydrophobicContact CE2-CD2 3.74Å; F572-L590 HydrophobicContact CZ-CD2 4.18Å; F572-Y600 HydrophobicContact CB-CD1 4.18Å; F572-Y600 HydrophobicContact CD1-CD1 4.46Å; F572-Y600 WeakPolarHBondContact CE1-O 3.47Å; F572-Y600 HydrophobicContact CG-CD1 4.33Å; F572-Y600 WeakPolarHBondContact CZ-O 3.35Å
573	A	73	Confident	69.4	Low	50 Å²	50	38.7 Å²	38.7	41%	0.413	22%	0.218	S	C	.	.	H	α-helix	trans	-62.1	-42.2	174.4	0	0	0	0	0	111.5	A569 H570 S576 A577	A569-A573 PolarHBondContact O-N 2.71Å; H570-A573 PolarHBondContact O-N 3.24Å; H570-A573 VanDerWaalsContact O-N 3.14Å; A573-S576 PolarHBondContact O-N 3.04Å; A573-A577 WeakPolarHBondContact O-CB 3.45Å; A573-A577 PolarHBondContact O-N 3.49Å
574	L	73.7	Confident	70.4	Confident	15 Å²	15	35.8 Å²	35.8	8%	0.079	20%	0.202	C	C	.	.	H	α-helix	trans	-63.8	-44.5	178.2	-62.9	-179.6	0	0	0	112.1	L532 F536 L559 H570 G571 F572 A577 A578	L532-L574 HydrophobicContact CD2-CD2 3.81Å; F536-L574 HydrophobicContact CE2-CB 4.01Å; F536-L574 HydrophobicContact CE2-CD2 3.42Å; F536-L574 VanDerWaalsContact CE2-CD2 3.42Å; F536-L574 HydrophobicContact CE2-CG 4.22Å; F536-L574 HydrophobicContact CZ-CB 3.76Å; F536-L574 HydrophobicContact CZ-CD1 4.31Å; F536-L574 HydrophobicContact CZ-CD2 3.56Å; F536-L574 HydrophobicContact CZ-CG 4.02Å; L559-L574 HydrophobicContact CD2-CD1 4.39Å; H570-L574 VanDerWaalsContact O-CG 3.3Å; H570-L574 WeakPolarHBondContact O-CG 3.46Å; H570-L574 PolarHBondContact O-N 2.99Å; G571-L574 PolarHBondContact O-N 3.46Å; F572-L574 VanDerWaalsContact C-N 3.34Å; F572-L574 PolarHBondContact O-N 3.04Å; L574-A577 PolarHBondContact O-N 2.82Å; L574-A578 WeakPolarHBondContact O-CB 3.15Å; L574-A578 PolarHBondContact O-N 2.86Å
575	I	75.7	Confident	71.4	Confident	7 Å²	7	34.4 Å²	34.4	4%	0.036	19%	0.189	C	C	.	.	H	α-helix	trans	-71.4	-35	-179.7	-159	149.1	0	0	0	112	I548 L551 G571 F572 A578 A579 A586 Y589 L590	I548-I575 HydrophobicContact CG1-CD1 3.99Å; L551-I575 HydrophobicContact CD1-CB 4.14Å; L551-I575 HydrophobicContact CD1-CD1 4.03Å; L551-I575 HydrophobicContact CD1-CG2 3.77Å; G571-I575 PolarHBondContact O-N 3.27Å; F572-I575 WeakPolarHBondContact O-CG2 3.4Å; F572-I575 PolarHBondContact O-N 3.3Å; I575-A578 PolarHBondContact O-N 3.17Å; I575-A579 WeakPolarHBondContact O-CB 3.29Å; I575-A579 PolarHBondContact O-N 2.84Å; I575-A586 HydrophobicContact CG1-CB 3.76Å; I575-Y589 HydrophobicContact CD1-CD1 3.28Å; I575-Y589 HydrophobicContact CD1-CD2 4.36Å; I575-Y589 HydrophobicContact CD1-CE1 3.83Å; I575-Y589 HydrophobicContact CD1-CG 3.58Å; I575-Y589 HydrophobicContact CG1-CD1 4.13Å; I575-L590 HydrophobicContact CG2-CD2 3.88Å; I575-L590 HydrophobicContact CG2-CG 4.35Å
576	S	78.7	Confident	72.3	Confident	27 Å²	27	29.7 Å²	29.7	19%	0.189	17%	0.165	C	C	.	.	H	α-helix	trans	-65	-42.7	174.1	-58.8	0	0	0	0	111.9	F572 A573 A579 S580	F572-S576 VanDerWaalsContact O-CB 3.31Å; F572-S576 WeakPolarHBondContact O-CB 3.27Å; F572-S576 PolarHBondContact O-N 3.19Å; F572-S576 PolarHBondContact O-OG 2.7Å; A573-S576 PolarHBondContact O-N 3.04Å; S576-A579 PolarHBondContact O-N 3.33Å; S576-S580 WeakPolarHBondContact O-CB 3.38Å; S576-S580 PolarHBondContact O-N 2.8Å; S576-S580 PolarHBondContact O-OG 3.44Å
577	A	74.7	Confident	73.5	Confident	14 Å²	14	24.8 Å²	24.8	12%	0.116	14%	0.142	C	C	.	.	H	α-helix	trans	-63.7	-41.8	173.1	0	0	0	0	0	111.6	I533 F536 A573 L574 S580 A581	I533-A577 HydrophobicContact CG1-CB 4.23Å; F536-A577 HydrophobicContact CD2-CB 4.22Å; A573-A577 WeakPolarHBondContact O-CB 3.45Å; A573-A577 PolarHBondContact O-N 3.49Å; L574-A577 PolarHBondContact O-N 2.82Å; A577-S580 PolarHBondContact O-N 3.14Å; A577-A581 VanDerWaalsContact O-CB 3.23Å; A577-A581 WeakPolarHBondContact O-CB 3.49Å; A577-A581 PolarHBondContact O-N 3.14Å
578	A	73.6	Confident	74.9	Confident	12 Å²	12	25 Å²	25	10%	0.099	14%	0.143	C	C	.	.	H	α-helix	trans	-65	-42.3	177.6	0	0	0	0	0	112.6	L574 I575 A581 G582 D583 A586	L574-A578 WeakPolarHBondContact O-CB 3.15Å; L574-A578 PolarHBondContact O-N 2.86Å; I575-A578 PolarHBondContact O-N 3.17Å; A578-A581 CarbonylContact O-C 3.42Å; A578-A581 PolarHBondContact O-N 3Å; A578-G582 PolarHBondContact O-N 2.93Å; A578-G582 VanDerWaalsContact O-N 3.13Å; A578-D583 HydrophobicContact CB-CB 4.25Å; A578-D583 WeakPolarHBondContact O-CB 3.41Å; A578-D583 PolarHBondContact O-N 3.1Å; A578-A586 HydrophobicContact CB-CB 3.9Å
579	A	79.2	Confident	75.8	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63.6	-44.6	175.1	0	0	0	0	0	111.1	I575 S576 A581 G582 A586 M587 L590 W628	I575-A579 WeakPolarHBondContact O-CB 3.29Å; I575-A579 PolarHBondContact O-N 2.84Å; S576-A579 PolarHBondContact O-N 3.33Å; A579-A581 PolarHBondContact O-N 3.38Å; A579-G582 PolarHBondContact O-N 2.92Å; A579-A586 HydrophobicContact CB-CB 3.84Å; A579-M587 HydrophobicContact CB-CG 3.96Å; A579-M587 WeakPolarHBondContact O-CE 3.26Å; A579-L590 HydrophobicContact CB-CD1 3.42Å; A579-L590 VanDerWaalsContact CB-CD1 3.42Å; A579-W628 HydrophobicContact CB-CE3 4.12Å; A579-W628 HydrophobicContact CB-CH2 3.91Å; A579-W628 HydrophobicContact CB-CZ3 3.63Å
580	S	77.7	Confident	76.7	Confident	67 Å²	67	21.3 Å²	21.3	47%	0.469	12%	0.123	S	C	.	.	H	α-helix	trans	-62.6	-31.9	174.3	-56	0	0	0	0	112.4	S576 A577 G582	S576-S580 WeakPolarHBondContact O-CB 3.38Å; S576-S580 PolarHBondContact O-N 2.8Å; S576-S580 PolarHBondContact O-OG 3.44Å; A577-S580 PolarHBondContact O-N 3.14Å; S580-G582 VanDerWaalsContact C-N 3.26Å; S580-G582 PolarHBondContact O-N 2.88Å
581	A	74.7	Confident	77.9	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.008	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-0.9	174.5	0	0	0	0	0	114.1	R537 Q540 A577 A578 A579 F654	R537-A581 HydrophobicContact CG-CB 4.02Å; Q540-A581 PolarHBondContact NE2-O 3.07Å; A577-A581 VanDerWaalsContact O-CB 3.23Å; A577-A581 WeakPolarHBondContact O-CB 3.49Å; A577-A581 PolarHBondContact O-N 3.14Å; A578-A581 CarbonylContact O-C 3.42Å; A578-A581 PolarHBondContact O-N 3Å; A579-A581 PolarHBondContact O-N 3.38Å; A581-F654 VanDerWaalsContact C-CE2 3.49Å; A581-F654 WeakPolarHBondContact O-CD2 3.44Å
582	G	73.5	Confident	78.8	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.1	7.9	172.4	0	0	0	0	0	117.6	A578 A579 S580 R584	A578-G582 PolarHBondContact O-N 2.93Å; A578-G582 VanDerWaalsContact O-N 3.13Å; A579-G582 PolarHBondContact O-N 2.92Å; S580-G582 VanDerWaalsContact C-N 3.26Å; S580-G582 PolarHBondContact O-N 2.88Å; G582-R584 PolarHBondContact O-N 2.6Å
583	D	74.3	Confident	79.4	Confident	17 Å²	17	18.5 Å²	18.5	9%	0.091	11%	0.112	C	C	.	.			trans	-70.5	105.3	173.8	-170.6	-19.1	0	0	0	109.7	R544 A578 M585 A586 M587	R544-D583 VanDerWaalsContact CD-OD2 3.23Å; R544-D583 WeakPolarHBondContact CD-OD2 3.43Å; R544-D583 IonicContact CZ-OD2 3.17Å; R544-D583 IonicContact NE-OD2 3.75Å; R544-D583 PolarHBondContact NE-OD2 2.85Å; A578-D583 HydrophobicContact CB-CB 4.25Å; A578-D583 WeakPolarHBondContact O-CB 3.41Å; A578-D583 PolarHBondContact O-N 3.1Å; D583-M585 PolarHBondContact O-N 2.66Å; D583-M585 PolarHBondContact OD1-N 3.45Å; D583-A586 HydrophobicContact CB-CB 3.86Å; D583-A586 WeakPolarHBondContact O-CB 3.47Å; D583-A586 PolarHBondContact O-N 2.86Å; D583-M587 WeakPolarHBondContact O-CG 3.15Å; D583-M587 PolarHBondContact O-N 2.89Å
584	R	79.4	Confident	80.1	Confident	10 Å²	10	16.6 Å²	16.6	4%	0.038	10%	0.095	C	C	.	.	H	α-helix	trans	-55	-38.3	179.3	-171.7	-177.7	-174.3	-107.4	0	112.7	G582 A586 M587 V588 A632 V635 T637 E667 W668	G582-R584 PolarHBondContact O-N 2.6Å; R584-A586 VanDerWaalsContact C-N 3.33Å; R584-M587 WeakPolarHBondContact O-CB 3.29Å; R584-M587 PolarHBondContact O-N 2.85Å; R584-V588 WeakPolarHBondContact O-CG2 3.25Å; R584-V588 PolarHBondContact O-N 2.69Å; R584-A632 HydrophobicContact CG-CB 4.08Å; R584-A632 PolarHBondContact NE-O 2.83Å; R584-V635 HydrophobicContact CB-CB 4.17Å; R584-V635 HydrophobicContact CB-CG1 3.92Å; R584-V635 HydrophobicContact CB-CG2 4.13Å; R584-V635 HydrophobicContact CG-CB 3.99Å; R584-V635 HydrophobicContact CG-CG1 4.08Å; R584-V635 HydrophobicContact CG-CG2 4.25Å; R584-T637 VanDerWaalsContact NE-CG2 3.31Å; R584-E667 IonicContact CZ-OE1 3.38Å; R584-E667 IonicContact NH1-OE1 2.81Å; R584-E667 PolarHBondContact NH1-OE1 2.91Å; R584-W668 VanDerWaalsContact CZ-O 3.23Å; R584-W668 PolarHBondContact NH1-O 2.94Å; R584-W668 PolarHBondContact NH2-O 2.96Å
585	M	78.4	Confident	80.9	Confident	51 Å²	51	17.5 Å²	17.5	25%	0.251	10%	0.097	S	C	.	.	H	α-helix	trans	-71.5	-33.4	-179.6	-71.7	-59	-62.3	0	0	111.5	D583 M587 V588 Y589 E667	D583-M585 PolarHBondContact O-N 2.66Å; D583-M585 PolarHBondContact OD1-N 3.45Å; M585-M587 VanDerWaalsContact C-N 3.34Å; M585-V588 PolarHBondContact O-N 3.01Å; M585-Y589 WeakPolarHBondContact O-CB 3.44Å; M585-Y589 PolarHBondContact O-N 3.47Å; M585-E667 HydrophobicContact SD-CB 4.36Å; M585-E667 HydrophobicContact SD-CG 4.21Å
586	A	79.7	Confident	81.3	Confident	4 Å²	4	22 Å²	22	3%	0.033	12%	0.118	C	C	.	.	H	α-helix	trans	-66	-39.4	171.6	0	0	0	0	0	111.2	I575 A578 A579 D583 R584 Y589 L590	I575-A586 HydrophobicContact CG1-CB 3.76Å; A578-A586 HydrophobicContact CB-CB 3.9Å; A579-A586 HydrophobicContact CB-CB 3.84Å; D583-A586 HydrophobicContact CB-CB 3.86Å; D583-A586 WeakPolarHBondContact O-CB 3.47Å; D583-A586 PolarHBondContact O-N 2.86Å; R584-A586 VanDerWaalsContact C-N 3.33Å; A586-Y589 PolarHBondContact O-N 2.83Å; A586-L590 WeakPolarHBondContact O-CG 3.46Å; A586-L590 PolarHBondContact O-N 3.29Å
587	M	84.7	Confident	81.4	Confident	1 Å²	1	21 Å²	21	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-60.8	-49.8	172.3	-61.1	169.6	175.2	0	0	111.4	A579 D583 R584 M585 Y589 L590 A591 W628 M631 A632 V635 F654	A579-M587 HydrophobicContact CB-CG 3.96Å; A579-M587 WeakPolarHBondContact O-CE 3.26Å; D583-M587 WeakPolarHBondContact O-CG 3.15Å; D583-M587 PolarHBondContact O-N 2.89Å; R584-M587 WeakPolarHBondContact O-CB 3.29Å; R584-M587 PolarHBondContact O-N 2.85Å; M585-M587 VanDerWaalsContact C-N 3.34Å; M587-Y589 VanDerWaalsContact C-N 3.31Å; M587-Y589 PolarHBondContact O-N 2.95Å; M587-L590 PolarHBondContact O-N 3.46Å; M587-A591 WeakPolarHBondContact O-CB 3.3Å; M587-A591 PolarHBondContact O-N 3.04Å; M587-W628 HydrophobicContact CB-CE3 4.2Å; M587-W628 HydrophobicContact CG-CE3 3.92Å; M587-W628 HydrophobicContact CG-CZ3 4.23Å; M587-M631 HydrophobicContact CE-CB 4.09Å; M587-M631 HydrophobicContact CE-CE 3.93Å; M587-M631 HydrophobicContact CE-SD 4.48Å; M587-M631 HydrophobicContact CG-CB 4.45Å; M587-M631 HydrophobicContact SD-CB 3.7Å; M587-A632 HydrophobicContact CB-CB 3.9Å; M587-A632 HydrophobicContact SD-CB 4.43Å; M587-V635 HydrophobicContact CE-CG2 4.36Å; M587-V635 HydrophobicContact SD-CG2 3.9Å; M587-F654 HydrophobicContact CE-CZ 4.15Å
588	V	85.4	Confident	81.3	Confident	7 Å²	7	26.6 Å²	26.6	4%	0.042	14%	0.136	C	C	.	.	H	α-helix	trans	-60.8	-40.8	178.4	174	0	0	0	0	111.2	R584 M585 A591 E592 A632 W668 L673	R584-V588 WeakPolarHBondContact O-CG2 3.25Å; R584-V588 PolarHBondContact O-N 2.69Å; M585-V588 PolarHBondContact O-N 3.01Å; V588-A591 WeakPolarHBondContact O-CB 3.31Å; V588-A591 PolarHBondContact O-N 2.98Å; V588-E592 WeakPolarHBondContact O-CG 3.4Å; V588-E592 PolarHBondContact O-N 3.36Å; V588-A632 HydrophobicContact CG2-CB 3.72Å; V588-W668 HydrophobicContact CG1-CG 4.21Å; V588-L673 HydrophobicContact CG2-CD2 3.94Å
589	Y	83.6	Confident	80.9	Confident	55 Å²	55	28.4 Å²	28.4	22%	0.216	14%	0.14	C	C	.	.	H	α-helix	trans	-62.9	-48.1	176.2	180	-85	0	0	0	112.1	I548 L551 I575 M585 A586 M587 A591 E592 A593	I548-Y589 HydrophobicContact CG1-CD2 4.45Å; I548-Y589 HydrophobicContact CG2-CE2 4.26Å; L551-Y589 HydrophobicContact CD1-CE1 3.66Å; I575-Y589 HydrophobicContact CD1-CD1 3.28Å; I575-Y589 HydrophobicContact CD1-CD2 4.36Å; I575-Y589 HydrophobicContact CD1-CE1 3.83Å; I575-Y589 HydrophobicContact CD1-CG 3.58Å; I575-Y589 HydrophobicContact CG1-CD1 4.13Å; M585-Y589 WeakPolarHBondContact O-CB 3.44Å; M585-Y589 PolarHBondContact O-N 3.47Å; A586-Y589 PolarHBondContact O-N 2.83Å; M587-Y589 VanDerWaalsContact C-N 3.31Å; M587-Y589 PolarHBondContact O-N 2.95Å; Y589-A591 VanDerWaalsContact C-N 3.27Å; Y589-A591 PolarHBondContact O-N 3.48Å; Y589-E592 PolarHBondContact O-N 3.3Å; Y589-A593 HydrophobicContact CE1-CB 4.5Å; Y589-A593 WeakPolarHBondContact O-CB 3.38Å; Y589-A593 PolarHBondContact O-N 3.18Å
590	L	85.9	Confident	80	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-61.7	-39.1	176.1	-74.2	172.7	0	0	0	111	F572 I575 A579 A586 M587 A593 N594 W628	F572-L590 HydrophobicContact CD2-CD2 4.42Å; F572-L590 HydrophobicContact CE2-CD2 3.74Å; F572-L590 HydrophobicContact CZ-CD2 4.18Å; I575-L590 HydrophobicContact CG2-CD2 3.88Å; I575-L590 HydrophobicContact CG2-CG 4.35Å; A579-L590 HydrophobicContact CB-CD1 3.42Å; A579-L590 VanDerWaalsContact CB-CD1 3.42Å; A586-L590 WeakPolarHBondContact O-CG 3.46Å; A586-L590 PolarHBondContact O-N 3.29Å; M587-L590 PolarHBondContact O-N 3.46Å; L590-A593 PolarHBondContact O-N 2.88Å; L590-N594 WeakPolarHBondContact O-CB 3.18Å; L590-N594 PolarHBondContact O-N 3.05Å; L590-N594 PolarHBondContact O-ND2 3.03Å; L590-W628 HydrophobicContact CB-CD2 4.24Å; L590-W628 HydrophobicContact CB-CG 3.96Å; L590-W628 HydrophobicContact CD1-CD2 4.16Å; L590-W628 HydrophobicContact CD1-CH2 4.28Å; L590-W628 HydrophobicContact CD1-CZ2 3.84Å
591	A	89.6	Confident	79	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61	-47.5	176.7	0	0	0	0	0	111.7	M587 V588 Y589 N594 Y595 A625 W628 Y629	M587-A591 WeakPolarHBondContact O-CB 3.3Å; M587-A591 PolarHBondContact O-N 3.04Å; V588-A591 WeakPolarHBondContact O-CB 3.31Å; V588-A591 PolarHBondContact O-N 2.98Å; Y589-A591 VanDerWaalsContact C-N 3.27Å; Y589-A591 PolarHBondContact O-N 3.48Å; A591-N594 PolarHBondContact O-N 3.06Å; A591-Y595 VanDerWaalsContact O-CB 3.23Å; A591-Y595 WeakPolarHBondContact O-CB 3.35Å; A591-Y595 PolarHBondContact O-N 3.18Å; A591-A625 WeakPolarHBondContact O-CB 3.33Å; A591-W628 HydrophobicContact CB-CB 3.7Å; A591-Y629 HydrophobicContact CB-CD1 3.57Å; A591-Y629 HydrophobicContact CB-CD2 3.72Å; A591-Y629 HydrophobicContact CB-CE1 3.56Å; A591-Y629 HydrophobicContact CB-CE2 3.68Å; A591-Y629 HydrophobicContact CB-CG 3.63Å
592	E	86.9	Confident	77.9	Confident	41 Å²	41	31.6 Å²	31.6	19%	0.192	16%	0.156	C	C	.	.	H	α-helix	trans	-62.9	-43.5	175.9	-77.3	-77.6	-156.7	0	0	112.6	V588 Y589 N594 Y595 H596 Y629 W668 R676	V588-E592 WeakPolarHBondContact O-CG 3.4Å; V588-E592 PolarHBondContact O-N 3.36Å; Y589-E592 PolarHBondContact O-N 3.3Å; E592-N594 VanDerWaalsContact C-N 3.34Å; E592-N594 PolarHBondContact O-N 3.24Å; E592-Y595 PolarHBondContact O-N 3.25Å; E592-H596 PolarHBondContact O-N 3.32Å; E592-H596 IonicContact OE2-CD2 3.21Å; E592-H596 PolarHBondContact OE2-CD2 2.85Å; E592-H596 IonicContact OE2-NE2 2.65Å; E592-H596 PolarHBondContact OE2-NE2 3.09Å; E592-Y629 PolarHBondContact OE2-OH 3.09Å; E592-W668 VanDerWaalsContact OE1-CZ2 3.29Å; E592-W668 WeakPolarHBondContact OE1-CZ2 3.38Å; E592-R676 IonicContact OE1-CZ 3.09Å; E592-R676 IonicContact OE1-NH1 3.1Å; E592-R676 PolarHBondContact OE1-NH1 3.35Å; E592-R676 IonicContact OE2-NH1 3.3Å; E592-R676 PolarHBondContact OE2-NH1 2.88Å
593	A	84.2	Confident	76.7	Confident	8 Å²	8	38.3 Å²	38.3	7%	0.066	19%	0.192	C	C	.	.	H	α-helix	trans	-62.3	-41.9	178.5	0	0	0	0	0	111.7	Y589 L590 G597 E598 Y599	Y589-A593 HydrophobicContact CE1-CB 4.5Å; Y589-A593 WeakPolarHBondContact O-CB 3.38Å; Y589-A593 PolarHBondContact O-N 3.18Å; L590-A593 PolarHBondContact O-N 2.88Å; A593-G597 CarbonylContact O-C 3.5Å; A593-G597 PolarHBondContact O-N 3.46Å; A593-E598 PolarHBondContact O-N 3.39Å; A593-Y599 PolarHBondContact O-N 2.89Å
594	N	88.9	Confident	75.4	Confident	11 Å²	11	41.1 Å²	41.1	6%	0.059	21%	0.21	C	C	.	.	H	α-helix	trans	-71.4	-34.2	175.5	-76.8	-77.9	0	0	0	112.2	L590 A591 E592 P620 D621 A624 A625	L590-N594 WeakPolarHBondContact O-CB 3.18Å; L590-N594 PolarHBondContact O-N 3.05Å; L590-N594 PolarHBondContact O-ND2 3.03Å; A591-N594 PolarHBondContact O-N 3.06Å; E592-N594 VanDerWaalsContact C-N 3.34Å; E592-N594 PolarHBondContact O-N 3.24Å; N594-P620 CarbonylContact O-C 3.52Å; N594-P620 VanDerWaalsContact O-CA 3.29Å; N594-P620 WeakPolarHBondContact O-CA 3.23Å; N594-D621 PolarHBondContact O-N 3.08Å; N594-A624 HydrophobicContact CB-CB 4.29Å; N594-A625 HydrophobicContact CB-CB 3.75Å
595	Y	89.3	Confident	73.7	Confident	33 Å²	33	43.6 Å²	43.6	13%	0.129	23%	0.229	C	C	.	.	H	α-helix	trans	-66.5	-37.7	177.5	-180	-102.9	0	0	0	112.8	A591 E592 P620 W622 M680	A591-Y595 VanDerWaalsContact O-CB 3.23Å; A591-Y595 WeakPolarHBondContact O-CB 3.35Å; A591-Y595 PolarHBondContact O-N 3.18Å; E592-Y595 PolarHBondContact O-N 3.25Å; Y595-P620 WeakPolarHBondContact O-CB 3.39Å; Y595-W622 AromaticContact CD2-NE1 3.78Å; Y595-W622 AromaticContact CE2-NE1 3.97Å; Y595-M680 HydrophobicContact CD2-CG 4.09Å; Y595-M680 HydrophobicContact CD2-SD 3.88Å; Y595-M680 HydrophobicContact CE2-CG 3.87Å; Y595-M680 HydrophobicContact CE2-SD 4.23Å
596	H	84.5	Confident	71.8	Confident	102 Å²	102	47.9 Å²	47.9	47%	0.472	25%	0.253	S	S	.	.	H	α-helix	trans	-93.7	-10.4	179.4	-73.5	-60.9	0	0	0	114.5	E592 E598	E592-H596 PolarHBondContact O-N 3.32Å; E592-H596 IonicContact OE2-CD2 3.21Å; E592-H596 PolarHBondContact OE2-CD2 2.85Å; E592-H596 IonicContact OE2-NE2 2.65Å; E592-H596 PolarHBondContact OE2-NE2 3.09Å; H596-E598 VanDerWaalsContact C-N 3.34Å; H596-E598 HydrophobicContact CB-CG 4.01Å
597	G	80.8	Confident	69.8	Low	5 Å²	5	52.8 Å²	52.8	5%	0.052	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	24.1	-174.1	0	0	0	0	0	113.6	A593 Q618	A593-G597 CarbonylContact O-C 3.5Å; A593-G597 PolarHBondContact O-N 3.46Å; G597-Q618 VanDerWaalsContact CA-O 3.27Å; G597-Q618 WeakPolarHBondContact CA-O 3.37Å; G597-Q618 PolarHBondContact O-N 3.21Å
598	E	72.8	Confident	67.6	Low	133 Å²	133	59.4 Å²	59.4	62%	0.621	31%	0.312	S	S	*	.			trans	-97.2	8.7	-179.4	-63.1	-170.7	171.8	0	0	113.2	R568 A593 H596	R568-E598 PolarHBondContact NH2-O 3.08Å; A593-E598 PolarHBondContact O-N 3.39Å; H596-E598 VanDerWaalsContact C-N 3.34Å; H596-E598 HydrophobicContact CB-CG 4.01Å
599	Y	66.1	Low	65.2	Low	49 Å²	49	66.4 Å²	66.4	19%	0.192	35%	0.35	C	S	.	.			trans	-74.7	164.8	179.3	68.1	-82.8	0	0	0	112.9	A593 Q618 E619 D621	A593-Y599 PolarHBondContact O-N 2.89Å; Y599-Q618 VanDerWaalsContact CD2-OE1 3.27Å; Y599-Q618 HydrophobicContact CE1-CB 4.07Å; Y599-Q618 PolarHBondContact O-OE1 3.42Å; Y599-E619 WeakPolarHBondContact CE1-O 3.28Å; Y599-E619 PolarHBondContact OH-O 3.36Å; Y599-D621 HydrophobicContact CE1-CB 4.46Å
600	Y	60.5	Low	62.9	Low	32 Å²	32	68.3 Å²	68.3	13%	0.125	36%	0.363	C	S	.	.			trans	-106.6	128.3	175.8	178.2	-93.8	0	0	0	109.1	R568 A569 F572	R568-Y600 HydrophobicContact CG-CD2 4.07Å; R568-Y600 HydrophobicContact CG-CG 4.36Å; A569-Y600 HydrophobicContact CB-CD1 4.47Å; A569-Y600 HydrophobicContact CB-CE1 3.62Å; F572-Y600 HydrophobicContact CB-CD1 4.18Å; F572-Y600 HydrophobicContact CD1-CD1 4.46Å; F572-Y600 WeakPolarHBondContact CE1-O 3.47Å; F572-Y600 HydrophobicContact CG-CD1 4.33Å; F572-Y600 WeakPolarHBondContact CZ-O 3.35Å
601	S	55.8	Low	60.4	Low	30 Å²	30	75.6 Å²	75.6	21%	0.21	40%	0.402	C	S	.	.			trans	-106.8	124.6	174.2	-179.8	0	0	0	0	110.7	D603 T604	S601-D603 PolarHBondContact O-N 3.19Å; S601-T604 PolarHBondContact O-N 3.37Å; S601-T604 PolarHBondContact O-OG1 2.86Å
602	P	50.7	Low	57.9	Low	74 Å²	74	81.3 Å²	81.3	48%	0.481	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-60.4	-31.8	176.5	-21.2	31.6	0	0	0	113.5	T604 S605	P602-T604 PolarHBondContact O-N 3.39Å; P602-S605 WeakPolarHBondContact O-CB 3.01Å; P602-S605 PolarHBondContact O-N 3.24Å; P602-S605 VanDerWaalsContact O-N 3.13Å; P602-S605 PolarHBondContact O-OG 2.96Å
603	D	48.8	Very low	55.5	Low	141 Å²	141	87.1 Å²	87.1	75%	0.754	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-69	-18.6	-174.5	-70.6	-25.4	0	0	0	113.2	S601 S605	S601-D603 PolarHBondContact O-N 3.19Å; D603-S605 PolarHBondContact O-N 2.94Å
604	T	48.2	Very low	53.1	Low	75 Å²	75	93.3 Å²	93.3	46%	0.46	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	-73.6	-4.1	173.9	16.6	0	0	0	0	114.3	S601 P602 N606	S601-T604 PolarHBondContact O-N 3.37Å; S601-T604 PolarHBondContact O-OG1 2.86Å; P602-T604 PolarHBondContact O-N 3.39Å; T604-N606 VanDerWaalsContact C-N 3.3Å; T604-N606 PolarHBondContact O-N 2.97Å
605	S	43.3	Very low	50.9	Low	62 Å²	62	101.1 Å²	101.1	43%	0.434	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-71.7	-16.8	179.3	60.5	0	0	0	0	114.7	P602 D603	P602-S605 WeakPolarHBondContact O-CB 3.01Å; P602-S605 PolarHBondContact O-N 3.24Å; P602-S605 VanDerWaalsContact O-N 3.13Å; P602-S605 PolarHBondContact O-OG 2.96Å; D603-S605 PolarHBondContact O-N 2.94Å
606	N	37.8	Very low	48.8	Very low	142 Å²	142	107.6 Å²	107.6	76%	0.759	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-87.3	-6.3	179.9	-79.7	-26.3	0	0	0	114.9	T604 I608	T604-N606 VanDerWaalsContact C-N 3.3Å; T604-N606 PolarHBondContact O-N 2.97Å; N606-I608 VanDerWaalsContact C-N 3.28Å; N606-I608 PolarHBondContact O-N 3.43Å
607	D	38.4	Very low	47.1	Very low	107 Å²	107	111.2 Å²	111.2	57%	0.572	57%	0.572	S	S	*	*			trans	-91.4	56.8	174	-89.8	-5.5	0	0	0	111.4	N609	D607-N609 PolarHBondContact O-N 3.48Å
608	I	38.1	Very low	46.5	Very low	139 Å²	139	113.1 Å²	113.1	71%	0.713	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-8.9	175.1	-67.1	171	0	0	0	112.4	N606	N606-I608 VanDerWaalsContact C-N 3.28Å; N606-I608 PolarHBondContact O-N 3.43Å
609	N	35.9	Very low	46.7	Very low	155 Å²	155	114.2 Å²	114.2	83%	0.829	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	14.9	-170.4	-88.3	-22.5	0	0	0	117	D607	D607-N609 PolarHBondContact O-N 3.48Å
610	N	33.4	Very low	47.8	Very low	94 Å²	94	113.5 Å²	113.5	50%	0.503	59%	0.586	S	S	.	*			trans	-117.1	85.5	172.1	-105.4	-41.2	0	0	0	112.9	N612 R616	N610-N612 PolarHBondContact O-N 3.01Å; N610-R616 PolarHBondContact ND2-NH2 3.26Å
611	N	34.2	Very low	49.2	Very low	155 Å²	155	114.3 Å²	114.3	83%	0.829	59%	0.593	S	S	*	*			trans	-65.3	26.8	169.2	-81	-32	0	0	0	114.6
612	N	36.6	Very low	51	Low	120 Å²	120	114.2 Å²	114.2	64%	0.642	59%	0.587	S	S	*	*			trans	-100.7	105	171.1	-75.8	-24.8	0	0	0	108.1	N610 N614	N610-N612 PolarHBondContact O-N 3.01Å; N612-N614 PolarHBondContact O-N 2.66Å
613	N	36.1	Very low	53.1	Low	163 Å²	163	115.3 Å²	115.3	87%	0.872	59%	0.589	S	S	*	*			trans	-59.3	30	174.7	-70.3	-29.4	0	0	0	114.9	E615	N613-E615 PolarHBondContact O-N 3.42Å
614	N	35.5	Very low	55.1	Low	137 Å²	137	109.8 Å²	109.8	73%	0.733	56%	0.563	S	S	*	*			trans	-83.9	102.5	165.6	-70.5	-9.9	0	0	0	105.9	N612 R616	N612-N614 PolarHBondContact O-N 2.66Å; N614-R616 PolarHBondContact O-N 3.44Å
615	E	43	Very low	57.2	Low	176 Å²	176	106.2 Å²	106.2	82%	0.822	54%	0.541	S	S	*	.			trans	-33.6	93.3	156.1	-64.4	172.2	167.5	0	0	108.5	N613 K617	N613-E615 PolarHBondContact O-N 3.42Å; E615-K617 PolarHBondContact O-N 3.19Å
616	R	44.5	Very low	59.7	Low	169 Å²	169	103.3 Å²	103.3	64%	0.638	52%	0.521	S	S	*	.			trans	-69.7	89.4	170.9	-74.9	-171.5	-167.3	178.9	5.2	104.2	N610 N614 Q618	N610-R616 PolarHBondContact ND2-NH2 3.26Å; N614-R616 PolarHBondContact O-N 3.44Å; R616-Q618 PolarHBondContact O-N 3.4Å
617	K	49.1	Very low	62.3	Low	178 Å²	178	101.2 Å²	101.2	77%	0.774	51%	0.506	S	S	*	.			trans	-50	114.1	164.4	-79.2	-171.8	174.6	-172.9	0	105.3	E615	E615-K617 PolarHBondContact O-N 3.19Å
618	Q	66.9	Low	64.8	Low	45 Å²	45	97.9 Å²	97.9	21%	0.21	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-63.5	142.6	177.1	-59.4	-164.6	-4.8	0	0	106.6	G597 Y599 R616	G597-Q618 VanDerWaalsContact CA-O 3.27Å; G597-Q618 WeakPolarHBondContact CA-O 3.37Å; G597-Q618 PolarHBondContact O-N 3.21Å; Y599-Q618 VanDerWaalsContact CD2-OE1 3.27Å; Y599-Q618 HydrophobicContact CE1-CB 4.07Å; Y599-Q618 PolarHBondContact O-OE1 3.42Å; R616-Q618 PolarHBondContact O-N 3.4Å
619	E	78.3	Confident	67.4	Low	156 Å²	156	91.3 Å²	91.3	73%	0.729	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-64.3	142	174.2	-69.7	-170	169.4	0	0	108.6	Y599	Y599-E619 WeakPolarHBondContact CE1-O 3.28Å; Y599-E619 PolarHBondContact OH-O 3.36Å
620	P	87.7	Confident	70	Confident	33 Å²	33	86.2 Å²	86.2	21%	0.214	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-51.4	143.5	170.8	-26.5	33.9	0	0	0	111.5	N594 Y595 H686	N594-P620 CarbonylContact O-C 3.52Å; N594-P620 VanDerWaalsContact O-CA 3.29Å; N594-P620 WeakPolarHBondContact O-CA 3.23Å; Y595-P620 WeakPolarHBondContact O-CB 3.39Å; P620-H686 HydrophobicContact CB-CB 4.39Å; P620-H686 VanDerWaalsContact O-CB 3.27Å; P620-H686 WeakPolarHBondContact O-CB 3.48Å; P620-H686 PolarHBondContact O-ND1 3.43Å; P620-H686 VanDerWaalsContact O-ND1 3.17Å
621	D	90.4	Very high	72.6	Confident	50 Å²	50	84.5 Å²	84.5	27%	0.267	41%	0.413	S	S	.	.			trans	-117	96	170.8	-177	-14.3	0	0	0	107.9	N594 Y599 L623 A624 A625	N594-D621 PolarHBondContact O-N 3.08Å; Y599-D621 HydrophobicContact CE1-CB 4.46Å; D621-L623 VanDerWaalsContact C-N 3.3Å; D621-L623 WeakPolarHBondContact OD1-CB 3.36Å; D621-L623 PolarHBondContact OD1-N 3.26Å; D621-A624 HydrophobicContact CB-CB 4.09Å; D621-A624 VanDerWaalsContact CG-CB 3.47Å; D621-A624 PolarHBondContact OD1-N 3.25Å; D621-A624 WeakPolarHBondContact OD2-CB 3.37Å; D621-A625 WeakPolarHBondContact O-CB 3.1Å; D621-A625 PolarHBondContact O-N 3.45Å
622	W	94.9	Very high	75.1	Confident	27 Å²	27	77.1 Å²	77.1	10%	0.102	37%	0.373	C	S	.	.	H	α-helix	trans	-75.9	-21.5	-178.5	-72.8	3.2	0	0	0	112.5	Y595 A626 M680 K683 G684 H686 L688	Y595-W622 AromaticContact CD2-NE1 3.78Å; Y595-W622 AromaticContact CE2-NE1 3.97Å; W622-A626 WeakPolarHBondContact O-CB 3.46Å; W622-A626 PolarHBondContact O-N 2.8Å; W622-M680 HydrophobicContact CB-CE 3.62Å; W622-M680 HydrophobicContact CD2-CG 4.47Å; W622-M680 HydrophobicContact CG-CE 3.9Å; W622-M680 WeakPolarHBondContact O-CE 3.49Å; W622-K683 HydrophobicContact CH2-CB 4.06Å; W622-K683 HydrophobicContact CH2-CD 4.13Å; W622-K683 HydrophobicContact CZ3-CB 3.76Å; W622-G684 WeakPolarHBondContact CZ3-O 3.28Å; W622-H686 HydrophobicContact CB-CB 3.77Å; W622-H686 HydrophobicContact CD2-CB 3.8Å; W622-H686 AromaticContact CD2-CD2 3.64Å; W622-H686 AromaticContact CE2-CD2 3.37Å; W622-H686 HydrophobicContact CE3-CB 4.34Å; W622-H686 HydrophobicContact CG-CB 3.52Å; W622-H686 AromaticContact CH2-CD2 3.91Å; W622-H686 AromaticContact CZ2-CD2 3.52Å; W622-H686 PolarHBondContact N-O 3.32Å; W622-H686 AromaticContact NE1-CD2 3.77Å; W622-L688 HydrophobicContact CB-CB 3.73Å; W622-L688 HydrophobicContact CB-CD2 4.24Å
623	L	94	Very high	77.4	Confident	98 Å²	98	72.4 Å²	72.4	51%	0.513	35%	0.351	S	S	.	.	H	α-helix	trans	-68.4	-47.6	173.8	-175.8	63.3	0	0	0	110.1	D621 A626 H627 L688	D621-L623 VanDerWaalsContact C-N 3.3Å; D621-L623 WeakPolarHBondContact OD1-CB 3.36Å; D621-L623 PolarHBondContact OD1-N 3.26Å; L623-A626 PolarHBondContact O-N 3.15Å; L623-H627 PolarHBondContact O-N 3Å; L623-H627 VanDerWaalsContact O-N 3.12Å; L623-L688 HydrophobicContact CD1-CD1 4.04Å
624	A	91.3	Very high	79.6	Confident	24 Å²	24	71.9 Å²	71.9	20%	0.198	34%	0.341	C	S	.	.	H	α-helix	trans	-65.9	-42.5	174.8	0	0	0	0	0	112.1	N594 D621 A626 H627 W628	N594-A624 HydrophobicContact CB-CB 4.29Å; D621-A624 HydrophobicContact CB-CB 4.09Å; D621-A624 VanDerWaalsContact CG-CB 3.47Å; D621-A624 PolarHBondContact OD1-N 3.25Å; D621-A624 WeakPolarHBondContact OD2-CB 3.37Å; A624-A626 PolarHBondContact O-N 3.24Å; A624-H627 PolarHBondContact O-N 2.87Å; A624-W628 PolarHBondContact O-N 3.1Å; A624-W628 VanDerWaalsContact O-N 3.17Å
625	A	92.6	Very high	81.5	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-62.2	-43.2	176.8	0	0	0	0	0	112	A591 N594 D621 H627 W628 Y629 M680	A591-A625 WeakPolarHBondContact O-CB 3.33Å; N594-A625 HydrophobicContact CB-CB 3.75Å; D621-A625 WeakPolarHBondContact O-CB 3.1Å; D621-A625 PolarHBondContact O-N 3.45Å; A625-H627 VanDerWaalsContact C-N 3.35Å; A625-H627 PolarHBondContact O-N 3.14Å; A625-W628 PolarHBondContact O-N 3.14Å; A625-Y629 HydrophobicContact CB-CD2 4.4Å; A625-Y629 HydrophobicContact CB-CE2 4.3Å; A625-Y629 WeakPolarHBondContact O-CD2 3.37Å; A625-Y629 PolarHBondContact O-N 3.29Å; A625-M680 HydrophobicContact CB-CE 3.7Å
626	A	94.1	Very high	82.1	Confident	2 Å²	2	60.5 Å²	60.5	2%	0.017	29%	0.288	C	S	.	.	H	α-helix	trans	-62.7	-43.5	179	0	0	0	0	0	111.1	W622 L623 A624 W628 Y629 E630 L677 M680 L688	W622-A626 WeakPolarHBondContact O-CB 3.46Å; W622-A626 PolarHBondContact O-N 2.8Å; L623-A626 PolarHBondContact O-N 3.15Å; A624-A626 PolarHBondContact O-N 3.24Å; A626-W628 VanDerWaalsContact C-N 3.34Å; A626-W628 PolarHBondContact O-N 3.17Å; A626-Y629 PolarHBondContact O-N 3.1Å; A626-E630 WeakPolarHBondContact O-CB 3.19Å; A626-E630 WeakPolarHBondContact O-CG 3.28Å; A626-E630 PolarHBondContact O-N 3.45Å; A626-L677 HydrophobicContact CB-CD2 3.89Å; A626-M680 HydrophobicContact CB-CE 3.89Å; A626-L688 HydrophobicContact CB-CD1 4.08Å; A626-L688 HydrophobicContact CB-CD2 4.34Å
627	H	92.8	Very high	82.2	Confident	97 Å²	97	54.1 Å²	54.1	45%	0.449	27%	0.268	S	S	.	.	H	α-helix	trans	-54.2	-49.6	174.5	172.6	-96.3	0	0	0	111.9	L623 A624 A625 E630 M631	L623-H627 PolarHBondContact O-N 3Å; L623-H627 VanDerWaalsContact O-N 3.12Å; A624-H627 PolarHBondContact O-N 2.87Å; A625-H627 VanDerWaalsContact C-N 3.35Å; A625-H627 PolarHBondContact O-N 3.14Å; H627-E630 PolarHBondContact O-N 3.4Å; H627-M631 PolarHBondContact CE1-SD 3.16Å; H627-M631 WeakPolarHBondContact O-CG 3.42Å; H627-M631 PolarHBondContact O-N 2.86Å
628	W	91.1	Very high	81.6	Confident	38 Å²	38	50 Å²	50	14%	0.144	25%	0.249	C	C	.	.	H	α-helix	trans	-71.1	-37.8	-178.8	-69.6	120.4	0	0	0	113.7	A579 M587 L590 A591 A624 A625 A626 M631 A632	A579-W628 HydrophobicContact CB-CE3 4.12Å; A579-W628 HydrophobicContact CB-CH2 3.91Å; A579-W628 HydrophobicContact CB-CZ3 3.63Å; M587-W628 HydrophobicContact CB-CE3 4.2Å; M587-W628 HydrophobicContact CG-CE3 3.92Å; M587-W628 HydrophobicContact CG-CZ3 4.23Å; L590-W628 HydrophobicContact CB-CD2 4.24Å; L590-W628 HydrophobicContact CB-CG 3.96Å; L590-W628 HydrophobicContact CD1-CD2 4.16Å; L590-W628 HydrophobicContact CD1-CH2 4.28Å; L590-W628 HydrophobicContact CD1-CZ2 3.84Å; A591-W628 HydrophobicContact CB-CB 3.7Å; A624-W628 PolarHBondContact O-N 3.1Å; A624-W628 VanDerWaalsContact O-N 3.17Å; A625-W628 PolarHBondContact O-N 3.14Å; A626-W628 VanDerWaalsContact C-N 3.34Å; A626-W628 PolarHBondContact O-N 3.17Å; W628-M631 HydrophobicContact CE3-SD 4.05Å; W628-M631 HydrophobicContact CZ3-SD 3.82Å; W628-M631 PolarHBondContact O-N 2.72Å; W628-A632 WeakPolarHBondContact O-CB 3.36Å; W628-A632 PolarHBondContact O-N 3.32Å
629	Y	93.2	Very high	79.9	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62	-43.5	172.6	-80	-54.2	0	0	0	111.7	A591 E592 A625 A626 A632 A633 L673 R676 L677 M680	A591-Y629 HydrophobicContact CB-CD1 3.57Å; A591-Y629 HydrophobicContact CB-CD2 3.72Å; A591-Y629 HydrophobicContact CB-CE1 3.56Å; A591-Y629 HydrophobicContact CB-CE2 3.68Å; A591-Y629 HydrophobicContact CB-CG 3.63Å; E592-Y629 PolarHBondContact OE2-OH 3.09Å; A625-Y629 HydrophobicContact CB-CD2 4.4Å; A625-Y629 HydrophobicContact CB-CE2 4.3Å; A625-Y629 WeakPolarHBondContact O-CD2 3.37Å; A625-Y629 PolarHBondContact O-N 3.29Å; A626-Y629 PolarHBondContact O-N 3.1Å; Y629-A632 PolarHBondContact O-N 2.89Å; Y629-A633 WeakPolarHBondContact O-CB 3.28Å; Y629-A633 PolarHBondContact O-N 3.48Å; Y629-L673 HydrophobicContact CD1-CD2 3.73Å; Y629-L673 HydrophobicContact CE1-CD2 4.03Å; Y629-R676 HydrophobicContact CD2-CG 4.43Å; Y629-R676 HydrophobicContact CE2-CG 3.88Å; Y629-R676 WeakPolarHBondContact OH-CD 3.19Å; Y629-R676 PolarHBondContact OH-NH1 3.36Å; Y629-L677 HydrophobicContact CG-CG 4.49Å; Y629-M680 HydrophobicContact CD2-SD 3.87Å; Y629-M680 HydrophobicContact CE2-SD 3.96Å
630	E	91.1	Very high	77.6	Confident	48 Å²	48	53.5 Å²	53.5	22%	0.224	27%	0.274	C	S	.	.	H	α-helix	trans	-63.2	-43.7	175.8	-77.1	-172.9	-178.2	0	0	111.7	A626 H627 A632 A633 K634 L677 Y681 K694	A626-E630 WeakPolarHBondContact O-CB 3.19Å; A626-E630 WeakPolarHBondContact O-CG 3.28Å; A626-E630 PolarHBondContact O-N 3.45Å; H627-E630 PolarHBondContact O-N 3.4Å; E630-A632 VanDerWaalsContact C-N 3.32Å; E630-A632 PolarHBondContact O-N 2.96Å; E630-A633 PolarHBondContact O-N 3.19Å; E630-K634 WeakPolarHBondContact O-CB 3.32Å; E630-K634 VanDerWaalsContact O-CG 3.25Å; E630-K634 WeakPolarHBondContact O-CG 3.5Å; E630-K634 PolarHBondContact O-N 3.45Å; E630-K634 IonicContact OE2-NZ 3.99Å; E630-L677 HydrophobicContact CG-CD1 3.83Å; E630-L677 HydrophobicContact CG-CD2 4.02Å; E630-Y681 PolarHBondContact OE1-OH 3.27Å; E630-K694 IonicContact OE1-NZ 2.7Å; E630-K694 PolarHBondContact OE1-NZ 3.19Å
631	M	87.7	Confident	74.9	Confident	58 Å²	58	55.2 Å²	55.2	29%	0.286	29%	0.29	S	S	.	.	H	α-helix	trans	-60.3	-43.8	174.4	-72.4	-157.5	79.5	0	0	111.1	M587 H627 W628 A633 K634 V635	M587-M631 HydrophobicContact CE-CB 4.09Å; M587-M631 HydrophobicContact CE-CE 3.93Å; M587-M631 HydrophobicContact CE-SD 4.48Å; M587-M631 HydrophobicContact CG-CB 4.45Å; M587-M631 HydrophobicContact SD-CB 3.7Å; H627-M631 PolarHBondContact CE1-SD 3.16Å; H627-M631 WeakPolarHBondContact O-CG 3.42Å; H627-M631 PolarHBondContact O-N 2.86Å; W628-M631 HydrophobicContact CE3-SD 4.05Å; W628-M631 HydrophobicContact CZ3-SD 3.82Å; W628-M631 PolarHBondContact O-N 2.72Å; M631-A633 VanDerWaalsContact C-N 3.35Å; M631-A633 PolarHBondContact O-N 2.92Å; M631-K634 PolarHBondContact O-N 2.68Å; M631-V635 WeakPolarHBondContact O-CG2 3.43Å; M631-V635 PolarHBondContact O-N 3.3Å; M631-V635 VanDerWaalsContact O-N 3.09Å
632	A	86.7	Confident	72	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-66.2	-33.4	178.1	0	0	0	0	0	113.4	R584 M587 V588 W628 Y629 E630 V635 L673	R584-A632 HydrophobicContact CG-CB 4.08Å; R584-A632 PolarHBondContact NE-O 2.83Å; M587-A632 HydrophobicContact CB-CB 3.9Å; M587-A632 HydrophobicContact SD-CB 4.43Å; V588-A632 HydrophobicContact CG2-CB 3.72Å; W628-A632 WeakPolarHBondContact O-CB 3.36Å; W628-A632 PolarHBondContact O-N 3.32Å; Y629-A632 PolarHBondContact O-N 2.89Å; E630-A632 VanDerWaalsContact C-N 3.32Å; E630-A632 PolarHBondContact O-N 2.96Å; A632-V635 WeakPolarHBondContact O-CB 3.44Å; A632-V635 PolarHBondContact O-N 3.48Å; A632-L673 HydrophobicContact CB-CD1 3.83Å
633	A	85.4	Confident	69	Low	22 Å²	22	56 Å²	56	18%	0.182	30%	0.297	C	S	.	.	H	α-helix	trans	-75.7	-34.1	175.7	0	0	0	0	0	112.3	Y629 E630 M631 V635 L673	Y629-A633 WeakPolarHBondContact O-CB 3.28Å; Y629-A633 PolarHBondContact O-N 3.48Å; E630-A633 PolarHBondContact O-N 3.19Å; M631-A633 VanDerWaalsContact C-N 3.35Å; M631-A633 PolarHBondContact O-N 2.92Å; A633-V635 PolarHBondContact O-N 3.19Å; A633-L673 HydrophobicContact CB-CB 4.31Å; A633-L673 HydrophobicContact CB-CD1 4.18Å
634	K	81.8	Confident	66	Low	151 Å²	151	53 Å²	53	66%	0.657	28%	0.281	S	S	*	.	H	α-helix	trans	-69.9	-17.7	171.5	-73	168.1	-175.8	164.4	0	112.7	E630 M631 V636	E630-K634 WeakPolarHBondContact O-CB 3.32Å; E630-K634 VanDerWaalsContact O-CG 3.25Å; E630-K634 WeakPolarHBondContact O-CG 3.5Å; E630-K634 PolarHBondContact O-N 3.45Å; E630-K634 IonicContact OE2-NZ 3.99Å; M631-K634 PolarHBondContact O-N 2.68Å; K634-V636 PolarHBondContact O-N 2.75Å
635	V	74.4	Confident	63.1	Low	6 Å²	6	57.5 Å²	57.5	4%	0.036	30%	0.302	C	S	.	.	S	Bend	trans	-68.2	104	167.4	171.3	0	0	0	0	108.4	R584 M587 M631 A632 A633 T637 K656	R584-V635 HydrophobicContact CB-CB 4.17Å; R584-V635 HydrophobicContact CB-CG1 3.92Å; R584-V635 HydrophobicContact CB-CG2 4.13Å; R584-V635 HydrophobicContact CG-CB 3.99Å; R584-V635 HydrophobicContact CG-CG1 4.08Å; R584-V635 HydrophobicContact CG-CG2 4.25Å; M587-V635 HydrophobicContact CE-CG2 4.36Å; M587-V635 HydrophobicContact SD-CG2 3.9Å; M631-V635 WeakPolarHBondContact O-CG2 3.43Å; M631-V635 PolarHBondContact O-N 3.3Å; M631-V635 VanDerWaalsContact O-N 3.09Å; A632-V635 WeakPolarHBondContact O-CB 3.44Å; A632-V635 PolarHBondContact O-N 3.48Å; A633-V635 PolarHBondContact O-N 3.19Å; V635-T637 HydrophobicContact CG1-CG2 4.13Å; V635-T637 PolarHBondContact O-N 2.92Å; V635-K656 HydrophobicContact CG1-CD 3.44Å; V635-K656 VanDerWaalsContact CG1-CD 3.44Å
636	V	55.4	Low	60.5	Low	68 Å²	68	62.8 Å²	62.8	41%	0.412	33%	0.327	S	S	.	.			trans	-55.6	105.7	161.6	-176.4	0	0	0	0	107.4	K634 Y638	K634-V636 PolarHBondContact O-N 2.75Å; V636-Y638 HydrophobicContact CG1-CD2 4.06Å; V636-Y638 HydrophobicContact CG1-CE1 4.29Å; V636-Y638 HydrophobicContact CG1-CE2 3.65Å
637	T	47.1	Very low	57.3	Low	35 Å²	35	71.4 Å²	71.4	22%	0.215	37%	0.369	C	S	.	.			trans	-89.6	106.3	163.4	51	0	0	0	0	105.4	R584 V635 D639 E667	R584-T637 VanDerWaalsContact NE-CG2 3.31Å; V635-T637 HydrophobicContact CG1-CG2 4.13Å; V635-T637 PolarHBondContact O-N 2.92Å; T637-D639 PolarHBondContact O-N 3.08Å; T637-E667 WeakPolarHBondContact CG2-OE1 3.34Å
638	Y	36.1	Very low	54.3	Low	93 Å²	93	73.5 Å²	73.5	37%	0.365	38%	0.384	S	S	.	.			trans	-60.4	113.4	164.2	-73.9	-80	0	0	0	107.2	V636 D640 D645 E646	V636-Y638 HydrophobicContact CG1-CD2 4.06Å; V636-Y638 HydrophobicContact CG1-CE1 4.29Å; V636-Y638 HydrophobicContact CG1-CE2 3.65Å; Y638-D640 PolarHBondContact O-N 3.41Å; Y638-D645 HydrophobicContact CE1-CB 3.52Å; Y638-D645 HydrophobicContact CE2-CB 4.19Å; Y638-D645 WeakPolarHBondContact CE2-O 3.35Å; Y638-D645 WeakPolarHBondContact OH-CB 3.37Å; Y638-D645 PolarHBondContact OH-O 3.12Å; Y638-E646 HydrophobicContact CE2-CG 4.5Å; Y638-E646 WeakPolarHBondContact OH-CG 3.38Å
639	D	32.6	Very low	51.3	Low	146 Å²	146	80.6 Å²	80.6	78%	0.781	42%	0.418	S	S	*	.	S	Bend	trans	-48.7	116.9	167.6	-81.3	-31.5	0	0	0	107.6	T637	T637-D639 PolarHBondContact O-N 3.08Å
640	D	29.9	Very low	48.1	Very low	128 Å²	128	84.1 Å²	84.1	68%	0.684	46%	0.455	S	S	*	.	S	Bend	trans	47.2	79.1	156.6	-146.6	21.2	0	0	0	114.3	Y638 T642	Y638-D640 PolarHBondContact O-N 3.41Å; D640-T642 VanDerWaalsContact C-N 3.34Å; D640-T642 PolarHBondContact O-N 3.43Å
641	A	29.6	Very low	45.1	Very low	68 Å²	68	88.2 Å²	88.2	56%	0.562	48%	0.478	S	S	*	.			trans	45.6	53.7	150.5	0	0	0	0	0	114.9	R94	R94-A641 PolarHBondContact NH1-O 3.22Å
642	T	29.8	Very low	42.6	Very low	50 Å²	50	91.7 Å²	91.7	31%	0.307	51%	0.505	S	S	.	.			trans	-103.7	95.9	140.5	67.4	0	0	0	0	106.8	I103 D640 D644	I103-T642 HydrophobicContact CD1-CG2 4.03Å; I103-T642 HydrophobicContact CG2-CG2 3.32Å; D640-T642 VanDerWaalsContact C-N 3.34Å; D640-T642 PolarHBondContact O-N 3.43Å; T642-D644 PolarHBondContact O-N 3.21Å
643	E	31.7	Very low	40	Very low	45 Å²	45	93.7 Å²	93.7	21%	0.21	52%	0.519	C	S	.	.			trans	-39.7	87.7	153.9	-93.1	-176.2	-167.3	0	0	108.7	R92 K129 N132 F133	R92-E643 IonicContact CZ-OE2 2.85Å; R92-E643 IonicContact NH1-OE2 3.46Å; R92-E643 PolarHBondContact NH1-OE2 3.44Å; R92-E643 IonicContact NH2-OE2 2.65Å; R92-E643 PolarHBondContact NH2-OE2 3.4Å; K129-E643 IonicContact NZ-OE2 3.53Å; N132-E643 HydrophobicContact CB-CB 3.64Å; N132-E643 HydrophobicContact CB-CG 3.93Å; N132-E643 PolarHBondContact ND2-O 3.47Å; F133-E643 HydrophobicContact CD1-CG 4.42Å; F133-E643 HydrophobicContact CD2-CG 3.68Å; F133-E643 WeakPolarHBondContact CD2-OE1 3.43Å; F133-E643 HydrophobicContact CE1-CG 3.89Å; F133-E643 HydrophobicContact CE2-CB 4.49Å; F133-E643 HydrophobicContact CE2-CG 3.08Å; F133-E643 WeakPolarHBondContact CE2-OE1 3.44Å; F133-E643 HydrophobicContact CG-CG 4.34Å; F133-E643 HydrophobicContact CZ-CB 4.32Å; F133-E643 HydrophobicContact CZ-CG 3.19Å
644	D	31.1	Very low	37.1	Very low	34 Å²	34	96.8 Å²	96.8	18%	0.182	53%	0.529	C	S	.	.			trans	169.1	110.7	157.4	-81.9	-16.9	0	0	0	108.5	D105 I106 N132 T642	D105-D644 WeakPolarHBondContact CA-OD2 3.4Å; D105-D644 HydrophobicContact CB-CB 4.22Å; D105-D644 WeakPolarHBondContact CB-OD2 3.48Å; I106-D644 PolarHBondContact N-OD2 3.4Å; N132-D644 WeakPolarHBondContact CB-OD1 3.41Å; N132-D644 VanDerWaalsContact CG-OD1 3.25Å; N132-D644 VanDerWaalsContact ND2-CG 3.3Å; N132-D644 PolarHBondContact ND2-OD1 2.97Å; N132-D644 PolarHBondContact ND2-OD2 3.36Å; T642-D644 PolarHBondContact O-N 3.21Å
645	D	30.3	Very low	34.7	Very low	118 Å²	118	92.2 Å²	92.2	63%	0.631	51%	0.513	S	S	*	.			trans	162.7	113.4	135.9	-81.5	-24.5	0	0	0	106.7	Y638	Y638-D645 HydrophobicContact CE1-CB 3.52Å; Y638-D645 HydrophobicContact CE2-CB 4.19Å; Y638-D645 WeakPolarHBondContact CE2-O 3.35Å; Y638-D645 WeakPolarHBondContact OH-CB 3.37Å; Y638-D645 PolarHBondContact OH-O 3.12Å
646	E	38	Very low	32.5	Very low	111 Å²	111	95.4 Å²	95.4	52%	0.519	53%	0.526	S	S	.	.				-176.5	104.6	117.6	-102.4	174.8	176.8	0	0	110.2	Y638 N648	Y638-E646 HydrophobicContact CE2-CG 4.5Å; Y638-E646 WeakPolarHBondContact OH-CG 3.38Å; E646-N648 PolarHBondContact O-N 2.83Å
647	M	28	Very low	31.2	Very low	184 Å²	184	99.1 Å²	99.1	91%	0.906	53%	0.533	S	S	*	.			trans	-57.4	107.2	141.6	-65.2	-162.4	-157	0	0	108.3
648	N	29.7	Very low	30.4	Very low	141 Å²	141	101.9 Å²	101.9	75%	0.754	55%	0.554	S	S	*	*			trans	-144.5	95.6	147.2	-138.5	-16.5	0	0	0	109.2	E646 G650	E646-N648 PolarHBondContact O-N 2.83Å; N648-G650 PolarHBondContact O-N 3.29Å
649	Q	27.6	Very low	30	Very low	186 Å²	186	103.6 Å²	103.6	87%	0.869	56%	0.56	S	S	*	*			trans	-67.4	114.6	173.1	-64.6	174.6	16.2	0	0	107.6
650	G	27	Very low	29.7	Very low	74 Å²	74	102 Å²	102	76%	0.763	56%	0.56	S	S	*	*	S	Bend	trans	142.2	19.2	161.8	0	0	0	0	0	119.6	N648	N648-G650 PolarHBondContact O-N 3.29Å
651	N	27.7	Very low	29.6	Very low	135 Å²	135	99.3 Å²	99.3	72%	0.722	56%	0.562	S	S	*	*			trans	-172.5	111.7	149.1	-132.7	-35.4	0	0	0	111.8	S653	N651-S653 VanDerWaalsContact C-N 3.27Å; N651-S653 PolarHBondContact O-N 3.03Å
652	P	35.5	Very low	29.5	Very low	131 Å²	131	103.4 Å²	103.4	85%	0.851	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	39.2	-165.1	34.3	-36	0	0	0	115
653	S	30.6	Very low	29.8	Very low	42 Å²	42	108.5 Å²	108.5	29%	0.294	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-129.7	16.7	-174.2	64.7	0	0	0	0	116.6	R537 N651	R537-S653 WeakPolarHBondContact CD-O 3.14Å; R537-S653 VanDerWaalsContact CZ-CB 3.48Å; R537-S653 PolarHBondContact NE-O 3.16Å; R537-S653 PolarHBondContact NH2-OG 3.09Å; N651-S653 VanDerWaalsContact C-N 3.27Å; N651-S653 PolarHBondContact O-N 3.03Å
654	F	26.1	Very low	29.7	Very low	87 Å²	87	111 Å²	111	38%	0.382	62%	0.616	S	S	.	*			trans	-144.3	80.9	-179.4	-162	-94.8	0	0	0	111.4	A581 M587 K656	A581-F654 VanDerWaalsContact C-CE2 3.49Å; A581-F654 WeakPolarHBondContact O-CD2 3.44Å; M587-F654 HydrophobicContact CE-CZ 4.15Å; F654-K656 VanDerWaalsContact CE1-CE 3.48Å
655	V	29.6	Very low	29.7	Very low	54 Å²	54	114.8 Å²	114.8	33%	0.327	64%	0.636	S	S	.	*			trans	-121.6	120.6	175.9	171.6	0	0	0	0	108.5	H135 Q540	H135-V655 WeakPolarHBondContact CD2-CG1 3.42Å; H135-V655 WeakPolarHBondContact CD2-CG2 3.41Å; H135-V655 WeakPolarHBondContact NE2-CG1 3.39Å; H135-V655 WeakPolarHBondContact NE2-CG2 3.37Å; Q540-V655 VanDerWaalsContact CD-O 3.27Å; Q540-V655 PolarHBondContact NE2-O 3.13Å; Q540-V655 VanDerWaalsContact NE2-O 3.11Å; Q540-V655 PolarHBondContact OE1-O 2.75Å
656	K	30.1	Very low	30.3	Very low	73 Å²	73	113.6 Å²	113.6	32%	0.317	64%	0.636	S	S	.	*			trans	-82.6	118.5	-177.6	-67.3	156.9	-176.1	153.1	0	110.6	V635 F654	V635-K656 HydrophobicContact CG1-CD 3.44Å; V635-K656 VanDerWaalsContact CG1-CD 3.44Å; F654-K656 VanDerWaalsContact CE1-CE 3.48Å
657	R	27.9	Very low	31.6	Very low	146 Å²	146	111.7 Å²	111.7	55%	0.551	63%	0.627	S	S	*	*			trans	-99.6	118.4	162.2	-74.9	177	167.4	168	-3.5	108.2	R544	R544-R657 PolarHBondContact NH2-O 3.01Å
658	S	29.4	Very low	33.8	Very low	94 Å²	94	105.3 Å²	105.3	66%	0.657	59%	0.593	S	S	*	*			trans	-113.4	135.1	162.4	-160.4	0	0	0	0	110.3
659	R	27.8	Very low	36.3	Very low	128 Å²	128	100.5 Å²	100.5	48%	0.483	57%	0.57	S	S	.	*			trans	-118.3	130.9	-163.4	-172.1	179.5	-176.7	-172.5	9.7	108.8	W63 A541 G661	W63-R659 VanDerWaalsContact CH2-NH2 3.34Å; A541-R659 HydrophobicContact CB-CB 4.1Å; A541-R659 PolarHBondContact O-NH1 3.04Å; R659-G661 PolarHBondContact O-N 2.93Å
660	S	25.9	Very low	39.1	Very low	114 Å²	114	94.6 Å²	94.6	80%	0.797	54%	0.543	S	S	*	.	S	Bend	trans	-62.7	125.4	176.8	69.3	0	0	0	0	111.4
661	G	28.1	Very low	42.1	Very low	70 Å²	70	92.1 Å²	92.1	72%	0.722	51%	0.511	S	S	*	.	S	Bend	trans	149	-3	167.3	0	0	0	0	0	117	R659	R659-G661 PolarHBondContact O-N 2.93Å
662	F	27.2	Very low	45.1	Very low	155 Å²	155	90.3 Å²	90.3	68%	0.68	49%	0.494	S	S	*	.			trans	-127.4	55.7	-179.1	-126.5	-94.5	0	0	0	111.6	A664	F662-A664 PolarHBondContact O-N 3.42Å
663	H	36.3	Very low	47.8	Very low	157 Å²	157	84.1 Å²	84.1	73%	0.727	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	18.9	-176.4	-96.8	-65.8	0	0	0	115.6
664	A	29.6	Very low	50.8	Low	96 Å²	96	83.7 Å²	83.7	79%	0.793	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-0	178.3	0	0	0	0	0	114.5	F662	F662-A664 PolarHBondContact O-N 3.42Å
665	L	30.5	Very low	54	Low	115 Å²	115	79.7 Å²	79.7	60%	0.602	43%	0.431	S	S	*	.	S	Bend	trans	-119.7	97.2	158.6	-68.3	172.4	0	0	0	105.3	E667	L665-E667 PolarHBondContact O-N 2.82Å; L665-E667 VanDerWaalsContact O-N 3.1Å
666	S	43.1	Very low	57.1	Low	92 Å²	92	79.3 Å²	79.3	64%	0.643	42%	0.423	S	S	*	.			trans	-41.8	117.3	177.3	-52.6	0	0	0	0	109.7	W668	S666-W668 PolarHBondContact O-N 3.38Å; S666-W668 VanDerWaalsContact O-N 3.1Å
667	E	67.1	Low	60.2	Low	72 Å²	72	76 Å²	76	34%	0.336	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-53.9	121.1	167.2	-180	158.9	-159.1	0	0	107	R584 M585 T637 L665 P669	R584-E667 IonicContact CZ-OE1 3.38Å; R584-E667 IonicContact NH1-OE1 2.81Å; R584-E667 PolarHBondContact NH1-OE1 2.91Å; M585-E667 HydrophobicContact SD-CB 4.36Å; M585-E667 HydrophobicContact SD-CG 4.21Å; T637-E667 WeakPolarHBondContact CG2-OE1 3.34Å; L665-E667 PolarHBondContact O-N 2.82Å; L665-E667 VanDerWaalsContact O-N 3.1Å; E667-P669 VanDerWaalsContact O-CD 3.27Å; E667-P669 WeakPolarHBondContact O-CD 3.27Å
668	W	72.6	Confident	63.4	Low	49 Å²	49	69 Å²	69	19%	0.186	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-63.3	119.5	179.6	-86.7	59.9	0	0	0	107.8	R584 V588 E592 S666 R672 L673 R676	R584-W668 VanDerWaalsContact CZ-O 3.23Å; R584-W668 PolarHBondContact NH1-O 2.94Å; R584-W668 PolarHBondContact NH2-O 2.96Å; V588-W668 HydrophobicContact CG1-CG 4.21Å; E592-W668 VanDerWaalsContact OE1-CZ2 3.29Å; E592-W668 WeakPolarHBondContact OE1-CZ2 3.38Å; S666-W668 PolarHBondContact O-N 3.38Å; S666-W668 VanDerWaalsContact O-N 3.1Å; W668-R672 HydrophobicContact CD2-CB 4.29Å; W668-R672 HydrophobicContact CE3-CB 3.4Å; W668-R672 VanDerWaalsContact CE3-CB 3.4Å; W668-R672 HydrophobicContact CZ3-CB 3.68Å; W668-R672 WeakPolarHBondContact CZ3-O 3.49Å; W668-L673 HydrophobicContact CB-CD2 3.6Å; W668-L673 HydrophobicContact CB-CG 4.11Å; W668-L673 HydrophobicContact CD2-CD2 4.2Å; W668-L673 HydrophobicContact CE3-CD2 3.89Å; W668-L673 HydrophobicContact CG-CD2 4.12Å; W668-R676 HydrophobicContact CZ3-CB 4.34Å
669	P	83.2	Confident	66.5	Low	41 Å²	41	67.5 Å²	67.5	27%	0.266	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-67.6	157	174.5	29	-34	0	0	0	110	E667 Y671 R672 L673	E667-P669 VanDerWaalsContact O-CD 3.27Å; E667-P669 WeakPolarHBondContact O-CD 3.27Å; P669-Y671 VanDerWaalsContact C-N 3.26Å; P669-Y671 HydrophobicContact CB-CD1 3.7Å; P669-Y671 HydrophobicContact CB-CE1 3.33Å; P669-Y671 HydrophobicContact CG-CD1 3.87Å; P669-Y671 HydrophobicContact CG-CD2 4.47Å; P669-Y671 HydrophobicContact CG-CE1 3.23Å; P669-Y671 HydrophobicContact CG-CE2 3.97Å; P669-Y671 HydrophobicContact CG-CG 4.43Å; P669-Y671 WeakPolarHBondContact CG-OH 3.25Å; P669-Y671 PolarHBondContact O-N 3.07Å; P669-R672 HydrophobicContact CG-CB 4.3Å; P669-R672 HydrophobicContact CG-CG 3.94Å; P669-R672 PolarHBondContact O-N 2.92Å; P669-L673 PolarHBondContact O-N 3.44Å
670	I	86.8	Confident	69.7	Low	61 Å²	61	61.5 Å²	61.5	31%	0.313	34%	0.343	S	S	.	.	H	α-helix	trans	-53.6	-44.3	-173.4	-63.8	173.5	0	0	0	111.3	R672 L673 Q674	I670-R672 PolarHBondContact O-N 3.28Å; I670-L673 WeakPolarHBondContact O-CB 3.45Å; I670-L673 PolarHBondContact O-N 3.4Å; I670-Q674 HydrophobicContact CG2-CG 4.2Å; I670-Q674 PolarHBondContact O-N 2.86Å
671	Y	89.2	Confident	73.1	Confident	23 Å²	23	57.3 Å²	57.3	9%	0.09	31%	0.31	C	S	.	.	H	α-helix	trans	-58.7	-32.8	179.9	67.4	-98.8	0	0	0	113.5	P669 G675 A702 A706 A709 I714 Y718	P669-Y671 VanDerWaalsContact C-N 3.26Å; P669-Y671 HydrophobicContact CB-CD1 3.7Å; P669-Y671 HydrophobicContact CB-CE1 3.33Å; P669-Y671 HydrophobicContact CG-CD1 3.87Å; P669-Y671 HydrophobicContact CG-CD2 4.47Å; P669-Y671 HydrophobicContact CG-CE1 3.23Å; P669-Y671 HydrophobicContact CG-CE2 3.97Å; P669-Y671 HydrophobicContact CG-CG 4.43Å; P669-Y671 WeakPolarHBondContact CG-OH 3.25Å; P669-Y671 PolarHBondContact O-N 3.07Å; Y671-G675 PolarHBondContact O-N 3.18Å; Y671-A702 WeakPolarHBondContact CB-O 3.5Å; Y671-A702 WeakPolarHBondContact O-CB 3.17Å; Y671-A706 HydrophobicContact CD2-CB 3.9Å; Y671-A706 HydrophobicContact CE2-CB 4.31Å; Y671-A706 HydrophobicContact CG-CB 4.13Å; Y671-A709 HydrophobicContact CD1-CB 4.09Å; Y671-A709 HydrophobicContact CE1-CB 3.58Å; Y671-I714 HydrophobicContact CD2-CG2 4.41Å; Y671-I714 HydrophobicContact CE2-CD1 4.39Å; Y671-I714 HydrophobicContact CE2-CG2 4.27Å; Y671-Y718 HydrophobicContact CD2-CE2 4.23Å
672	R	91.8	Very high	76.2	Confident	97 Å²	97	55.1 Å²	55.1	37%	0.366	29%	0.285	S	S	.	.	H	α-helix	trans	-73.9	-36.8	175.9	-73.9	-163	-176.3	-169.1	-1	112.5	W668 P669 I670 Q674 G675 R676	W668-R672 HydrophobicContact CD2-CB 4.29Å; W668-R672 HydrophobicContact CE3-CB 3.4Å; W668-R672 VanDerWaalsContact CE3-CB 3.4Å; W668-R672 HydrophobicContact CZ3-CB 3.68Å; W668-R672 WeakPolarHBondContact CZ3-O 3.49Å; P669-R672 HydrophobicContact CG-CB 4.3Å; P669-R672 HydrophobicContact CG-CG 3.94Å; P669-R672 PolarHBondContact O-N 2.92Å; I670-R672 PolarHBondContact O-N 3.28Å; R672-Q674 VanDerWaalsContact C-N 3.35Å; R672-G675 PolarHBondContact O-N 3.16Å; R672-R676 PolarHBondContact O-N 2.94Å
673	L	91.5	Very high	79.3	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.1	-44.5	175.2	-58.7	179	0	0	0	110.4	V588 Y629 A632 A633 W668 P669 I670 R676 L677	V588-L673 HydrophobicContact CG2-CD2 3.94Å; Y629-L673 HydrophobicContact CD1-CD2 3.73Å; Y629-L673 HydrophobicContact CE1-CD2 4.03Å; A632-L673 HydrophobicContact CB-CD1 3.83Å; A633-L673 HydrophobicContact CB-CB 4.31Å; A633-L673 HydrophobicContact CB-CD1 4.18Å; W668-L673 HydrophobicContact CB-CD2 3.6Å; W668-L673 HydrophobicContact CB-CG 4.11Å; W668-L673 HydrophobicContact CD2-CD2 4.2Å; W668-L673 HydrophobicContact CE3-CD2 3.89Å; W668-L673 HydrophobicContact CG-CD2 4.12Å; P669-L673 PolarHBondContact O-N 3.44Å; I670-L673 WeakPolarHBondContact O-CB 3.45Å; I670-L673 PolarHBondContact O-N 3.4Å; L673-R676 PolarHBondContact O-N 3.33Å; L673-L677 WeakPolarHBondContact O-CG 3.3Å; L673-L677 PolarHBondContact O-N 3.49Å
674	Q	93.1	Very high	82	Confident	33 Å²	33	46.5 Å²	46.5	15%	0.154	25%	0.249	C	C	.	.	H	α-helix	trans	-63	-45.2	176	-69.8	174.9	-49.2	0	0	111.8	I670 R672 R676 L677 G678 L698 S701 A702	I670-Q674 HydrophobicContact CG2-CG 4.2Å; I670-Q674 PolarHBondContact O-N 2.86Å; R672-Q674 VanDerWaalsContact C-N 3.35Å; Q674-R676 VanDerWaalsContact C-N 3.29Å; Q674-R676 PolarHBondContact O-N 2.9Å; Q674-L677 WeakPolarHBondContact O-CB 3.34Å; Q674-L677 PolarHBondContact O-N 3.01Å; Q674-G678 PolarHBondContact O-N 3.21Å; Q674-L698 HydrophobicContact CB-CD2 4.38Å; Q674-L698 HydrophobicContact CG-CD2 4.43Å; Q674-S701 PolarHBondContact NE2-OG 3.29Å; Q674-A702 HydrophobicContact CB-CB 3.89Å
675	G	94.3	Very high	84.9	Confident	3 Å²	3	43.7 Å²	43.7	3%	0.031	23%	0.229	C	C	.	.	H	α-helix	trans	-59.2	-39	175.8	0	0	0	0	0	113.1	Y671 R672 G678 E679 F699	Y671-G675 PolarHBondContact O-N 3.18Å; R672-G675 PolarHBondContact O-N 3.16Å; G675-G678 PolarHBondContact O-N 3.26Å; G675-E679 PolarHBondContact O-N 3.33Å; G675-F699 WeakPolarHBondContact O-CE1 3.21Å
676	R	94.2	Very high	87.8	Confident	46 Å²	46	42 Å²	42	17%	0.174	22%	0.218	C	C	.	.	H	α-helix	trans	-69.8	-39.7	175.5	-174.8	155	-76	-178.3	-5.8	112.9	E592 Y629 W668 R672 L673 Q674 G678 E679 M680	E592-R676 IonicContact OE1-CZ 3.09Å; E592-R676 IonicContact OE1-NH1 3.1Å; E592-R676 PolarHBondContact OE1-NH1 3.35Å; E592-R676 IonicContact OE2-NH1 3.3Å; E592-R676 PolarHBondContact OE2-NH1 2.88Å; Y629-R676 HydrophobicContact CD2-CG 4.43Å; Y629-R676 HydrophobicContact CE2-CG 3.88Å; Y629-R676 WeakPolarHBondContact OH-CD 3.19Å; Y629-R676 PolarHBondContact OH-NH1 3.36Å; W668-R676 HydrophobicContact CZ3-CB 4.34Å; R672-R676 PolarHBondContact O-N 2.94Å; L673-R676 PolarHBondContact O-N 3.33Å; Q674-R676 VanDerWaalsContact C-N 3.29Å; Q674-R676 PolarHBondContact O-N 2.9Å; R676-G678 VanDerWaalsContact C-N 3.32Å; R676-E679 PolarHBondContact O-N 3.45Å; R676-M680 HydrophobicContact CG-SD 4.27Å; R676-M680 VanDerWaalsContact O-CG 3.29Å; R676-M680 WeakPolarHBondContact O-CG 3.4Å; R676-M680 PolarHBondContact O-N 3.37Å; R676-M680 VanDerWaalsContact O-N 3.11Å
677	L	94.6	Very high	90	Very high	4 Å²	4	40.5 Å²	40.5	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-59.7	-43.5	170.9	-77.3	166.5	0	0	0	111.4	A626 Y629 E630 L673 Q674 E679 M680 Y681 L698	A626-L677 HydrophobicContact CB-CD2 3.89Å; Y629-L677 HydrophobicContact CG-CG 4.49Å; E630-L677 HydrophobicContact CG-CD1 3.83Å; E630-L677 HydrophobicContact CG-CD2 4.02Å; L673-L677 WeakPolarHBondContact O-CG 3.3Å; L673-L677 PolarHBondContact O-N 3.49Å; Q674-L677 WeakPolarHBondContact O-CB 3.34Å; Q674-L677 PolarHBondContact O-N 3.01Å; L677-E679 PolarHBondContact O-N 3.02Å; L677-M680 PolarHBondContact O-N 3.04Å; L677-Y681 HydrophobicContact CD2-CE2 4.31Å; L677-Y681 VanDerWaalsContact O-CD2 3.29Å; L677-Y681 WeakPolarHBondContact O-CD2 3.39Å; L677-Y681 PolarHBondContact O-N 3Å; L677-L698 HydrophobicContact CB-CD1 3.73Å; L677-L698 HydrophobicContact CB-CD2 4.17Å; L677-L698 HydrophobicContact CD1-CD2 4.39Å
678	G	95.2	Very high	91.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-58.7	-46.2	177.4	0	0	0	0	0	111.8	Q674 G675 R676 M680 Y681 A682 A695	Q674-G678 PolarHBondContact O-N 3.21Å; G675-G678 PolarHBondContact O-N 3.26Å; R676-G678 VanDerWaalsContact C-N 3.32Å; G678-M680 VanDerWaalsContact C-N 3.35Å; G678-M680 PolarHBondContact O-N 3.22Å; G678-Y681 PolarHBondContact O-N 2.72Å; G678-A682 VanDerWaalsContact O-CB 3.24Å; G678-A682 WeakPolarHBondContact O-CB 3.27Å; G678-A682 PolarHBondContact O-N 3.06Å; G678-A695 WeakPolarHBondContact O-CB 3.09Å
679	E	95.5	Very high	92.1	Very high	62 Å²	62	40.9 Å²	40.9	29%	0.29	23%	0.229	S	C	.	.	H	α-helix	trans	-58.7	-44.7	175.4	-174.9	-174.3	172.7	0	0	112.2	G675 R676 L677 A682 K683 F699	G675-E679 PolarHBondContact O-N 3.33Å; R676-E679 PolarHBondContact O-N 3.45Å; L677-E679 PolarHBondContact O-N 3.02Å; E679-A682 PolarHBondContact O-N 2.94Å; E679-K683 HydrophobicContact CG-CD 4.2Å; E679-K683 WeakPolarHBondContact O-CG 3.16Å; E679-K683 PolarHBondContact O-N 2.85Å; E679-K683 VanDerWaalsContact O-N 3.1Å; E679-K683 IonicContact OE1-NZ 2.7Å; E679-K683 PolarHBondContact OE1-NZ 3.1Å; E679-F699 HydrophobicContact CB-CZ 4.34Å; E679-F699 VanDerWaalsContact N-CZ 3.29Å
680	M	95.1	Very high	92.6	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-65	-44.9	179.8	-68.5	168	62.4	0	0	112	Y595 W622 A625 A626 Y629 R676 L677 G678 G684 L688	Y595-M680 HydrophobicContact CD2-CG 4.09Å; Y595-M680 HydrophobicContact CD2-SD 3.88Å; Y595-M680 HydrophobicContact CE2-CG 3.87Å; Y595-M680 HydrophobicContact CE2-SD 4.23Å; W622-M680 HydrophobicContact CB-CE 3.62Å; W622-M680 HydrophobicContact CD2-CG 4.47Å; W622-M680 HydrophobicContact CG-CE 3.9Å; W622-M680 WeakPolarHBondContact O-CE 3.49Å; A625-M680 HydrophobicContact CB-CE 3.7Å; A626-M680 HydrophobicContact CB-CE 3.89Å; Y629-M680 HydrophobicContact CD2-SD 3.87Å; Y629-M680 HydrophobicContact CE2-SD 3.96Å; R676-M680 HydrophobicContact CG-SD 4.27Å; R676-M680 VanDerWaalsContact O-CG 3.29Å; R676-M680 WeakPolarHBondContact O-CG 3.4Å; R676-M680 PolarHBondContact O-N 3.37Å; R676-M680 VanDerWaalsContact O-N 3.11Å; L677-M680 PolarHBondContact O-N 3.04Å; G678-M680 VanDerWaalsContact C-N 3.35Å; G678-M680 PolarHBondContact O-N 3.22Å; M680-G684 PolarHBondContact O-N 3.02Å; M680-L688 HydrophobicContact CB-CD2 3.81Å; M680-L688 HydrophobicContact CE-CD2 4.3Å
681	Y	95.9	Very high	92.9	Very high	26 Å²	26	45.5 Å²	45.5	10%	0.102	24%	0.242	C	C	.	.	H	α-helix	trans	-70	-33.2	178	-82.5	-66.8	0	0	0	113	E630 L677 G678 L688 R690 D691 K694 L698	E630-Y681 PolarHBondContact OE1-OH 3.27Å; L677-Y681 HydrophobicContact CD2-CE2 4.31Å; L677-Y681 VanDerWaalsContact O-CD2 3.29Å; L677-Y681 WeakPolarHBondContact O-CD2 3.39Å; L677-Y681 PolarHBondContact O-N 3Å; G678-Y681 PolarHBondContact O-N 2.72Å; Y681-L688 HydrophobicContact CD1-CD1 4.37Å; Y681-L688 HydrophobicContact CD1-CD2 4.05Å; Y681-L688 HydrophobicContact CD1-CG 4.25Å; Y681-L688 HydrophobicContact CE1-CD1 3.67Å; Y681-L688 HydrophobicContact CE1-CD2 4.1Å; Y681-L688 HydrophobicContact CE1-CG 4.04Å; Y681-L688 HydrophobicContact CG-CD2 4.32Å; Y681-R690 WeakPolarHBondContact O-CA 3.36Å; Y681-R690 WeakPolarHBondContact O-CG 3.28Å; Y681-D691 HydrophobicContact CD1-CB 3.88Å; Y681-D691 PolarHBondContact O-N 3.07Å; Y681-K694 HydrophobicContact CD1-CD 4.18Å; Y681-K694 HydrophobicContact CD2-CD 4.05Å; Y681-K694 HydrophobicContact CD2-CG 4.28Å; Y681-K694 HydrophobicContact CE1-CD 3.91Å; Y681-K694 HydrophobicContact CE2-CD 3.77Å; Y681-K694 VanDerWaalsContact CE2-CE 3.47Å; Y681-K694 HydrophobicContact CE2-CG 4.45Å; Y681-K694 HydrophobicContact CG-CD 4.25Å; Y681-K694 HydrophobicContact CG-CG 4.43Å; Y681-K694 PolarHBondContact OH-NZ 3.07Å; Y681-L698 HydrophobicContact CD2-CD1 3.65Å; Y681-L698 HydrophobicContact CE2-CD1 4.24Å
682	A	93.6	Very high	93	Very high	24 Å²	24	47.2 Å²	47.2	20%	0.198	25%	0.248	C	C	.	.	H	α-helix	trans	-66.2	-41.2	176.1	0	0	0	0	0	112.1	G678 E679 R690 A695 F699 L725	G678-A682 VanDerWaalsContact O-CB 3.24Å; G678-A682 WeakPolarHBondContact O-CB 3.27Å; G678-A682 PolarHBondContact O-N 3.06Å; E679-A682 PolarHBondContact O-N 2.94Å; A682-R690 VanDerWaalsContact O-CD 3.24Å; A682-R690 WeakPolarHBondContact O-CD 3.26Å; A682-R690 WeakPolarHBondContact O-CG 3.24Å; A682-A695 HydrophobicContact CB-CB 3.88Å; A682-F699 HydrophobicContact CB-CE2 4.28Å; A682-L725 HydrophobicContact CB-CD1 4.45Å; A682-L725 HydrophobicContact CB-CD2 4.03Å
683	K	93.2	Very high	92.9	Very high	117 Å²	117	45.7 Å²	45.7	51%	0.509	26%	0.257	S	S	.	.	H	α-helix	trans	-79.5	-48.2	179.3	-70.6	176	179.9	173.6	0	112	W622 E679 R690	W622-K683 HydrophobicContact CH2-CB 4.06Å; W622-K683 HydrophobicContact CH2-CD 4.13Å; W622-K683 HydrophobicContact CZ3-CB 3.76Å; E679-K683 HydrophobicContact CG-CD 4.2Å; E679-K683 WeakPolarHBondContact O-CG 3.16Å; E679-K683 PolarHBondContact O-N 2.85Å; E679-K683 VanDerWaalsContact O-N 3.1Å; E679-K683 IonicContact OE1-NZ 2.7Å; E679-K683 PolarHBondContact OE1-NZ 3.1Å; K683-R690 WeakPolarHBondContact O-CD 3.39Å
684	G	92.1	Very high	93	Very high	15 Å²	15	48.5 Å²	48.5	16%	0.155	27%	0.269	C	S	.	.			trans	60.3	171.8	-166.4	0	0	0	0	0	113.3	W622 M680	W622-G684 WeakPolarHBondContact CZ3-O 3.28Å; M680-G684 PolarHBondContact O-N 3.02Å
685	G	91.6	Very high	93	Very high	36 Å²	36	47 Å²	47	37%	0.371	26%	0.262	S	S	.	.	B	Isolated β-bridge	trans	110.3	179.1	-172.6	0	0	0	0	0	112	G687 L688	G685-G687 PolarHBondContact O-N 3.35Å; G685-L688 PolarHBondContact N-O 3.08Å; G685-L688 WeakPolarHBondContact O-CA 3.28Å; G685-L688 WeakPolarHBondContact O-CB 3.38Å; G685-L688 PolarHBondContact O-N 3.29Å
686	H	90.8	Very high	92.9	Very high	80 Å²	80	49.6 Å²	49.6	37%	0.37	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	41.4	179	-63.2	-70.4	0	0	0	113.4	P620 W622 L688	P620-H686 HydrophobicContact CB-CB 4.39Å; P620-H686 VanDerWaalsContact O-CB 3.27Å; P620-H686 WeakPolarHBondContact O-CB 3.48Å; P620-H686 PolarHBondContact O-ND1 3.43Å; P620-H686 VanDerWaalsContact O-ND1 3.17Å; W622-H686 HydrophobicContact CB-CB 3.77Å; W622-H686 HydrophobicContact CD2-CB 3.8Å; W622-H686 AromaticContact CD2-CD2 3.64Å; W622-H686 AromaticContact CE2-CD2 3.37Å; W622-H686 HydrophobicContact CE3-CB 4.34Å; W622-H686 HydrophobicContact CG-CB 3.52Å; W622-H686 AromaticContact CH2-CD2 3.91Å; W622-H686 AromaticContact CZ2-CD2 3.52Å; W622-H686 PolarHBondContact N-O 3.32Å; W622-H686 AromaticContact NE1-CD2 3.77Å; H686-L688 VanDerWaalsContact C-N 3.26Å; H686-L688 PolarHBondContact O-N 3.19Å
687	G	88.5	Confident	92.8	Very high	60 Å²	60	53.7 Å²	53.7	62%	0.619	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	-13	-176.3	0	0	0	0	0	115.3	G685	G685-G687 PolarHBondContact O-N 3.35Å
688	L	93	Very high	92.8	Very high	9 Å²	9	54.7 Å²	54.7	5%	0.047	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-91.7	127.6	177.7	-168	69.1	0	0	0	111.3	W622 L623 A626 M680 Y681 G685 H686	W622-L688 HydrophobicContact CB-CB 3.73Å; W622-L688 HydrophobicContact CB-CD2 4.24Å; L623-L688 HydrophobicContact CD1-CD1 4.04Å; A626-L688 HydrophobicContact CB-CD1 4.08Å; A626-L688 HydrophobicContact CB-CD2 4.34Å; M680-L688 HydrophobicContact CB-CD2 3.81Å; M680-L688 HydrophobicContact CE-CD2 4.3Å; Y681-L688 HydrophobicContact CD1-CD1 4.37Å; Y681-L688 HydrophobicContact CD1-CD2 4.05Å; Y681-L688 HydrophobicContact CD1-CG 4.25Å; Y681-L688 HydrophobicContact CE1-CD1 3.67Å; Y681-L688 HydrophobicContact CE1-CD2 4.1Å; Y681-L688 HydrophobicContact CE1-CG 4.04Å; Y681-L688 HydrophobicContact CG-CD2 4.32Å; G685-L688 PolarHBondContact N-O 3.08Å; G685-L688 WeakPolarHBondContact O-CA 3.28Å; G685-L688 WeakPolarHBondContact O-CB 3.38Å; G685-L688 PolarHBondContact O-N 3.29Å; H686-L688 VanDerWaalsContact C-N 3.26Å; H686-L688 PolarHBondContact O-N 3.19Å
689	V	92.1	Very high	92.8	Very high	120 Å²	120	54.9 Å²	54.9	73%	0.727	30%	0.299	S	S	*	.	P	Polyproline II helix	trans	-73.4	132.6	173.9	-179.5	0	0	0	0	109.3	D691	V689-D691 PolarHBondContact O-N 3.4Å
690	R	93.3	Very high	92.7	Very high	133 Å²	133	55.5 Å²	55.5	50%	0.502	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-64	125.1	175.4	-168.1	174.6	66.8	-174.9	2.5	109.9	Y681 A682 K683	Y681-R690 WeakPolarHBondContact O-CA 3.36Å; Y681-R690 WeakPolarHBondContact O-CG 3.28Å; A682-R690 VanDerWaalsContact O-CD 3.24Å; A682-R690 WeakPolarHBondContact O-CD 3.26Å; A682-R690 WeakPolarHBondContact O-CG 3.24Å; K683-R690 WeakPolarHBondContact O-CD 3.39Å
691	D	92.3	Very high	92.5	Very high	66 Å²	66	57.6 Å²	57.6	35%	0.353	32%	0.316	S	S	.	.			trans	-135.3	98	179.3	-173.1	-18.8	0	0	0	109.2	Y681 V689 A693 K694 A695	Y681-D691 HydrophobicContact CD1-CB 3.88Å; Y681-D691 PolarHBondContact O-N 3.07Å; V689-D691 PolarHBondContact O-N 3.4Å; D691-A693 PolarHBondContact OD1-N 2.86Å; D691-K694 HydrophobicContact CB-CB 4.01Å; D691-K694 VanDerWaalsContact CG-CB 3.4Å; D691-K694 PolarHBondContact OD1-N 2.96Å; D691-K694 WeakPolarHBondContact OD2-CB 3.06Å; D691-A695 WeakPolarHBondContact O-CB 3.44Å; D691-A695 PolarHBondContact O-N 2.96Å
692	R	90.9	Very high	92.2	Very high	59 Å²	59	56.3 Å²	56.3	22%	0.223	31%	0.311	C	S	.	.	H	α-helix	trans	-70.7	-33.6	-176.1	-63.2	-167.7	-172.6	107.6	-16	112.6	A695 Y696 L725 E732	R692-A695 PolarHBondContact O-N 3.28Å; R692-Y696 WeakPolarHBondContact O-CB 3.31Å; R692-Y696 PolarHBondContact O-N 3.45Å; R692-L725 HydrophobicContact CB-CD2 4.27Å; R692-L725 HydrophobicContact CG-CD2 4.22Å; R692-E732 IonicContact CZ-OE1 2.78Å; R692-E732 IonicContact CZ-OE2 2.64Å; R692-E732 IonicContact NH1-OE1 3.17Å; R692-E732 PolarHBondContact NH1-OE1 3.18Å; R692-E732 IonicContact NH1-OE2 2.79Å; R692-E732 PolarHBondContact NH1-OE2 3.08Å; R692-E732 IonicContact NH2-OE1 2.64Å; R692-E732 PolarHBondContact NH2-OE1 3.06Å
693	A	90.7	Very high	92	Very high	66 Å²	66	55.2 Å²	55.2	55%	0.545	30%	0.302	S	S	.	.	H	α-helix	trans	-67.4	-47.4	179.4	0	0	0	0	0	110	D691 A695 Y696 E697	D691-A693 PolarHBondContact OD1-N 2.86Å; A693-A695 VanDerWaalsContact C-N 3.33Å; A693-A695 PolarHBondContact O-N 3.21Å; A693-Y696 WeakPolarHBondContact O-CB 3.48Å; A693-Y696 PolarHBondContact O-N 3.48Å; A693-E697 PolarHBondContact O-N 3.31Å; A693-E697 VanDerWaalsContact O-N 3.16Å
694	K	92.2	Very high	91.7	Very high	59 Å²	59	55.5 Å²	55.5	26%	0.257	31%	0.305	S	S	.	.	H	α-helix	trans	-63.6	-38.5	175	-171.8	173	-179.4	-178.3	0	112.4	E630 Y681 D691 Y696 E697 L698	E630-K694 IonicContact OE1-NZ 2.7Å; E630-K694 PolarHBondContact OE1-NZ 3.19Å; Y681-K694 HydrophobicContact CD1-CD 4.18Å; Y681-K694 HydrophobicContact CD2-CD 4.05Å; Y681-K694 HydrophobicContact CD2-CG 4.28Å; Y681-K694 HydrophobicContact CE1-CD 3.91Å; Y681-K694 HydrophobicContact CE2-CD 3.77Å; Y681-K694 VanDerWaalsContact CE2-CE 3.47Å; Y681-K694 HydrophobicContact CE2-CG 4.45Å; Y681-K694 HydrophobicContact CG-CD 4.25Å; Y681-K694 HydrophobicContact CG-CG 4.43Å; Y681-K694 PolarHBondContact OH-NZ 3.07Å; D691-K694 HydrophobicContact CB-CB 4.01Å; D691-K694 VanDerWaalsContact CG-CB 3.4Å; D691-K694 PolarHBondContact OD1-N 2.96Å; D691-K694 WeakPolarHBondContact OD2-CB 3.06Å; K694-Y696 VanDerWaalsContact C-N 3.35Å; K694-E697 PolarHBondContact O-N 3.15Å; K694-L698 HydrophobicContact CG-CD1 4.03Å; K694-L698 WeakPolarHBondContact O-CB 3.35Å; K694-L698 WeakPolarHBondContact O-CD1 3.33Å; K694-L698 VanDerWaalsContact O-CG 3.27Å; K694-L698 WeakPolarHBondContact O-CG 3.32Å; K694-L698 PolarHBondContact O-N 3.31Å
695	A	93.5	Very high	91.3	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-62.5	-41.2	176.2	0	0	0	0	0	112.4	G678 A682 D691 R692 A693 L698 F699 L725	G678-A695 WeakPolarHBondContact O-CB 3.09Å; A682-A695 HydrophobicContact CB-CB 3.88Å; D691-A695 WeakPolarHBondContact O-CB 3.44Å; D691-A695 PolarHBondContact O-N 2.96Å; R692-A695 PolarHBondContact O-N 3.28Å; A693-A695 VanDerWaalsContact C-N 3.33Å; A693-A695 PolarHBondContact O-N 3.21Å; A695-L698 PolarHBondContact O-N 2.95Å; A695-F699 WeakPolarHBondContact O-CD2 3.25Å; A695-F699 PolarHBondContact O-N 3.12Å; A695-L725 HydrophobicContact CB-CD1 3.64Å
696	Y	93	Very high	90.9	Very high	58 Å²	58	54 Å²	54	23%	0.227	29%	0.29	C	S	.	.	H	α-helix	trans	-59.9	-52.1	176	174.9	-90	0	0	0	111.5	R692 A693 K694 L698 F699 E700 A722 E726	R692-Y696 WeakPolarHBondContact O-CB 3.31Å; R692-Y696 PolarHBondContact O-N 3.45Å; A693-Y696 WeakPolarHBondContact O-CB 3.48Å; A693-Y696 PolarHBondContact O-N 3.48Å; K694-Y696 VanDerWaalsContact C-N 3.35Å; Y696-L698 VanDerWaalsContact C-N 3.26Å; Y696-L698 PolarHBondContact O-N 2.98Å; Y696-F699 PolarHBondContact O-N 3.11Å; Y696-F699 VanDerWaalsContact O-N 3.09Å; Y696-E700 HydrophobicContact CD1-CG 4.36Å; Y696-E700 VanDerWaalsContact CE1-CD 3.43Å; Y696-E700 HydrophobicContact CE1-CG 3.92Å; Y696-E700 WeakPolarHBondContact CE1-OE2 3.34Å; Y696-E700 HydrophobicContact CE2-CG 4.41Å; Y696-E700 PolarHBondContact O-N 3.16Å; Y696-E700 PolarHBondContact OH-OE1 3.33Å; Y696-A722 HydrophobicContact CD2-CB 3.93Å; Y696-A722 WeakPolarHBondContact CD2-O 3.2Å; Y696-A722 HydrophobicContact CE2-CB 4.05Å; Y696-E726 HydrophobicContact CD2-CG 3.95Å; Y696-E726 HydrophobicContact CE2-CG 3.46Å; Y696-E726 VanDerWaalsContact CE2-CG 3.46Å; Y696-E726 WeakPolarHBondContact CE2-OE1 3.33Å; Y696-E726 PolarHBondContact OH-OE1 3.43Å
697	E	92.1	Very high	90.5	Very high	133 Å²	133	54.6 Å²	54.6	62%	0.621	30%	0.295	S	S	*	.	H	α-helix	trans	-57.8	-39.3	178.4	-68.5	179.3	179.5	0	0	112.1	A693 K694 S701	A693-E697 PolarHBondContact O-N 3.31Å; A693-E697 VanDerWaalsContact O-N 3.16Å; K694-E697 PolarHBondContact O-N 3.15Å; E697-S701 WeakPolarHBondContact O-CB 3.27Å; E697-S701 PolarHBondContact O-N 3.28Å
698	L	94	Very high	90.1	Very high	24 Å²	24	59.5 Å²	59.5	13%	0.126	30%	0.301	C	S	.	.	H	α-helix	trans	-67.4	-39	177.4	-76.2	165.5	0	0	0	112.6	Q674 L677 Y681 K694 A695 Y696 A702	Q674-L698 HydrophobicContact CB-CD2 4.38Å; Q674-L698 HydrophobicContact CG-CD2 4.43Å; L677-L698 HydrophobicContact CB-CD1 3.73Å; L677-L698 HydrophobicContact CB-CD2 4.17Å; L677-L698 HydrophobicContact CD1-CD2 4.39Å; Y681-L698 HydrophobicContact CD2-CD1 3.65Å; Y681-L698 HydrophobicContact CE2-CD1 4.24Å; K694-L698 HydrophobicContact CG-CD1 4.03Å; K694-L698 WeakPolarHBondContact O-CB 3.35Å; K694-L698 WeakPolarHBondContact O-CD1 3.33Å; K694-L698 VanDerWaalsContact O-CG 3.27Å; K694-L698 WeakPolarHBondContact O-CG 3.32Å; K694-L698 PolarHBondContact O-N 3.31Å; A695-L698 PolarHBondContact O-N 2.95Å; Y696-L698 VanDerWaalsContact C-N 3.26Å; Y696-L698 PolarHBondContact O-N 2.98Å; L698-A702 WeakPolarHBondContact O-CB 3.11Å; L698-A702 PolarHBondContact O-N 3.43Å
699	F	96.3	Very high	89.4	Confident	5 Å²	5	61.3 Å²	61.3	2%	0.022	32%	0.318	C	S	.	.	H	α-helix	trans	-71.3	-40.6	177.2	-77.6	-53.9	0	0	0	112.5	G675 E679 A682 A695 Y696 A702 A703 Y718 Q721 A722 L725	G675-F699 WeakPolarHBondContact O-CE1 3.21Å; E679-F699 HydrophobicContact CB-CZ 4.34Å; E679-F699 VanDerWaalsContact N-CZ 3.29Å; A682-F699 HydrophobicContact CB-CE2 4.28Å; A695-F699 WeakPolarHBondContact O-CD2 3.25Å; A695-F699 PolarHBondContact O-N 3.12Å; Y696-F699 PolarHBondContact O-N 3.11Å; Y696-F699 VanDerWaalsContact O-N 3.09Å; F699-A702 PolarHBondContact O-N 3.03Å; F699-A703 WeakPolarHBondContact O-CB 3.4Å; F699-A703 PolarHBondContact O-N 2.85Å; F699-Y718 AromaticContact CD1-CD1 3.66Å; F699-Y718 HydrophobicContact CD1-CD1 3.66Å; F699-Y718 HydrophobicContact CD1-CE1 4.41Å; F699-Y718 HydrophobicContact CD1-CG 4.3Å; F699-Y718 AromaticContact CE1-CD1 3.95Å; F699-Y718 HydrophobicContact CE1-CD1 3.95Å; F699-Y718 HydrophobicContact CE1-CE1 4.39Å; F699-Q721 HydrophobicContact CD1-CB 3.95Å; F699-Q721 HydrophobicContact CD2-CB 3.83Å; F699-Q721 HydrophobicContact CE1-CB 3.87Å; F699-Q721 HydrophobicContact CE1-CG 4.11Å; F699-Q721 HydrophobicContact CE2-CB 3.74Å; F699-Q721 HydrophobicContact CG-CB 3.94Å; F699-Q721 HydrophobicContact CZ-CB 3.75Å; F699-Q721 HydrophobicContact CZ-CG 4.08Å; F699-A722 HydrophobicContact CB-CB 3.97Å; F699-L725 HydrophobicContact CD2-CD1 3.72Å; F699-L725 HydrophobicContact CE2-CD1 3.97Å
700	E	91.8	Very high	89	Confident	74 Å²	74	63.9 Å²	63.9	35%	0.346	32%	0.322	S	S	.	.	H	α-helix	trans	-60.3	-49.7	173.1	-73.3	-156.2	131.3	0	0	111.1	Y696 A702 A703 E704 A722	Y696-E700 HydrophobicContact CD1-CG 4.36Å; Y696-E700 VanDerWaalsContact CE1-CD 3.43Å; Y696-E700 HydrophobicContact CE1-CG 3.92Å; Y696-E700 WeakPolarHBondContact CE1-OE2 3.34Å; Y696-E700 HydrophobicContact CE2-CG 4.41Å; Y696-E700 PolarHBondContact O-N 3.16Å; Y696-E700 PolarHBondContact OH-OE1 3.33Å; E700-A702 VanDerWaalsContact C-N 3.31Å; E700-A702 PolarHBondContact O-N 3.31Å; E700-A703 WeakPolarHBondContact O-CB 3.28Å; E700-A703 PolarHBondContact O-N 3.2Å; E700-E704 PolarHBondContact O-N 2.9Å; E700-A722 HydrophobicContact CG-CB 4.36Å
701	S	91	Very high	88.5	Confident	45 Å²	45	61.4 Å²	61.4	32%	0.315	32%	0.316	S	S	.	.	H	α-helix	trans	-62.1	-38.5	178.6	-171.4	0	0	0	0	112.4	Q674 E697 G705	Q674-S701 PolarHBondContact NE2-OG 3.29Å; E697-S701 WeakPolarHBondContact O-CB 3.27Å; E697-S701 PolarHBondContact O-N 3.28Å; S701-G705 PolarHBondContact O-N 3.45Å
702	A	91.1	Very high	87.7	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-65.3	-37.4	174	0	0	0	0	0	112.3	Y671 Q674 L698 F699 E700 A706 Y718	Y671-A702 WeakPolarHBondContact CB-O 3.5Å; Y671-A702 WeakPolarHBondContact O-CB 3.17Å; Q674-A702 HydrophobicContact CB-CB 3.89Å; L698-A702 WeakPolarHBondContact O-CB 3.11Å; L698-A702 PolarHBondContact O-N 3.43Å; F699-A702 PolarHBondContact O-N 3.03Å; E700-A702 VanDerWaalsContact C-N 3.31Å; E700-A702 PolarHBondContact O-N 3.31Å; A702-A706 VanDerWaalsContact O-CB 3.28Å; A702-A706 WeakPolarHBondContact O-CB 3.26Å; A702-A706 PolarHBondContact O-N 3.46Å; A702-Y718 HydrophobicContact CB-CD1 4.46Å; A702-Y718 HydrophobicContact CB-CD2 3.55Å; A702-Y718 HydrophobicContact CB-CE2 3.7Å; A702-Y718 HydrophobicContact CB-CG 3.97Å
703	A	89.1	Confident	87.7	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-67.7	-44.4	178.3	0	0	0	0	0	111.9	F699 E700 A706 I707 A715 Y719	F699-A703 WeakPolarHBondContact O-CB 3.4Å; F699-A703 PolarHBondContact O-N 2.85Å; E700-A703 WeakPolarHBondContact O-CB 3.28Å; E700-A703 PolarHBondContact O-N 3.2Å; A703-A706 PolarHBondContact O-N 3.42Å; A703-I707 WeakPolarHBondContact O-CG1 3.33Å; A703-I707 PolarHBondContact O-N 3.1Å; A703-A715 WeakPolarHBondContact O-CB 3.43Å; A703-Y719 HydrophobicContact CB-CD1 3.92Å; A703-Y719 HydrophobicContact CB-CD2 3.7Å; A703-Y719 HydrophobicContact CB-CE1 3.75Å; A703-Y719 HydrophobicContact CB-CE2 3.52Å; A703-Y719 HydrophobicContact CB-CG 3.89Å
704	E	85.3	Confident	87.5	Confident	123 Å²	123	65.1 Å²	65.1	58%	0.575	33%	0.328	S	S	*	.	H	α-helix	trans	-59.5	-49.5	174.1	-69.6	-177.3	161.7	0	0	111.5	E700 A706 I707 E708	E700-E704 PolarHBondContact O-N 2.9Å; E704-A706 VanDerWaalsContact C-N 3.28Å; E704-A706 PolarHBondContact O-N 2.72Å; E704-I707 PolarHBondContact O-N 3.17Å; E704-I707 VanDerWaalsContact O-N 3.14Å; E704-E708 PolarHBondContact O-N 2.92Å
705	G	84.1	Confident	87.4	Confident	21 Å²	21	62.4 Å²	62.4	22%	0.216	32%	0.317	C	S	.	.	H	α-helix	trans	-62.4	-33.7	177.5	0	0	0	0	0	113.2	S701 A709	S701-G705 PolarHBondContact O-N 3.45Å; G705-A709 WeakPolarHBondContact O-CB 3.49Å; G705-A709 PolarHBondContact O-N 3.29Å
706	A	84.5	Confident	87.3	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-71.1	-36	174.4	0	0	0	0	0	112.6	Y671 A702 A703 E704 A709 H710 E711 I714 A715	Y671-A706 HydrophobicContact CD2-CB 3.9Å; Y671-A706 HydrophobicContact CE2-CB 4.31Å; Y671-A706 HydrophobicContact CG-CB 4.13Å; A702-A706 VanDerWaalsContact O-CB 3.28Å; A702-A706 WeakPolarHBondContact O-CB 3.26Å; A702-A706 PolarHBondContact O-N 3.46Å; A703-A706 PolarHBondContact O-N 3.42Å; E704-A706 VanDerWaalsContact C-N 3.28Å; E704-A706 PolarHBondContact O-N 2.72Å; A706-A709 CarbonylContact O-C 3.46Å; A706-A709 PolarHBondContact O-N 3.42Å; A706-H710 PolarHBondContact O-N 3.17Å; A706-E711 HydrophobicContact CB-CB 4.37Å; A706-E711 WeakPolarHBondContact O-CA 3.43Å; A706-E711 PolarHBondContact O-N 2.87Å; A706-I714 HydrophobicContact CB-CG2 4.34Å; A706-A715 HydrophobicContact CB-CB 3.85Å
707	I	81.5	Confident	87.4	Confident	92 Å²	92	70.3 Å²	70.3	47%	0.472	36%	0.357	S	S	.	.	H	α-helix	trans	-63.3	-45.8	172.7	-72.7	171.1	0	0	0	110.6	A703 E704 A709 H710 A715 Y719	A703-I707 WeakPolarHBondContact O-CG1 3.33Å; A703-I707 PolarHBondContact O-N 3.1Å; E704-I707 PolarHBondContact O-N 3.17Å; E704-I707 VanDerWaalsContact O-N 3.14Å; I707-A709 PolarHBondContact O-N 3.3Å; I707-H710 WeakPolarHBondContact O-CA 3.12Å; I707-H710 PolarHBondContact O-N 3.31Å; I707-A715 HydrophobicContact CD1-CB 4.37Å; I707-A715 HydrophobicContact CG1-CB 3.64Å; I707-Y719 HydrophobicContact CD1-CE2 3.83Å
708	E	79.3	Confident	87.6	Confident	162 Å²	162	65.5 Å²	65.5	76%	0.757	33%	0.333	S	S	*	.	H	α-helix	trans	-60.3	-38.2	177.8	-172.7	171.8	-162.4	0	0	111.3	E704 H710	E704-E708 PolarHBondContact O-N 2.92Å; E708-H710 PolarHBondContact O-N 2.98Å
709	A	79.7	Confident	87.7	Confident	48 Å²	48	69 Å²	69	40%	0.397	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	2.8	173.4	0	0	0	0	0	114.7	Y671 G705 A706 I707 E711	Y671-A709 HydrophobicContact CD1-CB 4.09Å; Y671-A709 HydrophobicContact CE1-CB 3.58Å; G705-A709 WeakPolarHBondContact O-CB 3.49Å; G705-A709 PolarHBondContact O-N 3.29Å; A706-A709 CarbonylContact O-C 3.46Å; A706-A709 PolarHBondContact O-N 3.42Å; I707-A709 PolarHBondContact O-N 3.3Å; A709-E711 VanDerWaalsContact C-N 3.29Å; A709-E711 PolarHBondContact O-N 3.46Å
710	H	82.3	Confident	87.6	Confident	174 Å²	174	74.5 Å²	74.5	81%	0.806	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	26.2	-175.7	-54	-52.4	0	0	0	115.3	A706 I707 E708 G712	A706-H710 PolarHBondContact O-N 3.17Å; I707-H710 WeakPolarHBondContact O-CA 3.12Å; I707-H710 PolarHBondContact O-N 3.31Å; E708-H710 PolarHBondContact O-N 2.98Å; H710-G712 PolarHBondContact O-N 3.4Å
711	E	83.5	Confident	87.7	Confident	81 Å²	81	74.9 Å²	74.9	38%	0.379	37%	0.373	S	S	.	.			trans	-99.6	59.4	178.2	-71.6	-75	-167.6	0	0	111.7	A706 A709 R713 I714 A715	A706-E711 HydrophobicContact CB-CB 4.37Å; A706-E711 WeakPolarHBondContact O-CA 3.43Å; A706-E711 PolarHBondContact O-N 2.87Å; A709-E711 VanDerWaalsContact C-N 3.29Å; A709-E711 PolarHBondContact O-N 3.46Å; E711-R713 PolarHBondContact O-N 3.33Å; E711-R713 VanDerWaalsContact O-N 3.1Å; E711-I714 HydrophobicContact CB-CB 4.34Å; E711-I714 HydrophobicContact CB-CD1 4.31Å; E711-I714 PolarHBondContact O-N 3.36Å; E711-I714 VanDerWaalsContact O-N 3.09Å; E711-A715 PolarHBondContact O-N 3.04Å
712	G	76.8	Confident	87.8	Confident	49 Å²	49	72.9 Å²	72.9	51%	0.505	36%	0.36	S	S	.	.	H	α-helix	trans	-59.4	-26.1	-171.2	0	0	0	0	0	115.8	H710 M716	H710-G712 PolarHBondContact O-N 3.4Å; G712-M716 PolarHBondContact O-N 3.3Å; G712-M716 VanDerWaalsContact O-N 3.17Å
713	R	89.5	Confident	87.7	Confident	192 Å²	192	74.6 Å²	74.6	73%	0.725	38%	0.377	S	S	*	.	H	α-helix	trans	-70.7	-45.3	175.5	-171.8	-175.1	-62.6	164.1	2.3	111.5	E711 A715 M716 E717	E711-R713 PolarHBondContact O-N 3.33Å; E711-R713 VanDerWaalsContact O-N 3.1Å; R713-A715 VanDerWaalsContact C-N 3.32Å; R713-M716 PolarHBondContact O-N 2.95Å; R713-E717 PolarHBondContact O-N 3.34Å; R713-E717 VanDerWaalsContact O-N 3.16Å
714	I	87	Confident	87.9	Confident	27 Å²	27	77.8 Å²	77.8	14%	0.138	39%	0.394	C	S	.	.	H	α-helix	trans	-66.4	-39.6	178.1	-63.6	176.4	0	0	0	109.7	Y671 A706 E711 M716 E717 Y718	Y671-I714 HydrophobicContact CD2-CG2 4.41Å; Y671-I714 HydrophobicContact CE2-CD1 4.39Å; Y671-I714 HydrophobicContact CE2-CG2 4.27Å; A706-I714 HydrophobicContact CB-CG2 4.34Å; E711-I714 HydrophobicContact CB-CB 4.34Å; E711-I714 HydrophobicContact CB-CD1 4.31Å; E711-I714 PolarHBondContact O-N 3.36Å; E711-I714 VanDerWaalsContact O-N 3.09Å; I714-M716 VanDerWaalsContact C-N 3.3Å; I714-M716 PolarHBondContact O-N 3.31Å; I714-E717 WeakPolarHBondContact O-CB 3.36Å; I714-E717 PolarHBondContact O-N 2.9Å; I714-Y718 HydrophobicContact CG2-CD2 3.9Å; I714-Y718 HydrophobicContact CG2-CE2 3.32Å; I714-Y718 WeakPolarHBondContact O-CD2 3.45Å; I714-Y718 PolarHBondContact O-N 2.85Å
715	A	89.1	Confident	88.1	Confident	3 Å²	3	72.8 Å²	72.8	3%	0.025	37%	0.371	C	S	.	.	H	α-helix	trans	-57.7	-43.3	174.6	0	0	0	0	0	112.4	A703 A706 I707 E711 R713 E717 Y718 Y719	A703-A715 WeakPolarHBondContact O-CB 3.43Å; A706-A715 HydrophobicContact CB-CB 3.85Å; I707-A715 HydrophobicContact CD1-CB 4.37Å; I707-A715 HydrophobicContact CG1-CB 3.64Å; E711-A715 PolarHBondContact O-N 3.04Å; R713-A715 VanDerWaalsContact C-N 3.32Å; A715-E717 PolarHBondContact O-N 3.2Å; A715-Y718 PolarHBondContact O-N 3.47Å; A715-Y719 WeakPolarHBondContact O-CD2 3.41Å; A715-Y719 PolarHBondContact O-N 3.49Å
716	M	93.3	Very high	88	Confident	125 Å²	125	76.8 Å²	76.8	62%	0.616	38%	0.384	S	S	*	.	H	α-helix	trans	-63.9	-39.3	177.3	-169.1	176.1	71.2	0	0	112.2	G712 R713 I714 Y718 Y719 E720	G712-M716 PolarHBondContact O-N 3.3Å; G712-M716 VanDerWaalsContact O-N 3.17Å; R713-M716 PolarHBondContact O-N 2.95Å; I714-M716 VanDerWaalsContact C-N 3.3Å; I714-M716 PolarHBondContact O-N 3.31Å; M716-Y718 VanDerWaalsContact C-N 3.34Å; M716-Y718 PolarHBondContact O-N 2.93Å; M716-Y719 PolarHBondContact O-N 3.22Å; M716-E720 WeakPolarHBondContact O-CB 3.41Å; M716-E720 PolarHBondContact O-N 2.96Å
717	E	93.8	Very high	87.8	Confident	98 Å²	98	82.5 Å²	82.5	46%	0.458	41%	0.411	S	S	.	.	H	α-helix	trans	-61.5	-40.9	174.9	-69.9	169.3	-170.9	0	0	111.6	R713 I714 A715 E720 Q721	R713-E717 PolarHBondContact O-N 3.34Å; R713-E717 VanDerWaalsContact O-N 3.16Å; I714-E717 WeakPolarHBondContact O-CB 3.36Å; I714-E717 PolarHBondContact O-N 2.9Å; A715-E717 PolarHBondContact O-N 3.2Å; E717-E720 PolarHBondContact O-N 2.82Å; E717-Q721 WeakPolarHBondContact O-CG 3.18Å; E717-Q721 PolarHBondContact O-N 2.7Å; E717-Q721 VanDerWaalsContact O-N 3.08Å
718	Y	96	Very high	87.5	Confident	32 Å²	32	84.3 Å²	84.3	13%	0.125	41%	0.413	C	S	.	.	H	α-helix	trans	-69.6	-40.9	176.8	-66.1	-38.4	0	0	0	113.3	Y671 F699 A702 I714 A715 M716 E720 Q721 A722	Y671-Y718 HydrophobicContact CD2-CE2 4.23Å; F699-Y718 AromaticContact CD1-CD1 3.66Å; F699-Y718 HydrophobicContact CD1-CD1 3.66Å; F699-Y718 HydrophobicContact CD1-CE1 4.41Å; F699-Y718 HydrophobicContact CD1-CG 4.3Å; F699-Y718 AromaticContact CE1-CD1 3.95Å; F699-Y718 HydrophobicContact CE1-CD1 3.95Å; F699-Y718 HydrophobicContact CE1-CE1 4.39Å; A702-Y718 HydrophobicContact CB-CD1 4.46Å; A702-Y718 HydrophobicContact CB-CD2 3.55Å; A702-Y718 HydrophobicContact CB-CE2 3.7Å; A702-Y718 HydrophobicContact CB-CG 3.97Å; I714-Y718 HydrophobicContact CG2-CD2 3.9Å; I714-Y718 HydrophobicContact CG2-CE2 3.32Å; I714-Y718 WeakPolarHBondContact O-CD2 3.45Å; I714-Y718 PolarHBondContact O-N 2.85Å; A715-Y718 PolarHBondContact O-N 3.47Å; M716-Y718 VanDerWaalsContact C-N 3.34Å; M716-Y718 PolarHBondContact O-N 2.93Å; Y718-E720 VanDerWaalsContact C-N 3.28Å; Y718-E720 PolarHBondContact O-N 3.2Å; Y718-Q721 PolarHBondContact O-N 2.9Å; Y718-A722 PolarHBondContact O-N 3.46Å
719	Y	96.6	Very high	87	Confident	97 Å²	97	79.2 Å²	79.2	38%	0.38	40%	0.398	S	S	.	.	H	α-helix	trans	-61.9	-36.7	172.9	-77.5	-57.7	0	0	0	112.5	A703 I707 A715 M716 A722 G723	A703-Y719 HydrophobicContact CB-CD1 3.92Å; A703-Y719 HydrophobicContact CB-CD2 3.7Å; A703-Y719 HydrophobicContact CB-CE1 3.75Å; A703-Y719 HydrophobicContact CB-CE2 3.52Å; A703-Y719 HydrophobicContact CB-CG 3.89Å; I707-Y719 HydrophobicContact CD1-CE2 3.83Å; A715-Y719 WeakPolarHBondContact O-CD2 3.41Å; A715-Y719 PolarHBondContact O-N 3.49Å; M716-Y719 PolarHBondContact O-N 3.22Å; Y719-A722 PolarHBondContact O-N 2.75Å; Y719-G723 PolarHBondContact O-N 3.32Å
720	E	95.1	Very high	86.1	Confident	121 Å²	121	79.8 Å²	79.8	57%	0.565	40%	0.403	S	S	*	.	H	α-helix	trans	-63.4	-43.8	174.3	-173.6	177.2	-173.4	0	0	111.2	M716 E717 Y718 A722 G723 L724	M716-E720 WeakPolarHBondContact O-CB 3.41Å; M716-E720 PolarHBondContact O-N 2.96Å; E717-E720 PolarHBondContact O-N 2.82Å; Y718-E720 VanDerWaalsContact C-N 3.28Å; Y718-E720 PolarHBondContact O-N 3.2Å; E720-A722 PolarHBondContact O-N 3.33Å; E720-G723 PolarHBondContact O-N 2.86Å; E720-L724 WeakPolarHBondContact O-CG 3.17Å; E720-L724 PolarHBondContact O-N 3.43Å
721	Q	93.7	Very high	85.1	Confident	83 Å²	83	76 Å²	76	39%	0.388	39%	0.388	S	S	.	.	H	α-helix	trans	-63.3	-39.4	174.8	-66	-57.9	-54.1	0	0	112.7	F699 E717 Y718 L724 L725	F699-Q721 HydrophobicContact CD1-CB 3.95Å; F699-Q721 HydrophobicContact CD2-CB 3.83Å; F699-Q721 HydrophobicContact CE1-CB 3.87Å; F699-Q721 HydrophobicContact CE1-CG 4.11Å; F699-Q721 HydrophobicContact CE2-CB 3.74Å; F699-Q721 HydrophobicContact CG-CB 3.94Å; F699-Q721 HydrophobicContact CZ-CB 3.75Å; F699-Q721 HydrophobicContact CZ-CG 4.08Å; E717-Q721 WeakPolarHBondContact O-CG 3.18Å; E717-Q721 PolarHBondContact O-N 2.7Å; E717-Q721 VanDerWaalsContact O-N 3.08Å; Y718-Q721 PolarHBondContact O-N 2.9Å; Q721-L724 PolarHBondContact O-N 3.27Å; Q721-L725 WeakPolarHBondContact O-CG 3.36Å; Q721-L725 PolarHBondContact O-N 3.14Å
722	A	91.5	Very high	83.8	Confident	3 Å²	3	77 Å²	77	3%	0.025	39%	0.392	C	S	.	.	H	α-helix	trans	-62.8	-45.2	174.6	0	0	0	0	0	111.6	Y696 F699 E700 Y718 Y719 E720 L724 L725 E726	Y696-A722 HydrophobicContact CD2-CB 3.93Å; Y696-A722 WeakPolarHBondContact CD2-O 3.2Å; Y696-A722 HydrophobicContact CE2-CB 4.05Å; F699-A722 HydrophobicContact CB-CB 3.97Å; E700-A722 HydrophobicContact CG-CB 4.36Å; Y718-A722 PolarHBondContact O-N 3.46Å; Y719-A722 PolarHBondContact O-N 2.75Å; E720-A722 PolarHBondContact O-N 3.33Å; A722-L724 PolarHBondContact O-N 3.28Å; A722-L725 VanDerWaalsContact O-N 3.12Å; A722-L725 PolarHBondContact O-N 3.23Å; A722-L725 WeakPolarHBondContact O-CB 3.35Å; A722-E726 PolarHBondContact O-N 3.44Å
723	G	90.9	Very high	82.6	Confident	36 Å²	36	82.4 Å²	82.4	37%	0.371	40%	0.402	S	S	.	.	H	α-helix	trans	-62.5	-38.6	177.7	0	0	0	0	0	113.5	Y719 E720 L725 E726 E727	Y719-G723 PolarHBondContact O-N 3.32Å; E720-G723 PolarHBondContact O-N 2.86Å; G723-L725 VanDerWaalsContact C-N 3.29Å; G723-L725 PolarHBondContact O-N 3.14Å; G723-E726 PolarHBondContact O-N 3.39Å; G723-E727 PolarHBondContact O-N 3.2Å
724	L	91.7	Very high	80.5	Confident	67 Å²	67	79.1 Å²	79.1	35%	0.351	40%	0.399	S	S	.	.	H	α-helix	trans	-61.2	-38.2	173.9	-70.2	173.9	0	0	0	111.7	E720 Q721 A722 E727 Y728	E720-L724 WeakPolarHBondContact O-CG 3.17Å; E720-L724 PolarHBondContact O-N 3.43Å; Q721-L724 PolarHBondContact O-N 3.27Å; A722-L724 PolarHBondContact O-N 3.28Å; L724-E727 PolarHBondContact O-N 3.33Å; L724-Y728 WeakPolarHBondContact O-CD2 3.49Å; L724-Y728 PolarHBondContact O-N 3.25Å
725	L	89.4	Confident	78.5	Confident	18 Å²	18	80.6 Å²	80.6	9%	0.094	42%	0.421	C	S	.	.	H	α-helix	trans	-67.8	-34.6	178.6	-69.8	169.7	0	0	0	112.9	A682 R692 A695 F699 Q721 A722 G723 A729	A682-L725 HydrophobicContact CB-CD1 4.45Å; A682-L725 HydrophobicContact CB-CD2 4.03Å; R692-L725 HydrophobicContact CB-CD2 4.27Å; R692-L725 HydrophobicContact CG-CD2 4.22Å; A695-L725 HydrophobicContact CB-CD1 3.64Å; F699-L725 HydrophobicContact CD2-CD1 3.72Å; F699-L725 HydrophobicContact CE2-CD1 3.97Å; Q721-L725 WeakPolarHBondContact O-CG 3.36Å; Q721-L725 PolarHBondContact O-N 3.14Å; A722-L725 VanDerWaalsContact O-N 3.12Å; A722-L725 PolarHBondContact O-N 3.23Å; A722-L725 WeakPolarHBondContact O-CB 3.35Å; G723-L725 VanDerWaalsContact C-N 3.29Å; G723-L725 PolarHBondContact O-N 3.14Å; L725-A729 PolarHBondContact O-N 3.36Å
726	E	82.8	Confident	76.3	Confident	104 Å²	104	89 Å²	89	49%	0.486	46%	0.46	S	S	.	.	H	α-helix	trans	-64.7	-44.3	172.6	-72.9	-175.5	170.5	0	0	112.1	Y696 A722 G723 Y728 A729 A730	Y696-E726 HydrophobicContact CD2-CG 3.95Å; Y696-E726 HydrophobicContact CE2-CG 3.46Å; Y696-E726 VanDerWaalsContact CE2-CG 3.46Å; Y696-E726 WeakPolarHBondContact CE2-OE1 3.33Å; Y696-E726 PolarHBondContact OH-OE1 3.43Å; A722-E726 PolarHBondContact O-N 3.44Å; G723-E726 PolarHBondContact O-N 3.39Å; E726-Y728 VanDerWaalsContact C-N 3.3Å; E726-Y728 PolarHBondContact O-N 2.78Å; E726-A729 VanDerWaalsContact O-N 3.09Å; E726-A729 PolarHBondContact O-N 3.07Å; E726-A729 WeakPolarHBondContact O-CB 3.06Å; E726-A730 PolarHBondContact O-N 3.01Å; E726-A730 VanDerWaalsContact O-N 3.09Å
727	E	80.2	Confident	73.8	Confident	121 Å²	121	88 Å²	88	57%	0.565	46%	0.456	S	S	*	.	H	α-helix	trans	-60.4	-41.4	179.2	-171.5	178.1	-177.2	0	0	111.2	G723 L724 A729 A730 I731	G723-E727 PolarHBondContact O-N 3.2Å; L724-E727 PolarHBondContact O-N 3.33Å; E727-A729 VanDerWaalsContact C-N 3.35Å; E727-A729 PolarHBondContact O-N 3.31Å; E727-A730 PolarHBondContact O-N 3.19Å; E727-I731 HydrophobicContact CG-CD1 4.32Å; E727-I731 WeakPolarHBondContact O-CG1 3.3Å; E727-I731 PolarHBondContact O-N 3.02Å
728	Y	74.9	Confident	71.2	Confident	130 Å²	130	86.3 Å²	86.3	51%	0.51	47%	0.465	S	S	.	.	H	α-helix	trans	-64.6	-35.4	174.5	-77.8	-65.2	0	0	0	113.4	L724 E726 A730 I731 E732	L724-Y728 WeakPolarHBondContact O-CD2 3.49Å; L724-Y728 PolarHBondContact O-N 3.25Å; E726-Y728 VanDerWaalsContact C-N 3.3Å; E726-Y728 PolarHBondContact O-N 2.78Å; Y728-A730 VanDerWaalsContact C-N 3.32Å; Y728-I731 PolarHBondContact O-N 3.35Å; Y728-E732 PolarHBondContact O-N 2.96Å
729	A	69	Low	68.5	Low	55 Å²	55	93.4 Å²	93.4	46%	0.455	50%	0.499	S	S	.	.	H	α-helix	trans	-67	-34	176.5	0	0	0	0	0	111.9	L725 E726 E727	L725-A729 PolarHBondContact O-N 3.36Å; E726-A729 VanDerWaalsContact O-N 3.09Å; E726-A729 PolarHBondContact O-N 3.07Å; E726-A729 WeakPolarHBondContact O-CB 3.06Å; E727-A729 VanDerWaalsContact C-N 3.35Å; E727-A729 PolarHBondContact O-N 3.31Å
730	A	60.7	Low	65.8	Low	59 Å²	59	96.4 Å²	96.4	49%	0.488	51%	0.514	S	S	.	.	H	α-helix	trans	-68.4	-39.6	174.6	0	0	0	0	0	112.5	E726 E727 Y728 F733 D734	E726-A730 PolarHBondContact O-N 3.01Å; E726-A730 VanDerWaalsContact O-N 3.09Å; E727-A730 PolarHBondContact O-N 3.19Å; Y728-A730 VanDerWaalsContact C-N 3.32Å; A730-F733 PolarHBondContact O-N 3.12Å; A730-D734 PolarHBondContact O-N 3.27Å
731	I	61.5	Low	63.3	Low	96 Å²	96	95 Å²	95	49%	0.492	51%	0.514	S	S	.	.	H	α-helix	trans	-68.1	-36.2	-179.4	-64.7	165.6	0	0	0	112.2	E727 Y728 F733 D734 G735	E727-I731 HydrophobicContact CG-CD1 4.32Å; E727-I731 WeakPolarHBondContact O-CG1 3.3Å; E727-I731 PolarHBondContact O-N 3.02Å; Y728-I731 PolarHBondContact O-N 3.35Å; I731-F733 VanDerWaalsContact C-N 3.27Å; I731-F733 PolarHBondContact O-N 3.37Å; I731-D734 PolarHBondContact O-N 2.88Å; I731-G735 PolarHBondContact O-N 3.5Å
732	E	56.1	Low	61.1	Low	102 Å²	102	99.4 Å²	99.4	48%	0.477	53%	0.534	S	S	.	.	H	α-helix	trans	-66	-30.6	176.3	-81.8	-179.1	179.6	0	0	112.3	R692 Y728 G735	R692-E732 IonicContact CZ-OE1 2.78Å; R692-E732 IonicContact CZ-OE2 2.64Å; R692-E732 IonicContact NH1-OE1 3.17Å; R692-E732 PolarHBondContact NH1-OE1 3.18Å; R692-E732 IonicContact NH1-OE2 2.79Å; R692-E732 PolarHBondContact NH1-OE2 3.08Å; R692-E732 IonicContact NH2-OE1 2.64Å; R692-E732 PolarHBondContact NH2-OE1 3.06Å; Y728-E732 PolarHBondContact O-N 2.96Å; E732-G735 PolarHBondContact O-N 3.42Å
733	F	51.6	Low	59	Low	161 Å²	161	107.7 Å²	107.7	71%	0.706	57%	0.573	S	S	*	*	H	α-helix	trans	-71.9	-34.1	175.3	-122.9	-89	0	0	0	112.9	A730 I731 I737	A730-F733 PolarHBondContact O-N 3.12Å; I731-F733 VanDerWaalsContact C-N 3.27Å; I731-F733 PolarHBondContact O-N 3.37Å; F733-I737 WeakPolarHBondContact O-CG1 3.31Å
734	D	46.2	Very low	56.9	Low	123 Å²	123	112.1 Å²	112.1	66%	0.658	59%	0.588	S	S	*	*	H	α-helix	trans	-78.6	-24.2	175.4	-80.1	-17.7	0	0	0	112.7	A730 I731 I737	A730-D734 PolarHBondContact O-N 3.27Å; I731-D734 PolarHBondContact O-N 2.88Å; D734-I737 PolarHBondContact O-N 3.44Å
735	G	44.7	Very low	54.4	Low	59 Å²	59	120.4 Å²	120.4	61%	0.608	62%	0.621	S	S	*	*	H	α-helix	trans	-69.7	-29.7	175.9	0	0	0	0	0	114.3	I731 E732	I731-G735 PolarHBondContact O-N 3.5Å; E732-G735 PolarHBondContact O-N 3.42Å
736	E	42	Very low	52.7	Low	180 Å²	180	125.6 Å²	125.6	84%	0.841	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-8.5	175.8	-78.2	-167.9	161.3	0	0	113.8	G738	E736-G738 PolarHBondContact O-N 2.74Å
737	I	41.7	Very low	51.1	Low	103 Å²	103	126.7 Å²	126.7	53%	0.528	66%	0.656	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.6	10.2	176.1	-56.6	174.1	0	0	0	111.6	F733 D734	F733-I737 WeakPolarHBondContact O-CG1 3.31Å; D734-I737 PolarHBondContact O-N 3.44Å
738	G	38.5	Very low	49.5	Very low	63 Å²	63	127 Å²	127	65%	0.649	66%	0.661	S	S	*	*	S	Bend	trans	-95.6	23	-171	0	0	0	0	0	117.9	E736	E736-G738 PolarHBondContact O-N 2.74Å
739	E	39.1	Very low	48	Very low	180 Å²	180	126.8 Å²	126.8	84%	0.841	67%	0.67	S	S	*	*			trans	-151.3	58.3	164.5	-126.9	177.7	-152.8	0	0	111.7	T741	E739-T741 PolarHBondContact O-N 3.02Å; E739-T741 VanDerWaalsContact O-N 3.09Å
740	K	40.1	Very low	46.7	Very low	160 Å²	160	131.3 Å²	131.3	70%	0.696	68%	0.683	S	S	*	*			trans	-70.2	102.5	160.2	-76.6	-172.4	176.4	-176.9	0	108.4
741	T	43.7	Very low	45.8	Very low	91 Å²	91	136.1 Å²	136.1	56%	0.558	70%	0.697	S	S	*	*			trans	-52.5	144.5	168.5	43.2	0	0	0	0	110.4	E739 E743 D744	E739-T741 PolarHBondContact O-N 3.02Å; E739-T741 VanDerWaalsContact O-N 3.09Å; T741-E743 PolarHBondContact O-N 2.89Å; T741-D744 PolarHBondContact O-N 3.48Å; T741-D744 VanDerWaalsContact O-N 3.14Å
742	E	47.3	Very low	44.6	Very low	176 Å²	176	139 Å²	139	82%	0.822	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	2.9	-173.9	-138.6	170.1	-164.9	0	0	115.1
743	E	47.6	Very low	43.8	Very low	177 Å²	177	141.8 Å²	141.8	83%	0.827	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-17.3	171.9	-74.9	-174.6	152.6	0	0	113.9	T741	T741-E743 PolarHBondContact O-N 2.89Å
744	D	46.9	Very low	43.1	Very low	130 Å²	130	140.3 Å²	140.3	70%	0.695	73%	0.731	S	S	*	*			trans	-98.3	6.7	-178.1	-87.7	-6.1	0	0	0	114.6	T741	T741-D744 PolarHBondContact O-N 3.48Å; T741-D744 VanDerWaalsContact O-N 3.14Å
745	K	39.4	Very low	42.8	Very low	241 Å²	241	141.8 Å²	141.8	100%	1.048	74%	0.738	S	S	*	*			trans	-98.3	0	170	-77.3	-177.1	-178.6	171	0	110.7

Retrieved 745 of 745 residues in 610.5 ms (Link to these results)

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