A0A3Q0KRQ9_SCHMA Loading...

Lim homeobox protein, putative

AlphaFold DB , UniProt , Accession A0A3Q0KRQ9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 493 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	37.9	Very low	31.7	Very low	233 Å²	233	142 Å²	142	100%	1.148	89%	0.888	S	S	*	*				0	73.7	0	-61.6	-175.6	-179.3	0	0	106.6
2	S	28.2	Very low	31.6	Very low	115 Å²	115	135.9 Å²	135.9	80%	0.804	87%	0.874	S	S	*	*				84.7	96.8	50.9	-49.4	0	0	0	0	111.3
3	S	35	Very low	31.4	Very low	132 Å²	132	135 Å²	135	92%	0.923	87%	0.873	S	S	*	*			trans	-170.7	94.4	156.2	-95.7	0	0	0	0	108
4	T	29.6	Very low	31.6	Very low	140 Å²	140	131.7 Å²	131.7	86%	0.859	86%	0.863	S	S	*	*			trans	-94.9	125.5	173.6	22.1	0	0	0	0	110
5	L	38.6	Very low	31.7	Very low	182 Å²	182	132.7 Å²	132.7	95%	0.953	86%	0.858	S	S	*	*			trans	-138.7	130.2	154.4	-74.7	179.8	0	0	0	107.9
6	G	27.6	Very low	31.7	Very low	75 Å²	75	131.7 Å²	131.7	77%	0.773	85%	0.852	S	S	*	*			trans	-125.3	155.2	173.9	0	0	0	0	0	110.2
7	V	33	Very low	31.6	Very low	153 Å²	153	133.2 Å²	133.2	93%	0.927	85%	0.851	S	S	*	*			trans	-129.7	138.2	169.4	-178.5	0	0	0	0	107.5
8	S	30.4	Very low	31.4	Very low	117 Å²	117	132.1 Å²	132.1	82%	0.818	85%	0.847	S	S	*	*			trans	-82.8	163.9	-162.4	-60.2	0	0	0	0	114.9
9	A	27.1	Very low	31.2	Very low	89 Å²	89	135.6 Å²	135.6	74%	0.736	84%	0.844	S	S	*	*			trans	-58.4	150	-177.5	0	0	0	0	0	115.3
10	L	32.4	Very low	31.4	Very low	177 Å²	177	138.4 Å²	138.4	93%	0.927	84%	0.844	S	S	*	*			trans	-119.2	140.4	143.3	-83.6	172.2	0	0	0	108.4
11	V	29.1	Very low	31.3	Very low	149 Å²	149	136.9 Å²	136.9	90%	0.903	84%	0.836	S	S	*	*			trans	-88	124	179.8	177.4	0	0	0	0	109
12	G	30.1	Very low	30.8	Very low	69 Å²	69	129.2 Å²	129.2	71%	0.711	82%	0.818	S	S	*	*			trans	-148.9	118.3	174.8	0	0	0	0	0	110.7
13	S	28.6	Very low	31.1	Very low	124 Å²	124	130.3 Å²	130.3	87%	0.867	81%	0.814	S	S	*	*			trans	-77.5	121.2	175	-167.2	0	0	0	0	109.4
14	A	35.2	Very low	31	Very low	89 Å²	89	131.3 Å²	131.3	74%	0.736	81%	0.808	S	S	*	*			trans	-145.9	115.6	177.9	0	0	0	0	0	110.3
15	D	32.2	Very low	31.3	Very low	146 Å²	146	132.1 Å²	132.1	78%	0.781	80%	0.795	S	S	*	*			trans	-72.2	127.9	-175.4	-68.7	-79	0	0	0	113.1	N17	D15-N17 PolarHBondContact O-N 3.21Å
16	P	31.8	Very low	31.2	Very low	117 Å²	117	132 Å²	132	76%	0.76	79%	0.789	S	S	*	*	S	Bend	trans	-88.9	76.4	177.3	35.4	-34	0	0	0	111.5
17	N	30.3	Very low	32.1	Very low	158 Å²	158	131 Å²	131	85%	0.845	76%	0.764	S	S	*	*			trans	-169.9	82.4	158.1	-99.2	-39.6	0	0	0	113	D15	D15-N17 PolarHBondContact O-N 3.21Å
18	S	27.9	Very low	33	Very low	112 Å²	112	124.9 Å²	124.9	78%	0.783	73%	0.728	S	S	*	*			trans	-126.5	41.2	-179.5	50.7	0	0	0	0	113.3
19	Y	28.7	Very low	34.4	Very low	200 Å²	200	122.2 Å²	122.2	78%	0.784	71%	0.71	S	S	*	*			trans	-147.9	75.1	-178.5	-131.7	-84.5	0	0	0	115.2	P21	Y19-P21 HydrophobicContact CE1-CG 4.48Å
20	F	33.5	Very low	36.3	Very low	190 Å²	190	121.3 Å²	121.3	83%	0.833	69%	0.693	S	S	*	*			trans	-138.4	73.5	165.2	-103.2	-74.2	0	0	0	113.5	L165	F20-L165 HydrophobicContact CE1-CD2 4.13Å; F20-L165 HydrophobicContact CZ-CD2 4.28Å
21	P	29.4	Very low	38.3	Very low	107 Å²	107	113.2 Å²	113.2	70%	0.695	65%	0.65	S	S	*	*			trans	-97.4	103.9	172	34.8	-28.1	0	0	0	112.3	Y19	Y19-P21 HydrophobicContact CE1-CG 4.48Å
22	G	28.3	Very low	40.6	Very low	73 Å²	73	110.5 Å²	110.5	75%	0.753	63%	0.634	S	S	*	*			trans	82.3	117.5	156.4	0	0	0	0	0	118.2
23	L	34	Very low	42.9	Very low	138 Å²	138	107.6 Å²	107.6	72%	0.723	60%	0.602	S	S	*	*			trans	-165.7	-11.7	134.6	-110.1	176.1	0	0	0	113.7	R25	L23-R25 VanDerWaalsContact C-N 3.33Å; L23-R25 PolarHBondContact O-N 2.99Å
24	L	33	Very low	45.3	Very low	152 Å²	152	107.1 Å²	107.1	80%	0.796	59%	0.587	S	S	*	*			trans	-63.8	95.8	156.4	-106.3	68.8	0	0	0	108.6
25	R	36.3	Very low	47.7	Very low	157 Å²	157	109.7 Å²	109.7	59%	0.592	58%	0.577	S	S	*	*			trans	-74.1	134.1	160.2	-73.3	-171.9	176.2	-129.5	0.5	107.4	L23 H27	L23-R25 VanDerWaalsContact C-N 3.33Å; L23-R25 PolarHBondContact O-N 2.99Å; R25-H27 PolarHBondContact O-CD2 3.14Å; R25-H27 VanDerWaalsContact O-CD2 3.25Å; R25-H27 PolarHBondContact O-N 3.05Å
26	H	36	Very low	50	Low	180 Å²	180	104 Å²	104	83%	0.833	55%	0.548	S	S	*	.			trans	-62.1	105.4	172.1	-64.3	-81.4	0	0	0	109	S28	H26-S28 PolarHBondContact O-N 3.05Å
27	H	47.1	Very low	52.2	Low	54 Å²	54	99.6 Å²	99.6	25%	0.25	52%	0.52	C	S	.	.			trans	-70.6	109.2	171.9	-68.9	-80.2	0	0	0	107.6	R25 S29 Y124 Y128 Y457	R25-H27 PolarHBondContact O-CD2 3.14Å; R25-H27 VanDerWaalsContact O-CD2 3.25Å; R25-H27 PolarHBondContact O-N 3.05Å; H27-S29 PolarHBondContact O-N 2.76Å; H27-Y124 WeakPolarHBondContact CA-OH 3.24Å; H27-Y124 WeakPolarHBondContact CB-OH 3.38Å; H27-Y124 PolarHBondContact ND1-OH 3.47Å; H27-Y124 VanDerWaalsContact ND1-OH 3.14Å; H27-Y128 PolarHBondContact CE1-O 2.97Å; H27-Y457 PolarHBondContact CD2-OH 3.46Å
28	S	51.9	Low	53.8	Low	24 Å²	24	95.2 Å²	95.2	17%	0.168	49%	0.492	C	S	.	.			trans	-56.6	126.4	169.8	-178	0	0	0	0	107.8	H26 Q88 I112	H26-S28 PolarHBondContact O-N 3.05Å; S28-Q88 PolarHBondContact OG-NE2 3.33Å; S28-Q88 VanDerWaalsContact OG-NE2 3.16Å; S28-I112 VanDerWaalsContact CB-O 3.22Å; S28-I112 WeakPolarHBondContact CB-O 3.18Å
29	S	59.3	Low	55.6	Low	61 Å²	61	101.2 Å²	101.2	43%	0.427	50%	0.497	S	S	.	.			trans	-59.7	148.5	166.9	42.7	0	0	0	0	110.1	H27 C31	H27-S29 PolarHBondContact O-N 2.76Å; S29-C31 PolarHBondContact O-N 3.5Å; S29-C31 VanDerWaalsContact O-N 3.17Å; S29-C31 PolarHBondContact O-SG 3.38Å; S29-C31 VanDerWaalsContact O-SG 3.36Å
30	D	66.7	Low	57	Low	71 Å²	71	98.2 Å²	98.2	38%	0.38	49%	0.49	S	S	.	.			trans	-45.4	114.9	178.7	-48.9	11.5	0	0	0	110.6	V32 V109 F111	D30-V32 PolarHBondContact O-N 3.25Å; D30-V109 HydrophobicContact CB-CG1 4.01Å; D30-F111 HydrophobicContact CB-CE1 4.37Å; D30-F111 HydrophobicContact CB-CZ 4.34Å; D30-F111 WeakPolarHBondContact OD1-CE1 3.4Å
31	C	75.8	Confident	57.9	Low	6 Å²	6	90.6 Å²	90.6	4%	0.041	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	106.7	-179	-57.3	0	0	0	0	109.1	S29 T33 I87 Q88 V109 C110	S29-C31 PolarHBondContact O-N 3.5Å; S29-C31 VanDerWaalsContact O-N 3.17Å; S29-C31 PolarHBondContact O-SG 3.38Å; S29-C31 VanDerWaalsContact O-SG 3.36Å; C31-T33 PolarHBondContact O-N 2.99Å; C31-I87 HydrophobicContact CB-CG2 3.78Å; C31-Q88 PolarHBondContact SG-NE2 2.82Å; C31-V109 WeakPolarHBondContact O-CA 3.5Å; C31-C110 WeakPolarHBondContact CA-O 3.46Å; C31-C110 VanDerWaalsContact CB-O 3.26Å; C31-C110 WeakPolarHBondContact CB-O 3.3Å; C31-C110 PolarHBondContact N-O 3.3Å; C31-C110 PolarHBondContact O-N 3.16Å
32	V	76.4	Confident	58.6	Low	93 Å²	93	91.3 Å²	91.3	56%	0.564	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.5	132.5	169.1	-176.7	0	0	0	0	109.1	D30 E34	D30-V32 PolarHBondContact O-N 3.25Å; V32-E34 HydrophobicContact CG1-CG 4.11Å
33	T	78.1	Confident	59.4	Low	7 Å²	7	94 Å²	94	4%	0.043	45%	0.452	C	S	.	.			trans	-98	89.4	178.8	48.6	0	0	0	0	109.8	C31 R35 I87 L106 V107 E108 C110	C31-T33 PolarHBondContact O-N 2.99Å; T33-R35 PolarHBondContact O-N 3Å; T33-I87 HydrophobicContact CG2-CD1 3.88Å; T33-I87 HydrophobicContact CG2-CG1 4.04Å; T33-L106 HydrophobicContact CG2-CB 4.46Å; T33-L106 PolarHBondContact OG1-O 2.9Å; T33-V107 PolarHBondContact OG1-O 3.16Å; T33-E108 PolarHBondContact N-O 3.27Å; T33-E108 VanDerWaalsContact N-O 3.1Å; T33-E108 VanDerWaalsContact OG1-CA 3.23Å; T33-E108 WeakPolarHBondContact OG1-CA 3.44Å; T33-E108 PolarHBondContact OG1-N 3.48Å; T33-E108 VanDerWaalsContact OG1-N 3.09Å; T33-E108 PolarHBondContact OG1-O 3.09Å; T33-C110 HydrophobicContact CG2-CB 4.17Å; T33-C110 VanDerWaalsContact CG2-SG 3.5Å
34	E	79.6	Confident	59.8	Low	115 Å²	115	93.1 Å²	93.1	54%	0.537	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	118.5	-178.1	-66.2	-177.2	162.6	0	0	110.7	V32 V36 Y85 R86	V32-E34 HydrophobicContact CG1-CG 4.11Å; E34-V36 HydrophobicContact CB-CG2 4.19Å; E34-Y85 CarbonylContact O-C 3.6Å; E34-Y85 WeakPolarHBondContact O-CA 3.45Å; E34-R86 PolarHBondContact N-O 2.95Å; E34-R86 PolarHBondContact O-N 2.88Å
35	R	84.5	Confident	59.7	Low	143 Å²	143	92 Å²	92	54%	0.54	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	113.8	172.2	-167.8	-176.1	-166.8	176.2	11.1	109.4	T33 L84 Y85 E94	T33-R35 PolarHBondContact O-N 3Å; R35-L84 WeakPolarHBondContact CA-O 3.26Å; R35-Y85 HydrophobicContact CB-CD1 4.11Å; R35-Y85 HydrophobicContact CB-CE1 3.82Å; R35-Y85 HydrophobicContact CG-CE1 4.27Å; R35-E94 IonicContact CZ-OE1 2.67Å; R35-E94 IonicContact CZ-OE2 3.95Å; R35-E94 IonicContact NE-OE1 3.97Å; R35-E94 PolarHBondContact NE-OE1 3.12Å; R35-E94 IonicContact NE-OE2 2.89Å; R35-E94 IonicContact NH2-OE1 3.34Å; R35-E94 PolarHBondContact NH2-OE1 3.24Å; R35-E94 IonicContact NH2-OE2 3.17Å; R35-E94 PolarHBondContact NH2-OE2 3.35Å
36	V	80.8	Confident	60	Low	27 Å²	27	90 Å²	90	16%	0.164	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	139.2	-173.4	-168.6	0	0	0	0	110.4	E34 E40 T41 Y83 L84 R86	E34-V36 HydrophobicContact CB-CG2 4.19Å; V36-E40 HydrophobicContact CG1-CB 4.18Å; V36-T41 HydrophobicContact CB-CG2 4.3Å; V36-T41 HydrophobicContact CG1-CG2 3.74Å; V36-Y83 WeakPolarHBondContact O-CA 3.46Å; V36-L84 PolarHBondContact N-O 2.84Å; V36-L84 PolarHBondContact O-N 3.24Å; V36-R86 HydrophobicContact CG2-CB 4.49Å
37	S	78.9	Confident	59.7	Low	23 Å²	23	88.7 Å²	88.7	16%	0.161	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	136.2	170.2	178.9	0	0	0	0	110	R39 E40	S37-R39 PolarHBondContact O-N 3.27Å; S37-R39 VanDerWaalsContact O-N 3.11Å; S37-E40 WeakPolarHBondContact CB-OE2 3.1Å; S37-E40 PolarHBondContact O-N 2.98Å
38	Y	63.8	Low	59.2	Low	66 Å²	66	93 Å²	93	26%	0.259	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-56.2	-34.3	-179.7	172.4	-128.7	0	0	0	112.7	E40 T41 L69 P70 Q82	Y38-E40 PolarHBondContact O-N 3.28Å; Y38-T41 PolarHBondContact O-OG1 3.45Å; Y38-L69 HydrophobicContact CD1-CD2 4.45Å; Y38-L69 HydrophobicContact CE1-CD2 3.66Å; Y38-P70 HydrophobicContact CD2-CG 4.07Å; Y38-P70 HydrophobicContact CE2-CG 3.97Å; Y38-Q82 PolarHBondContact N-O 2.99Å
39	R	65.6	Low	58.3	Low	239 Å²	239	96.6 Å²	96.6	90%	0.902	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-70.2	-10.2	178.7	-67.2	-172.4	176.8	-167.5	-1	114.8	S37	S37-R39 PolarHBondContact O-N 3.27Å; S37-R39 VanDerWaalsContact O-N 3.11Å
40	E	58.2	Low	57.4	Low	137 Å²	137	98.4 Å²	98.4	64%	0.64	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-105.3	2.8	-173.2	-65.7	174.8	158.3	0	0	113.1	V36 S37 Y38 P42	V36-E40 HydrophobicContact CG1-CB 4.18Å; S37-E40 WeakPolarHBondContact CB-OE2 3.1Å; S37-E40 PolarHBondContact O-N 2.98Å; Y38-E40 PolarHBondContact O-N 3.28Å; E40-P42 WeakPolarHBondContact O-CD 3.46Å
41	T	51.4	Low	56.1	Low	29 Å²	29	100.8 Å²	100.8	18%	0.178	54%	0.542	C	S	.	.			trans	-93.5	108.4	-176.4	62.5	0	0	0	0	113.3	V36 Y38 Y43 L84 R86	V36-T41 HydrophobicContact CB-CG2 4.3Å; V36-T41 HydrophobicContact CG1-CG2 3.74Å; Y38-T41 PolarHBondContact O-OG1 3.45Å; T41-Y43 PolarHBondContact O-N 2.84Å; T41-L84 HydrophobicContact CG2-CD2 4.48Å; T41-R86 VanDerWaalsContact CG2-NH2 3.29Å
42	P	45.7	Very low	54.7	Low	122 Å²	122	107.9 Å²	107.9	79%	0.792	58%	0.579	S	S	*	*			trans	-85.3	107.6	169.9	33.2	-29.2	0	0	0	108.8	E40	E40-P42 WeakPolarHBondContact O-CD 3.46Å
43	Y	44	Very low	53.1	Low	131 Å²	131	109.8 Å²	109.8	51%	0.514	59%	0.586	S	S	.	*			trans	-128.9	128.4	-176.1	-126.8	-117	0	0	0	113.9	T41 R86 G89	T41-Y43 PolarHBondContact O-N 2.84Å; Y43-R86 VanDerWaalsContact CZ-NH1 3.25Å; Y43-G89 WeakPolarHBondContact OH-CA 3.07Å; Y43-G89 PolarHBondContact OH-O 3.28Å
44	N	41.7	Very low	51.6	Low	119 Å²	119	115.3 Å²	115.3	64%	0.636	62%	0.619	S	S	*	*			trans	64.1	59.3	162.6	-62.6	-9.3	0	0	0	119.2	V46	N44-V46 VanDerWaalsContact C-N 3.29Å; N44-V46 HydrophobicContact CB-CG2 4.24Å; N44-V46 PolarHBondContact O-N 2.8Å
45	S	32.4	Very low	49.8	Very low	127 Å²	127	114.1 Å²	114.1	89%	0.888	62%	0.624	S	S	*	*			trans	-79.6	77.2	147.8	57.5	0	0	0	0	110.3
46	V	41.8	Very low	47.9	Very low	115 Å²	115	115.5 Å²	115.5	70%	0.697	64%	0.636	S	S	*	*			trans	-88.6	132.6	175	-173.9	0	0	0	0	109.5	N44 V48	N44-V46 VanDerWaalsContact C-N 3.29Å; N44-V46 HydrophobicContact CB-CG2 4.24Å; N44-V46 PolarHBondContact O-N 2.8Å; V46-V48 PolarHBondContact O-N 2.77Å
47	N	29.6	Very low	46.2	Very low	154 Å²	154	119.3 Å²	119.3	82%	0.824	66%	0.663	S	S	*	*			trans	-58.6	126.5	-176.5	-80	-25.8	0	0	0	113.6
48	V	37.1	Very low	44.2	Very low	144 Å²	144	123.9 Å²	123.9	87%	0.873	69%	0.693	S	S	*	*			trans	-135.3	126.3	147.4	-176.3	0	0	0	0	107.6	V46	V46-V48 PolarHBondContact O-N 2.77Å
49	S	33.1	Very low	43	Very low	99 Å²	99	128.8 Å²	128.8	69%	0.692	72%	0.722	S	S	*	*			trans	-87.8	166.6	-175.7	-57.7	0	0	0	0	113.3
50	S	40.7	Very low	41.7	Very low	99 Å²	99	125.8 Å²	125.8	69%	0.692	72%	0.723	S	S	*	*			trans	107.6	94.1	144	-53.8	0	0	0	0	119.7
51	T	39.9	Very low	40.5	Very low	121 Å²	121	124.2 Å²	124.2	74%	0.742	73%	0.727	S	S	*	*				68.9	146.3	125.2	60.1	0	0	0	0	122.7
52	L	45.6	Very low	39.8	Very low	155 Å²	155	130.9 Å²	130.9	81%	0.812	76%	0.756	S	S	*	*			trans	77.7	135.5	165.2	-49.2	-175	0	0	0	116.7
53	D	41.7	Very low	39.6	Very low	134 Å²	134	131 Å²	131	72%	0.717	76%	0.756	S	S	*	*			cis	-159.3	170	-20.9	-144.8	-17.3	0	0	0	112.2
54	V	46.9	Very low	39.2	Very low	122 Å²	122	129.7 Å²	129.7	74%	0.739	77%	0.766	S	S	*	*			trans	1.3	135.5	151.5	157.8	0	0	0	0	118.2
55	S	42.2	Very low	39.5	Very low	91 Å²	91	127.9 Å²	127.9	64%	0.636	76%	0.763	S	S	*	*			cis	-175.6	177.2	0	56.8	0	0	0	0	114.3
56	H	44.5	Very low	40.2	Very low	172 Å²	172	130.9 Å²	130.9	80%	0.796	76%	0.76	S	S	*	*			trans	79.7	114.6	151.4	-85	-66.8	0	0	0	123.8
57	S	45	Very low	40.9	Very low	106 Å²	106	131.4 Å²	131.4	74%	0.741	76%	0.759	S	S	*	*			trans	94.1	143.8	139.7	-59.6	0	0	0	0	119.3
58	P	37.9	Very low	43.2	Very low	120 Å²	120	130.2 Å²	130.2	78%	0.779	76%	0.757	S	S	*	*			trans	-117.2	114.9	-149.1	34.3	-17.6	0	0	0	113.6
59	L	36.9	Very low	45.4	Very low	168 Å²	168	126.3 Å²	126.3	88%	0.88	73%	0.731	S	S	*	*			trans	-137.2	151.6	171.9	-72.5	176.3	0	0	0	112.3	S61	L59-S61 PolarHBondContact O-N 2.92Å
60	I	38.4	Very low	48	Very low	177 Å²	177	122.9 Å²	122.9	91%	0.908	71%	0.706	S	S	*	*			trans	-56.7	122.5	-174.1	-60.1	162.9	0	0	0	111
61	S	34	Very low	50.5	Low	103 Å²	103	122 Å²	122	72%	0.72	70%	0.697	S	S	*	*			trans	-153	154.9	168.5	50.1	0	0	0	0	111.5	L59	L59-S61 PolarHBondContact O-N 2.92Å
62	H	36.2	Very low	53.1	Low	170 Å²	170	116.3 Å²	116.3	79%	0.787	66%	0.662	S	S	*	*			trans	-79.1	152.4	-168.1	-52.7	-91.6	0	0	0	112.9	S64	H62-S64 PolarHBondContact O-N 3.27Å
63	P	42.3	Very low	55.2	Low	123 Å²	123	109.9 Å²	109.9	80%	0.799	63%	0.631	S	S	*	*			trans	-70.3	78.8	164.5	31.6	-34.7	0	0	0	110	S65	P63-S65 PolarHBondContact O-N 3.4Å
64	S	36.1	Very low	57.5	Low	105 Å²	105	105.2 Å²	105.2	73%	0.734	62%	0.615	S	S	*	*			trans	-81.5	43	175.4	-178.6	0	0	0	0	111.8	H62 K66	H62-S64 PolarHBondContact O-N 3.27Å; S64-K66 PolarHBondContact O-N 3.13Å
65	S	46.2	Very low	59.7	Low	80 Å²	80	102.1 Å²	102.1	56%	0.559	60%	0.598	S	S	*	*			trans	-75	119.4	166.8	46.7	0	0	0	0	109	P63 D67	P63-S65 PolarHBondContact O-N 3.4Å; S65-D67 PolarHBondContact O-N 3.48Å; S65-D67 VanDerWaalsContact O-N 3.11Å
66	K	47.2	Very low	62.1	Low	191 Å²	191	106.7 Å²	106.7	83%	0.83	60%	0.601	S	S	*	*			trans	-79	91.9	174.7	-69.4	179	179.9	176.4	0	109.1	S64 T68	S64-K66 PolarHBondContact O-N 3.13Å; K66-T68 PolarHBondContact O-N 3.01Å
67	D	58.2	Low	64.4	Low	126 Å²	126	104.4 Å²	104.4	67%	0.674	59%	0.591	S	S	*	*			trans	-58.8	111	175.3	-62.1	-28.1	0	0	0	109.9	S65 L69	S65-D67 PolarHBondContact O-N 3.48Å; S65-D67 VanDerWaalsContact O-N 3.11Å; D67-L69 PolarHBondContact O-N 3.05Å; D67-L69 VanDerWaalsContact O-N 3.08Å
68	T	77.7	Confident	66.7	Low	128 Å²	128	103.1 Å²	103.1	79%	0.785	58%	0.576	S	S	*	*			trans	-75.8	100	-177.1	50	0	0	0	0	110.3	K66	K66-T68 PolarHBondContact O-N 3.01Å
69	L	83.2	Confident	69.2	Low	62 Å²	62	97.5 Å²	97.5	33%	0.325	54%	0.539	S	S	.	.			trans	-45.9	129.5	175.7	-71.4	158.3	0	0	0	111	Y38 D67 T71 N78 T80	Y38-L69 HydrophobicContact CD1-CD2 4.45Å; Y38-L69 HydrophobicContact CE1-CD2 3.66Å; D67-L69 PolarHBondContact O-N 3.05Å; D67-L69 VanDerWaalsContact O-N 3.08Å; L69-T71 PolarHBondContact O-N 3.46Å; L69-N78 HydrophobicContact CB-CB 3.83Å; L69-N78 HydrophobicContact CD1-CB 4.46Å; L69-N78 PolarHBondContact O-ND2 3Å; L69-T80 HydrophobicContact CD1-CG2 4.21Å
70	P	87.9	Confident	71.8	Confident	27 Å²	27	94.6 Å²	94.6	18%	0.175	53%	0.528	C	S	.	.	P	Polyproline II helix	trans	-64.2	129.9	-172.7	23.6	-32.8	0	0	0	111.4	Y38 I79 L84 A91	Y38-P70 HydrophobicContact CD2-CG 4.07Å; Y38-P70 HydrophobicContact CE2-CG 3.97Å; P70-I79 HydrophobicContact CG-CB 4.41Å; P70-I79 WeakPolarHBondContact O-CB 3.39Å; P70-I79 WeakPolarHBondContact O-CG1 3.33Å; P70-I79 PolarHBondContact O-N 3.42Å; P70-L84 HydrophobicContact CG-CD2 3.73Å; P70-A91 HydrophobicContact CB-CB 4.08Å
71	T	93.4	Very high	74.2	Confident	82 Å²	82	89 Å²	89	50%	0.503	50%	0.501	S	S	.	.	B	Isolated β-bridge	trans	-77.7	128.4	179.2	-49.1	0	0	0	0	111	L69 A73 R76	L69-T71 PolarHBondContact O-N 3.46Å; T71-A73 PolarHBondContact O-N 3.43Å; T71-R76 VanDerWaalsContact CG2-O 3.26Å; T71-R76 WeakPolarHBondContact CG2-O 3.43Å
72	C	93.9	Very high	76.8	Confident	1 Å²	1	90.5 Å²	90.5	1%	0.007	50%	0.496	C	S	.	.	P	Polyproline II helix	trans	-66.4	125.6	175.7	174.3	0	0	0	0	111.5	G74 R76 Q77 I79 A91 H93	C72-G74 PolarHBondContact O-N 3.49Å; C72-G74 PolarHBondContact SG-N 2.91Å; C72-G74 VanDerWaalsContact SG-N 3.38Å; C72-R76 WeakPolarHBondContact O-CA 3.38Å; C72-R76 PolarHBondContact O-N 3.01Å; C72-Q77 WeakPolarHBondContact CB-O 3.39Å; C72-Q77 PolarHBondContact N-O 3.39Å; C72-I79 HydrophobicContact CB-CD1 4.09Å; C72-I79 HydrophobicContact CB-CG1 3.8Å; C72-A91 CarbonylContact C-O 3.13Å; C72-A91 WeakPolarHBondContact CA-O 3.43Å; C72-H93 VanDerWaalsContact CB-CE1 3.41Å; C72-H93 WeakPolarHBondContact CB-CE1 3.21Å; C72-H93 WeakPolarHBondContact CB-ND1 3.23Å; C72-H93 PolarHBondContact SG-ND1 2.99Å; C72-H93 VanDerWaalsContact SG-ND1 3.36Å
73	A	90.4	Very high	79.2	Confident	19 Å²	19	86.6 Å²	86.6	16%	0.157	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-18.3	179.5	0	0	0	0	0	114.4	T71 L90 A91 W92 N116	T71-A73 PolarHBondContact O-N 3.43Å; A73-L90 HydrophobicContact CB-CB 4.02Å; A73-L90 HydrophobicContact CB-CD1 4.07Å; A73-L90 HydrophobicContact CB-CG 4.46Å; A73-A91 PolarHBondContact N-O 3.34Å; A73-W92 HydrophobicContact CB-CD2 4.17Å; A73-W92 HydrophobicContact CB-CH2 4.13Å; A73-W92 HydrophobicContact CB-CZ2 3.72Å; A73-N116 PolarHBondContact O-ND2 3.03Å
74	G	89	Confident	81.5	Confident	36 Å²	36	80.8 Å²	80.8	37%	0.371	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-75.8	172.6	0	0	0	0	0	112.6	C72	C72-G74 PolarHBondContact O-N 3.49Å; C72-G74 PolarHBondContact SG-N 2.91Å; C72-G74 VanDerWaalsContact SG-N 3.38Å
75	C	92.7	Very high	84	Confident	58 Å²	58	76.6 Å²	76.6	39%	0.392	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-4.5	-172.5	71.1	0	0	0	0	115.4	Q77 H93	C75-Q77 PolarHBondContact O-N 2.91Å; C75-Q77 VanDerWaalsContact O-N 3.15Å; C75-H93 PolarHBondContact SG-CE1 2.91Å; C75-H93 PolarHBondContact SG-ND1 3.34Å
76	R	92.2	Very high	86.1	Confident	186 Å²	186	74.5 Å²	74.5	70%	0.702	39%	0.385	S	S	*	.			trans	63.4	10.4	179	-52	178.6	-175.3	-85.2	-7.1	116.1	T71 C72	T71-R76 VanDerWaalsContact CG2-O 3.26Å; T71-R76 WeakPolarHBondContact CG2-O 3.43Å; C72-R76 WeakPolarHBondContact O-CA 3.38Å; C72-R76 PolarHBondContact O-N 3.01Å
77	Q	92.8	Very high	88	Confident	125 Å²	125	65.4 Å²	65.4	58%	0.584	35%	0.346	S	S	*	.	S	Bend	trans	-88.1	156.8	170.6	-58.4	-57.7	-32.7	0	0	111.3	C72 C75	C72-Q77 WeakPolarHBondContact CB-O 3.39Å; C72-Q77 PolarHBondContact N-O 3.39Å; C75-Q77 PolarHBondContact O-N 2.91Å; C75-Q77 VanDerWaalsContact O-N 3.15Å
78	N	93.3	Very high	89.1	Confident	79 Å²	79	65 Å²	65	42%	0.422	34%	0.34	S	S	.	.	B	Isolated β-bridge	trans	-68.2	133	172.1	-62.7	95	0	0	0	110.7	L69 T80	L69-N78 HydrophobicContact CB-CB 3.83Å; L69-N78 HydrophobicContact CD1-CB 4.46Å; L69-N78 PolarHBondContact O-ND2 3Å; N78-T80 PolarHBondContact O-N 3.45Å
79	I	92.2	Very high	89.4	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.005	32%	0.315	C	S	.	.			trans	-77.6	113.4	178.5	-57.6	161.4	0	0	0	109	P70 C72 D81 L84 A91 H93	P70-I79 HydrophobicContact CG-CB 4.41Å; P70-I79 WeakPolarHBondContact O-CB 3.39Å; P70-I79 WeakPolarHBondContact O-CG1 3.33Å; P70-I79 PolarHBondContact O-N 3.42Å; C72-I79 HydrophobicContact CB-CD1 4.09Å; C72-I79 HydrophobicContact CB-CG1 3.8Å; I79-D81 HydrophobicContact CG2-CB 4.01Å; I79-L84 HydrophobicContact CD1-CB 4.15Å; I79-L84 HydrophobicContact CD1-CD2 4.4Å; I79-L84 HydrophobicContact CG2-CB 4.14Å; I79-A91 HydrophobicContact CD1-CB 3.69Å; I79-H93 WeakPolarHBondContact CA-NE2 3.38Å
80	T	90.2	Very high	89.6	Confident	107 Å²	107	60.6 Å²	60.6	66%	0.656	32%	0.317	S	S	*	.			trans	-101.7	-3.1	174.5	52.6	0	0	0	0	113.2	L69 N78	L69-T80 HydrophobicContact CD1-CG2 4.21Å; N78-T80 PolarHBondContact O-N 3.45Å
81	D	88.3	Confident	89.8	Confident	61 Å²	61	59.8 Å²	59.8	33%	0.326	31%	0.313	S	S	.	.	S	Bend	trans	-64.7	153.2	179.6	-61.5	-15.4	0	0	0	111.3	I79 Y83 H93	I79-D81 HydrophobicContact CG2-CB 4.01Å; D81-Y83 WeakPolarHBondContact CB-O 3.45Å; D81-Y83 PolarHBondContact O-N 3.25Å; D81-H93 IonicContact OD2-CD2 3.29Å; D81-H93 PolarHBondContact OD2-CD2 2.85Å; D81-H93 IonicContact OD2-CG 3.56Å
82	Q	88.6	Confident	89.7	Confident	134 Å²	134	56.2 Å²	56.2	63%	0.626	29%	0.29	S	S	*	.	S	Bend	trans	-62	-29.5	176.2	-178.8	177.3	-16.9	0	0	112.5	Y38	Y38-Q82 PolarHBondContact N-O 2.99Å
83	Y	87.3	Confident	89.6	Confident	88 Å²	88	57.1 Å²	57.1	35%	0.345	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	150.5	-176.1	-62.6	-76.3	0	0	0	110.1	V36 D81 E94	V36-Y83 WeakPolarHBondContact O-CA 3.46Å; D81-Y83 WeakPolarHBondContact CB-O 3.45Å; D81-Y83 PolarHBondContact O-N 3.25Å; Y83-E94 WeakPolarHBondContact CB-OE1 3.47Å
84	L	90.7	Very high	89.6	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	153.8	174	62.6	84.4	0	0	0	110.6	R35 V36 T41 P70 I79 R86 A91	R35-L84 WeakPolarHBondContact CA-O 3.26Å; V36-L84 PolarHBondContact N-O 2.84Å; V36-L84 PolarHBondContact O-N 3.24Å; T41-L84 HydrophobicContact CG2-CD2 4.48Å; P70-L84 HydrophobicContact CG-CD2 3.73Å; I79-L84 HydrophobicContact CD1-CB 4.15Å; I79-L84 HydrophobicContact CD1-CD2 4.4Å; I79-L84 HydrophobicContact CG2-CB 4.14Å; L84-R86 HydrophobicContact CD1-CB 4.35Å; L84-A91 HydrophobicContact CD1-CB 4.28Å; L84-A91 HydrophobicContact CD2-CB 4.49Å
85	Y	89.3	Confident	89.7	Confident	18 Å²	18	60.9 Å²	60.9	7%	0.071	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	133.4	165.6	-74.6	-67.1	0	0	0	110.4	E34 R35 A91 W92 E94 A97	E34-Y85 CarbonylContact O-C 3.6Å; E34-Y85 WeakPolarHBondContact O-CA 3.45Å; R35-Y85 HydrophobicContact CB-CD1 4.11Å; R35-Y85 HydrophobicContact CB-CE1 3.82Å; R35-Y85 HydrophobicContact CG-CE1 4.27Å; Y85-A91 CarbonylContact O-C 3.58Å; Y85-A91 WeakPolarHBondContact O-CA 3.41Å; Y85-W92 PolarHBondContact N-O 3.23Å; Y85-W92 PolarHBondContact O-N 3.32Å; Y85-E94 HydrophobicContact CD2-CB 4.3Å; Y85-E94 HydrophobicContact CD2-CG 4.21Å; Y85-E94 HydrophobicContact CE2-CB 3.97Å; Y85-E94 HydrophobicContact CE2-CG 4.06Å; Y85-A97 HydrophobicContact CD2-CB 3.53Å; Y85-A97 HydrophobicContact CE2-CB 4.16Å; Y85-A97 HydrophobicContact CG-CB 4.19Å
86	R	88.6	Confident	89.6	Confident	36 Å²	36	59.3 Å²	59.3	14%	0.136	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	122.4	169.9	-169.4	169.4	-65.6	-81.4	7.7	109.4	E34 V36 T41 Y43 L84 G89 L90	E34-R86 PolarHBondContact N-O 2.95Å; E34-R86 PolarHBondContact O-N 2.88Å; V36-R86 HydrophobicContact CG2-CB 4.49Å; T41-R86 VanDerWaalsContact CG2-NH2 3.29Å; Y43-R86 VanDerWaalsContact CZ-NH1 3.25Å; L84-R86 HydrophobicContact CD1-CB 4.35Å; R86-G89 PolarHBondContact NH1-O 3.18Å; R86-L90 WeakPolarHBondContact CA-O 3.36Å
87	I	87.7	Confident	89.6	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	114.2	-173.9	-43.8	-179.6	0	0	0	108.4	C31 T33 G89 L90 W92 A97 C110 I112 L118	C31-I87 HydrophobicContact CB-CG2 3.78Å; T33-I87 HydrophobicContact CG2-CD1 3.88Å; T33-I87 HydrophobicContact CG2-CG1 4.04Å; I87-G89 PolarHBondContact O-N 2.8Å; I87-G89 VanDerWaalsContact O-N 3.15Å; I87-L90 PolarHBondContact N-O 2.88Å; I87-L90 WeakPolarHBondContact O-CB 3.16Å; I87-L90 PolarHBondContact O-N 3.47Å; I87-W92 HydrophobicContact CD1-CD2 4.41Å; I87-W92 HydrophobicContact CD1-CG 4.05Å; I87-W92 HydrophobicContact CG1-CG 4.46Å; I87-A97 HydrophobicContact CD1-CB 4.38Å; I87-C110 WeakPolarHBondContact CG2-SG 3.17Å; I87-I112 HydrophobicContact CG2-CD1 3.83Å; I87-I112 HydrophobicContact CG2-CG1 4.4Å; I87-L118 HydrophobicContact CD1-CD1 3.9Å; I87-L118 HydrophobicContact CD1-CD2 4.16Å; I87-L118 HydrophobicContact CG2-CD2 4.34Å
88	Q	82.6	Confident	89.6	Confident	118 Å²	118	47.6 Å²	47.6	55%	0.551	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.1	39.5	-168.7	-67.7	-173	1.7	0	0	113	S28 C31 L90 I112	S28-Q88 PolarHBondContact OG-NE2 3.33Å; S28-Q88 VanDerWaalsContact OG-NE2 3.16Å; C31-Q88 PolarHBondContact SG-NE2 2.82Å; Q88-L90 PolarHBondContact O-N 2.9Å; Q88-I112 HydrophobicContact CB-CD1 3.92Å; Q88-I112 HydrophobicContact CG-CD1 3.78Å
89	G	83.4	Confident	89.6	Confident	25 Å²	25	43.9 Å²	43.9	26%	0.258	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.6	-21.9	-176.7	0	0	0	0	0	115.4	Y43 R86 I87	Y43-G89 WeakPolarHBondContact OH-CA 3.07Å; Y43-G89 PolarHBondContact OH-O 3.28Å; R86-G89 PolarHBondContact NH1-O 3.18Å; I87-G89 PolarHBondContact O-N 2.8Å; I87-G89 VanDerWaalsContact O-N 3.15Å
90	L	87.8	Confident	89.5	Confident	72 Å²	72	47.2 Å²	47.2	38%	0.377	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	143.6	174.1	-61.1	178.6	0	0	0	111.1	A73 R86 I87 Q88 W92	A73-L90 HydrophobicContact CB-CB 4.02Å; A73-L90 HydrophobicContact CB-CD1 4.07Å; A73-L90 HydrophobicContact CB-CG 4.46Å; R86-L90 WeakPolarHBondContact CA-O 3.36Å; I87-L90 PolarHBondContact N-O 2.88Å; I87-L90 WeakPolarHBondContact O-CB 3.16Å; I87-L90 PolarHBondContact O-N 3.47Å; Q88-L90 PolarHBondContact O-N 2.9Å; L90-W92 HydrophobicContact CD1-CZ2 4.49Å
91	A	90.9	Very high	89.6	Confident	10 Å²	10	45.5 Å²	45.5	8%	0.083	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	142.8	178.1	0	0	0	0	0	111.6	P70 C72 A73 I79 L84 Y85	P70-A91 HydrophobicContact CB-CB 4.08Å; C72-A91 CarbonylContact C-O 3.13Å; C72-A91 WeakPolarHBondContact CA-O 3.43Å; A73-A91 PolarHBondContact N-O 3.34Å; I79-A91 HydrophobicContact CD1-CB 3.69Å; L84-A91 HydrophobicContact CD1-CB 4.28Å; L84-A91 HydrophobicContact CD2-CB 4.49Å; Y85-A91 CarbonylContact O-C 3.58Å; Y85-A91 WeakPolarHBondContact O-CA 3.41Å
92	W	91.7	Very high	89.9	Confident	7 Å²	7	44.8 Å²	44.8	3%	0.027	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	140.5	-178.6	-55.9	76.8	0	0	0	110.7	A73 Y85 I87 L90 C96 A97 L118	A73-W92 HydrophobicContact CB-CD2 4.17Å; A73-W92 HydrophobicContact CB-CH2 4.13Å; A73-W92 HydrophobicContact CB-CZ2 3.72Å; Y85-W92 PolarHBondContact N-O 3.23Å; Y85-W92 PolarHBondContact O-N 3.32Å; I87-W92 HydrophobicContact CD1-CD2 4.41Å; I87-W92 HydrophobicContact CD1-CG 4.05Å; I87-W92 HydrophobicContact CG1-CG 4.46Å; L90-W92 HydrophobicContact CD1-CZ2 4.49Å; W92-C96 HydrophobicContact CE3-CB 4.39Å; W92-A97 HydrophobicContact CB-CB 4.48Å; W92-L118 HydrophobicContact CD2-CD1 3.99Å; W92-L118 HydrophobicContact CE3-CD1 3.75Å; W92-L118 HydrophobicContact CH2-CD1 3.84Å; W92-L118 HydrophobicContact CH2-CD2 4.26Å; W92-L118 HydrophobicContact CH2-CG 3.81Å; W92-L118 HydrophobicContact CZ2-CD1 4.06Å; W92-L118 HydrophobicContact CZ2-CD2 4.04Å; W92-L118 HydrophobicContact CZ2-CG 4.08Å; W92-L118 HydrophobicContact CZ3-CD1 3.67Å; W92-L118 HydrophobicContact CZ3-CG 4.09Å
93	H	92.4	Very high	90.1	Very high	19 Å²	19	42.5 Å²	42.5	9%	0.088	24%	0.243	C	C	.	.			trans	-61	154.2	161.1	-57.5	100	0	0	0	109.3	C72 C75 I79 D81 S95 C96 A97	C72-H93 VanDerWaalsContact CB-CE1 3.41Å; C72-H93 WeakPolarHBondContact CB-CE1 3.21Å; C72-H93 WeakPolarHBondContact CB-ND1 3.23Å; C72-H93 PolarHBondContact SG-ND1 2.99Å; C72-H93 VanDerWaalsContact SG-ND1 3.36Å; C75-H93 PolarHBondContact SG-CE1 2.91Å; C75-H93 PolarHBondContact SG-ND1 3.34Å; I79-H93 WeakPolarHBondContact CA-NE2 3.38Å; D81-H93 IonicContact OD2-CD2 3.29Å; D81-H93 PolarHBondContact OD2-CD2 2.85Å; D81-H93 IonicContact OD2-CG 3.56Å; H93-S95 VanDerWaalsContact C-N 3.3Å; H93-S95 PolarHBondContact O-N 2.88Å; H93-C96 HydrophobicContact CB-CB 4Å; H93-C96 PolarHBondContact O-N 3.12Å; H93-A97 PolarHBondContact O-N 2.99Å
94	E	89.6	Confident	90.3	Very high	51 Å²	51	41.8 Å²	41.8	24%	0.238	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-60.9	-43	178	-52.5	-167.1	149	0	0	111.1	R35 Y83 Y85 C96 A97	R35-E94 IonicContact CZ-OE1 2.67Å; R35-E94 IonicContact CZ-OE2 3.95Å; R35-E94 IonicContact NE-OE1 3.97Å; R35-E94 PolarHBondContact NE-OE1 3.12Å; R35-E94 IonicContact NE-OE2 2.89Å; R35-E94 IonicContact NH2-OE1 3.34Å; R35-E94 PolarHBondContact NH2-OE1 3.24Å; R35-E94 IonicContact NH2-OE2 3.17Å; R35-E94 PolarHBondContact NH2-OE2 3.35Å; Y83-E94 WeakPolarHBondContact CB-OE1 3.47Å; Y85-E94 HydrophobicContact CD2-CB 4.3Å; Y85-E94 HydrophobicContact CD2-CG 4.21Å; Y85-E94 HydrophobicContact CE2-CB 3.97Å; Y85-E94 HydrophobicContact CE2-CG 4.06Å; E94-C96 PolarHBondContact O-N 3.41Å; E94-A97 PolarHBondContact O-N 2.82Å
95	S	90.5	Very high	90.3	Very high	84 Å²	84	48 Å²	48	59%	0.587	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-66.7	-12.1	172.7	59	0	0	0	0	115.4	H93	H93-S95 VanDerWaalsContact C-N 3.3Å; H93-S95 PolarHBondContact O-N 2.88Å
96	C	91.8	Very high	90.3	Very high	25 Å²	25	47.4 Å²	47.4	17%	0.169	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-101.9	-12.7	178.1	-69.2	0	0	0	0	113	W92 H93 E94 I98	W92-C96 HydrophobicContact CE3-CB 4.39Å; H93-C96 HydrophobicContact CB-CB 4Å; H93-C96 PolarHBondContact O-N 3.12Å; E94-C96 PolarHBondContact O-N 3.41Å; C96-I98 PolarHBondContact O-N 3.48Å
97	A	91.5	Very high	89.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.291	C	S	.	.			trans	-83.6	62.8	176.2	0	0	0	0	0	110.4	Y85 I87 W92 H93 E94 L106	Y85-A97 HydrophobicContact CD2-CB 3.53Å; Y85-A97 HydrophobicContact CE2-CB 4.16Å; Y85-A97 HydrophobicContact CG-CB 4.19Å; I87-A97 HydrophobicContact CD1-CB 4.38Å; W92-A97 HydrophobicContact CB-CB 4.48Å; H93-A97 PolarHBondContact O-N 2.99Å; E94-A97 PolarHBondContact O-N 2.82Å; A97-L106 VanDerWaalsContact O-CB 3.29Å; A97-L106 WeakPolarHBondContact O-CB 3.38Å; A97-L106 WeakPolarHBondContact O-CG 3.48Å; A97-L106 PolarHBondContact O-N 3.08Å
98	I	92.4	Very high	89.3	Confident	65 Å²	65	52.2 Å²	52.2	33%	0.333	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-119.1	150.4	-176.1	62.4	172.2	0	0	0	112.4	C96 S100 V104 E105 L106	C96-I98 PolarHBondContact O-N 3.48Å; I98-S100 PolarHBondContact O-N 3.29Å; I98-V104 CarbonylContact C-O 3.59Å; I98-V104 WeakPolarHBondContact CA-O 3.34Å; I98-E105 HydrophobicContact CG2-CG 4.16Å; I98-L106 VanDerWaalsContact C-CD1 3.47Å
99	C	93.3	Very high	89.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	29%	0.291	C	S	.	.			trans	-69.7	125.1	174.5	177.9	0	0	0	0	111.4	V101 C102 S103 V104 L106 L118 C120	C99-V101 PolarHBondContact O-N 2.97Å; C99-C102 VanDerWaalsContact SG-SG 3.68Å; C99-S103 WeakPolarHBondContact O-CA 3.37Å; C99-S103 PolarHBondContact O-N 3.17Å; C99-V104 HydrophobicContact CB-CG1 4Å; C99-V104 PolarHBondContact N-O 3.08Å; C99-L106 HydrophobicContact CB-CD2 4.3Å; C99-L118 CarbonylContact C-O 3.55Å; C99-L118 WeakPolarHBondContact CA-O 3.2Å; C99-C120 HydrophobicContact CB-CB 4.11Å; C99-C120 PolarHBondContact SG-N 3.19Å; C99-C120 VanDerWaalsContact SG-N 3.38Å
100	S	91.8	Very high	89.6	Confident	71 Å²	71	47.6 Å²	47.6	50%	0.497	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-12.3	-180	63.6	0	0	0	0	115.3	I98 L118 L119	I98-S100 PolarHBondContact O-N 3.29Å; S100-L118 PolarHBondContact N-O 2.82Å; S100-L118 PolarHBondContact OG-O 3.29Å; S100-L119 WeakPolarHBondContact OG-CD2 3.38Å
101	V	91.8	Very high	89.6	Confident	72 Å²	72	44.4 Å²	44.4	44%	0.436	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-34.8	-176.4	172.9	0	0	0	0	113.2	C99 L119 D123 L127	C99-V101 PolarHBondContact O-N 2.97Å; V101-L119 HydrophobicContact CB-CD2 4.19Å; V101-L119 HydrophobicContact CG2-CD2 3.51Å; V101-D123 HydrophobicContact CB-CB 4.05Å; V101-D123 HydrophobicContact CG1-CB 3.95Å; V101-L127 HydrophobicContact CG2-CD1 3.88Å
102	C	93.9	Very high	89.4	Confident	45 Å²	45	44.7 Å²	44.7	30%	0.304	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.9	3.9	-178	68.5	0	0	0	0	115	C99 V104 R122 D123	C99-C102 VanDerWaalsContact SG-SG 3.68Å; C102-V104 PolarHBondContact O-N 2.79Å; C102-V104 VanDerWaalsContact SG-CG1 3.55Å; C102-R122 VanDerWaalsContact CB-NH2 3.3Å; C102-R122 PolarHBondContact SG-NH2 2.89Å; C102-D123 WeakPolarHBondContact CB-OD2 3.4Å; C102-D123 PolarHBondContact SG-OD2 3.43Å
103	S	92.4	Very high	89	Confident	87 Å²	87	45.2 Å²	45.2	61%	0.608	27%	0.265	S	S	*	.			trans	57.6	14.9	177.7	-51	0	0	0	0	116.2	C99	C99-S103 WeakPolarHBondContact O-CA 3.37Å; C99-S103 PolarHBondContact O-N 3.17Å
104	V	91.8	Very high	88.3	Confident	73 Å²	73	49.4 Å²	49.4	44%	0.442	29%	0.289	S	S	.	.			trans	-71.3	141	173.4	76.9	0	0	0	0	110.8	I98 C99 C102 C120	I98-V104 CarbonylContact C-O 3.59Å; I98-V104 WeakPolarHBondContact CA-O 3.34Å; C99-V104 HydrophobicContact CB-CG1 4Å; C99-V104 PolarHBondContact N-O 3.08Å; C102-V104 PolarHBondContact O-N 2.79Å; C102-V104 VanDerWaalsContact SG-CG1 3.55Å; V104-C120 HydrophobicContact CG1-CB 3.92Å
105	E	90	Very high	87.5	Confident	131 Å²	131	55.6 Å²	55.6	61%	0.612	32%	0.315	S	S	*	.	B	Isolated β-bridge	trans	-65.3	142.7	172.4	-65.1	173.9	-177.3	0	0	111.4	I98	I98-E105 HydrophobicContact CG2-CG 4.16Å
106	L	89.5	Confident	86.7	Confident	5 Å²	5	55.1 Å²	55.1	3%	0.026	31%	0.305	C	S	.	.			trans	-110	88.3	-171.4	-62.1	167.7	0	0	0	109.7	T33 A97 I98 C99 C110 L118 C120	T33-L106 HydrophobicContact CG2-CB 4.46Å; T33-L106 PolarHBondContact OG1-O 2.9Å; A97-L106 VanDerWaalsContact O-CB 3.29Å; A97-L106 WeakPolarHBondContact O-CB 3.38Å; A97-L106 WeakPolarHBondContact O-CG 3.48Å; A97-L106 PolarHBondContact O-N 3.08Å; I98-L106 VanDerWaalsContact C-CD1 3.47Å; C99-L106 HydrophobicContact CB-CD2 4.3Å; L106-C110 HydrophobicContact CB-CB 4.12Å; L106-C110 HydrophobicContact CD1-CB 3.75Å; L106-C110 HydrophobicContact CD2-CB 4.07Å; L106-C110 HydrophobicContact CG-CB 4.2Å; L106-L118 HydrophobicContact CD1-CB 3.56Å; L106-L118 HydrophobicContact CD1-CD1 4.11Å; L106-L118 HydrophobicContact CD1-CG 4.4Å; L106-C120 HydrophobicContact CD2-CB 3.67Å
107	V	81	Confident	86.3	Confident	78 Å²	78	57.9 Å²	57.9	47%	0.473	32%	0.316	S	S	.	.	S	Bend	trans	-89.2	-36.5	-167.5	-177.7	0	0	0	0	113.9	T33	T33-V107 PolarHBondContact OG1-O 3.16Å
108	E	75.5	Confident	86.3	Confident	59 Å²	59	58 Å²	58	28%	0.276	32%	0.317	S	S	.	.	S	Bend	trans	-118.6	-45.1	-177	-59	-177.6	-176.2	0	0	114.1	T33 H383 L384	T33-E108 PolarHBondContact N-O 3.27Å; T33-E108 VanDerWaalsContact N-O 3.1Å; T33-E108 VanDerWaalsContact OG1-CA 3.23Å; T33-E108 WeakPolarHBondContact OG1-CA 3.44Å; T33-E108 PolarHBondContact OG1-N 3.48Å; T33-E108 VanDerWaalsContact OG1-N 3.09Å; T33-E108 PolarHBondContact OG1-O 3.09Å; E108-H383 IonicContact OE1-CG 3.62Å; E108-H383 IonicContact OE1-ND1 2.73Å; E108-H383 PolarHBondContact OE1-ND1 3.11Å; E108-L384 HydrophobicContact CB-CD1 4.25Å; E108-L384 HydrophobicContact CG-CD2 4.13Å; E108-L384 WeakPolarHBondContact OE2-CG 3.5Å
109	V	83.2	Confident	86.2	Confident	45 Å²	45	55.1 Å²	55.1	27%	0.273	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	136.8	-176.1	-176.4	0	0	0	0	111.3	D30 C31 F111	D30-V109 HydrophobicContact CB-CG1 4.01Å; C31-V109 WeakPolarHBondContact O-CA 3.5Å; V109-F111 HydrophobicContact CG1-CE2 4.38Å
110	C	87.9	Confident	86.1	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	174.9	170.7	66.8	0	0	0	0	112.4	C31 T33 I87 L106 L119	C31-C110 WeakPolarHBondContact CA-O 3.46Å; C31-C110 VanDerWaalsContact CB-O 3.26Å; C31-C110 WeakPolarHBondContact CB-O 3.3Å; C31-C110 PolarHBondContact N-O 3.3Å; C31-C110 PolarHBondContact O-N 3.16Å; T33-C110 HydrophobicContact CG2-CB 4.17Å; T33-C110 VanDerWaalsContact CG2-SG 3.5Å; I87-C110 WeakPolarHBondContact CG2-SG 3.17Å; L106-C110 HydrophobicContact CB-CB 4.12Å; L106-C110 HydrophobicContact CD1-CB 3.75Å; L106-C110 HydrophobicContact CD2-CB 4.07Å; L106-C110 HydrophobicContact CG-CB 4.2Å; C110-L119 CarbonylContact C-O 3.51Å; C110-L119 WeakPolarHBondContact CA-O 3.29Å
111	F	88.1	Confident	85.9	Confident	5 Å²	5	56.5 Å²	56.5	2%	0.022	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	127	174.4	-65.6	-92.5	0	0	0	109.1	D30 V109 L119 H121 Y124	D30-F111 HydrophobicContact CB-CE1 4.37Å; D30-F111 HydrophobicContact CB-CZ 4.34Å; D30-F111 WeakPolarHBondContact OD1-CE1 3.4Å; V109-F111 HydrophobicContact CG1-CE2 4.38Å; F111-L119 HydrophobicContact CB-CB 4.41Å; F111-L119 PolarHBondContact N-O 2.92Å; F111-L119 PolarHBondContact O-N 3.08Å; F111-H121 HydrophobicContact CE2-CB 3.97Å; F111-Y124 HydrophobicContact CB-CD1 4.4Å; F111-Y124 HydrophobicContact CB-CD2 3.62Å; F111-Y124 HydrophobicContact CB-CE2 4.11Å; F111-Y124 HydrophobicContact CB-CG 3.78Å; F111-Y124 AromaticContact CD1-CD1 3.53Å; F111-Y124 HydrophobicContact CD1-CD1 3.53Å; F111-Y124 HydrophobicContact CD1-CD2 4.05Å; F111-Y124 AromaticContact CD1-CE1 3.47Å; F111-Y124 HydrophobicContact CD1-CE1 3.47Å; F111-Y124 VanDerWaalsContact CD1-CE1 3.47Å; F111-Y124 HydrophobicContact CD1-CE2 4.02Å; F111-Y124 AromaticContact CD1-CG 3.81Å; F111-Y124 HydrophobicContact CD1-CG 3.81Å; F111-Y124 AromaticContact CD1-CZ 3.72Å; F111-Y124 AromaticContact CD2-CD1 3.91Å; F111-Y124 HydrophobicContact CD2-CD1 3.91Å; F111-Y124 AromaticContact CD2-CG 3.82Å; F111-Y124 HydrophobicContact CD2-CG 3.82Å; F111-Y124 AromaticContact CE1-CD1 3.69Å; F111-Y124 HydrophobicContact CE1-CD1 3.69Å; F111-Y124 AromaticContact CE1-CE1 3.57Å; F111-Y124 HydrophobicContact CE1-CE1 3.57Å; F111-Y124 HydrophobicContact CE1-CG 4.4Å; F111-Y124 HydrophobicContact CE2-CD1 4.07Å; F111-Y124 HydrophobicContact CE2-CG 4.42Å; F111-Y124 AromaticContact CG-CD1 3.65Å; F111-Y124 HydrophobicContact CG-CD1 3.65Å; F111-Y124 AromaticContact CG-CD2 3.81Å; F111-Y124 HydrophobicContact CG-CD2 3.81Å; F111-Y124 HydrophobicContact CG-CE1 4.07Å; F111-Y124 HydrophobicContact CG-CE2 4.23Å; F111-Y124 AromaticContact CG-CG 3.5Å; F111-Y124 HydrophobicContact CG-CG 3.5Å; F111-Y124 VanDerWaalsContact CG-CG 3.5Å; F111-Y124 AromaticContact CZ-CD1 3.96Å; F111-Y124 HydrophobicContact CZ-CD1 3.96Å; F111-Y124 HydrophobicContact CZ-CE1 4.24Å
112	I	86.4	Confident	85.8	Confident	17 Å²	17	60.3 Å²	60.3	9%	0.087	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	124.4	171.9	-71.1	161.4	0	0	0	108.7	S28 I87 Q88 L118	S28-I112 VanDerWaalsContact CB-O 3.22Å; S28-I112 WeakPolarHBondContact CB-O 3.18Å; I87-I112 HydrophobicContact CG2-CD1 3.83Å; I87-I112 HydrophobicContact CG2-CG1 4.4Å; Q88-I112 HydrophobicContact CB-CD1 3.92Å; Q88-I112 HydrophobicContact CG-CD1 3.78Å; I112-L118 HydrophobicContact CD1-CD2 4.38Å; I112-L118 HydrophobicContact CG1-CD2 3.57Å
113	V	83.5	Confident	85.7	Confident	17 Å²	17	58.3 Å²	58.3	10%	0.103	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	150.6	171.5	-176	0	0	0	0	108.5	K115 N116 E117 L119 Y124 Y128	V113-K115 VanDerWaalsContact C-N 3.29Å; V113-K115 PolarHBondContact O-N 2.72Å; V113-K115 VanDerWaalsContact O-N 3.08Å; V113-N116 PolarHBondContact O-N 2.85Å; V113-E117 PolarHBondContact N-O 3.43Å; V113-E117 WeakPolarHBondContact O-CB 3.42Å; V113-E117 PolarHBondContact O-N 2.94Å; V113-L119 HydrophobicContact CB-CD1 4.3Å; V113-L119 HydrophobicContact CG2-CD1 3.68Å; V113-L119 HydrophobicContact CG2-CG 4.5Å; V113-Y124 HydrophobicContact CG2-CD2 4.12Å; V113-Y124 HydrophobicContact CG2-CE2 4.21Å; V113-Y128 HydrophobicContact CG1-CE1 4.45Å; V113-Y128 HydrophobicContact CG1-CE2 4.15Å; V113-Y128 HydrophobicContact CG2-CD2 4.3Å; V113-Y128 HydrophobicContact CG2-CE2 4.16Å
114	N	78.7	Confident	85.6	Confident	107 Å²	107	55 Å²	55	57%	0.572	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.5	45.3	175.8	-57.2	-33.2	0	0	0	114.9	N116 E117	N114-N116 PolarHBondContact O-N 2.95Å; N114-E117 HydrophobicContact CB-CG 4.35Å; N114-E117 WeakPolarHBondContact CB-OE2 3.23Å; N114-E117 PolarHBondContact ND2-OE2 3.29Å
115	K	71.9	Confident	85.4	Confident	182 Å²	182	53.5 Å²	53.5	79%	0.791	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	-31	178.6	-55.1	-177.5	177.6	-176.7	0	117.1	V113	V113-K115 VanDerWaalsContact C-N 3.29Å; V113-K115 PolarHBondContact O-N 2.72Å; V113-K115 VanDerWaalsContact O-N 3.08Å
116	N	73.2	Confident	85.3	Confident	73 Å²	73	55.9 Å²	55.9	39%	0.39	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143	0.8	-175.5	-75.1	99.9	0	0	0	115.3	A73 V113 N114	A73-N116 PolarHBondContact O-ND2 3.03Å; V113-N116 PolarHBondContact O-N 2.85Å; N114-N116 PolarHBondContact O-N 2.95Å
117	E	84.6	Confident	85.2	Confident	83 Å²	83	59.9 Å²	59.9	39%	0.388	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	111.9	178.8	-56.8	-176.6	125.6	0	0	110	V113 N114	V113-E117 PolarHBondContact N-O 3.43Å; V113-E117 WeakPolarHBondContact O-CB 3.42Å; V113-E117 PolarHBondContact O-N 2.94Å; N114-E117 HydrophobicContact CB-CG 4.35Å; N114-E117 WeakPolarHBondContact CB-OE2 3.23Å; N114-E117 PolarHBondContact ND2-OE2 3.29Å
118	L	90.6	Very high	85.5	Confident	4 Å²	4	59.3 Å²	59.3	2%	0.021	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	135.5	175	-62.1	177.4	0	0	0	110.9	I87 W92 C99 S100 L106 I112	I87-L118 HydrophobicContact CD1-CD1 3.9Å; I87-L118 HydrophobicContact CD1-CD2 4.16Å; I87-L118 HydrophobicContact CG2-CD2 4.34Å; W92-L118 HydrophobicContact CD2-CD1 3.99Å; W92-L118 HydrophobicContact CE3-CD1 3.75Å; W92-L118 HydrophobicContact CH2-CD1 3.84Å; W92-L118 HydrophobicContact CH2-CD2 4.26Å; W92-L118 HydrophobicContact CH2-CG 3.81Å; W92-L118 HydrophobicContact CZ2-CD1 4.06Å; W92-L118 HydrophobicContact CZ2-CD2 4.04Å; W92-L118 HydrophobicContact CZ2-CG 4.08Å; W92-L118 HydrophobicContact CZ3-CD1 3.67Å; W92-L118 HydrophobicContact CZ3-CG 4.09Å; C99-L118 CarbonylContact C-O 3.55Å; C99-L118 WeakPolarHBondContact CA-O 3.2Å; S100-L118 PolarHBondContact N-O 2.82Å; S100-L118 PolarHBondContact OG-O 3.29Å; L106-L118 HydrophobicContact CD1-CB 3.56Å; L106-L118 HydrophobicContact CD1-CD1 4.11Å; L106-L118 HydrophobicContact CD1-CG 4.4Å; I112-L118 HydrophobicContact CD1-CD2 4.38Å; I112-L118 HydrophobicContact CG1-CD2 3.57Å
119	L	91.2	Very high	86	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.021	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	145.6	175.9	-64.3	175.7	0	0	0	111.8	S100 V101 C110 F111 V113 Y124 Y128	S100-L119 WeakPolarHBondContact OG-CD2 3.38Å; V101-L119 HydrophobicContact CB-CD2 4.19Å; V101-L119 HydrophobicContact CG2-CD2 3.51Å; C110-L119 CarbonylContact C-O 3.51Å; C110-L119 WeakPolarHBondContact CA-O 3.29Å; F111-L119 HydrophobicContact CB-CB 4.41Å; F111-L119 PolarHBondContact N-O 2.92Å; F111-L119 PolarHBondContact O-N 3.08Å; V113-L119 HydrophobicContact CB-CD1 4.3Å; V113-L119 HydrophobicContact CG2-CD1 3.68Å; V113-L119 HydrophobicContact CG2-CG 4.5Å; L119-Y124 HydrophobicContact CD1-CD2 4.37Å; L119-Y128 HydrophobicContact CD1-CD2 3.96Å; L119-Y128 HydrophobicContact CD1-CE2 3.59Å
120	C	91	Very high	86.2	Confident	15 Å²	15	58.1 Å²	58.1	10%	0.101	27%	0.271	C	S	.	.			trans	-77.2	157.7	165.6	74.2	0	0	0	0	110.3	C99 V104 L106 R122 D123 Y124	C99-C120 HydrophobicContact CB-CB 4.11Å; C99-C120 PolarHBondContact SG-N 3.19Å; C99-C120 VanDerWaalsContact SG-N 3.38Å; V104-C120 HydrophobicContact CG1-CB 3.92Å; L106-C120 HydrophobicContact CD2-CB 3.67Å; C120-R122 VanDerWaalsContact C-N 3.26Å; C120-R122 PolarHBondContact O-N 3.5Å; C120-D123 PolarHBondContact O-N 3.1Å; C120-D123 VanDerWaalsContact O-N 3.15Å; C120-D123 PolarHBondContact SG-OD2 3.04Å; C120-Y124 WeakPolarHBondContact O-CB 3.2Å; C120-Y124 PolarHBondContact O-N 3.04Å
121	H	87.6	Confident	86.2	Confident	84 Å²	84	61.9 Å²	61.9	39%	0.389	29%	0.287	S	S	.	.	H	α-helix	trans	-50.9	-42.4	-179.5	-171.9	-45.6	0	0	0	113.3	F111 D123 D125	F111-H121 HydrophobicContact CE2-CB 3.97Å; H121-D123 PolarHBondContact O-N 2.88Å; H121-D125 IonicContact CE1-OD1 3.72Å; H121-D125 IonicContact CE1-OD2 3.02Å; H121-D125 PolarHBondContact CE1-OD2 3.02Å; H121-D125 IonicContact ND1-OD1 3.7Å; H121-D125 IonicContact ND1-OD2 3.82Å; H121-D125 PolarHBondContact ND1-OD2 2.86Å; H121-D125 WeakPolarHBondContact O-CB 3.29Å; H121-D125 PolarHBondContact O-N 3.39Å
122	R	89.4	Confident	86.4	Confident	153 Å²	153	61.7 Å²	61.7	58%	0.577	29%	0.287	S	S	*	.	H	α-helix	trans	-61.9	-45.2	-179.1	-176.1	-169.1	67.3	-148.1	-10.1	112.5	C102 C120 R126	C102-R122 VanDerWaalsContact CB-NH2 3.3Å; C102-R122 PolarHBondContact SG-NH2 2.89Å; C120-R122 VanDerWaalsContact C-N 3.26Å; C120-R122 PolarHBondContact O-N 3.5Å; R122-R126 VanDerWaalsContact O-CB 3.29Å; R122-R126 WeakPolarHBondContact O-CB 3.42Å; R122-R126 PolarHBondContact O-N 3.34Å
123	D	91.3	Very high	86.7	Confident	3 Å²	3	62.3 Å²	62.3	2%	0.016	30%	0.297	C	S	.	.	H	α-helix	trans	-84.3	-27.7	-174.6	-63.2	-39.1	0	0	0	111.3	V101 C102 C120 H121 R126 L127	V101-D123 HydrophobicContact CB-CB 4.05Å; V101-D123 HydrophobicContact CG1-CB 3.95Å; C102-D123 WeakPolarHBondContact CB-OD2 3.4Å; C102-D123 PolarHBondContact SG-OD2 3.43Å; C120-D123 PolarHBondContact O-N 3.1Å; C120-D123 VanDerWaalsContact O-N 3.15Å; C120-D123 PolarHBondContact SG-OD2 3.04Å; H121-D123 PolarHBondContact O-N 2.88Å; D123-R126 PolarHBondContact O-N 3.22Å; D123-L127 WeakPolarHBondContact O-CB 3.43Å; D123-L127 VanDerWaalsContact O-CG 3.28Å; D123-L127 WeakPolarHBondContact O-CG 3.48Å; D123-L127 PolarHBondContact O-N 2.68Å
124	Y	90.3	Very high	87.1	Confident	18 Å²	18	63.6 Å²	63.6	7%	0.071	30%	0.303	C	S	.	.	H	α-helix	trans	-61.7	-48.3	164.6	-179.3	-103.5	0	0	0	112.1	H27 F111 V113 L119 C120 R126 L127 Y128 A129	H27-Y124 WeakPolarHBondContact CA-OH 3.24Å; H27-Y124 WeakPolarHBondContact CB-OH 3.38Å; H27-Y124 PolarHBondContact ND1-OH 3.47Å; H27-Y124 VanDerWaalsContact ND1-OH 3.14Å; F111-Y124 HydrophobicContact CB-CD1 4.4Å; F111-Y124 HydrophobicContact CB-CD2 3.62Å; F111-Y124 HydrophobicContact CB-CE2 4.11Å; F111-Y124 HydrophobicContact CB-CG 3.78Å; F111-Y124 AromaticContact CD1-CD1 3.53Å; F111-Y124 HydrophobicContact CD1-CD1 3.53Å; F111-Y124 HydrophobicContact CD1-CD2 4.05Å; F111-Y124 AromaticContact CD1-CE1 3.47Å; F111-Y124 HydrophobicContact CD1-CE1 3.47Å; F111-Y124 VanDerWaalsContact CD1-CE1 3.47Å; F111-Y124 HydrophobicContact CD1-CE2 4.02Å; F111-Y124 AromaticContact CD1-CG 3.81Å; F111-Y124 HydrophobicContact CD1-CG 3.81Å; F111-Y124 AromaticContact CD1-CZ 3.72Å; F111-Y124 AromaticContact CD2-CD1 3.91Å; F111-Y124 HydrophobicContact CD2-CD1 3.91Å; F111-Y124 AromaticContact CD2-CG 3.82Å; F111-Y124 HydrophobicContact CD2-CG 3.82Å; F111-Y124 AromaticContact CE1-CD1 3.69Å; F111-Y124 HydrophobicContact CE1-CD1 3.69Å; F111-Y124 AromaticContact CE1-CE1 3.57Å; F111-Y124 HydrophobicContact CE1-CE1 3.57Å; F111-Y124 HydrophobicContact CE1-CG 4.4Å; F111-Y124 HydrophobicContact CE2-CD1 4.07Å; F111-Y124 HydrophobicContact CE2-CG 4.42Å; F111-Y124 AromaticContact CG-CD1 3.65Å; F111-Y124 HydrophobicContact CG-CD1 3.65Å; F111-Y124 AromaticContact CG-CD2 3.81Å; F111-Y124 HydrophobicContact CG-CD2 3.81Å; F111-Y124 HydrophobicContact CG-CE1 4.07Å; F111-Y124 HydrophobicContact CG-CE2 4.23Å; F111-Y124 AromaticContact CG-CG 3.5Å; F111-Y124 HydrophobicContact CG-CG 3.5Å; F111-Y124 VanDerWaalsContact CG-CG 3.5Å; F111-Y124 AromaticContact CZ-CD1 3.96Å; F111-Y124 HydrophobicContact CZ-CD1 3.96Å; F111-Y124 HydrophobicContact CZ-CE1 4.24Å; V113-Y124 HydrophobicContact CG2-CD2 4.12Å; V113-Y124 HydrophobicContact CG2-CE2 4.21Å; L119-Y124 HydrophobicContact CD1-CD2 4.37Å; C120-Y124 WeakPolarHBondContact O-CB 3.2Å; C120-Y124 PolarHBondContact O-N 3.04Å; Y124-R126 VanDerWaalsContact C-N 3.33Å; Y124-R126 PolarHBondContact O-N 2.78Å; Y124-L127 PolarHBondContact O-N 3.43Å; Y124-Y128 AromaticContact CD2-CD2 3.86Å; Y124-Y128 HydrophobicContact CD2-CD2 3.86Å; Y124-Y128 HydrophobicContact CD2-CG 4.34Å; Y124-Y128 HydrophobicContact CE2-CD2 4.25Å; Y124-Y128 HydrophobicContact CE2-CG 4.33Å; Y124-Y128 WeakPolarHBondContact O-CA 3.16Å; Y124-Y128 PolarHBondContact O-N 3.44Å; Y124-A129 PolarHBondContact O-N 3.01Å
125	D	88.6	Confident	87.8	Confident	40 Å²	40	60.7 Å²	60.7	21%	0.214	29%	0.291	C	S	.	.	H	α-helix	trans	-58.3	-44.7	173.8	-88.4	-18.1	0	0	0	112.3	H121 L127 A129 K131 P138	H121-D125 IonicContact CE1-OD1 3.72Å; H121-D125 IonicContact CE1-OD2 3.02Å; H121-D125 PolarHBondContact CE1-OD2 3.02Å; H121-D125 IonicContact ND1-OD1 3.7Å; H121-D125 IonicContact ND1-OD2 3.82Å; H121-D125 PolarHBondContact ND1-OD2 2.86Å; H121-D125 WeakPolarHBondContact O-CB 3.29Å; H121-D125 PolarHBondContact O-N 3.39Å; D125-L127 VanDerWaalsContact C-N 3.33Å; D125-L127 PolarHBondContact O-N 3.3Å; D125-A129 HydrophobicContact CB-CB 4.42Å; D125-K131 WeakPolarHBondContact O-CE 3.45Å; D125-K131 PolarHBondContact O-NZ 3.36Å; D125-P138 HydrophobicContact CB-CB 4.43Å; D125-P138 HydrophobicContact CB-CG 3.69Å
126	R	86.9	Confident	88.7	Confident	181 Å²	181	61.5 Å²	61.5	68%	0.683	29%	0.289	S	S	*	.	H	α-helix	trans	-61.2	-41.3	-179.4	-173.6	178.5	-179.5	-173.8	0.3	111.9	R122 D123 Y124 K131	R122-R126 VanDerWaalsContact O-CB 3.29Å; R122-R126 WeakPolarHBondContact O-CB 3.42Å; R122-R126 PolarHBondContact O-N 3.34Å; D123-R126 PolarHBondContact O-N 3.22Å; Y124-R126 VanDerWaalsContact C-N 3.33Å; Y124-R126 PolarHBondContact O-N 2.78Å; R126-K131 PolarHBondContact O-NZ 2.76Å
127	L	87.3	Confident	89.5	Confident	90 Å²	90	63.7 Å²	63.7	47%	0.471	30%	0.297	S	S	.	.	H	α-helix	trans	-95	-38.2	-172.7	-64.9	173.8	0	0	0	114.4	V101 D123 Y124 D125	V101-L127 HydrophobicContact CG2-CD1 3.88Å; D123-L127 WeakPolarHBondContact O-CB 3.43Å; D123-L127 VanDerWaalsContact O-CG 3.28Å; D123-L127 WeakPolarHBondContact O-CG 3.48Å; D123-L127 PolarHBondContact O-N 2.68Å; Y124-L127 PolarHBondContact O-N 3.43Å; D125-L127 VanDerWaalsContact C-N 3.33Å; D125-L127 PolarHBondContact O-N 3.3Å
128	Y	87.5	Confident	89.7	Confident	65 Å²	65	60.9 Å²	60.9	26%	0.255	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	-21.8	-164.9	-60.9	-70.2	0	0	0	115.7	H27 V113 L119 Y124 T130	H27-Y128 PolarHBondContact CE1-O 2.97Å; V113-Y128 HydrophobicContact CG1-CE1 4.45Å; V113-Y128 HydrophobicContact CG1-CE2 4.15Å; V113-Y128 HydrophobicContact CG2-CD2 4.3Å; V113-Y128 HydrophobicContact CG2-CE2 4.16Å; L119-Y128 HydrophobicContact CD1-CD2 3.96Å; L119-Y128 HydrophobicContact CD1-CE2 3.59Å; Y124-Y128 AromaticContact CD2-CD2 3.86Å; Y124-Y128 HydrophobicContact CD2-CD2 3.86Å; Y124-Y128 HydrophobicContact CD2-CG 4.34Å; Y124-Y128 HydrophobicContact CE2-CD2 4.25Å; Y124-Y128 HydrophobicContact CE2-CG 4.33Å; Y124-Y128 WeakPolarHBondContact O-CA 3.16Å; Y124-Y128 PolarHBondContact O-N 3.44Å; Y128-T130 PolarHBondContact O-N 3.25Å
129	A	86	Confident	89.5	Confident	14 Å²	14	61.5 Å²	61.5	12%	0.116	29%	0.289	C	S	.	.			trans	-66.9	134.8	179.4	0	0	0	0	0	112.3	Y124 D125 K131 P138	Y124-A129 PolarHBondContact O-N 3.01Å; D125-A129 HydrophobicContact CB-CB 4.42Å; A129-K131 VanDerWaalsContact O-CE 3.29Å; A129-K131 WeakPolarHBondContact O-CE 3.26Å; A129-K131 WeakPolarHBondContact O-CG 3.17Å; A129-P138 HydrophobicContact CB-CB 3.81Å; A129-P138 HydrophobicContact CB-CG 4.27Å
130	T	87.4	Confident	89.1	Confident	65 Å²	65	67.8 Å²	67.8	40%	0.399	31%	0.312	S	S	.	.			trans	-65.7	135.3	169	-33.7	0	0	0	0	109	Y128 M139 I170	Y128-T130 PolarHBondContact O-N 3.25Å; T130-M139 WeakPolarHBondContact O-CB 3.29Å; T130-M139 WeakPolarHBondContact O-CG 3.12Å; T130-M139 PolarHBondContact O-N 3.4Å; T130-I170 HydrophobicContact CG2-CD1 3.48Å; T130-I170 VanDerWaalsContact CG2-CD1 3.48Å; T130-I170 HydrophobicContact CG2-CG1 4.4Å
131	K	88.8	Confident	88.5	Confident	80 Å²	80	70 Å²	70	35%	0.348	33%	0.328	S	S	.	.	B	Isolated β-bridge	trans	-120	146.3	-166.4	-75.3	150.1	-172.1	154.3	0	112.4	D125 R126 A129 G133 R136 Q137	D125-K131 WeakPolarHBondContact O-CE 3.45Å; D125-K131 PolarHBondContact O-NZ 3.36Å; R126-K131 PolarHBondContact O-NZ 2.76Å; A129-K131 VanDerWaalsContact O-CE 3.29Å; A129-K131 WeakPolarHBondContact O-CE 3.26Å; A129-K131 WeakPolarHBondContact O-CG 3.17Å; K131-G133 PolarHBondContact O-N 2.93Å; K131-R136 WeakPolarHBondContact CG-O 3.27Å; K131-Q137 VanDerWaalsContact CA-O 3.32Å; K131-Q137 WeakPolarHBondContact CA-O 3.28Å
132	C	93.3	Very high	88	Confident	1 Å²	1	73 Å²	73	1%	0.007	34%	0.342	C	S	.	.			trans	-61.2	128.2	175.9	172.8	0	0	0	0	111.4	N134 C135 R136 Q137 M139 I170 H172 C175	C132-N134 PolarHBondContact O-N 2.93Å; C132-N134 VanDerWaalsContact O-N 3.1Å; C132-C135 VanDerWaalsContact CB-SG 3.54Å; C132-R136 WeakPolarHBondContact O-CA 3.27Å; C132-R136 PolarHBondContact O-N 3.03Å; C132-Q137 PolarHBondContact N-O 3.35Å; C132-M139 HydrophobicContact CB-SD 3.66Å; C132-I170 CarbonylContact C-O 3.56Å; C132-I170 WeakPolarHBondContact CA-O 3.44Å; C132-H172 WeakPolarHBondContact CB-CE1 3.24Å; C132-H172 VanDerWaalsContact CB-ND1 3.29Å; C132-H172 WeakPolarHBondContact CB-ND1 3.41Å; C132-C175 VanDerWaalsContact SG-CB 3.53Å
133	G	90.7	Very high	87.8	Confident	30 Å²	30	67.4 Å²	67.4	31%	0.309	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-20.3	-179.2	0	0	0	0	0	115	K131 I170	K131-G133 PolarHBondContact O-N 2.93Å; G133-I170 PolarHBondContact N-O 3.37Å
134	N	92.3	Very high	87.7	Confident	43 Å²	43	70.7 Å²	70.7	23%	0.23	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-60.8	-179.8	-168.8	25.9	0	0	0	111.9	C132 F171 C175 R199	C132-N134 PolarHBondContact O-N 2.93Å; C132-N134 VanDerWaalsContact O-N 3.1Å; N134-F171 HydrophobicContact CB-CD1 3.78Å; N134-F171 HydrophobicContact CB-CE1 4.03Å; N134-C175 HydrophobicContact CB-CB 4.26Å; N134-C175 PolarHBondContact ND2-O 3.26Å; N134-R199 PolarHBondContact OD1-NE 2.79Å
135	C	93.7	Very high	87.7	Confident	47 Å²	47	70.1 Å²	70.1	32%	0.318	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-7.5	-175.2	73.5	0	0	0	0	115	C132 Q137 H172 C175	C132-C135 VanDerWaalsContact CB-SG 3.54Å; C135-Q137 PolarHBondContact O-N 3.03Å; C135-H172 PolarHBondContact SG-CE1 2.56Å; C135-H172 PolarHBondContact SG-ND1 2.93Å; C135-H172 VanDerWaalsContact SG-ND1 3.39Å; C135-C175 VanDerWaalsContact SG-SG 3.68Å
136	R	91.2	Very high	87.9	Confident	198 Å²	198	68.7 Å²	68.7	75%	0.747	33%	0.329	S	S	*	.			trans	60.1	7.9	179.3	-56.9	-177.4	179.2	-122.7	-4.2	116.4	K131 C132	K131-R136 WeakPolarHBondContact CG-O 3.27Å; C132-R136 WeakPolarHBondContact O-CA 3.27Å; C132-R136 PolarHBondContact O-N 3.03Å
137	Q	90.4	Very high	88.1	Confident	120 Å²	120	64.5 Å²	64.5	56%	0.561	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-75.3	153.7	172.7	-59.7	-55.8	-36.3	0	0	111.6	K131 C132 C135 H172	K131-Q137 VanDerWaalsContact CA-O 3.32Å; K131-Q137 WeakPolarHBondContact CA-O 3.28Å; C132-Q137 PolarHBondContact N-O 3.35Å; C135-Q137 PolarHBondContact O-N 3.03Å; Q137-H172 VanDerWaalsContact C-CE1 3.45Å; Q137-H172 WeakPolarHBondContact CB-CE1 3.37Å; Q137-H172 PolarHBondContact O-CE1 3.47Å
138	P	88.3	Confident	88.2	Confident	23 Å²	23	60.4 Å²	60.4	15%	0.149	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-51	143.1	170	-27.6	36	0	0	0	113.2	D125 A129 H172	D125-P138 HydrophobicContact CB-CB 4.43Å; D125-P138 HydrophobicContact CB-CG 3.69Å; A129-P138 HydrophobicContact CB-CB 3.81Å; A129-P138 HydrophobicContact CB-CG 4.27Å; P138-H172 VanDerWaalsContact C-NE2 3.31Å; P138-H172 PolarHBondContact O-CE1 2.73Å; P138-H172 PolarHBondContact O-NE2 3.37Å
139	M	87.2	Confident	88	Confident	17 Å²	17	65.3 Å²	65.3	8%	0.084	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-91	121.1	170	-60.9	-61.8	-44.3	0	0	109.2	T130 C132 F145 I170 H172	T130-M139 WeakPolarHBondContact O-CB 3.29Å; T130-M139 WeakPolarHBondContact O-CG 3.12Å; T130-M139 PolarHBondContact O-N 3.4Å; C132-M139 HydrophobicContact CB-SD 3.66Å; M139-F145 HydrophobicContact CE-CB 3.59Å; M139-F145 HydrophobicContact CE-CD1 4.48Å; M139-F145 HydrophobicContact CE-CG 4.45Å; M139-I170 HydrophobicContact CB-CD1 4.49Å; M139-I170 HydrophobicContact CG-CD1 3.7Å; M139-I170 HydrophobicContact CG-CG1 4.14Å; M139-H172 WeakPolarHBondContact CA-NE2 3.29Å; M139-H172 HydrophobicContact CE-CB 4.5Å; M139-H172 VanDerWaalsContact CE-CD2 3.47Å; M139-H172 WeakPolarHBondContact CE-CD2 3.47Å
140	R	81.8	Confident	87.6	Confident	137 Å²	137	66.7 Å²	66.7	52%	0.517	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-82.1	152.5	179.8	-56.5	-171.6	177.9	97.2	-5.7	112.6	H142 E143	R140-H142 VanDerWaalsContact CD-CE1 3.5Å; R140-H142 WeakPolarHBondContact CD-CE1 3.48Å; R140-H142 PolarHBondContact O-N 3.26Å; R140-H142 VanDerWaalsContact O-N 3.16Å; R140-E143 HydrophobicContact CB-CB 4.38Å; R140-E143 VanDerWaalsContact CB-CD 3.48Å; R140-E143 HydrophobicContact CB-CG 3.89Å; R140-E143 WeakPolarHBondContact CD-OE1 3.39Å; R140-E143 HydrophobicContact CG-CG 4.49Å; R140-E143 WeakPolarHBondContact CG-OE1 3.32Å; R140-E143 IonicContact CZ-OE1 2.97Å; R140-E143 PolarHBondContact N-OE2 3.07Å; R140-E143 IonicContact NE-OE1 2.68Å; R140-E143 IonicContact NH1-OE1 3.7Å; R140-E143 PolarHBondContact NH1-OE1 3.13Å; R140-E143 PolarHBondContact O-N 2.84Å
141	S	79.8	Confident	86.4	Confident	62 Å²	62	66.5 Å²	66.5	43%	0.434	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-22.7	-178.8	56.9	0	0	0	0	115.2
142	H	76.8	Confident	84.8	Confident	146 Å²	146	66.6 Å²	66.6	68%	0.676	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-4.7	177.3	60	-102.9	0	0	0	113.8	R140	R140-H142 VanDerWaalsContact CD-CE1 3.5Å; R140-H142 WeakPolarHBondContact CD-CE1 3.48Å; R140-H142 PolarHBondContact O-N 3.26Å; R140-H142 VanDerWaalsContact O-N 3.16Å
143	E	84.4	Confident	82.8	Confident	36 Å²	36	75 Å²	75	17%	0.168	37%	0.365	C	S	.	.			trans	-83.5	144.7	-179.2	-74.3	166.3	-179	0	0	111.1	R140 H172	R140-E143 HydrophobicContact CB-CB 4.38Å; R140-E143 VanDerWaalsContact CB-CD 3.48Å; R140-E143 HydrophobicContact CB-CG 3.89Å; R140-E143 WeakPolarHBondContact CD-OE1 3.39Å; R140-E143 HydrophobicContact CG-CG 4.49Å; R140-E143 WeakPolarHBondContact CG-OE1 3.32Å; R140-E143 IonicContact CZ-OE1 2.97Å; R140-E143 PolarHBondContact N-OE2 3.07Å; R140-E143 IonicContact NE-OE1 2.68Å; R140-E143 IonicContact NH1-OE1 3.7Å; R140-E143 PolarHBondContact NH1-OE1 3.13Å; R140-E143 PolarHBondContact O-N 2.84Å; E143-H172 IonicContact OE2-CD2 2.85Å; E143-H172 PolarHBondContact OE2-CD2 3.21Å; E143-H172 IonicContact OE2-NE2 3.92Å; E143-H172 PolarHBondContact OE2-NE2 2.76Å
144	L	89.5	Confident	80.8	Confident	72 Å²	72	78.8 Å²	78.8	38%	0.377	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	144.8	168.1	-68.8	169.1	0	0	0	109.4	V173 L454 R456	L144-V173 HydrophobicContact CB-CG2 4.04Å; L144-L454 HydrophobicContact CB-CD1 4.14Å; L144-L454 HydrophobicContact CD1-CD1 4.42Å; L144-L454 HydrophobicContact CD1-CD2 4.36Å; L144-L454 HydrophobicContact CD2-CD1 4.46Å; L144-L454 HydrophobicContact CD2-CG 4.29Å; L144-R456 HydrophobicContact CD2-CG 3.56Å
145	F	91.2	Very high	78.6	Confident	5 Å²	5	85.3 Å²	85.3	2%	0.022	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	156.4	178.8	58.4	-109.2	0	0	0	111.8	M139 R147 F171 V455 Y457	M139-F145 HydrophobicContact CE-CB 3.59Å; M139-F145 HydrophobicContact CE-CD1 4.48Å; M139-F145 HydrophobicContact CE-CG 4.45Å; F145-R147 HydrophobicContact CD2-CG 3.86Å; F145-R147 HydrophobicContact CE2-CG 3.6Å; F145-F171 CarbonylContact C-O 3.55Å; F145-F171 WeakPolarHBondContact CA-O 3.27Å; F145-F171 WeakPolarHBondContact CB-O 3.35Å; F145-V455 HydrophobicContact CE2-CB 3.76Å; F145-V455 HydrophobicContact CE2-CG1 4.33Å; F145-V455 HydrophobicContact CZ-CB 3.99Å; F145-V455 HydrophobicContact CZ-CG1 4.1Å; F145-Y457 HydrophobicContact CE1-CD2 4.23Å
146	M	91.6	Very high	76	Confident	10 Å²	10	88.9 Å²	88.9	5%	0.049	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	135.2	166.9	-62.1	-68	-73.9	0	0	108.4	I170 F171 V173 F176	M146-I170 WeakPolarHBondContact O-CA 3.4Å; M146-F171 PolarHBondContact N-O 2.97Å; M146-F171 PolarHBondContact O-N 2.97Å; M146-V173 HydrophobicContact CG-CG2 4.33Å; M146-F176 HydrophobicContact CB-CB 4Å; M146-F176 HydrophobicContact CB-CD1 4.23Å; M146-F176 HydrophobicContact CB-CD2 3.73Å; M146-F176 HydrophobicContact CB-CE2 4.26Å; M146-F176 HydrophobicContact CB-CG 3.72Å; M146-F176 HydrophobicContact CE-CD1 3.74Å; M146-F176 HydrophobicContact CE-CE1 3.85Å; M146-F176 HydrophobicContact CE-CG 4.4Å; M146-F176 HydrophobicContact CG-CB 3.71Å; M146-F176 HydrophobicContact CG-CD1 4.03Å; M146-F176 HydrophobicContact CG-CD2 4.3Å; M146-F176 HydrophobicContact CG-CG 3.75Å
147	R	90.9	Very high	73.6	Confident	94 Å²	94	83.9 Å²	83.9	36%	0.355	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	143.5	167	-64.4	-167.9	173.1	167.7	8.5	110.3	F145 E168 L169 I170	F145-R147 HydrophobicContact CD2-CG 3.86Å; F145-R147 HydrophobicContact CE2-CG 3.6Å; R147-E168 WeakPolarHBondContact CD-OE2 3.5Å; R147-E168 IonicContact CZ-OE2 2.94Å; R147-E168 IonicContact NE-OE2 3.97Å; R147-E168 IonicContact NH1-OE2 3.87Å; R147-E168 PolarHBondContact NH1-OE2 2.33Å; R147-L169 WeakPolarHBondContact CA-O 3.34Å; R147-I170 HydrophobicContact CG-CG2 4.26Å
148	A	89.9	Confident	71.6	Confident	3 Å²	3	85.1 Å²	85.1	3%	0.025	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	145.6	167	0	0	0	0	0	110.5	L169 F171 F176 Y191 I193	A148-L169 PolarHBondContact N-O 3.49Å; A148-L169 PolarHBondContact O-N 2.99Å; A148-F171 HydrophobicContact CB-CE2 4.29Å; A148-F176 HydrophobicContact CB-CE2 4.18Å; A148-Y191 HydrophobicContact CB-CE2 3.9Å; A148-Y191 WeakPolarHBondContact CB-OH 3.47Å; A148-I193 HydrophobicContact CB-CD1 3.63Å; A148-I193 HydrophobicContact CB-CG1 3.87Å
149	K	84	Confident	69.1	Low	169 Å²	169	91.8 Å²	91.8	74%	0.735	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	130.4	175.9	-64.7	-179.4	-179.8	178.4	0	109.3	S151	K149-S151 PolarHBondContact O-N 3.45Å
150	H	76.8	Confident	66.9	Low	42 Å²	42	94.9 Å²	94.9	19%	0.194	48%	0.484	C	S	.	.			trans	-66.9	132.7	172.8	-174.1	-72.3	0	0	0	110.3	T152 L169 C198	H150-T152 VanDerWaalsContact C-N 3.27Å; H150-T152 WeakPolarHBondContact ND1-CG2 3.44Å; H150-T152 PolarHBondContact ND1-N 3.24Å; H150-T152 PolarHBondContact O-N 2.85Å; H150-L169 HydrophobicContact CB-CD1 4.17Å; H150-L169 HydrophobicContact CB-CG 4.19Å; H150-C198 VanDerWaalsContact CD2-SG 3.59Å; H150-C198 PolarHBondContact NE2-SG 3.46Å; H150-C198 VanDerWaalsContact NE2-SG 3.43Å
151	S	62.7	Low	65	Low	62 Å²	62	95.1 Å²	95.1	43%	0.434	50%	0.501	S	S	.	.			trans	-78.8	70.6	176.7	-165	0	0	0	0	111.7	K149 F153	K149-S151 PolarHBondContact O-N 3.45Å; S151-F153 PolarHBondContact O-N 2.87Å; S151-F153 VanDerWaalsContact O-N 3.08Å
152	T	55.2	Low	63.1	Low	82 Å²	82	99.4 Å²	99.4	50%	0.503	52%	0.519	S	S	.	.			trans	-79	79.2	174.8	47.6	0	0	0	0	111.8	H150	H150-T152 VanDerWaalsContact C-N 3.27Å; H150-T152 WeakPolarHBondContact ND1-CG2 3.44Å; H150-T152 PolarHBondContact ND1-N 3.24Å; H150-T152 PolarHBondContact O-N 2.85Å
153	F	50.4	Low	61.3	Low	177 Å²	177	95.5 Å²	95.5	78%	0.776	51%	0.508	S	S	*	.			trans	-114.3	4.5	157.4	-142.1	-94.3	0	0	0	113.7	S151 K155	S151-F153 PolarHBondContact O-N 2.87Å; S151-F153 VanDerWaalsContact O-N 3.08Å; F153-K155 VanDerWaalsContact C-N 3.33Å; F153-K155 PolarHBondContact O-N 3.18Å
154	V	47.9	Very low	59.2	Low	110 Å²	110	98.8 Å²	98.8	67%	0.667	54%	0.535	S	S	*	.			trans	-73.3	88.8	166.8	-173.6	0	0	0	0	108.9	N156	V154-N156 VanDerWaalsContact C-N 3.27Å; V154-N156 HydrophobicContact CG1-CB 4.37Å; V154-N156 PolarHBondContact O-N 3.29Å
155	K	47.3	Very low	57.2	Low	180 Å²	180	100.9 Å²	100.9	78%	0.783	55%	0.546	S	S	*	.			trans	-66.2	88	162.1	-70.2	-178.6	-178.8	176.8	0	108.3	F153 P157	F153-K155 VanDerWaalsContact C-N 3.33Å; F153-K155 PolarHBondContact O-N 3.18Å; K155-P157 VanDerWaalsContact O-CD 3.3Å; K155-P157 WeakPolarHBondContact O-CD 3.44Å
156	N	38.9	Very low	55.2	Low	121 Å²	121	105 Å²	105	65%	0.647	58%	0.575	S	S	*	*			trans	-85.6	111.6	171.8	-164	30.5	0	0	0	109.1	V154	V154-N156 VanDerWaalsContact C-N 3.27Å; V154-N156 HydrophobicContact CG1-CB 4.37Å; V154-N156 PolarHBondContact O-N 3.29Å
157	P	41.3	Very low	54	Low	93 Å²	93	109.8 Å²	109.8	60%	0.604	60%	0.598	S	S	*	*			trans	-80.4	147.2	178.6	34.2	-33.9	0	0	0	111	K155	K155-P157 VanDerWaalsContact O-CD 3.3Å; K155-P157 WeakPolarHBondContact O-CD 3.44Å
158	L	47.2	Very low	53.5	Low	146 Å²	146	110.1 Å²	110.1	76%	0.764	60%	0.603	S	S	*	*	S	Bend	trans	71.3	133.1	-178.7	-54.6	110.1	0	0	0	116.1
159	N	35.9	Very low	53.5	Low	164 Å²	164	111.2 Å²	111.2	88%	0.877	61%	0.608	S	S	*	*	S	Bend	trans	62.7	57.6	167.1	-64.2	-2	0	0	0	119.1
160	S	41.8	Very low	53.8	Low	81 Å²	81	104.3 Å²	104.3	57%	0.566	58%	0.579	S	S	*	*			trans	-145.5	69.2	155.7	54	0	0	0	0	112.8	L162	S160-L162 PolarHBondContact O-N 3.46Å
161	T	40.9	Very low	54.6	Low	142 Å²	142	102.3 Å²	102.3	87%	0.871	57%	0.57	S	S	*	*			trans	-75.7	61.4	176.5	52	0	0	0	0	113.1
162	L	41.2	Very low	56.1	Low	153 Å²	153	100.6 Å²	100.6	80%	0.801	56%	0.555	S	S	*	*	S	Bend	trans	-170.6	146.6	149.1	-128	70	0	0	0	111.7	S160 S164	S160-L162 PolarHBondContact O-N 3.46Å; L162-S164 PolarHBondContact O-N 3.38Å
163	S	37.7	Very low	57.9	Low	63 Å²	63	99.9 Å²	99.9	44%	0.441	55%	0.551	S	S	.	*			trans	49.5	39.8	157.7	63.4	0	0	0	0	120	L165 Q167	S163-L165 PolarHBondContact O-N 2.77Å; S163-Q167 PolarHBondContact O-NE2 2.83Å
164	S	41.2	Very low	60	Low	106 Å²	106	96.1 Å²	96.1	74%	0.741	55%	0.546	S	S	*	.			trans	-72.1	28.9	162.6	72.1	0	0	0	0	114	L162	L162-S164 PolarHBondContact O-N 3.38Å
165	L	46.1	Very low	62.2	Low	116 Å²	116	91.9 Å²	91.9	61%	0.607	52%	0.521	S	S	*	.	S	Bend	trans	-91	133.4	174.1	-133.8	75.4	0	0	0	107.9	F20 S163 Q167	F20-L165 HydrophobicContact CE1-CD2 4.13Å; F20-L165 HydrophobicContact CZ-CD2 4.28Å; S163-L165 PolarHBondContact O-N 2.77Å; L165-Q167 WeakPolarHBondContact O-CG 3.47Å; L165-Q167 PolarHBondContact O-N 2.99Å
166	S	51.2	Low	64.5	Low	92 Å²	92	83.3 Å²	83.3	64%	0.643	48%	0.484	S	S	*	.			trans	-39.3	95.8	-172.2	55.4	0	0	0	0	114.7	E168	S166-E168 PolarHBondContact O-N 2.91Å
167	Q	64.7	Low	67.3	Low	110 Å²	110	78.4 Å²	78.4	51%	0.514	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-77	122.9	178.2	-61.3	-174.8	10.3	0	0	109.4	S163 L165 L169	S163-Q167 PolarHBondContact O-NE2 2.83Å; L165-Q167 WeakPolarHBondContact O-CG 3.47Å; L165-Q167 PolarHBondContact O-N 2.99Å; Q167-L169 PolarHBondContact O-N 2.87Å
168	E	80.6	Confident	69.8	Low	101 Å²	101	74 Å²	74	47%	0.472	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	121.6	170.2	-63.6	-159.1	142.5	0	0	109.2	R147 S166	R147-E168 WeakPolarHBondContact CD-OE2 3.5Å; R147-E168 IonicContact CZ-OE2 2.94Å; R147-E168 IonicContact NE-OE2 3.97Å; R147-E168 IonicContact NH1-OE2 3.87Å; R147-E168 PolarHBondContact NH1-OE2 2.33Å; S166-E168 PolarHBondContact O-N 2.91Å
169	L	89.9	Confident	72.1	Confident	25 Å²	25	68.3 Å²	68.3	13%	0.131	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	128.2	173.3	-58.8	174.3	0	0	0	108.4	R147 A148 H150 Q167 F171 I193 C198	R147-L169 WeakPolarHBondContact CA-O 3.34Å; A148-L169 PolarHBondContact N-O 3.49Å; A148-L169 PolarHBondContact O-N 2.99Å; H150-L169 HydrophobicContact CB-CD1 4.17Å; H150-L169 HydrophobicContact CB-CG 4.19Å; Q167-L169 PolarHBondContact O-N 2.87Å; L169-F171 HydrophobicContact CB-CE2 3.58Å; L169-F171 HydrophobicContact CB-CZ 3.9Å; L169-F171 HydrophobicContact CD1-CZ 4.38Å; L169-I193 HydrophobicContact CD1-CG1 4.36Å; L169-I193 HydrophobicContact CD1-CG2 3.69Å; L169-C198 HydrophobicContact CD1-CB 4.11Å; L169-C198 HydrophobicContact CD2-CB 4.39Å
170	I	91.2	Very high	74.9	Confident	25 Å²	25	64.5 Å²	64.5	13%	0.128	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	145.1	177.1	70	177.5	0	0	0	111.2	T130 C132 G133 M139 M146 R147	T130-I170 HydrophobicContact CG2-CD1 3.48Å; T130-I170 VanDerWaalsContact CG2-CD1 3.48Å; T130-I170 HydrophobicContact CG2-CG1 4.4Å; C132-I170 CarbonylContact C-O 3.56Å; C132-I170 WeakPolarHBondContact CA-O 3.44Å; G133-I170 PolarHBondContact N-O 3.37Å; M139-I170 HydrophobicContact CB-CD1 4.49Å; M139-I170 HydrophobicContact CG-CD1 3.7Å; M139-I170 HydrophobicContact CG-CG1 4.14Å; M146-I170 WeakPolarHBondContact O-CA 3.4Å; R147-I170 HydrophobicContact CG-CG2 4.26Å
171	F	93.5	Very high	77.4	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	142.5	-177.2	-53.7	-95.1	0	0	0	110.2	N134 F145 M146 A148 L169 F176	N134-F171 HydrophobicContact CB-CD1 3.78Å; N134-F171 HydrophobicContact CB-CE1 4.03Å; F145-F171 CarbonylContact C-O 3.55Å; F145-F171 WeakPolarHBondContact CA-O 3.27Å; F145-F171 WeakPolarHBondContact CB-O 3.35Å; M146-F171 PolarHBondContact N-O 2.97Å; M146-F171 PolarHBondContact O-N 2.97Å; A148-F171 HydrophobicContact CB-CE2 4.29Å; L169-F171 HydrophobicContact CB-CE2 3.58Å; L169-F171 HydrophobicContact CB-CZ 3.9Å; L169-F171 HydrophobicContact CD1-CZ 4.38Å; F171-F176 HydrophobicContact CB-CB 4.33Å; F171-F176 HydrophobicContact CB-CD2 4.09Å; F171-F176 AromaticContact CD2-CD2 3.6Å; F171-F176 HydrophobicContact CD2-CD2 3.6Å; F171-F176 AromaticContact CD2-CE2 3.92Å; F171-F176 HydrophobicContact CD2-CE2 3.92Å; F171-F176 HydrophobicContact CE2-CD2 4.17Å; F171-F176 HydrophobicContact CE2-CE2 4.11Å; F171-F176 AromaticContact CG-CD2 3.89Å; F171-F176 HydrophobicContact CG-CD2 3.89Å
172	H	93.2	Very high	80	Confident	26 Å²	26	61.4 Å²	61.4	12%	0.12	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	145.2	161.3	-49.7	98.9	0	0	0	109	C132 C135 Q137 P138 M139 E143 S174 C175 F176	C132-H172 WeakPolarHBondContact CB-CE1 3.24Å; C132-H172 VanDerWaalsContact CB-ND1 3.29Å; C132-H172 WeakPolarHBondContact CB-ND1 3.41Å; C135-H172 PolarHBondContact SG-CE1 2.56Å; C135-H172 PolarHBondContact SG-ND1 2.93Å; C135-H172 VanDerWaalsContact SG-ND1 3.39Å; Q137-H172 VanDerWaalsContact C-CE1 3.45Å; Q137-H172 WeakPolarHBondContact CB-CE1 3.37Å; Q137-H172 PolarHBondContact O-CE1 3.47Å; P138-H172 VanDerWaalsContact C-NE2 3.31Å; P138-H172 PolarHBondContact O-CE1 2.73Å; P138-H172 PolarHBondContact O-NE2 3.37Å; M139-H172 WeakPolarHBondContact CA-NE2 3.29Å; M139-H172 HydrophobicContact CE-CB 4.5Å; M139-H172 VanDerWaalsContact CE-CD2 3.47Å; M139-H172 WeakPolarHBondContact CE-CD2 3.47Å; E143-H172 IonicContact OE2-CD2 2.85Å; E143-H172 PolarHBondContact OE2-CD2 3.21Å; E143-H172 IonicContact OE2-NE2 3.92Å; E143-H172 PolarHBondContact OE2-NE2 2.76Å; H172-S174 PolarHBondContact O-N 3.26Å; H172-C175 HydrophobicContact CB-CB 4.01Å; H172-C175 CarbonylContact O-C 3.58Å; H172-C175 WeakPolarHBondContact O-CA 3.22Å; H172-C175 WeakPolarHBondContact O-CB 3.34Å; H172-C175 PolarHBondContact O-N 3.19Å; H172-F176 PolarHBondContact O-N 3.18Å
173	V	93.8	Very high	82.6	Confident	67 Å²	67	60 Å²	60	41%	0.406	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-55	-41.2	-180	177.9	0	0	0	0	111.6	L144 M146 C175 F176 L454	L144-V173 HydrophobicContact CB-CG2 4.04Å; M146-V173 HydrophobicContact CG-CG2 4.33Å; V173-C175 PolarHBondContact O-N 3.24Å; V173-F176 PolarHBondContact O-N 3.07Å; V173-L454 HydrophobicContact CG2-CD1 4.11Å
174	S	94.1	Very high	85.3	Confident	98 Å²	98	61.1 Å²	61.1	69%	0.685	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-67.3	-17.4	174.4	55.2	0	0	0	0	114.9	H172	H172-S174 PolarHBondContact O-N 3.26Å
175	C	95.4	Very high	87.7	Confident	20 Å²	20	56.5 Å²	56.5	14%	0.135	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-97.8	-4.2	178.8	-70.9	0	0	0	0	113.2	C132 N134 C135 H172 V173 T177	C132-C175 VanDerWaalsContact SG-CB 3.53Å; N134-C175 HydrophobicContact CB-CB 4.26Å; N134-C175 PolarHBondContact ND2-O 3.26Å; C135-C175 VanDerWaalsContact SG-SG 3.68Å; H172-C175 HydrophobicContact CB-CB 4.01Å; H172-C175 CarbonylContact O-C 3.58Å; H172-C175 WeakPolarHBondContact O-CA 3.22Å; H172-C175 WeakPolarHBondContact O-CB 3.34Å; H172-C175 PolarHBondContact O-N 3.19Å; V173-C175 PolarHBondContact O-N 3.24Å; C175-T177 PolarHBondContact O-N 3.19Å; C175-T177 VanDerWaalsContact O-N 3.08Å
176	F	95.4	Very high	89.8	Confident	1 Å²	1	53.6 Å²	53.6	0%	0.004	31%	0.307	C	S	.	.			trans	-86.1	65.6	176.8	-161.8	-104.8	0	0	0	110.5	M146 A148 F171 H172 V173 I185 Y191 P200	M146-F176 HydrophobicContact CB-CB 4Å; M146-F176 HydrophobicContact CB-CD1 4.23Å; M146-F176 HydrophobicContact CB-CD2 3.73Å; M146-F176 HydrophobicContact CB-CE2 4.26Å; M146-F176 HydrophobicContact CB-CG 3.72Å; M146-F176 HydrophobicContact CE-CD1 3.74Å; M146-F176 HydrophobicContact CE-CE1 3.85Å; M146-F176 HydrophobicContact CE-CG 4.4Å; M146-F176 HydrophobicContact CG-CB 3.71Å; M146-F176 HydrophobicContact CG-CD1 4.03Å; M146-F176 HydrophobicContact CG-CD2 4.3Å; M146-F176 HydrophobicContact CG-CG 3.75Å; A148-F176 HydrophobicContact CB-CE2 4.18Å; F171-F176 HydrophobicContact CB-CB 4.33Å; F171-F176 HydrophobicContact CB-CD2 4.09Å; F171-F176 AromaticContact CD2-CD2 3.6Å; F171-F176 HydrophobicContact CD2-CD2 3.6Å; F171-F176 AromaticContact CD2-CE2 3.92Å; F171-F176 HydrophobicContact CD2-CE2 3.92Å; F171-F176 HydrophobicContact CE2-CD2 4.17Å; F171-F176 HydrophobicContact CE2-CE2 4.11Å; F171-F176 AromaticContact CG-CD2 3.89Å; F171-F176 HydrophobicContact CG-CD2 3.89Å; H172-F176 PolarHBondContact O-N 3.18Å; V173-F176 PolarHBondContact O-N 3.07Å; F176-I185 HydrophobicContact CD1-CB 3.82Å; F176-I185 HydrophobicContact CD1-CG2 4.29Å; F176-I185 HydrophobicContact CE1-CB 3.86Å; F176-I185 HydrophobicContact CE1-CG2 3.86Å; F176-I185 PolarHBondContact O-N 3.03Å; F176-Y191 HydrophobicContact CE1-CD1 4.14Å; F176-Y191 HydrophobicContact CE1-CE1 4.26Å; F176-Y191 HydrophobicContact CE1-CG 4.32Å; F176-Y191 HydrophobicContact CZ-CD1 4.05Å; F176-Y191 AromaticContact CZ-CD2 3.88Å; F176-Y191 HydrophobicContact CZ-CD2 3.88Å; F176-Y191 AromaticContact CZ-CE1 3.9Å; F176-Y191 HydrophobicContact CZ-CE1 3.9Å; F176-Y191 AromaticContact CZ-CE2 3.75Å; F176-Y191 HydrophobicContact CZ-CE2 3.75Å; F176-Y191 HydrophobicContact CZ-CG 4.05Å; F176-Y191 AromaticContact CZ-CZ 3.76Å; F176-P200 HydrophobicContact CD2-CB 4.36Å; F176-P200 HydrophobicContact CD2-CG 3.89Å; F176-P200 HydrophobicContact CE1-CB 4.5Å; F176-P200 HydrophobicContact CE2-CB 3.84Å; F176-P200 HydrophobicContact CE2-CG 3.87Å; F176-P200 HydrophobicContact CG-CG 4.38Å; F176-P200 HydrophobicContact CZ-CB 3.92Å; F176-P200 HydrophobicContact CZ-CG 4.34Å
177	T	96	Very high	91.5	Very high	17 Å²	17	52.9 Å²	52.9	10%	0.104	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-113.7	141.9	-174.7	53.4	0	0	0	0	111.5	C175 C179 Q183 P184	C175-T177 PolarHBondContact O-N 3.19Å; C175-T177 VanDerWaalsContact O-N 3.08Å; T177-C179 PolarHBondContact O-N 3.1Å; T177-Q183 CarbonylContact C-O 3.54Å; T177-Q183 WeakPolarHBondContact CA-O 3.34Å; T177-P184 HydrophobicContact CG2-CB 4.43Å; T177-P184 HydrophobicContact CG2-CG 4.3Å
178	C	95.6	Very high	92.6	Very high	0 Å²	0	51 Å²	51	0%	0	32%	0.317	C	S	.	.			trans	-56	128.4	177.8	179.2	0	0	0	0	111.1	I180 Q182 Q183 I185 P200 C202 D205	C178-I180 PolarHBondContact O-N 3.02Å; C178-I180 PolarHBondContact SG-N 3.42Å; C178-Q182 WeakPolarHBondContact O-CA 3.33Å; C178-Q182 PolarHBondContact O-N 3.41Å; C178-Q182 PolarHBondContact O-OE1 3.11Å; C178-Q183 PolarHBondContact N-O 3.05Å; C178-I185 HydrophobicContact CB-CD1 4.15Å; C178-I185 HydrophobicContact CB-CG1 4.45Å; C178-P200 CarbonylContact C-O 3.53Å; C178-P200 WeakPolarHBondContact CA-O 3.35Å; C178-C202 HydrophobicContact CB-CB 4.12Å; C178-C202 PolarHBondContact SG-N 3.42Å; C178-D205 PolarHBondContact SG-OD2 2.9Å
179	C	94.4	Very high	93	Very high	27 Å²	27	51.1 Å²	51.1	18%	0.182	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-6.1	-178.1	63.3	0	0	0	0	115.7	T177 R199 P200	T177-C179 PolarHBondContact O-N 3.1Å; C179-R199 HydrophobicContact CB-CB 3.77Å; C179-R199 VanDerWaalsContact CB-NH1 3.34Å; C179-P200 PolarHBondContact N-O 3.39Å; C179-P200 PolarHBondContact SG-O 3.44Å
180	I	93.8	Very high	93	Very high	85 Å²	85	53 Å²	53	44%	0.436	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-71.8	179	-65.4	171.7	0	0	0	110.6	C178 Q182 M201 D205 K209	C178-I180 PolarHBondContact O-N 3.02Å; C178-I180 PolarHBondContact SG-N 3.42Å; I180-Q182 VanDerWaalsContact C-N 3.26Å; I180-Q182 PolarHBondContact O-N 2.99Å; I180-M201 HydrophobicContact CD1-CE 3.91Å; I180-M201 HydrophobicContact CD1-CG 4.13Å; I180-M201 HydrophobicContact CD1-SD 3.75Å; I180-D205 HydrophobicContact CB-CB 3.93Å; I180-D205 WeakPolarHBondContact CB-OD2 3.42Å; I180-D205 HydrophobicContact CD1-CB 4.04Å; I180-D205 HydrophobicContact CG2-CB 4.04Å; I180-K209 HydrophobicContact CD1-CD 4.38Å
181	C	95.9	Very high	93.1	Very high	51 Å²	51	54.9 Å²	54.9	35%	0.345	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-6.2	179.2	68.3	0	0	0	0	115.3	Q183 D205	C181-Q183 HydrophobicContact CB-CG 4.38Å; C181-Q183 PolarHBondContact O-N 3.46Å; C181-Q183 PolarHBondContact O-NE2 2.93Å; C181-D205 WeakPolarHBondContact CB-OD2 3.35Å; C181-D205 PolarHBondContact N-OD2 3.11Å; C181-D205 PolarHBondContact SG-OD2 3.35Å
182	Q	95.5	Very high	93	Very high	106 Å²	106	58 Å²	58	50%	0.495	36%	0.358	S	S	.	.			trans	59	9.8	178	-62.7	-83	113.8	0	0	115.5	C178 I180	C178-Q182 WeakPolarHBondContact O-CA 3.33Å; C178-Q182 PolarHBondContact O-N 3.41Å; C178-Q182 PolarHBondContact O-OE1 3.11Å; I180-Q182 VanDerWaalsContact C-N 3.26Å; I180-Q182 PolarHBondContact O-N 2.99Å
183	Q	95.3	Very high	92.9	Very high	124 Å²	124	57.2 Å²	57.2	58%	0.579	36%	0.355	S	S	*	.			trans	-69.5	144.2	171.9	-60.5	-52.5	-55.7	0	0	111.3	T177 C178 C181	T177-Q183 CarbonylContact C-O 3.54Å; T177-Q183 WeakPolarHBondContact CA-O 3.34Å; C178-Q183 PolarHBondContact N-O 3.05Å; C181-Q183 HydrophobicContact CB-CG 4.38Å; C181-Q183 PolarHBondContact O-N 3.46Å; C181-Q183 PolarHBondContact O-NE2 2.93Å
184	P	94.4	Very high	92.5	Very high	86 Å²	86	54.9 Å²	54.9	56%	0.558	34%	0.34	S	S	*	.	B	Isolated β-bridge	trans	-57.9	144.7	166.3	-20.1	32.7	0	0	0	111	T177	T177-P184 HydrophobicContact CG2-CB 4.43Å; T177-P184 HydrophobicContact CG2-CG 4.3Å
185	I	92	Very high	92	Very high	10 Å²	10	53.1 Å²	53.1	5%	0.051	33%	0.326	C	S	.	.			trans	-106.4	119.9	174.9	-61.3	174.4	0	0	0	108	F176 C178 E189 Y191 P200 C202	F176-I185 HydrophobicContact CD1-CB 3.82Å; F176-I185 HydrophobicContact CD1-CG2 4.29Å; F176-I185 HydrophobicContact CE1-CB 3.86Å; F176-I185 HydrophobicContact CE1-CG2 3.86Å; F176-I185 PolarHBondContact O-N 3.03Å; C178-I185 HydrophobicContact CB-CD1 4.15Å; C178-I185 HydrophobicContact CB-CG1 4.45Å; I185-E189 WeakPolarHBondContact CA-OE2 3.44Å; I185-E189 HydrophobicContact CG2-CB 3.91Å; I185-Y191 HydrophobicContact CG2-CD1 4.35Å; I185-Y191 HydrophobicContact CG2-CG 4.5Å; I185-P200 HydrophobicContact CD1-CB 4.14Å; I185-C202 HydrophobicContact CD1-CB 4.06Å; I185-C202 HydrophobicContact CG1-CB 4.25Å
186	A	89.6	Confident	91.4	Very high	55 Å²	55	58.2 Å²	58.2	46%	0.455	36%	0.357	S	S	.	.			trans	-79.8	159.7	-175.4	0	0	0	0	0	112.9	G188 E189	A186-G188 PolarHBondContact O-N 2.95Å; A186-E189 HydrophobicContact CB-CG 4.01Å; A186-E189 PolarHBondContact N-OE2 3.03Å; A186-E189 WeakPolarHBondContact O-CB 3.43Å; A186-E189 PolarHBondContact O-N 2.87Å; A186-E189 VanDerWaalsContact O-N 3.08Å
187	A	87.5	Confident	91.1	Very high	76 Å²	76	61.8 Å²	61.8	63%	0.628	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	116.8	175.5	0	0	0	0	0	110.4
188	G	87	Confident	90.7	Very high	72 Å²	72	62.8 Å²	62.8	74%	0.742	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.8	-12.6	-175.3	0	0	0	0	0	114.2	A186	A186-G188 PolarHBondContact O-N 2.95Å
189	E	89.2	Confident	90.6	Very high	102 Å²	102	65.5 Å²	65.5	48%	0.477	40%	0.396	S	S	.	.			trans	-75.7	145.6	173.8	-68.8	-175.9	156	0	0	112.2	I185 A186 Y191	I185-E189 WeakPolarHBondContact CA-OE2 3.44Å; I185-E189 HydrophobicContact CG2-CB 3.91Å; A186-E189 HydrophobicContact CB-CG 4.01Å; A186-E189 PolarHBondContact N-OE2 3.03Å; A186-E189 WeakPolarHBondContact O-CB 3.43Å; A186-E189 PolarHBondContact O-N 2.87Å; A186-E189 VanDerWaalsContact O-N 3.08Å; E189-Y191 PolarHBondContact O-N 3.29Å
190	A	90.5	Very high	90.5	Very high	64 Å²	64	64.2 Å²	64.2	53%	0.529	39%	0.388	S	S	.	.			trans	-74.6	124.8	176.8	0	0	0	0	0	111.4	H203	A190-H203 HydrophobicContact CB-CB 3.83Å; A190-H203 WeakPolarHBondContact O-CB 3.34Å; A190-H203 PolarHBondContact O-N 2.98Å
191	Y	92.7	Very high	90.4	Very high	66 Å²	66	60.4 Å²	60.4	26%	0.259	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	161.1	178	75.2	-90.6	0	0	0	111.4	A148 F176 I185 E189 I193 P200 M201	A148-Y191 HydrophobicContact CB-CE2 3.9Å; A148-Y191 WeakPolarHBondContact CB-OH 3.47Å; F176-Y191 HydrophobicContact CE1-CD1 4.14Å; F176-Y191 HydrophobicContact CE1-CE1 4.26Å; F176-Y191 HydrophobicContact CE1-CG 4.32Å; F176-Y191 HydrophobicContact CZ-CD1 4.05Å; F176-Y191 AromaticContact CZ-CD2 3.88Å; F176-Y191 HydrophobicContact CZ-CD2 3.88Å; F176-Y191 AromaticContact CZ-CE1 3.9Å; F176-Y191 HydrophobicContact CZ-CE1 3.9Å; F176-Y191 AromaticContact CZ-CE2 3.75Å; F176-Y191 HydrophobicContact CZ-CE2 3.75Å; F176-Y191 HydrophobicContact CZ-CG 4.05Å; F176-Y191 AromaticContact CZ-CZ 3.76Å; I185-Y191 HydrophobicContact CG2-CD1 4.35Å; I185-Y191 HydrophobicContact CG2-CG 4.5Å; E189-Y191 PolarHBondContact O-N 3.29Å; Y191-I193 HydrophobicContact CD2-CD1 4.16Å; Y191-I193 HydrophobicContact CE2-CD1 3.87Å; Y191-I193 HydrophobicContact CE2-CG1 4.12Å; Y191-P200 HydrophobicContact CD2-CB 4.29Å; Y191-M201 CarbonylContact C-O 3.56Å; Y191-M201 VanDerWaalsContact CA-O 3.23Å; Y191-M201 WeakPolarHBondContact CA-O 3.49Å; Y191-M201 WeakPolarHBondContact CB-O 3.36Å
192	I	91.4	Very high	90.3	Very high	65 Å²	65	59 Å²	59	33%	0.333	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	140.2	172.1	-73.6	172.2	0	0	0	108.9	P200 M201 F206	I192-P200 CarbonylContact O-C 3.56Å; I192-M201 PolarHBondContact N-O 3.17Å; I192-M201 PolarHBondContact O-N 3.29Å; I192-F206 HydrophobicContact CB-CD2 4.25Å; I192-F206 HydrophobicContact CB-CE2 4.46Å; I192-F206 HydrophobicContact CD1-CD1 3.62Å; I192-F206 HydrophobicContact CD1-CD2 3.87Å; I192-F206 HydrophobicContact CD1-CE1 3.4Å; I192-F206 VanDerWaalsContact CD1-CE1 3.4Å; I192-F206 HydrophobicContact CD1-CE2 3.65Å; I192-F206 HydrophobicContact CD1-CG 3.84Å; I192-F206 HydrophobicContact CD1-CZ 3.4Å; I192-F206 VanDerWaalsContact CD1-CZ 3.4Å; I192-F206 HydrophobicContact CG2-CD2 4.18Å; I192-F206 HydrophobicContact CG2-CE2 4.05Å
193	I	91.3	Very high	90.2	Very high	9 Å²	9	58.5 Å²	58.5	5%	0.046	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	122.2	168.6	-59.8	-54.8	0	0	0	108.4	A148 L169 Y191 P195 P200	A148-I193 HydrophobicContact CB-CD1 3.63Å; A148-I193 HydrophobicContact CB-CG1 3.87Å; L169-I193 HydrophobicContact CD1-CG1 4.36Å; L169-I193 HydrophobicContact CD1-CG2 3.69Å; Y191-I193 HydrophobicContact CD2-CD1 4.16Å; Y191-I193 HydrophobicContact CE2-CD1 3.87Å; Y191-I193 HydrophobicContact CE2-CG1 4.12Å; I193-P195 WeakPolarHBondContact O-CD 3.26Å; I193-P200 HydrophobicContact CD1-CB 3.83Å
194	D	85.7	Confident	90.1	Very high	18 Å²	18	56.6 Å²	56.6	10%	0.096	36%	0.357	C	S	.	.			trans	-67	119	172.6	178.6	-76.6	0	0	0	109.1	V196 T197 C198 R199 M201 K209	D194-V196 PolarHBondContact O-N 3.02Å; D194-V196 VanDerWaalsContact O-N 3.12Å; D194-V196 PolarHBondContact OD1-N 3.42Å; D194-T197 WeakPolarHBondContact CB-OG1 3.28Å; D194-T197 VanDerWaalsContact CG-OG1 3.31Å; D194-T197 PolarHBondContact O-N 3.42Å; D194-T197 PolarHBondContact OD1-N 3.33Å; D194-T197 PolarHBondContact OD1-OG1 2.99Å; D194-C198 WeakPolarHBondContact O-CA 3.32Å; D194-C198 PolarHBondContact O-N 3.37Å; D194-R199 PolarHBondContact N-O 3Å; D194-M201 HydrophobicContact CB-CE 4.1Å; D194-K209 IonicContact OD2-NZ 2.77Å; D194-K209 PolarHBondContact OD2-NZ 3.29Å
195	P	83.4	Confident	90.1	Very high	61 Å²	61	53.9 Å²	53.9	40%	0.396	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-0.8	-167	31.3	-37.4	0	0	0	114.2	I193	I193-P195 WeakPolarHBondContact O-CD 3.26Å
196	V	83.2	Confident	90.1	Very high	128 Å²	128	55.3 Å²	55.3	78%	0.776	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-40	176.1	-178.2	0	0	0	0	110.6	D194	D194-V196 PolarHBondContact O-N 3.02Å; D194-V196 VanDerWaalsContact O-N 3.12Å; D194-V196 PolarHBondContact OD1-N 3.42Å
197	T	87.8	Confident	90.2	Very high	75 Å²	75	55.7 Å²	55.7	46%	0.46	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-12.8	-177	60.5	0	0	0	0	114.2	D194 R199	D194-T197 WeakPolarHBondContact CB-OG1 3.28Å; D194-T197 VanDerWaalsContact CG-OG1 3.31Å; D194-T197 PolarHBondContact O-N 3.42Å; D194-T197 PolarHBondContact OD1-N 3.33Å; D194-T197 PolarHBondContact OD1-OG1 2.99Å; T197-R199 PolarHBondContact O-N 3.45Å; T197-R199 VanDerWaalsContact O-N 3.12Å
198	C	88.7	Confident	90.4	Very high	39 Å²	39	54.3 Å²	54.3	26%	0.264	32%	0.32	S	S	.	.			trans	57.2	16.8	-173.3	-53.4	0	0	0	0	114.4	H150 L169 D194	H150-C198 VanDerWaalsContact CD2-SG 3.59Å; H150-C198 PolarHBondContact NE2-SG 3.46Å; H150-C198 VanDerWaalsContact NE2-SG 3.43Å; L169-C198 HydrophobicContact CD1-CB 4.11Å; L169-C198 HydrophobicContact CD2-CB 4.39Å; D194-C198 WeakPolarHBondContact O-CA 3.32Å; D194-C198 PolarHBondContact O-N 3.37Å
199	R	92.6	Very high	90.4	Very high	57 Å²	57	54.3 Å²	54.3	22%	0.215	30%	0.3	C	S	.	.			trans	-97.4	145.9	177.9	-62.9	-178.5	71.7	-135.8	-11.7	110.6	N134 C179 D194 T197	N134-R199 PolarHBondContact OD1-NE 2.79Å; C179-R199 HydrophobicContact CB-CB 3.77Å; C179-R199 VanDerWaalsContact CB-NH1 3.34Å; D194-R199 PolarHBondContact N-O 3Å; T197-R199 PolarHBondContact O-N 3.45Å; T197-R199 VanDerWaalsContact O-N 3.12Å
200	P	92.3	Very high	90.3	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	151.6	175.5	31.5	-35	0	0	0	111.7	F176 C178 C179 I185 Y191 I192 I193	F176-P200 HydrophobicContact CD2-CB 4.36Å; F176-P200 HydrophobicContact CD2-CG 3.89Å; F176-P200 HydrophobicContact CE1-CB 4.5Å; F176-P200 HydrophobicContact CE2-CB 3.84Å; F176-P200 HydrophobicContact CE2-CG 3.87Å; F176-P200 HydrophobicContact CG-CG 4.38Å; F176-P200 HydrophobicContact CZ-CB 3.92Å; F176-P200 HydrophobicContact CZ-CG 4.34Å; C178-P200 CarbonylContact C-O 3.53Å; C178-P200 WeakPolarHBondContact CA-O 3.35Å; C179-P200 PolarHBondContact N-O 3.39Å; C179-P200 PolarHBondContact SG-O 3.44Å; I185-P200 HydrophobicContact CD1-CB 4.14Å; Y191-P200 HydrophobicContact CD2-CB 4.29Å; I192-P200 CarbonylContact O-C 3.56Å; I193-P200 HydrophobicContact CD1-CB 3.83Å
201	M	93.2	Very high	90.2	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.02	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	130.5	177.9	-170.3	-175.8	-55.1	0	0	108	I180 Y191 I192 D194 D205 F206 K209	I180-M201 HydrophobicContact CD1-CE 3.91Å; I180-M201 HydrophobicContact CD1-CG 4.13Å; I180-M201 HydrophobicContact CD1-SD 3.75Å; Y191-M201 CarbonylContact C-O 3.56Å; Y191-M201 VanDerWaalsContact CA-O 3.23Å; Y191-M201 WeakPolarHBondContact CA-O 3.49Å; Y191-M201 WeakPolarHBondContact CB-O 3.36Å; I192-M201 PolarHBondContact N-O 3.17Å; I192-M201 PolarHBondContact O-N 3.29Å; D194-M201 HydrophobicContact CB-CE 4.1Å; M201-D205 HydrophobicContact CG-CB 4.1Å; M201-F206 HydrophobicContact CG-CB 4.25Å; M201-F206 VanDerWaalsContact SD-CA 3.59Å; M201-F206 HydrophobicContact SD-CB 3.8Å; M201-F206 HydrophobicContact SD-CD2 4.09Å; M201-F206 HydrophobicContact SD-CG 4.46Å; M201-K209 HydrophobicContact CE-CD 3.79Å; M201-K209 HydrophobicContact SD-CD 3.95Å
202	C	93.8	Very high	89.8	Confident	23 Å²	23	61.2 Å²	61.2	16%	0.155	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	154.2	177.5	71.7	0	0	0	0	110.7	C178 I185 S204 D205 F206	C178-C202 HydrophobicContact CB-CB 4.12Å; C178-C202 PolarHBondContact SG-N 3.42Å; I185-C202 HydrophobicContact CD1-CB 4.06Å; I185-C202 HydrophobicContact CG1-CB 4.25Å; C202-S204 PolarHBondContact O-N 3.15Å; C202-D205 PolarHBondContact O-N 3.49Å; C202-D205 PolarHBondContact SG-OD2 2.96Å; C202-F206 PolarHBondContact O-N 3.18Å
203	H	92.7	Very high	89.1	Confident	95 Å²	95	64.9 Å²	64.9	44%	0.44	33%	0.331	S	S	.	.	H	α-helix	trans	-54.3	-37.7	-177.4	-175.4	-104.8	0	0	0	113.8	A190 F206 M207	A190-H203 HydrophobicContact CB-CB 3.83Å; A190-H203 WeakPolarHBondContact O-CB 3.34Å; A190-H203 PolarHBondContact O-N 2.98Å; H203-F206 PolarHBondContact O-N 3.16Å; H203-M207 WeakPolarHBondContact O-CB 3.33Å; H203-M207 VanDerWaalsContact O-CG 3.26Å; H203-M207 WeakPolarHBondContact O-CG 3.4Å; H203-M207 PolarHBondContact O-N 3.44Å
204	S	92.7	Very high	88.2	Confident	84 Å²	84	71 Å²	71	59%	0.587	36%	0.36	S	S	*	.	H	α-helix	trans	-64.2	-49.1	-179.6	-170.5	0	0	0	0	112.8	C202 F206 M207 T208	C202-S204 PolarHBondContact O-N 3.15Å; S204-F206 VanDerWaalsContact C-N 3.32Å; S204-F206 PolarHBondContact O-N 3.06Å; S204-M207 PolarHBondContact O-N 3.11Å; S204-T208 WeakPolarHBondContact O-CB 3.39Å; S204-T208 PolarHBondContact O-N 3.03Å; S204-T208 PolarHBondContact O-OG1 3.18Å
205	D	94.4	Very high	86.8	Confident	28 Å²	28	73.2 Å²	73.2	15%	0.15	38%	0.376	C	S	.	.	H	α-helix	trans	-67.2	-34.5	177	-75.8	-35.8	0	0	0	111.6	C178 I180 C181 M201 C202 T208 K209	C178-D205 PolarHBondContact SG-OD2 2.9Å; I180-D205 HydrophobicContact CB-CB 3.93Å; I180-D205 WeakPolarHBondContact CB-OD2 3.42Å; I180-D205 HydrophobicContact CD1-CB 4.04Å; I180-D205 HydrophobicContact CG2-CB 4.04Å; C181-D205 WeakPolarHBondContact CB-OD2 3.35Å; C181-D205 PolarHBondContact N-OD2 3.11Å; C181-D205 PolarHBondContact SG-OD2 3.35Å; M201-D205 HydrophobicContact CG-CB 4.1Å; C202-D205 PolarHBondContact O-N 3.49Å; C202-D205 PolarHBondContact SG-OD2 2.96Å; D205-T208 PolarHBondContact O-N 2.94Å; D205-K209 WeakPolarHBondContact O-CB 3.45Å; D205-K209 PolarHBondContact O-N 3.3Å
206	F	92.1	Very high	85.5	Confident	41 Å²	41	75.8 Å²	75.8	18%	0.18	39%	0.393	C	S	.	.	H	α-helix	trans	-65.4	-48.5	175.8	176.5	-95.4	0	0	0	112.5	I192 M201 C202 H203 S204 T208 K209 Q210	I192-F206 HydrophobicContact CB-CD2 4.25Å; I192-F206 HydrophobicContact CB-CE2 4.46Å; I192-F206 HydrophobicContact CD1-CD1 3.62Å; I192-F206 HydrophobicContact CD1-CD2 3.87Å; I192-F206 HydrophobicContact CD1-CE1 3.4Å; I192-F206 VanDerWaalsContact CD1-CE1 3.4Å; I192-F206 HydrophobicContact CD1-CE2 3.65Å; I192-F206 HydrophobicContact CD1-CG 3.84Å; I192-F206 HydrophobicContact CD1-CZ 3.4Å; I192-F206 VanDerWaalsContact CD1-CZ 3.4Å; I192-F206 HydrophobicContact CG2-CD2 4.18Å; I192-F206 HydrophobicContact CG2-CE2 4.05Å; M201-F206 HydrophobicContact CG-CB 4.25Å; M201-F206 VanDerWaalsContact SD-CA 3.59Å; M201-F206 HydrophobicContact SD-CB 3.8Å; M201-F206 HydrophobicContact SD-CD2 4.09Å; M201-F206 HydrophobicContact SD-CG 4.46Å; C202-F206 PolarHBondContact O-N 3.18Å; H203-F206 PolarHBondContact O-N 3.16Å; S204-F206 VanDerWaalsContact C-N 3.32Å; S204-F206 PolarHBondContact O-N 3.06Å; F206-T208 VanDerWaalsContact C-N 3.28Å; F206-T208 PolarHBondContact O-N 3.48Å; F206-K209 WeakPolarHBondContact O-CB 3.41Å; F206-K209 PolarHBondContact O-N 3.02Å; F206-K209 VanDerWaalsContact O-N 3.13Å; F206-Q210 HydrophobicContact CE1-CG 4.04Å; F206-Q210 HydrophobicContact CZ-CG 4.08Å; F206-Q210 PolarHBondContact O-N 3.2Å
207	M	91.6	Very high	83.9	Confident	62 Å²	62	77.5 Å²	77.5	31%	0.305	39%	0.394	S	S	.	.	H	α-helix	trans	-57.9	-43.2	173.9	-72.2	-74	108.1	0	0	110.9	H203 S204 K209 Q210 Q211	H203-M207 WeakPolarHBondContact O-CB 3.33Å; H203-M207 VanDerWaalsContact O-CG 3.26Å; H203-M207 WeakPolarHBondContact O-CG 3.4Å; H203-M207 PolarHBondContact O-N 3.44Å; S204-M207 PolarHBondContact O-N 3.11Å; M207-K209 VanDerWaalsContact C-N 3.34Å; M207-K209 PolarHBondContact O-N 3.48Å; M207-Q210 PolarHBondContact O-N 2.87Å; M207-Q211 WeakPolarHBondContact O-CG 3.37Å; M207-Q211 PolarHBondContact O-N 3.13Å
208	T	91.7	Very high	82.1	Confident	48 Å²	48	81.4 Å²	81.4	29%	0.294	41%	0.411	S	S	.	.	H	α-helix	trans	-63.1	-38.5	176	-55.7	0	0	0	0	112.2	S204 D205 F206 R212	S204-T208 WeakPolarHBondContact O-CB 3.39Å; S204-T208 PolarHBondContact O-N 3.03Å; S204-T208 PolarHBondContact O-OG1 3.18Å; D205-T208 PolarHBondContact O-N 2.94Å; F206-T208 VanDerWaalsContact C-N 3.28Å; F206-T208 PolarHBondContact O-N 3.48Å; T208-R212 WeakPolarHBondContact O-CG 3.45Å; T208-R212 PolarHBondContact O-N 3.27Å
209	K	86.6	Confident	80.3	Confident	71 Å²	71	85.1 Å²	85.1	31%	0.309	44%	0.435	S	S	.	.	H	α-helix	trans	-65.8	-41.4	175.1	-171.8	177.2	178.6	178.7	0	111.3	I180 D194 M201 D205 F206 M207 Q213	I180-K209 HydrophobicContact CD1-CD 4.38Å; D194-K209 IonicContact OD2-NZ 2.77Å; D194-K209 PolarHBondContact OD2-NZ 3.29Å; M201-K209 HydrophobicContact CE-CD 3.79Å; M201-K209 HydrophobicContact SD-CD 3.95Å; D205-K209 WeakPolarHBondContact O-CB 3.45Å; D205-K209 PolarHBondContact O-N 3.3Å; F206-K209 WeakPolarHBondContact O-CB 3.41Å; F206-K209 PolarHBondContact O-N 3.02Å; F206-K209 VanDerWaalsContact O-N 3.13Å; M207-K209 VanDerWaalsContact C-N 3.34Å; M207-K209 PolarHBondContact O-N 3.48Å; K209-Q213 WeakPolarHBondContact O-CG 3.1Å; K209-Q213 PolarHBondContact O-N 2.99Å
210	Q	87.5	Confident	78.2	Confident	63 Å²	63	91.5 Å²	91.5	29%	0.294	47%	0.467	S	S	.	.	H	α-helix	trans	-65.1	-48.4	175.7	-74.5	-163.7	-21.2	0	0	112.8	F206 M207 R212 Q213 Q214	F206-Q210 HydrophobicContact CE1-CG 4.04Å; F206-Q210 HydrophobicContact CZ-CG 4.08Å; F206-Q210 PolarHBondContact O-N 3.2Å; M207-Q210 PolarHBondContact O-N 2.87Å; Q210-R212 VanDerWaalsContact C-N 3.26Å; Q210-R212 PolarHBondContact O-N 2.86Å; Q210-Q213 PolarHBondContact O-N 3.29Å; Q210-Q214 PolarHBondContact O-N 3Å
211	Q	88.1	Confident	75.9	Confident	123 Å²	123	102.1 Å²	102.1	58%	0.575	51%	0.508	S	S	*	.	H	α-helix	trans	-57.2	-40.3	180	-71.9	172.4	4.7	0	0	112	M207 Q213 Q214 S215	M207-Q211 WeakPolarHBondContact O-CG 3.37Å; M207-Q211 PolarHBondContact O-N 3.13Å; Q211-Q213 PolarHBondContact O-N 2.9Å; Q211-Q214 PolarHBondContact O-N 2.94Å; Q211-S215 WeakPolarHBondContact O-CB 3.47Å; Q211-S215 PolarHBondContact O-N 2.89Å; Q211-S215 PolarHBondContact O-OG 3.46Å
212	R	85.5	Confident	73.6	Confident	191 Å²	191	107.5 Å²	107.5	72%	0.721	54%	0.543	S	S	*	.	H	α-helix	trans	-66.1	-34	175.1	-70.7	177.2	-176.7	178.8	3.9	113.2	T208 Q210 S215	T208-R212 WeakPolarHBondContact O-CG 3.45Å; T208-R212 PolarHBondContact O-N 3.27Å; Q210-R212 VanDerWaalsContact C-N 3.26Å; Q210-R212 PolarHBondContact O-N 2.86Å; R212-S215 PolarHBondContact O-N 3.45Å
213	Q	77	Confident	71.3	Confident	143 Å²	143	113.8 Å²	113.8	67%	0.668	57%	0.573	S	S	*	*	H	α-helix	trans	-74.2	-30.3	176.9	-72.9	176.2	-12.7	0	0	112.8	K209 Q210 Q211 S215	K209-Q213 WeakPolarHBondContact O-CG 3.1Å; K209-Q213 PolarHBondContact O-N 2.99Å; Q210-Q213 PolarHBondContact O-N 3.29Å; Q211-Q213 PolarHBondContact O-N 2.9Å; Q213-S215 VanDerWaalsContact C-N 3.26Å; Q213-S215 PolarHBondContact O-N 2.54Å
214	Q	71.3	Confident	69.2	Low	138 Å²	138	117.1 Å²	117.1	65%	0.645	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-4.4	174.8	-65.7	176.1	9.7	0	0	113.6	Q210 Q211 P216	Q210-Q214 PolarHBondContact O-N 3Å; Q211-Q214 PolarHBondContact O-N 2.94Å; Q214-P216 VanDerWaalsContact C-CD 3.49Å; Q214-P216 WeakPolarHBondContact O-CD 3.38Å
215	S	56.4	Low	66.7	Low	64 Å²	64	121.4 Å²	121.4	45%	0.448	60%	0.599	S	S	.	*			trans	-110.9	77.1	-174.8	-59	0	0	0	0	112.2	Q211 R212 Q213 M217	Q211-S215 WeakPolarHBondContact O-CB 3.47Å; Q211-S215 PolarHBondContact O-N 2.89Å; Q211-S215 PolarHBondContact O-OG 3.46Å; R212-S215 PolarHBondContact O-N 3.45Å; Q213-S215 VanDerWaalsContact C-N 3.26Å; Q213-S215 PolarHBondContact O-N 2.54Å; S215-M217 PolarHBondContact O-N 3.34Å; S215-M217 VanDerWaalsContact O-N 3.14Å
216	P	55.3	Low	64.3	Low	114 Å²	114	129 Å²	129	74%	0.74	63%	0.633	S	S	*	*			trans	-64.1	116.7	176.4	27.4	-34	0	0	0	110.3	Q214 L218	Q214-P216 VanDerWaalsContact C-CD 3.49Å; Q214-P216 WeakPolarHBondContact O-CD 3.38Å; P216-L218 PolarHBondContact O-N 3.17Å
217	M	51.4	Low	61.8	Low	165 Å²	165	132.6 Å²	132.6	81%	0.813	66%	0.663	S	S	*	*			trans	-63.2	108	176.9	-70.8	-75.4	99.4	0	0	110.4	S215	S215-M217 PolarHBondContact O-N 3.34Å; S215-M217 VanDerWaalsContact O-N 3.14Å
218	L	49.8	Very low	59.6	Low	156 Å²	156	135.5 Å²	135.5	82%	0.817	69%	0.69	S	S	*	*			trans	-60.9	130.4	164.3	-75	172.9	0	0	0	108.9	P216 Q220	P216-L218 PolarHBondContact O-N 3.17Å; L218-Q220 PolarHBondContact O-N 2.82Å
219	P	49.3	Very low	57.3	Low	117 Å²	117	139.1 Å²	139.1	76%	0.76	71%	0.712	S	S	*	*			trans	-62.5	112.1	178.4	-23.2	33.8	0	0	0	111.1	R221	P219-R221 PolarHBondContact O-N 3.23Å
220	Q	49.1	Very low	55.2	Low	191 Å²	191	144 Å²	144	89%	0.893	74%	0.741	S	S	*	*			trans	-66.3	102.9	172.5	-71.2	-173.6	-11.6	0	0	109.3	L218	L218-Q220 PolarHBondContact O-N 2.82Å
221	R	44.8	Very low	53	Low	224 Å²	224	145.9 Å²	145.9	85%	0.845	76%	0.761	S	S	*	*			trans	-66.6	137.7	167.5	-76.6	-174.6	171	-170.9	-2.6	109.2	P219 I223	P219-R221 PolarHBondContact O-N 3.23Å; R221-I223 PolarHBondContact O-N 3.19Å
222	P	44.3	Very low	50.8	Low	117 Å²	117	146.3 Å²	146.3	76%	0.76	77%	0.772	S	S	*	*			trans	-62.8	119.7	171.8	-19.3	31.7	0	0	0	110.3
223	I	46	Very low	48.8	Very low	154 Å²	154	142.2 Å²	142.2	79%	0.79	77%	0.768	S	S	*	*			trans	-90.7	111.1	172.2	-61.2	177.2	0	0	0	107.5	R221	R221-I223 PolarHBondContact O-N 3.19Å
224	H	48	Very low	47.3	Very low	165 Å²	165	145.2 Å²	145.2	76%	0.764	78%	0.775	S	S	*	*			trans	-68.5	134.4	171.6	-87.4	-102.5	0	0	0	110.7
225	H	40.6	Very low	46.1	Very low	174 Å²	174	143.7 Å²	143.7	81%	0.806	78%	0.776	S	S	*	*			trans	-74.1	124.9	174	-56.2	-83.8	0	0	0	111.2
226	H	43.6	Very low	45.3	Very low	187 Å²	187	145.7 Å²	145.7	87%	0.866	79%	0.786	S	S	*	*			trans	-144	124.7	149.7	-79.4	-64.7	0	0	0	110.3
227	S	40.5	Very low	44.8	Very low	117 Å²	117	149.9 Å²	149.9	82%	0.818	80%	0.795	S	S	*	*			trans	-86	141.2	178.7	-50.4	0	0	0	0	111.5
228	S	44.2	Very low	44.3	Very low	123 Å²	123	148.1 Å²	148.1	86%	0.86	79%	0.788	S	S	*	*			trans	-165.4	135	140.3	-87.9	0	0	0	0	113.1
229	T	44.5	Very low	43.9	Very low	125 Å²	125	148.8 Å²	148.8	77%	0.767	79%	0.792	S	S	*	*			trans	-55.6	147.2	175.1	48.5	0	0	0	0	115.8
230	L	42.1	Very low	43.4	Very low	173 Å²	173	149.9 Å²	149.9	91%	0.906	79%	0.792	S	S	*	*				-172.4	159.2	121.1	-101.1	154.8	0	0	0	111.4
231	S	40.3	Very low	42.8	Very low	103 Å²	103	144.2 Å²	144.2	72%	0.72	77%	0.773	S	S	*	*			trans	-133.9	135.7	-160.2	-51.4	0	0	0	0	114.8
232	T	42.3	Very low	42.5	Very low	132 Å²	132	141.8 Å²	141.8	81%	0.81	77%	0.771	S	S	*	*			trans	-149	97.7	163.9	-54.9	0	0	0	0	107
233	V	44.3	Very low	42.2	Very low	104 Å²	104	141.1 Å²	141.1	63%	0.63	77%	0.769	S	S	*	*				84.1	141	64.6	180	0	0	0	0	113
234	Y	45.7	Very low	42.4	Very low	207 Å²	207	139.7 Å²	139.7	81%	0.812	77%	0.773	S	S	*	*			trans	100	140.3	178.6	-60.4	-59.9	0	0	0	117.4
235	P	45.5	Very low	42.2	Very low	105 Å²	105	138 Å²	138	68%	0.682	77%	0.77	S	S	*	*				-140.1	156.7	-114.7	43	-26.3	0	0	0	119
236	V	39	Very low	42.3	Very low	107 Å²	107	137.6 Å²	137.6	65%	0.648	77%	0.766	S	S	*	*			trans	44.9	121.5	132.6	-176.4	0	0	0	0	120.4	I238	V236-I238 HydrophobicContact CG1-CB 4.35Å; V236-I238 HydrophobicContact CG1-CD1 3.7Å; V236-I238 HydrophobicContact CG1-CG1 3.65Å
237	Q	46.5	Very low	42	Very low	201 Å²	201	137 Å²	137	94%	0.939	76%	0.761	S	S	*	*				-114	141	129.1	-77.6	-169.7	-23.7	0	0	109.4
238	I	39.2	Very low	42	Very low	128 Å²	128	136.7 Å²	136.7	66%	0.656	76%	0.758	S	S	*	*			trans	-111.9	141.6	174.8	-81.6	155.2	0	0	0	108.2	V236	V236-I238 HydrophobicContact CG1-CB 4.35Å; V236-I238 HydrophobicContact CG1-CD1 3.7Å; V236-I238 HydrophobicContact CG1-CG1 3.65Å
239	N	42.8	Very low	41.7	Very low	170 Å²	170	135.7 Å²	135.7	91%	0.909	75%	0.752	S	S	*	*			trans	-142.6	127.2	137.4	-101.9	-28.1	0	0	0	110.6
240	N	38.4	Very low	41.4	Very low	140 Å²	140	135.6 Å²	135.6	75%	0.749	75%	0.751	S	S	*	*			trans	-84.1	175.7	174.9	-114	-14.4	0	0	0	108.8
241	C	36.4	Very low	41.2	Very low	73 Å²	73	132.6 Å²	132.6	49%	0.493	75%	0.745	S	S	.	*			cis	-160.2	162.5	15.6	-130.6	0	0	0	0	110.2
242	Q	38.1	Very low	41.1	Very low	172 Å²	172	133.2 Å²	133.2	80%	0.804	75%	0.749	S	S	*	*			trans	35.4	142.8	130.2	-63.9	167	-3.6	0	0	120.7
243	S	38.2	Very low	40.7	Very low	103 Å²	103	132.5 Å²	132.5	72%	0.72	75%	0.749	S	S	*	*			cis	-154	160.6	15	-46.4	0	0	0	0	111.8
244	S	49.8	Very low	40.4	Very low	124 Å²	124	133.2 Å²	133.2	87%	0.867	76%	0.759	S	S	*	*			trans	-154.4	138.4	150.6	53.5	0	0	0	0	111.5
245	D	45.2	Very low	39.9	Very low	131 Å²	131	128.8 Å²	128.8	70%	0.701	76%	0.758	S	S	*	*			trans	-118.5	168.4	-169.1	-83.7	-67.1	0	0	0	113.8
246	F	40.7	Very low	39.6	Very low	165 Å²	165	129 Å²	129	72%	0.724	76%	0.759	S	S	*	*			trans	85.6	97.2	158.6	-58.3	-61	0	0	0	121.4
247	K	39.1	Very low	39.3	Very low	174 Å²	174	134.7 Å²	134.7	76%	0.757	77%	0.769	S	S	*	*				75.3	116.9	120.7	-73.3	172.3	178.2	172.9	0	121.2
248	S	39	Very low	38.7	Very low	110 Å²	110	131.5 Å²	131.5	77%	0.769	76%	0.758	S	S	*	*				73.8	131.7	123.1	-62	0	0	0	0	119
249	S	39.3	Very low	38.2	Very low	103 Å²	103	138 Å²	138	72%	0.72	78%	0.775	S	S	*	*			cis	-153	144.8	4	-63.6	0	0	0	0	113.1
250	T	37.7	Very low	37.8	Very low	122 Å²	122	140.2 Å²	140.2	75%	0.748	77%	0.77	S	S	*	*			trans	28.7	126.7	141.8	60.8	0	0	0	0	122.5
251	S	36.9	Very low	37.4	Very low	111 Å²	111	142 Å²	142	78%	0.776	77%	0.774	S	S	*	*			trans	62.1	145.4	140.4	55.2	0	0	0	0	120.5
252	S	38.5	Very low	37.3	Very low	116 Å²	116	148.6 Å²	148.6	81%	0.811	79%	0.79	S	S	*	*			cis	-156.6	167.7	-1.1	37.3	0	0	0	0	111.7
253	S	34.9	Very low	37.3	Very low	117 Å²	117	146.9 Å²	146.9	82%	0.818	79%	0.787	S	S	*	*			trans	-80.9	134.3	-176.4	53.8	0	0	0	0	115
254	S	36.7	Very low	37	Very low	119 Å²	119	149.7 Å²	149.7	83%	0.832	79%	0.789	S	S	*	*			trans	-163.9	129.3	150.5	50.5	0	0	0	0	113.7
255	S	35	Very low	36.3	Very low	113 Å²	113	151.1 Å²	151.1	79%	0.79	79%	0.786	S	S	*	*			trans	-84.6	163.2	148.3	-34.7	0	0	0	0	107.7
256	P	39.5	Very low	35.9	Very low	109 Å²	109	151 Å²	151	71%	0.708	79%	0.79	S	S	*	*				-161.2	179.5	67.3	44.3	-22.6	0	0	0	118.3
257	R	34.5	Very low	35.6	Very low	227 Å²	227	152 Å²	152	86%	0.857	80%	0.797	S	S	*	*			trans	35.6	156.8	135.6	-64.9	173.2	-172	-138.1	2	124
258	N	33.3	Very low	35.3	Very low	134 Å²	134	151.8 Å²	151.8	72%	0.717	80%	0.799	S	S	*	*			trans	78.1	103.7	150.1	-85.5	5.2	0	0	0	119.6
259	W	28.9	Very low	35.1	Very low	265 Å²	265	154.2 Å²	154.2	100%	1.004	80%	0.802	S	S	*	*			trans	-94.1	80.6	147.7	-75.8	105.9	0	0	0	110.2
260	R	33.4	Very low	34.7	Very low	216 Å²	216	157 Å²	157	82%	0.815	80%	0.803	S	S	*	*			trans	-149.8	130.6	163.3	-84	-162.4	175.1	-168	-2.3	110.7
261	Q	31.1	Very low	34.6	Very low	177 Å²	177	160.1 Å²	160.1	83%	0.827	81%	0.809	S	S	*	*			trans	67.3	88.7	152.8	-163.7	166.7	-5.3	0	0	117.7
262	Y	33.2	Very low	34.4	Very low	213 Å²	213	159.5 Å²	159.5	84%	0.835	81%	0.805	S	S	*	*			trans	-144.7	138.5	149.7	-97.2	-96.9	0	0	0	104.8
263	D	38	Very low	34	Very low	136 Å²	136	159 Å²	159	73%	0.727	80%	0.801	S	S	*	*			cis	-150.5	167.2	-6.7	-138.8	-1.8	0	0	0	110.5
264	E	32.7	Very low	33.9	Very low	162 Å²	162	156.7 Å²	156.7	76%	0.757	79%	0.785	S	S	*	*			trans	-86.6	170.2	172.5	-76.4	-177.6	86.7	0	0	112.8
265	N	35.3	Very low	33.6	Very low	153 Å²	153	159.8 Å²	159.8	82%	0.818	79%	0.786	S	S	*	*			trans	88.7	106.6	174.8	-47.4	-67	0	0	0	117.4
266	T	36.4	Very low	33.4	Very low	128 Å²	128	162.9 Å²	162.9	79%	0.785	78%	0.781	S	S	*	*				-177.6	106.4	114.3	-70.3	0	0	0	0	110.5
267	E	35.2	Very low	32.8	Very low	186 Å²	186	163.8 Å²	163.8	87%	0.869	79%	0.789	S	S	*	*			trans	57.1	138	148.4	-57.9	-172.1	146.7	0	0	122.8
268	H	31	Very low	32.7	Very low	171 Å²	171	160 Å²	160	79%	0.792	79%	0.785	S	S	*	*			trans	-87.8	133.2	-178.1	-61.2	-104	0	0	0	112.5
269	I	35.1	Very low	32.4	Very low	161 Å²	161	159 Å²	159	83%	0.826	79%	0.789	S	S	*	*			trans	-129.3	100.5	147.7	-58.9	-177.4	0	0	0	108.6
270	H	31.8	Very low	32.5	Very low	160 Å²	160	154 Å²	154	74%	0.741	78%	0.782	S	S	*	*			trans	-84.8	124.4	167.2	-94.4	-120.5	0	0	0	109.8
271	Q	35.3	Very low	32.2	Very low	188 Å²	188	154 Å²	154	88%	0.879	78%	0.781	S	S	*	*			trans	-134.5	137.4	153.8	-69.7	-165.9	-2.2	0	0	109.5
272	S	32.8	Very low	32.1	Very low	99 Å²	99	153.9 Å²	153.9	69%	0.692	78%	0.781	S	S	*	*			trans	-106.3	139.6	-160	-54.7	0	0	0	0	113.7
273	S	29.6	Very low	32.1	Very low	105 Å²	105	150.6 Å²	150.6	73%	0.734	78%	0.778	S	S	*	*			trans	36.2	108.8	140.9	63.1	0	0	0	0	120.4
274	S	33.7	Very low	31.9	Very low	68 Å²	68	152.5 Å²	152.5	48%	0.476	78%	0.782	S	S	.	*				-154.1	144.1	125.2	-19.2	0	0	0	0	107.9	Y276	S274-Y276 VanDerWaalsContact CB-CE1 3.47Å; S274-Y276 VanDerWaalsContact CB-CZ 3.45Å; S274-Y276 PolarHBondContact OG-OH 3.35Å
275	H	30.3	Very low	31.7	Very low	185 Å²	185	149.4 Å²	149.4	86%	0.856	78%	0.778	S	S	*	*			cis	60.2	66	42.5	-84.5	-80.2	0	0	0	114.5
276	Y	30.1	Very low	31.7	Very low	177 Å²	177	150 Å²	150	69%	0.694	78%	0.781	S	S	*	*			trans	-126.8	82.3	166.2	-41.5	-73.6	0	0	0	111.1	S274 L278	S274-Y276 VanDerWaalsContact CB-CE1 3.47Å; S274-Y276 VanDerWaalsContact CB-CZ 3.45Å; S274-Y276 PolarHBondContact OG-OH 3.35Å; Y276-L278 PolarHBondContact O-N 3.04Å
277	C	26.9	Very low	31.3	Very low	129 Å²	129	151 Å²	151	87%	0.872	78%	0.781	S	S	*	*			trans	-77.8	78.2	161.9	-67.1	0	0	0	0	108.7
278	L	31.9	Very low	31.6	Very low	147 Å²	147	149.8 Å²	149.8	77%	0.77	78%	0.779	S	S	*	*			trans	-108.7	97.8	175.5	-77.2	173.4	0	0	0	110.7	Y276 N280	Y276-L278 PolarHBondContact O-N 3.04Å; L278-N280 PolarHBondContact O-N 2.75Å
279	S	28.2	Very low	31.6	Very low	113 Å²	113	149 Å²	149	79%	0.79	78%	0.776	S	S	*	*			trans	-56	125.3	158.2	52.6	0	0	0	0	109.7
280	N	30.8	Very low	31.3	Very low	161 Å²	161	147.7 Å²	147.7	86%	0.861	77%	0.77	S	S	*	*			trans	-123	132.6	156.1	-154.2	23.5	0	0	0	109.3	L278	L278-N280 PolarHBondContact O-N 2.75Å
281	R	27.6	Very low	31.2	Very low	214 Å²	214	145.1 Å²	145.1	81%	0.808	77%	0.766	S	S	*	*			trans	-87.4	168.7	173.5	-78	178.7	163.9	-123.7	0.5	109.4
282	Q	28.6	Very low	30.9	Very low	176 Å²	176	142.3 Å²	142.3	82%	0.822	77%	0.767	S	S	*	*			trans	74.6	147.5	168.6	-66.1	151.6	-43.8	0	0	115.7
283	N	31.9	Very low	30.8	Very low	143 Å²	143	145.5 Å²	145.5	77%	0.765	77%	0.771	S	S	*	*			trans	80	115.2	-177.7	-53.3	15.6	0	0	0	115.7
284	E	34	Very low	30.9	Very low	176 Å²	176	151.5 Å²	151.5	82%	0.822	78%	0.777	S	S	*	*			cis	-154.2	165	-18.2	-135	163	159.7	0	0	108.9
285	C	28	Very low	30.7	Very low	98 Å²	98	154.7 Å²	154.7	66%	0.662	79%	0.789	S	S	*	*			trans	-83	140.4	-176	54.9	0	0	0	0	112.6
286	D	35.7	Very low	30.6	Very low	164 Å²	164	152.4 Å²	152.4	88%	0.877	78%	0.783	S	S	*	*			trans	-141.1	73.1	157.4	-104.1	-34.7	0	0	0	106.9
287	D	28.9	Very low	30.4	Very low	150 Å²	150	155.4 Å²	155.4	80%	0.802	79%	0.793	S	S	*	*			trans	-72.6	124.1	168.7	-80.6	-73.9	0	0	0	109.3
288	I	41.5	Very low	30.9	Very low	160 Å²	160	155.2 Å²	155.2	82%	0.821	79%	0.79	S	S	*	*			trans	-117.6	91	163.3	-58.6	-176.8	0	0	0	107.1
289	E	30.1	Very low	30.9	Very low	155 Å²	155	154.3 Å²	154.3	72%	0.724	79%	0.791	S	S	*	*			trans	-69.2	172.6	169.7	-155.9	-157	136.7	0	0	110.8
290	L	29.7	Very low	31	Very low	133 Å²	133	157.7 Å²	157.7	70%	0.696	80%	0.797	S	S	*	*			trans	70.9	139	172.2	-50	119.7	0	0	0	114.7
291	T	29.7	Very low	31.3	Very low	107 Å²	107	154.6 Å²	154.6	66%	0.656	79%	0.793	S	S	*	*			cis	-149.2	152.2	1.3	-7.8	0	0	0	0	111.7	Q293	T291-Q293 PolarHBondContact O-N 3.27Å
292	S	28.7	Very low	31.6	Very low	129 Å²	129	149.9 Å²	149.9	90%	0.902	79%	0.793	S	S	*	*			trans	-71.1	86.9	163.4	-65.2	0	0	0	0	110.9
293	Q	31.7	Very low	31.8	Very low	166 Å²	166	149.8 Å²	149.8	78%	0.776	79%	0.793	S	S	*	*			trans	-119.3	118.8	164.9	-73.3	-170	-4.9	0	0	110.9	T291	T291-Q293 PolarHBondContact O-N 3.27Å
294	R	30.7	Very low	32	Very low	231 Å²	231	149.6 Å²	149.6	87%	0.872	79%	0.792	S	S	*	*			trans	-61.1	139.4	149	-68.9	172.9	168.3	175.4	-5.3	107.2
295	N	29.5	Very low	32.4	Very low	135 Å²	135	149.7 Å²	149.7	72%	0.722	80%	0.797	S	S	*	*				179.3	135.9	116.4	-86	-1.7	0	0	0	111
296	D	29.1	Very low	32.7	Very low	137 Å²	137	151.2 Å²	151.2	73%	0.733	80%	0.799	S	S	*	*			trans	50.1	132.9	140.1	-48.7	-41	0	0	0	122.6	P298	D296-P298 WeakPolarHBondContact O-CD 3.5Å
297	W	25.6	Very low	32.9	Very low	240 Å²	240	151.2 Å²	151.2	91%	0.909	79%	0.793	S	S	*	*			trans	-71.2	126.1	171	-71.6	79.3	0	0	0	111.5	T299	W297-T299 PolarHBondContact O-N 2.99Å; W297-T299 VanDerWaalsContact O-N 3.16Å
298	P	36	Very low	33.4	Very low	124 Å²	124	149.3 Å²	149.3	81%	0.805	79%	0.791	S	S	*	*			trans	-80	94.3	170.8	-9.2	26.7	0	0	0	111	D296 M300	D296-P298 WeakPolarHBondContact O-CD 3.5Å; P298-M300 PolarHBondContact O-N 3.34Å
299	T	32.4	Very low	33	Very low	129 Å²	129	151.3 Å²	151.3	79%	0.791	79%	0.79	S	S	*	*			trans	-91.7	65.8	172.3	-53.4	0	0	0	0	110.9	W297	W297-T299 PolarHBondContact O-N 2.99Å; W297-T299 VanDerWaalsContact O-N 3.16Å
300	M	31.3	Very low	33.4	Very low	183 Å²	183	153.3 Å²	153.3	90%	0.901	80%	0.799	S	S	*	*			trans	-152.9	148.6	170.9	-69.5	-164.2	-176.6	0	0	108.9	P298	P298-M300 PolarHBondContact O-N 3.34Å
301	A	35.4	Very low	33.6	Very low	96 Å²	96	151 Å²	151	79%	0.793	79%	0.794	S	S	*	*			cis	-140.7	167.5	-1	0	0	0	0	0	110.6
302	S	34.1	Very low	34	Very low	115 Å²	115	153.1 Å²	153.1	80%	0.804	81%	0.807	S	S	*	*			trans	-69.3	142.2	173.7	-49.3	0	0	0	0	112.5
303	Q	34	Very low	34.1	Very low	174 Å²	174	152.5 Å²	152.5	81%	0.813	80%	0.803	S	S	*	*			trans	-159.3	129	138.6	-109.6	154.9	5.8	0	0	111.7
304	D	35.2	Very low	34.4	Very low	140 Å²	140	150.4 Å²	150.4	75%	0.749	81%	0.806	S	S	*	*			trans	51.2	99.2	147.7	-45.1	-23.6	0	0	0	119.9
305	L	42.2	Very low	34.3	Very low	177 Å²	177	143.6 Å²	143.6	93%	0.927	81%	0.808	S	S	*	*				-168.6	124.2	94.4	-96.5	164.6	0	0	0	111.1
306	D	34.8	Very low	34.5	Very low	130 Å²	130	140.8 Å²	140.8	70%	0.695	81%	0.811	S	S	*	*			trans	-94.2	146.4	176.5	165.6	56.4	0	0	0	111.2
307	H	40.7	Very low	35	Very low	164 Å²	164	144.6 Å²	144.6	76%	0.759	82%	0.821	S	S	*	*			trans	-175.5	146.8	130.8	-97.6	3.1	0	0	0	115.8
308	S	39.4	Very low	35.5	Very low	110 Å²	110	138.4 Å²	138.4	77%	0.769	81%	0.814	S	S	*	*			trans	67.6	58.3	157.1	59	0	0	0	0	119.5
309	Y	32	Very low	35.9	Very low	203 Å²	203	140.5 Å²	140.5	80%	0.796	82%	0.818	S	S	*	*				12.7	118.3	117.9	-139.8	-92.9	0	0	0	118.7
310	Q	40.2	Very low	36.3	Very low	196 Å²	196	141.3 Å²	141.3	92%	0.916	82%	0.818	S	S	*	*				-160.2	138.4	128.2	-117.5	167.9	81.3	0	0	111.7
311	S	32.9	Very low	37.1	Very low	85 Å²	85	143.5 Å²	143.5	59%	0.594	82%	0.816	S	S	*	*			trans	-124.4	129.6	-163.7	-51.5	0	0	0	0	112
312	V	38	Very low	37.9	Very low	152 Å²	152	150.3 Å²	150.3	92%	0.921	82%	0.821	S	S	*	*			trans	-141.1	136.4	153.4	-82.1	0	0	0	0	109.6
313	S	31.6	Very low	39.1	Very low	116 Å²	116	152.7 Å²	152.7	81%	0.811	82%	0.823	S	S	*	*			trans	-96.5	140.9	-167.8	-50.1	0	0	0	0	112.7
314	S	36.9	Very low	40.6	Very low	122 Å²	122	155.2 Å²	155.2	85%	0.853	83%	0.825	S	S	*	*				172.1	124	126.3	-78.9	0	0	0	0	113.5
315	G	29.8	Very low	42.4	Very low	88 Å²	88	153.4 Å²	153.4	91%	0.907	82%	0.819	S	S	*	*			trans	54.4	104.5	149.8	0	0	0	0	0	120.5
316	G	33.8	Very low	44.2	Very low	76 Å²	76	150 Å²	150	78%	0.784	81%	0.81	S	S	*	*			trans	-170.9	131.2	164.4	0	0	0	0	0	113
317	F	39.4	Very low	46.7	Very low	217 Å²	217	145 Å²	145	95%	0.952	78%	0.783	S	S	*	*			trans	-74.7	131.2	-177.5	-66.9	-89.1	0	0	0	111.7	L319	F317-L319 PolarHBondContact O-N 3.39Å
318	S	34.8	Very low	49.1	Very low	109 Å²	109	140.7 Å²	140.7	76%	0.762	77%	0.769	S	S	*	*			trans	-73.1	112.2	-172	-174.5	0	0	0	0	113.2	N320	S318-N320 PolarHBondContact O-N 3.46Å
319	L	46.1	Very low	51.4	Low	169 Å²	169	141.1 Å²	141.1	89%	0.885	76%	0.762	S	S	*	*			trans	-74.9	62.1	173.2	-74.5	170.2	0	0	0	111.9	F317 R321	F317-L319 PolarHBondContact O-N 3.39Å; L319-R321 PolarHBondContact O-N 2.97Å
320	N	40	Very low	54.2	Low	146 Å²	146	136.4 Å²	136.4	78%	0.781	75%	0.748	S	S	*	*			trans	-76.4	50.4	-179.6	-161.6	1.8	0	0	0	113.3	S318	S318-N320 PolarHBondContact O-N 3.46Å
321	R	48.3	Very low	56.8	Low	228 Å²	228	128.7 Å²	128.7	86%	0.86	71%	0.711	S	S	*	*			trans	-91.9	114.6	174.3	-137	-177.5	-158.9	-161.4	7.8	108.1	L319 I323	L319-R321 PolarHBondContact O-N 2.97Å; R321-I323 PolarHBondContact O-N 3.21Å; R321-I323 VanDerWaalsContact O-N 3.11Å
322	R	51.3	Low	59.7	Low	240 Å²	240	129.5 Å²	129.5	91%	0.906	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-53.5	119	-179.9	-59.9	-178.1	-165.5	156.2	5	110.5	R324	R322-R324 PolarHBondContact O-N 2.81Å
323	I	60.4	Low	62.3	Low	165 Å²	165	129.1 Å²	129.1	85%	0.846	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-61.8	128.5	175.8	-60	175.3	0	0	0	108.3	R321	R321-I323 PolarHBondContact O-N 3.21Å; R321-I323 VanDerWaalsContact O-N 3.11Å
324	R	64.5	Low	65.4	Low	227 Å²	227	127.1 Å²	127.1	86%	0.857	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-80.5	123.7	177.4	-175.5	177.9	-173.6	164.2	3.2	108.9	R322 S326	R322-R324 PolarHBondContact O-N 2.81Å; R324-S326 PolarHBondContact O-N 3.37Å
325	T	73.6	Confident	68.2	Low	102 Å²	102	121.3 Å²	121.3	63%	0.626	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-62.2	122.8	173.3	43.7	0	0	0	0	110.8
326	S	80.2	Confident	71.2	Confident	105 Å²	105	122 Å²	122	73%	0.734	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-100.5	118.4	174.9	51.7	0	0	0	0	109.8	R324	R324-S326 PolarHBondContact O-N 3.37Å
327	L	87.2	Confident	74.1	Confident	25 Å²	25	122.5 Å²	122.5	13%	0.131	58%	0.58	C	S	.	*	P	Polyproline II helix	trans	-69.9	148.5	163.9	-67.1	159.1	0	0	0	109.6	Q331 R332 L335 V359 V363 W367	L327-Q331 HydrophobicContact CB-CB 4.23Å; L327-Q331 HydrophobicContact CD2-CB 3.93Å; L327-R332 HydrophobicContact CB-CG 4.2Å; L327-R332 PolarHBondContact O-NH1 3Å; L327-R332 PolarHBondContact O-NH2 3.46Å; L327-L335 HydrophobicContact CD1-CD1 3.95Å; L327-L335 HydrophobicContact CD2-CD1 4.14Å; L327-V359 HydrophobicContact CD2-CG1 3.96Å; L327-V363 HydrophobicContact CD1-CG1 4.42Å; L327-V363 HydrophobicContact CD2-CG1 4.08Å; L327-V363 HydrophobicContact CG-CG1 4.34Å; L327-W367 VanDerWaalsContact CD1-CD1 3.49Å; L327-W367 HydrophobicContact CD1-CG 4.38Å
328	T	89.9	Confident	76.8	Confident	74 Å²	74	112.9 Å²	112.9	45%	0.454	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-77.7	168.5	165.1	67.3	0	0	0	0	110.7	Q331 R332	T328-Q331 PolarHBondContact O-N 3.31Å; T328-Q331 VanDerWaalsContact OG1-CG 3.26Å; T328-Q331 WeakPolarHBondContact OG1-CG 3.43Å; T328-Q331 PolarHBondContact OG1-N 3.43Å; T328-R332 WeakPolarHBondContact O-CG 3.43Å; T328-R332 PolarHBondContact O-N 3.49Å
329	D	88	Confident	79.7	Confident	119 Å²	119	108.5 Å²	108.5	64%	0.636	51%	0.508	S	S	*	.	H	α-helix	trans	-69.7	-35.4	178.9	-65.9	-68.6	0	0	0	113	Q331 R332 Y333	D329-Q331 PolarHBondContact O-N 3.27Å; D329-R332 WeakPolarHBondContact O-CB 3.42Å; D329-R332 PolarHBondContact O-N 2.86Å; D329-R332 VanDerWaalsContact O-N 3.16Å; D329-R332 IonicContact OD1-CZ 3.34Å; D329-R332 IonicContact OD1-NH1 3.7Å; D329-R332 PolarHBondContact OD1-NH1 3.29Å; D329-R332 IonicContact OD2-NH1 2.98Å; D329-R332 PolarHBondContact OD2-NH1 3Å; D329-Y333 WeakPolarHBondContact O-CB 3.32Å; D329-Y333 PolarHBondContact O-N 3.24Å
330	E	91.1	Very high	81.9	Confident	103 Å²	103	107 Å²	107	48%	0.481	50%	0.496	S	S	.	.	H	α-helix	trans	-57.1	-47.9	167.7	176.4	61.1	-159.9	0	0	111.2	R332 Y333 R334	E330-R332 VanDerWaalsContact C-N 3.26Å; E330-R332 PolarHBondContact O-N 2.92Å; E330-Y333 PolarHBondContact O-N 3.4Å; E330-Y333 VanDerWaalsContact O-N 3.16Å; E330-R334 WeakPolarHBondContact O-CG 3.41Å; E330-R334 PolarHBondContact O-N 3.38Å; E330-R334 VanDerWaalsContact O-N 3.09Å; E330-R334 IonicContact OE1-CZ 3.27Å; E330-R334 IonicContact OE1-NE 2.72Å; E330-R334 PolarHBondContact OE1-NE 2.96Å; E330-R334 IonicContact OE1-NH2 3.52Å
331	Q	94.5	Very high	84.5	Confident	34 Å²	34	107.3 Å²	107.3	16%	0.159	50%	0.497	C	S	.	.	H	α-helix	trans	-63.5	-31.4	177.4	-70.2	170.8	-20.4	0	0	112.5	L327 T328 D329 L335 L357 V359	L327-Q331 HydrophobicContact CB-CB 4.23Å; L327-Q331 HydrophobicContact CD2-CB 3.93Å; T328-Q331 PolarHBondContact O-N 3.31Å; T328-Q331 VanDerWaalsContact OG1-CG 3.26Å; T328-Q331 WeakPolarHBondContact OG1-CG 3.43Å; T328-Q331 PolarHBondContact OG1-N 3.43Å; D329-Q331 PolarHBondContact O-N 3.27Å; Q331-L335 WeakPolarHBondContact O-CB 3.34Å; Q331-L335 VanDerWaalsContact O-CD1 3.28Å; Q331-L335 WeakPolarHBondContact O-CD1 3.32Å; Q331-L335 WeakPolarHBondContact O-CG 3.39Å; Q331-L335 PolarHBondContact O-N 3.47Å; Q331-L357 HydrophobicContact CG-CB 4.24Å; Q331-L357 HydrophobicContact CG-CD2 4.37Å; Q331-L357 PolarHBondContact NE2-O 2.76Å; Q331-V359 VanDerWaalsContact NE2-CG1 3.34Å
332	R	94	Very high	86.5	Confident	102 Å²	102	99.5 Å²	99.5	39%	0.385	47%	0.472	S	S	.	.	H	α-helix	trans	-69.3	-44.3	172.6	-70.1	171.7	-174.9	109.9	16.3	111.5	L327 T328 D329 E330 L335 Q336	L327-R332 HydrophobicContact CB-CG 4.2Å; L327-R332 PolarHBondContact O-NH1 3Å; L327-R332 PolarHBondContact O-NH2 3.46Å; T328-R332 WeakPolarHBondContact O-CG 3.43Å; T328-R332 PolarHBondContact O-N 3.49Å; D329-R332 WeakPolarHBondContact O-CB 3.42Å; D329-R332 PolarHBondContact O-N 2.86Å; D329-R332 VanDerWaalsContact O-N 3.16Å; D329-R332 IonicContact OD1-CZ 3.34Å; D329-R332 IonicContact OD1-NH1 3.7Å; D329-R332 PolarHBondContact OD1-NH1 3.29Å; D329-R332 IonicContact OD2-NH1 2.98Å; D329-R332 PolarHBondContact OD2-NH1 3Å; E330-R332 VanDerWaalsContact C-N 3.26Å; E330-R332 PolarHBondContact O-N 2.92Å; R332-L335 PolarHBondContact O-N 2.97Å; R332-Q336 PolarHBondContact O-N 3.26Å
333	Y	93.9	Very high	88.5	Confident	145 Å²	145	92.5 Å²	92.5	57%	0.569	45%	0.452	S	S	*	.	H	α-helix	trans	-60.5	-51.8	-177.6	-179.3	-96.3	0	0	0	111.5	D329 E330 L335 Q336 E337	D329-Y333 WeakPolarHBondContact O-CB 3.32Å; D329-Y333 PolarHBondContact O-N 3.24Å; E330-Y333 PolarHBondContact O-N 3.4Å; E330-Y333 VanDerWaalsContact O-N 3.16Å; Y333-L335 VanDerWaalsContact C-N 3.33Å; Y333-L335 PolarHBondContact O-N 3.22Å; Y333-Q336 WeakPolarHBondContact O-CA 3.39Å; Y333-Q336 WeakPolarHBondContact O-CB 3.38Å; Y333-Q336 PolarHBondContact O-N 2.95Å; Y333-E337 PolarHBondContact O-N 3.45Å
334	R	95	Very high	90.1	Very high	74 Å²	74	94 Å²	94	28%	0.279	45%	0.447	S	S	.	.	H	α-helix	trans	-62.6	-35.8	177.8	-58.8	-57.9	-152.8	86.3	24.2	113.8	E330 Q336 A338 E356 L357	E330-R334 WeakPolarHBondContact O-CG 3.41Å; E330-R334 PolarHBondContact O-N 3.38Å; E330-R334 VanDerWaalsContact O-N 3.09Å; E330-R334 IonicContact OE1-CZ 3.27Å; E330-R334 IonicContact OE1-NE 2.72Å; E330-R334 PolarHBondContact OE1-NE 2.96Å; E330-R334 IonicContact OE1-NH2 3.52Å; R334-Q336 VanDerWaalsContact C-N 3.29Å; R334-A338 WeakPolarHBondContact O-CB 3.21Å; R334-A338 PolarHBondContact O-N 2.86Å; R334-E356 IonicContact CZ-OE1 3.6Å; R334-E356 IonicContact NH1-OE1 3.53Å; R334-E356 PolarHBondContact NH1-OE1 3.44Å; R334-E356 IonicContact NH2-OE1 3.51Å; R334-L357 HydrophobicContact CB-CD1 4.33Å; R334-L357 HydrophobicContact CB-CD2 3.81Å; R334-L357 HydrophobicContact CG-CD2 3.93Å
335	L	96.1	Very high	91.5	Very high	0 Å²	0	83.4 Å²	83.4	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-67.1	-32.3	174.2	-73.8	171	0	0	0	112	L327 Q331 R332 Y333 Y339 L357 V364 W367 F368	L327-L335 HydrophobicContact CD1-CD1 3.95Å; L327-L335 HydrophobicContact CD2-CD1 4.14Å; Q331-L335 WeakPolarHBondContact O-CB 3.34Å; Q331-L335 VanDerWaalsContact O-CD1 3.28Å; Q331-L335 WeakPolarHBondContact O-CD1 3.32Å; Q331-L335 WeakPolarHBondContact O-CG 3.39Å; Q331-L335 PolarHBondContact O-N 3.47Å; R332-L335 PolarHBondContact O-N 2.97Å; Y333-L335 VanDerWaalsContact C-N 3.33Å; Y333-L335 PolarHBondContact O-N 3.22Å; L335-Y339 WeakPolarHBondContact O-CB 3.34Å; L335-Y339 PolarHBondContact O-N 3.42Å; L335-L357 HydrophobicContact CD1-CD1 4.29Å; L335-L357 HydrophobicContact CD2-CD1 3.89Å; L335-L357 HydrophobicContact CG-CD1 3.68Å; L335-V364 HydrophobicContact CD2-CG1 3.96Å; L335-V364 HydrophobicContact CD2-CG2 4.43Å; L335-W367 VanDerWaalsContact C-CH2 3.45Å; L335-W367 HydrophobicContact CB-CD2 3.84Å; L335-W367 HydrophobicContact CB-CE3 3.91Å; L335-W367 HydrophobicContact CB-CH2 3.92Å; L335-W367 HydrophobicContact CB-CZ2 3.78Å; L335-W367 HydrophobicContact CB-CZ3 3.97Å; L335-W367 HydrophobicContact CD1-CB 4.32Å; L335-W367 HydrophobicContact CD1-CD2 3.96Å; L335-W367 HydrophobicContact CD1-CG 3.79Å; L335-W367 HydrophobicContact CG-CD2 4.37Å; L335-W367 WeakPolarHBondContact O-CH2 3.38Å; L335-W367 VanDerWaalsContact O-CZ3 3.24Å; L335-W367 WeakPolarHBondContact O-CZ3 3.17Å; L335-F368 HydrophobicContact CD2-CE2 3.86Å
336	Q	93.8	Very high	92.5	Very high	103 Å²	103	81 Å²	81	48%	0.481	40%	0.395	S	S	.	.	H	α-helix	trans	-73.3	-46.3	174.8	-178.8	174.9	-29.1	0	0	112.1	R332 Y333 R334 A338 Y339 E340 W367	R332-Q336 PolarHBondContact O-N 3.26Å; Y333-Q336 WeakPolarHBondContact O-CA 3.39Å; Y333-Q336 WeakPolarHBondContact O-CB 3.38Å; Y333-Q336 PolarHBondContact O-N 2.95Å; R334-Q336 VanDerWaalsContact C-N 3.29Å; Q336-A338 VanDerWaalsContact C-N 3.32Å; Q336-A338 PolarHBondContact O-N 2.82Å; Q336-Y339 WeakPolarHBondContact O-CA 3.43Å; Q336-Y339 VanDerWaalsContact O-CB 3.29Å; Q336-Y339 WeakPolarHBondContact O-CB 2.78Å; Q336-Y339 PolarHBondContact O-N 3.07Å; Q336-E340 HydrophobicContact CG-CG 4.49Å; Q336-E340 VanDerWaalsContact CG-OE1 3.24Å; Q336-E340 WeakPolarHBondContact CG-OE1 3.33Å; Q336-E340 PolarHBondContact NE2-OE1 3.09Å; Q336-E340 PolarHBondContact O-N 2.87Å; Q336-W367 HydrophobicContact CB-CH2 4.44Å
337	E	94.5	Very high	93.2	Very high	86 Å²	86	82.4 Å²	82.4	40%	0.402	39%	0.388	S	S	.	.	H	α-helix	trans	-52.8	-49	173	177.4	179.3	-123.2	0	0	111.3	Y333 Y339 E340 L341	Y333-E337 PolarHBondContact O-N 3.45Å; E337-Y339 PolarHBondContact O-N 3.38Å; E337-E340 PolarHBondContact O-N 2.88Å; E337-L341 WeakPolarHBondContact O-CG 3.49Å; E337-L341 PolarHBondContact O-N 3.05Å; E337-L341 VanDerWaalsContact O-N 3.13Å
338	A	95.4	Very high	93.6	Very high	15 Å²	15	85 Å²	85	12%	0.124	41%	0.408	C	S	.	.	H	α-helix	trans	-66.8	-20.7	176	0	0	0	0	0	114.4	R334 Q336 N342 L353 F368	R334-A338 WeakPolarHBondContact O-CB 3.21Å; R334-A338 PolarHBondContact O-N 2.86Å; Q336-A338 VanDerWaalsContact C-N 3.32Å; Q336-A338 PolarHBondContact O-N 2.82Å; A338-N342 PolarHBondContact O-N 3.4Å; A338-N342 VanDerWaalsContact O-N 3.07Å; A338-L353 HydrophobicContact CB-CD1 3.68Å; A338-L353 HydrophobicContact CB-CD2 3.9Å; A338-L353 HydrophobicContact CB-CG 4.43Å; A338-F368 HydrophobicContact CB-CZ 4.2Å
339	Y	96.4	Very high	93.8	Very high	16 Å²	16	85 Å²	85	6%	0.063	40%	0.404	C	S	.	.	H	α-helix	trans	-81.8	-39.4	176.4	-174.9	-90.9	0	0	0	112.5	L335 Q336 E337 L341 N342 I343 W367 F368 Q371 R372 D375	L335-Y339 WeakPolarHBondContact O-CB 3.34Å; L335-Y339 PolarHBondContact O-N 3.42Å; Q336-Y339 WeakPolarHBondContact O-CA 3.43Å; Q336-Y339 VanDerWaalsContact O-CB 3.29Å; Q336-Y339 WeakPolarHBondContact O-CB 2.78Å; Q336-Y339 PolarHBondContact O-N 3.07Å; E337-Y339 PolarHBondContact O-N 3.38Å; Y339-L341 VanDerWaalsContact C-N 3.3Å; Y339-N342 CarbonylContact O-C 3.49Å; Y339-N342 PolarHBondContact O-N 3.14Å; Y339-I343 HydrophobicContact CE1-CG1 4.16Å; Y339-I343 HydrophobicContact CE2-CG2 4.15Å; Y339-I343 PolarHBondContact O-N 3.25Å; Y339-W367 HydrophobicContact CD2-CH2 4.49Å; Y339-W367 AromaticContact CD2-CZ3 3.95Å; Y339-W367 HydrophobicContact CD2-CZ3 3.95Å; Y339-W367 HydrophobicContact CG-CH2 4.36Å; Y339-W367 HydrophobicContact CG-CZ3 4.2Å; Y339-F368 AromaticContact CD2-CD1 3.58Å; Y339-F368 HydrophobicContact CD2-CD1 3.58Å; Y339-F368 AromaticContact CD2-CE1 3.61Å; Y339-F368 HydrophobicContact CD2-CE1 3.61Å; Y339-F368 HydrophobicContact CE2-CD1 4.24Å; Y339-F368 HydrophobicContact CG-CE1 4.25Å; Y339-Q371 HydrophobicContact CD1-CG 4.05Å; Y339-Q371 HydrophobicContact CD2-CB 4.15Å; Y339-Q371 HydrophobicContact CD2-CG 3.9Å; Y339-Q371 HydrophobicContact CE1-CG 3.76Å; Y339-Q371 HydrophobicContact CE2-CB 3.79Å; Y339-Q371 HydrophobicContact CE2-CG 3.62Å; Y339-Q371 HydrophobicContact CG-CG 4.12Å; Y339-R372 HydrophobicContact CE2-CG 3.92Å; Y339-R372 WeakPolarHBondContact OH-CA 3.39Å; Y339-R372 WeakPolarHBondContact OH-CG 3.48Å; Y339-R372 PolarHBondContact OH-N 3.12Å; Y339-D375 WeakPolarHBondContact CE1-OD2 3.37Å; Y339-D375 PolarHBondContact OH-OD2 2.82Å
340	E	93.1	Very high	94.2	Very high	139 Å²	139	81.6 Å²	81.6	65%	0.65	38%	0.383	S	S	*	.	H	α-helix	trans	-65.7	-35.5	174.5	-69.3	170.9	-165	0	0	110.7	Q336 E337	Q336-E340 HydrophobicContact CG-CG 4.49Å; Q336-E340 VanDerWaalsContact CG-OE1 3.24Å; Q336-E340 WeakPolarHBondContact CG-OE1 3.33Å; Q336-E340 PolarHBondContact NE2-OE1 3.09Å; Q336-E340 PolarHBondContact O-N 2.87Å; E337-E340 PolarHBondContact O-N 2.88Å
341	L	93.6	Very high	94.5	Very high	151 Å²	151	80.7 Å²	80.7	79%	0.791	38%	0.378	S	S	*	.	H	α-helix	trans	-71.3	-38.3	169	-66.9	173.8	0	0	0	113.6	E337 Y339	E337-L341 WeakPolarHBondContact O-CG 3.49Å; E337-L341 PolarHBondContact O-N 3.05Å; E337-L341 VanDerWaalsContact O-N 3.13Å; Y339-L341 VanDerWaalsContact C-N 3.3Å
342	N	90.5	Very high	94.5	Very high	64 Å²	64	81.9 Å²	81.9	34%	0.342	39%	0.394	S	S	.	.			trans	-154.3	108.1	178.3	-169.1	-22.3	0	0	0	113.3	A338 Y339 R344 P345	A338-N342 PolarHBondContact O-N 3.4Å; A338-N342 VanDerWaalsContact O-N 3.07Å; Y339-N342 CarbonylContact O-C 3.49Å; Y339-N342 PolarHBondContact O-N 3.14Å; N342-R344 PolarHBondContact O-N 2.79Å; N342-R344 WeakPolarHBondContact OD1-CA 3.35Å; N342-R344 PolarHBondContact OD1-N 3.24Å; N342-R344 PolarHBondContact OD1-O 3.1Å; N342-P345 WeakPolarHBondContact O-CD 3.34Å
343	I	93.1	Very high	94.6	Very high	94 Å²	94	77.8 Å²	77.8	48%	0.482	38%	0.38	S	S	.	.	S	Bend	trans	-62.2	-23.9	178.2	-63.3	169.9	0	0	0	112.8	Y339 R372	Y339-I343 HydrophobicContact CE1-CG1 4.16Å; Y339-I343 HydrophobicContact CE2-CG2 4.15Å; Y339-I343 PolarHBondContact O-N 3.25Å; I343-R372 HydrophobicContact CG2-CG 3.81Å; I343-R372 WeakPolarHBondContact O-CD 3.44Å; I343-R372 PolarHBondContact O-NH1 2.92Å
344	R	93.8	Very high	94.8	Very high	195 Å²	195	71.4 Å²	71.4	74%	0.736	36%	0.357	S	S	*	.	S	Bend	trans	-133.1	66.3	-177.9	-64.9	-176.9	68.7	123.5	-4.4	111	N342	N342-R344 PolarHBondContact O-N 2.79Å; N342-R344 WeakPolarHBondContact OD1-CA 3.35Å; N342-R344 PolarHBondContact OD1-N 3.24Å; N342-R344 PolarHBondContact OD1-O 3.1Å
345	P	93.8	Very high	94.8	Very high	6 Å²	6	72.8 Å²	72.8	4%	0.039	38%	0.378	C	S	.	.			trans	-65.2	144.8	-174.2	31.2	-38.3	0	0	0	111.9	N342 I349 R350 F368	N342-P345 WeakPolarHBondContact O-CD 3.34Å; P345-I349 HydrophobicContact CB-CB 4.03Å; P345-I349 HydrophobicContact CB-CG2 3.7Å; P345-R350 HydrophobicContact CB-CG 4.02Å; P345-R350 HydrophobicContact CG-CG 3.56Å; P345-R350 PolarHBondContact O-NE 2.9Å; P345-R350 PolarHBondContact O-NH2 3.13Å; P345-F368 HydrophobicContact CB-CE1 4.45Å; P345-F368 HydrophobicContact CG-CD1 3.5Å; P345-F368 HydrophobicContact CG-CD2 4.2Å; P345-F368 HydrophobicContact CG-CE1 3.42Å; P345-F368 VanDerWaalsContact CG-CE1 3.42Å; P345-F368 HydrophobicContact CG-CE2 4.14Å; P345-F368 HydrophobicContact CG-CG 3.92Å; P345-F368 HydrophobicContact CG-CZ 3.78Å
346	S	95.3	Very high	94.8	Very high	50 Å²	50	78.1 Å²	78.1	35%	0.35	40%	0.403	S	S	.	.			trans	-58.4	172.5	177.7	74.2	0	0	0	0	112.2	S348 I349 R350	S346-S348 PolarHBondContact OG-N 2.86Å; S346-S348 PolarHBondContact OG-OG 3.11Å; S346-I349 WeakPolarHBondContact OG-CG1 3.23Å; S346-I349 PolarHBondContact OG-N 3Å; S346-I349 VanDerWaalsContact OG-N 3.11Å; S346-R350 PolarHBondContact O-N 2.84Å; S346-R350 PolarHBondContact O-NE 2.93Å
347	K	94.4	Very high	94.8	Very high	136 Å²	136	74 Å²	74	59%	0.591	38%	0.384	S	S	*	.	H	α-helix	trans	-58.9	-49.8	172	-175.7	-175.8	162.2	-177.6	0	110.8	I349 R350 E351 M361	K347-I349 PolarHBondContact O-N 3.38Å; K347-R350 PolarHBondContact O-N 3.41Å; K347-E351 VanDerWaalsContact CE-CD 3.43Å; K347-E351 WeakPolarHBondContact CE-OE1 3.31Å; K347-E351 WeakPolarHBondContact CE-OE2 3.44Å; K347-E351 HydrophobicContact CG-CG 4.48Å; K347-E351 IonicContact NZ-OE1 2.74Å; K347-E351 WeakPolarHBondContact O-CG 3.47Å; K347-E351 PolarHBondContact O-N 3.21Å; K347-M361 HydrophobicContact CG-CE 4.09Å
348	S	95.3	Very high	94.8	Very high	80 Å²	80	73.3 Å²	73.3	56%	0.559	40%	0.399	S	S	*	.	H	α-helix	trans	-62.4	-41.2	-178.2	50.4	0	0	0	0	113.9	S346 R350 E351 A352	S346-S348 PolarHBondContact OG-N 2.86Å; S346-S348 PolarHBondContact OG-OG 3.11Å; S348-R350 VanDerWaalsContact C-N 3.33Å; S348-R350 PolarHBondContact O-N 3.08Å; S348-E351 PolarHBondContact O-N 3.05Å; S348-A352 PolarHBondContact O-N 3.17Å
349	I	94.4	Very high	94.8	Very high	72 Å²	72	73.4 Å²	73.4	37%	0.369	40%	0.399	S	S	.	.	H	α-helix	trans	-62.8	-41.9	176.7	-67	166.1	0	0	0	110.4	P345 S346 K347 A352 L353	P345-I349 HydrophobicContact CB-CB 4.03Å; P345-I349 HydrophobicContact CB-CG2 3.7Å; S346-I349 WeakPolarHBondContact OG-CG1 3.23Å; S346-I349 PolarHBondContact OG-N 3Å; S346-I349 VanDerWaalsContact OG-N 3.11Å; K347-I349 PolarHBondContact O-N 3.38Å; I349-A352 PolarHBondContact O-N 3.19Å; I349-L353 HydrophobicContact CG2-CD1 4.05Å; I349-L353 WeakPolarHBondContact O-CG 3.36Å; I349-L353 PolarHBondContact O-N 2.72Å
350	R	96.2	Very high	94.7	Very high	49 Å²	49	76.7 Å²	76.7	19%	0.185	42%	0.422	C	S	.	.	H	α-helix	trans	-70.9	-29.4	177.3	-72.5	-178.2	-80	120.8	-3.1	113.5	P345 S346 K347 S348 A354 M361 V364	P345-R350 HydrophobicContact CB-CG 4.02Å; P345-R350 HydrophobicContact CG-CG 3.56Å; P345-R350 PolarHBondContact O-NE 2.9Å; P345-R350 PolarHBondContact O-NH2 3.13Å; S346-R350 PolarHBondContact O-N 2.84Å; S346-R350 PolarHBondContact O-NE 2.93Å; K347-R350 PolarHBondContact O-N 3.41Å; S348-R350 VanDerWaalsContact C-N 3.33Å; S348-R350 PolarHBondContact O-N 3.08Å; R350-A354 VanDerWaalsContact O-CB 3.26Å; R350-A354 WeakPolarHBondContact O-CB 3.26Å; R350-A354 PolarHBondContact O-N 3.2Å; R350-M361 HydrophobicContact CB-CE 3.86Å; R350-M361 HydrophobicContact CB-SD 3.63Å; R350-V364 HydrophobicContact CB-CG1 3.99Å; R350-V364 HydrophobicContact CG-CG1 3.91Å
351	E	96.7	Very high	94.7	Very high	84 Å²	84	72.5 Å²	72.5	39%	0.393	40%	0.403	S	S	.	.	H	α-helix	trans	-71.7	-39.2	173.7	-72.5	171.2	152.5	0	0	111.5	K347 S348 A354 S355 M361	K347-E351 VanDerWaalsContact CE-CD 3.43Å; K347-E351 WeakPolarHBondContact CE-OE1 3.31Å; K347-E351 WeakPolarHBondContact CE-OE2 3.44Å; K347-E351 HydrophobicContact CG-CG 4.48Å; K347-E351 IonicContact NZ-OE1 2.74Å; K347-E351 WeakPolarHBondContact O-CG 3.47Å; K347-E351 PolarHBondContact O-N 3.21Å; S348-E351 PolarHBondContact O-N 3.05Å; E351-A354 PolarHBondContact O-N 3.16Å; E351-S355 WeakPolarHBondContact O-CB 3.4Å; E351-S355 PolarHBondContact O-N 2.83Å; E351-M361 HydrophobicContact CG-CE 3.63Å; E351-M361 HydrophobicContact CG-CG 4.41Å; E351-M361 HydrophobicContact CG-SD 3.98Å
352	A	95.7	Very high	94.7	Very high	58 Å²	58	72.8 Å²	72.8	48%	0.479	39%	0.393	S	S	.	.	H	α-helix	trans	-60.8	-51.1	171.2	0	0	0	0	0	111.7	S348 I349 A354 S355 E356	S348-A352 PolarHBondContact O-N 3.17Å; I349-A352 PolarHBondContact O-N 3.19Å; A352-A354 VanDerWaalsContact C-N 3.31Å; A352-A354 PolarHBondContact O-N 2.93Å; A352-S355 WeakPolarHBondContact O-CB 3.29Å; A352-S355 PolarHBondContact O-N 3.28Å; A352-S355 VanDerWaalsContact O-N 3.11Å; A352-E356 PolarHBondContact O-N 3.33Å
353	L	96.4	Very high	95	Very high	17 Å²	17	71 Å²	71	9%	0.089	38%	0.384	C	S	.	.	H	α-helix	trans	-60.4	-36.9	176.9	-69.8	166.1	0	0	0	112.9	A338 I349 L357 V364 F368	A338-L353 HydrophobicContact CB-CD1 3.68Å; A338-L353 HydrophobicContact CB-CD2 3.9Å; A338-L353 HydrophobicContact CB-CG 4.43Å; I349-L353 HydrophobicContact CG2-CD1 4.05Å; I349-L353 WeakPolarHBondContact O-CG 3.36Å; I349-L353 PolarHBondContact O-N 2.72Å; L353-L357 VanDerWaalsContact O-CB 3.27Å; L353-L357 WeakPolarHBondContact O-CB 3.47Å; L353-L357 VanDerWaalsContact O-CG 3.27Å; L353-L357 WeakPolarHBondContact O-CG 3.36Å; L353-L357 PolarHBondContact O-N 2.86Å; L353-V364 HydrophobicContact CB-CG1 4.34Å; L353-F368 HydrophobicContact CD1-CE2 4.06Å; L353-F368 HydrophobicContact CD1-CZ 4.21Å
354	A	96.9	Very high	95.1	Very high	11 Å²	11	66.5 Å²	66.5	9%	0.091	36%	0.361	C	S	.	.	H	α-helix	trans	-64.1	-42.4	175	0	0	0	0	0	111.8	R350 E351 A352 G358 V359 M361 V364	R350-A354 VanDerWaalsContact O-CB 3.26Å; R350-A354 WeakPolarHBondContact O-CB 3.26Å; R350-A354 PolarHBondContact O-N 3.2Å; E351-A354 PolarHBondContact O-N 3.16Å; A352-A354 VanDerWaalsContact C-N 3.31Å; A352-A354 PolarHBondContact O-N 2.93Å; A354-G358 PolarHBondContact O-N 2.91Å; A354-V359 CarbonylContact C-O 3.54Å; A354-V359 WeakPolarHBondContact CA-O 3.24Å; A354-V359 WeakPolarHBondContact CB-O 3.38Å; A354-V359 PolarHBondContact O-N 3.36Å; A354-V359 VanDerWaalsContact O-N 3.1Å; A354-V359 VanDerWaalsContact O-O 3.09Å; A354-M361 HydrophobicContact CB-CB 4.17Å; A354-V364 HydrophobicContact CB-CG2 3.88Å
355	S	95.7	Very high	95.2	Very high	102 Å²	102	60.4 Å²	60.4	71%	0.713	34%	0.341	S	S	*	.	H	α-helix	trans	-67.9	-44.4	177.6	-169.8	0	0	0	0	112.5	E351 A352	E351-S355 WeakPolarHBondContact O-CB 3.4Å; E351-S355 PolarHBondContact O-N 2.83Å; A352-S355 WeakPolarHBondContact O-CB 3.29Å; A352-S355 PolarHBondContact O-N 3.28Å; A352-S355 VanDerWaalsContact O-N 3.11Å
356	E	95.3	Very high	95.2	Very high	113 Å²	113	62.4 Å²	62.4	53%	0.528	35%	0.353	S	S	.	.	H	α-helix	trans	-65.8	-44.9	179.7	-176.6	-178.7	-176.7	0	0	112	R334 A352 G358	R334-E356 IonicContact CZ-OE1 3.6Å; R334-E356 IonicContact NH1-OE1 3.53Å; R334-E356 PolarHBondContact NH1-OE1 3.44Å; R334-E356 IonicContact NH2-OE1 3.51Å; A352-E356 PolarHBondContact O-N 3.33Å; E356-G358 VanDerWaalsContact C-N 3.32Å; E356-G358 PolarHBondContact O-N 2.83Å
357	L	94.8	Very high	95.3	Very high	17 Å²	17	61.9 Å²	61.9	9%	0.089	34%	0.344	C	S	.	.	H	α-helix	trans	-83.6	-5.7	-175.2	-62.1	-179.1	0	0	0	113.9	Q331 R334 L335 L353 V359	Q331-L357 HydrophobicContact CG-CB 4.24Å; Q331-L357 HydrophobicContact CG-CD2 4.37Å; Q331-L357 PolarHBondContact NE2-O 2.76Å; R334-L357 HydrophobicContact CB-CD1 4.33Å; R334-L357 HydrophobicContact CB-CD2 3.81Å; R334-L357 HydrophobicContact CG-CD2 3.93Å; L335-L357 HydrophobicContact CD1-CD1 4.29Å; L335-L357 HydrophobicContact CD2-CD1 3.89Å; L335-L357 HydrophobicContact CG-CD1 3.68Å; L353-L357 VanDerWaalsContact O-CB 3.27Å; L353-L357 WeakPolarHBondContact O-CB 3.47Å; L353-L357 VanDerWaalsContact O-CG 3.27Å; L353-L357 WeakPolarHBondContact O-CG 3.36Å; L353-L357 PolarHBondContact O-N 2.86Å; L357-V359 VanDerWaalsContact C-N 3.3Å; L357-V359 HydrophobicContact CB-CG1 4.46Å; L357-V359 HydrophobicContact CB-CG2 4.01Å; L357-V359 PolarHBondContact O-N 3.37Å
358	G	94.6	Very high	95.4	Very high	70 Å²	70	55.5 Å²	55.5	72%	0.722	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	29.3	-176.6	0	0	0	0	0	113.7	A354 E356	A354-G358 PolarHBondContact O-N 2.91Å; E356-G358 VanDerWaalsContact C-N 3.32Å; E356-G358 PolarHBondContact O-N 2.83Å
359	V	94.1	Very high	95.4	Very high	18 Å²	18	55.8 Å²	55.8	11%	0.109	31%	0.308	C	S	.	.			trans	-120.3	146.3	-176.5	-59	0	0	0	0	111.8	L327 Q331 A354 L357 M361 V364	L327-V359 HydrophobicContact CD2-CG1 3.96Å; Q331-V359 VanDerWaalsContact NE2-CG1 3.34Å; A354-V359 CarbonylContact C-O 3.54Å; A354-V359 WeakPolarHBondContact CA-O 3.24Å; A354-V359 WeakPolarHBondContact CB-O 3.38Å; A354-V359 PolarHBondContact O-N 3.36Å; A354-V359 VanDerWaalsContact O-N 3.1Å; A354-V359 VanDerWaalsContact O-O 3.09Å; L357-V359 VanDerWaalsContact C-N 3.3Å; L357-V359 HydrophobicContact CB-CG1 4.46Å; L357-V359 HydrophobicContact CB-CG2 4.01Å; L357-V359 PolarHBondContact O-N 3.37Å; V359-M361 PolarHBondContact O-N 3.47Å; V359-V364 HydrophobicContact CG2-CG2 3.7Å
360	P	94.5	Very high	95.4	Very high	84 Å²	84	56.9 Å²	56.9	55%	0.545	32%	0.315	S	S	.	.			trans	-58.7	138.5	178.9	-24	33.1	0	0	0	112.4	R362 V363 V364	P360-R362 PolarHBondContact O-N 3.17Å; P360-V363 HydrophobicContact CB-CG2 4.24Å; P360-V363 HydrophobicContact CG-CG2 4.3Å; P360-V363 WeakPolarHBondContact O-CA 3.37Å; P360-V363 WeakPolarHBondContact O-CB 3.22Å; P360-V363 PolarHBondContact O-N 3.48Å; P360-V364 PolarHBondContact O-N 3.41Å
361	M	93.6	Very high	95.3	Very high	51 Å²	51	55.8 Å²	55.8	25%	0.251	31%	0.312	S	S	.	.	H	α-helix	trans	-48.3	-32.7	174.4	170	57.3	159.9	0	0	113.4	K347 R350 E351 A354 V359 V363 V364 Q365	K347-M361 HydrophobicContact CG-CE 4.09Å; R350-M361 HydrophobicContact CB-CE 3.86Å; R350-M361 HydrophobicContact CB-SD 3.63Å; E351-M361 HydrophobicContact CG-CE 3.63Å; E351-M361 HydrophobicContact CG-CG 4.41Å; E351-M361 HydrophobicContact CG-SD 3.98Å; A354-M361 HydrophobicContact CB-CB 4.17Å; V359-M361 PolarHBondContact O-N 3.47Å; M361-V363 VanDerWaalsContact C-N 3.33Å; M361-V363 PolarHBondContact O-N 2.85Å; M361-V364 PolarHBondContact O-N 2.95Å; M361-Q365 WeakPolarHBondContact O-CB 3.35Å; M361-Q365 PolarHBondContact O-N 3.22Å
362	R	94.3	Very high	95.2	Very high	157 Å²	157	55.3 Å²	55.3	59%	0.592	31%	0.307	S	S	*	.	H	α-helix	trans	-59.1	-39.8	172.8	-167.9	75.3	-179.5	104.2	0.4	112.8	P360 V366	P360-R362 PolarHBondContact O-N 3.17Å; R362-V366 WeakPolarHBondContact O-CB 3.48Å; R362-V366 VanDerWaalsContact O-CG2 3.24Å; R362-V366 WeakPolarHBondContact O-CG2 3.26Å; R362-V366 PolarHBondContact O-N 3.14Å
363	V	95.1	Very high	94.9	Very high	26 Å²	26	54.6 Å²	54.6	16%	0.158	30%	0.301	C	S	.	.	H	α-helix	trans	-69.1	-46.3	178.5	-178.9	0	0	0	0	110.3	L327 P360 M361 Q365 V366 W367	L327-V363 HydrophobicContact CD1-CG1 4.42Å; L327-V363 HydrophobicContact CD2-CG1 4.08Å; L327-V363 HydrophobicContact CG-CG1 4.34Å; P360-V363 HydrophobicContact CB-CG2 4.24Å; P360-V363 HydrophobicContact CG-CG2 4.3Å; P360-V363 WeakPolarHBondContact O-CA 3.37Å; P360-V363 WeakPolarHBondContact O-CB 3.22Å; P360-V363 PolarHBondContact O-N 3.48Å; M361-V363 VanDerWaalsContact C-N 3.33Å; M361-V363 PolarHBondContact O-N 2.85Å; V363-Q365 PolarHBondContact O-N 3.17Å; V363-V366 PolarHBondContact O-N 3.1Å; V363-W367 WeakPolarHBondContact O-CB 3.46Å; V363-W367 PolarHBondContact O-N 3.39Å
364	V	96.1	Very high	94.5	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-57.9	-50.5	174.5	-177.2	0	0	0	0	110.5	L335 R350 L353 A354 V359 P360 M361 V366 W367 F368	L335-V364 HydrophobicContact CD2-CG1 3.96Å; L335-V364 HydrophobicContact CD2-CG2 4.43Å; R350-V364 HydrophobicContact CB-CG1 3.99Å; R350-V364 HydrophobicContact CG-CG1 3.91Å; L353-V364 HydrophobicContact CB-CG1 4.34Å; A354-V364 HydrophobicContact CB-CG2 3.88Å; V359-V364 HydrophobicContact CG2-CG2 3.7Å; P360-V364 PolarHBondContact O-N 3.41Å; M361-V364 PolarHBondContact O-N 2.95Å; V364-V366 PolarHBondContact O-N 2.96Å; V364-W367 PolarHBondContact O-N 2.96Å; V364-F368 HydrophobicContact CG1-CD2 3.82Å; V364-F368 HydrophobicContact CG1-CE2 3.91Å; V364-F368 WeakPolarHBondContact O-CD2 3.29Å; V364-F368 PolarHBondContact O-N 2.94Å
365	Q	95.7	Very high	94	Very high	67 Å²	67	63.8 Å²	63.8	31%	0.313	34%	0.336	S	S	.	.	H	α-helix	trans	-57.3	-45.4	178.1	-177.2	-176.8	6.9	0	0	112.5	M361 V363 Q369	M361-Q365 WeakPolarHBondContact O-CB 3.35Å; M361-Q365 PolarHBondContact O-N 3.22Å; V363-Q365 PolarHBondContact O-N 3.17Å; Q365-Q369 WeakPolarHBondContact O-CB 3.49Å; Q365-Q369 VanDerWaalsContact O-CG 3.29Å; Q365-Q369 WeakPolarHBondContact O-CG 3.19Å; Q365-Q369 PolarHBondContact O-N 2.9Å
366	V	94.8	Very high	93.3	Very high	48 Å²	48	66.4 Å²	66.4	29%	0.291	34%	0.335	S	S	.	.	H	α-helix	trans	-69.8	-35.1	179	168	0	0	0	0	111.6	R362 V363 V364 Q369 N370	R362-V366 WeakPolarHBondContact O-CB 3.48Å; R362-V366 VanDerWaalsContact O-CG2 3.24Å; R362-V366 WeakPolarHBondContact O-CG2 3.26Å; R362-V366 PolarHBondContact O-N 3.14Å; V363-V366 PolarHBondContact O-N 3.1Å; V364-V366 PolarHBondContact O-N 2.96Å; V366-Q369 PolarHBondContact O-N 3.23Å; V366-N370 WeakPolarHBondContact CG1-ND2 3.22Å; V366-N370 VanDerWaalsContact O-CB 3.32Å; V366-N370 WeakPolarHBondContact O-CB 3.44Å; V366-N370 PolarHBondContact O-N 2.74Å; V366-N370 PolarHBondContact O-ND2 2.88Å
367	W	96.3	Very high	92.5	Very high	40 Å²	40	69.8 Å²	69.8	15%	0.152	34%	0.343	C	S	.	.	H	α-helix	trans	-61.8	-50.6	173.5	-173.4	101.2	0	0	0	110.7	L327 L335 Q336 Y339 V363 V364 Q369 N370 Q371	L327-W367 VanDerWaalsContact CD1-CD1 3.49Å; L327-W367 HydrophobicContact CD1-CG 4.38Å; L335-W367 VanDerWaalsContact C-CH2 3.45Å; L335-W367 HydrophobicContact CB-CD2 3.84Å; L335-W367 HydrophobicContact CB-CE3 3.91Å; L335-W367 HydrophobicContact CB-CH2 3.92Å; L335-W367 HydrophobicContact CB-CZ2 3.78Å; L335-W367 HydrophobicContact CB-CZ3 3.97Å; L335-W367 HydrophobicContact CD1-CB 4.32Å; L335-W367 HydrophobicContact CD1-CD2 3.96Å; L335-W367 HydrophobicContact CD1-CG 3.79Å; L335-W367 HydrophobicContact CG-CD2 4.37Å; L335-W367 WeakPolarHBondContact O-CH2 3.38Å; L335-W367 VanDerWaalsContact O-CZ3 3.24Å; L335-W367 WeakPolarHBondContact O-CZ3 3.17Å; Q336-W367 HydrophobicContact CB-CH2 4.44Å; Y339-W367 HydrophobicContact CD2-CH2 4.49Å; Y339-W367 AromaticContact CD2-CZ3 3.95Å; Y339-W367 HydrophobicContact CD2-CZ3 3.95Å; Y339-W367 HydrophobicContact CG-CH2 4.36Å; Y339-W367 HydrophobicContact CG-CZ3 4.2Å; V363-W367 WeakPolarHBondContact O-CB 3.46Å; V363-W367 PolarHBondContact O-N 3.39Å; V364-W367 PolarHBondContact O-N 2.96Å; W367-Q369 VanDerWaalsContact C-N 3.31Å; W367-Q369 PolarHBondContact O-N 2.84Å; W367-N370 PolarHBondContact O-N 2.89Å; W367-N370 VanDerWaalsContact O-N 3.13Å; W367-Q371 HydrophobicContact CE3-CB 4.35Å; W367-Q371 HydrophobicContact CH2-CB 4.18Å; W367-Q371 HydrophobicContact CH2-CG 4.06Å; W367-Q371 HydrophobicContact CZ3-CB 4.03Å; W367-Q371 HydrophobicContact CZ3-CG 4.31Å; W367-Q371 PolarHBondContact O-N 3.15Å
368	F	97.3	Very high	91.5	Very high	1 Å²	1	72 Å²	72	0%	0.004	36%	0.363	C	S	.	.	H	α-helix	trans	-64	-32.3	177.3	-87.7	-88.6	0	0	0	113.1	L335 A338 Y339 P345 L353 V364 R372	L335-F368 HydrophobicContact CD2-CE2 3.86Å; A338-F368 HydrophobicContact CB-CZ 4.2Å; Y339-F368 AromaticContact CD2-CD1 3.58Å; Y339-F368 HydrophobicContact CD2-CD1 3.58Å; Y339-F368 AromaticContact CD2-CE1 3.61Å; Y339-F368 HydrophobicContact CD2-CE1 3.61Å; Y339-F368 HydrophobicContact CE2-CD1 4.24Å; Y339-F368 HydrophobicContact CG-CE1 4.25Å; P345-F368 HydrophobicContact CB-CE1 4.45Å; P345-F368 HydrophobicContact CG-CD1 3.5Å; P345-F368 HydrophobicContact CG-CD2 4.2Å; P345-F368 HydrophobicContact CG-CE1 3.42Å; P345-F368 VanDerWaalsContact CG-CE1 3.42Å; P345-F368 HydrophobicContact CG-CE2 4.14Å; P345-F368 HydrophobicContact CG-CG 3.92Å; P345-F368 HydrophobicContact CG-CZ 3.78Å; L353-F368 HydrophobicContact CD1-CE2 4.06Å; L353-F368 HydrophobicContact CD1-CZ 4.21Å; V364-F368 HydrophobicContact CG1-CD2 3.82Å; V364-F368 HydrophobicContact CG1-CE2 3.91Å; V364-F368 WeakPolarHBondContact O-CD2 3.29Å; V364-F368 PolarHBondContact O-N 2.94Å; F368-R372 VanDerWaalsContact O-CZ 3.23Å; F368-R372 PolarHBondContact O-N 3.29Å; F368-R372 PolarHBondContact O-NH1 3.25Å; F368-R372 PolarHBondContact O-NH2 3.15Å
369	Q	94.2	Very high	90.2	Very high	86 Å²	86	72.4 Å²	72.4	40%	0.402	36%	0.355	S	S	.	.	H	α-helix	trans	-66.9	-46.3	171.3	-76.9	172.4	-27.4	0	0	111.6	Q365 V366 W367 A373	Q365-Q369 WeakPolarHBondContact O-CB 3.49Å; Q365-Q369 VanDerWaalsContact O-CG 3.29Å; Q365-Q369 WeakPolarHBondContact O-CG 3.19Å; Q365-Q369 PolarHBondContact O-N 2.9Å; V366-Q369 PolarHBondContact O-N 3.23Å; W367-Q369 VanDerWaalsContact C-N 3.31Å; W367-Q369 PolarHBondContact O-N 2.84Å; Q369-A373 WeakPolarHBondContact O-CB 3.35Å; Q369-A373 PolarHBondContact O-N 3.38Å; Q369-A373 VanDerWaalsContact O-N 3.1Å
370	N	95.4	Very high	88.5	Confident	95 Å²	95	76.1 Å²	76.1	51%	0.508	38%	0.378	S	S	.	.	H	α-helix	trans	-66.9	-36.7	179.1	-72.2	-26	0	0	0	112.3	V366 W367 A373 R374	V366-N370 WeakPolarHBondContact CG1-ND2 3.22Å; V366-N370 VanDerWaalsContact O-CB 3.32Å; V366-N370 WeakPolarHBondContact O-CB 3.44Å; V366-N370 PolarHBondContact O-N 2.74Å; V366-N370 PolarHBondContact O-ND2 2.88Å; W367-N370 PolarHBondContact O-N 2.89Å; W367-N370 VanDerWaalsContact O-N 3.13Å; N370-A373 CarbonylContact O-C 3.57Å; N370-A373 WeakPolarHBondContact O-CB 3.41Å; N370-A373 PolarHBondContact O-N 2.67Å; N370-R374 WeakPolarHBondContact O-CG 3.48Å; N370-R374 PolarHBondContact O-N 3.47Å
371	Q	93.5	Very high	86.6	Confident	27 Å²	27	79.2 Å²	79.2	13%	0.126	38%	0.383	C	S	.	.	H	α-helix	trans	-66.3	-49	178.6	-169.8	57.5	37.4	0	0	111.2	Y339 W367 A373 R374 D375	Y339-Q371 HydrophobicContact CD1-CG 4.05Å; Y339-Q371 HydrophobicContact CD2-CB 4.15Å; Y339-Q371 HydrophobicContact CD2-CG 3.9Å; Y339-Q371 HydrophobicContact CE1-CG 3.76Å; Y339-Q371 HydrophobicContact CE2-CB 3.79Å; Y339-Q371 HydrophobicContact CE2-CG 3.62Å; Y339-Q371 HydrophobicContact CG-CG 4.12Å; W367-Q371 HydrophobicContact CE3-CB 4.35Å; W367-Q371 HydrophobicContact CH2-CB 4.18Å; W367-Q371 HydrophobicContact CH2-CG 4.06Å; W367-Q371 HydrophobicContact CZ3-CB 4.03Å; W367-Q371 HydrophobicContact CZ3-CG 4.31Å; W367-Q371 PolarHBondContact O-N 3.15Å; Q371-A373 PolarHBondContact O-N 2.94Å; Q371-A373 VanDerWaalsContact O-N 3.17Å; Q371-R374 WeakPolarHBondContact O-CA 3.4Å; Q371-R374 WeakPolarHBondContact O-CB 3.33Å; Q371-R374 PolarHBondContact O-N 3.36Å; Q371-D375 PolarHBondContact NE2-OD1 3.31Å; Q371-D375 PolarHBondContact O-N 2.9Å
372	R	95.4	Very high	84.2	Confident	74 Å²	74	79.5 Å²	79.5	28%	0.279	40%	0.399	S	S	.	.	H	α-helix	trans	-57.8	-32.4	171.7	-71.8	-170.9	-61.4	-81.5	-8.2	113.1	Y339 I343 F368 K376	Y339-R372 HydrophobicContact CE2-CG 3.92Å; Y339-R372 WeakPolarHBondContact OH-CA 3.39Å; Y339-R372 WeakPolarHBondContact OH-CG 3.48Å; Y339-R372 PolarHBondContact OH-N 3.12Å; I343-R372 HydrophobicContact CG2-CG 3.81Å; I343-R372 WeakPolarHBondContact O-CD 3.44Å; I343-R372 PolarHBondContact O-NH1 2.92Å; F368-R372 VanDerWaalsContact O-CZ 3.23Å; F368-R372 PolarHBondContact O-N 3.29Å; F368-R372 PolarHBondContact O-NH1 3.25Å; F368-R372 PolarHBondContact O-NH2 3.15Å; R372-K376 WeakPolarHBondContact O-CB 3.22Å; R372-K376 PolarHBondContact O-N 3.44Å
373	A	89.1	Confident	82	Confident	43 Å²	43	78.8 Å²	78.8	36%	0.355	40%	0.402	S	S	.	.	H	α-helix	trans	-74.3	-26.3	175.1	0	0	0	0	0	113.6	Q369 N370 Q371 R377	Q369-A373 WeakPolarHBondContact O-CB 3.35Å; Q369-A373 PolarHBondContact O-N 3.38Å; Q369-A373 VanDerWaalsContact O-N 3.1Å; N370-A373 CarbonylContact O-C 3.57Å; N370-A373 WeakPolarHBondContact O-CB 3.41Å; N370-A373 PolarHBondContact O-N 2.67Å; Q371-A373 PolarHBondContact O-N 2.94Å; Q371-A373 VanDerWaalsContact O-N 3.17Å; A373-R377 VanDerWaalsContact O-CD 3.31Å; A373-R377 WeakPolarHBondContact O-CD 3.47Å; A373-R377 VanDerWaalsContact O-CG 3.26Å; A373-R377 WeakPolarHBondContact O-CG 3.26Å
374	R	88	Confident	79.5	Confident	162 Å²	162	82.8 Å²	82.8	61%	0.611	42%	0.422	S	S	*	.	H	α-helix	trans	-71.8	-48.5	168	-70.3	171.4	69.5	-158.2	4.6	110.2	N370 Q371 K376 R377 A378	N370-R374 WeakPolarHBondContact O-CG 3.48Å; N370-R374 PolarHBondContact O-N 3.47Å; Q371-R374 WeakPolarHBondContact O-CA 3.4Å; Q371-R374 WeakPolarHBondContact O-CB 3.33Å; Q371-R374 PolarHBondContact O-N 3.36Å; R374-K376 PolarHBondContact O-N 2.87Å; R374-R377 CarbonylContact O-C 3.54Å; R374-R377 WeakPolarHBondContact O-CA 3.48Å; R374-R377 WeakPolarHBondContact O-CB 3.38Å; R374-R377 PolarHBondContact O-N 3.34Å; R374-A378 PolarHBondContact O-N 2.82Å
375	D	86.3	Confident	76.5	Confident	58 Å²	58	89.6 Å²	89.6	31%	0.31	46%	0.458	S	S	.	.	H	α-helix	trans	-64.8	-40.8	-176.1	-63.9	7.1	0	0	0	111.8	Y339 Q371 R377 A378 S379	Y339-D375 WeakPolarHBondContact CE1-OD2 3.37Å; Y339-D375 PolarHBondContact OH-OD2 2.82Å; Q371-D375 PolarHBondContact NE2-OD1 3.31Å; Q371-D375 PolarHBondContact O-N 2.9Å; D375-R377 PolarHBondContact O-N 3.41Å; D375-A378 PolarHBondContact O-N 2.99Å; D375-A378 VanDerWaalsContact O-N 3.13Å; D375-S379 PolarHBondContact O-N 2.96Å; D375-S379 PolarHBondContact O-OG 3.27Å
376	K	81.7	Confident	73.6	Confident	157 Å²	157	91.8 Å²	91.8	68%	0.683	48%	0.479	S	S	*	.	H	α-helix	trans	-59	-34.1	172	-175.6	175.6	179.9	-178.5	0	112.3	R372 R374 S379 T380	R372-K376 WeakPolarHBondContact O-CB 3.22Å; R372-K376 PolarHBondContact O-N 3.44Å; R374-K376 PolarHBondContact O-N 2.87Å; K376-S379 PolarHBondContact O-OG 3.04Å; K376-T380 PolarHBondContact O-N 3.31Å; K376-T380 PolarHBondContact O-OG1 3.16Å; K376-T380 VanDerWaalsContact O-OG1 3.05Å
377	R	77.6	Confident	70.7	Confident	185 Å²	185	96.3 Å²	96.3	70%	0.698	50%	0.501	S	S	*	.	H	α-helix	trans	-74.9	-40	175	-67.2	167.9	-174	-167.9	-0.4	111.1	A373 R374 D375 T380 F381	A373-R377 VanDerWaalsContact O-CD 3.31Å; A373-R377 WeakPolarHBondContact O-CD 3.47Å; A373-R377 VanDerWaalsContact O-CG 3.26Å; A373-R377 WeakPolarHBondContact O-CG 3.26Å; R374-R377 CarbonylContact O-C 3.54Å; R374-R377 WeakPolarHBondContact O-CA 3.48Å; R374-R377 WeakPolarHBondContact O-CB 3.38Å; R374-R377 PolarHBondContact O-N 3.34Å; D375-R377 PolarHBondContact O-N 3.41Å; R377-T380 PolarHBondContact O-N 3.18Å; R377-F381 WeakPolarHBondContact O-CD2 3.47Å; R377-F381 PolarHBondContact O-N 2.84Å
378	A	74.7	Confident	68	Low	63 Å²	63	100.3 Å²	100.3	52%	0.521	53%	0.53	S	S	.	.	H	α-helix	trans	-63.9	-42.4	178.2	0	0	0	0	0	112.1	R374 D375 F381 G382	R374-A378 PolarHBondContact O-N 2.82Å; D375-A378 PolarHBondContact O-N 2.99Å; D375-A378 VanDerWaalsContact O-N 3.13Å; A378-F381 CarbonylContact O-C 3.56Å; A378-F381 PolarHBondContact O-N 3.32Å; A378-G382 PolarHBondContact O-N 3.32Å
379	S	65.5	Low	65.1	Low	78 Å²	78	106.8 Å²	106.8	55%	0.545	56%	0.564	S	S	.	*	H	α-helix	trans	-68.2	-37.2	178.4	59.4	0	0	0	0	112.9	D375 K376 F381 G382	D375-S379 PolarHBondContact O-N 2.96Å; D375-S379 PolarHBondContact O-OG 3.27Å; K376-S379 PolarHBondContact O-OG 3.04Å; S379-F381 PolarHBondContact O-N 3.37Å; S379-G382 PolarHBondContact O-N 3.21Å; S379-G382 VanDerWaalsContact O-N 3.11Å
380	T	59.1	Low	62.5	Low	97 Å²	97	113 Å²	113	60%	0.595	59%	0.59	S	S	*	*	H	α-helix	trans	-63.8	-21.3	172	-59.4	0	0	0	0	113.6	K376 R377	K376-T380 PolarHBondContact O-N 3.31Å; K376-T380 PolarHBondContact O-OG1 3.16Å; K376-T380 VanDerWaalsContact O-OG1 3.05Å; R377-T380 PolarHBondContact O-N 3.18Å
381	F	54	Low	59.5	Low	149 Å²	149	113.8 Å²	113.8	65%	0.654	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	-1.3	173.5	-84.2	-96.5	0	0	0	113.6	R377 A378 S379	R377-F381 WeakPolarHBondContact O-CD2 3.47Å; R377-F381 PolarHBondContact O-N 2.84Å; A378-F381 CarbonylContact O-C 3.56Å; A378-F381 PolarHBondContact O-N 3.32Å; S379-F381 PolarHBondContact O-N 3.37Å
382	G	44.8	Very low	56.9	Low	56 Å²	56	118 Å²	118	58%	0.577	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	-5.9	-165.9	0	0	0	0	0	116.2	A378 S379 L384	A378-G382 PolarHBondContact O-N 3.32Å; S379-G382 PolarHBondContact O-N 3.21Å; S379-G382 VanDerWaalsContact O-N 3.11Å; G382-L384 VanDerWaalsContact C-N 3.35Å; G382-L384 PolarHBondContact O-N 2.95Å
383	H	47.4	Very low	54.2	Low	143 Å²	143	120.4 Å²	120.4	66%	0.662	66%	0.658	S	S	*	*			trans	-82	-8.3	-169	-165.6	-113.4	0	0	0	114.6	E108 N385	E108-H383 IonicContact OE1-CG 3.62Å; E108-H383 IonicContact OE1-ND1 2.73Å; E108-H383 PolarHBondContact OE1-ND1 3.11Å; H383-N385 PolarHBondContact O-N 3Å
384	L	41.8	Very low	51.6	Low	110 Å²	110	123.2 Å²	123.2	58%	0.576	68%	0.676	S	S	*	*	S	Bend	trans	-101.3	48.5	-172.1	-64.1	179.1	0	0	0	115.3	E108 G382	E108-L384 HydrophobicContact CB-CD1 4.25Å; E108-L384 HydrophobicContact CG-CD2 4.13Å; E108-L384 WeakPolarHBondContact OE2-CG 3.5Å; G382-L384 VanDerWaalsContact C-N 3.35Å; G382-L384 PolarHBondContact O-N 2.95Å
385	N	34.5	Very low	49	Very low	142 Å²	142	123.9 Å²	123.9	76%	0.759	69%	0.685	S	S	*	*			trans	-167	112.3	154.5	-124.4	-20.4	0	0	0	114.1	H383	H383-N385 PolarHBondContact O-N 3Å
386	P	33.2	Very low	46.5	Very low	114 Å²	114	128.1 Å²	128.1	74%	0.74	71%	0.705	S	S	*	*			trans	-142.8	91.5	144.1	34.2	-16.6	0	0	0	112.7
387	N	34.2	Very low	44.3	Very low	143 Å²	143	127.9 Å²	127.9	77%	0.765	71%	0.711	S	S	*	*			trans	-160.7	157.7	160	-99.4	-49.5	0	0	0	110.1
388	T	40.3	Very low	42.2	Very low	123 Å²	123	124.9 Å²	124.9	76%	0.755	71%	0.714	S	S	*	*			trans	64.8	139.7	-170.9	75.1	0	0	0	0	115.9
389	D	35.8	Very low	40.4	Very low	137 Å²	137	130 Å²	130	73%	0.733	73%	0.73	S	S	*	*			cis	-155.3	130.2	-16.4	-96.2	-29.1	0	0	0	109.2
390	K	39.5	Very low	38.9	Very low	216 Å²	216	133.4 Å²	133.4	94%	0.939	74%	0.742	S	S	*	*			trans	-153.9	104.8	156.7	-76.5	-156.2	177.6	-178.9	0	111.5
391	S	34.2	Very low	38	Very low	112 Å²	112	133.2 Å²	133.2	78%	0.783	74%	0.743	S	S	*	*			trans	-125.9	91.1	-174.3	43.6	0	0	0	0	113.2
392	S	37.7	Very low	37.3	Very low	116 Å²	116	133.3 Å²	133.3	81%	0.811	75%	0.745	S	S	*	*			trans	179.6	152.8	161.1	50.4	0	0	0	0	111.8
393	V	38	Very low	36.9	Very low	124 Å²	124	137.5 Å²	137.5	75%	0.752	75%	0.75	S	S	*	*			cis	-161.6	141.1	-23.1	129.1	0	0	0	0	106.6
394	S	35.1	Very low	36.5	Very low	103 Å²	103	140 Å²	140	72%	0.72	76%	0.759	S	S	*	*			trans	63.6	156.1	167.6	76.6	0	0	0	0	117.8
395	H	34	Very low	36.3	Very low	175 Å²	175	141.4 Å²	141.4	81%	0.81	77%	0.767	S	S	*	*			cis	-146.8	178.9	-9.4	-141	-116.2	0	0	0	110.9
396	M	34	Very low	36.3	Very low	148 Å²	148	137.5 Å²	137.5	73%	0.729	76%	0.761	S	S	*	*			trans	-93.7	159.7	-160.3	-48.3	-55.1	177.6	0	0	117.2
397	N	34	Very low	36.5	Very low	151 Å²	151	140.7 Å²	140.7	81%	0.807	77%	0.765	S	S	*	*			trans	138	102.6	147.2	-69.9	-16.5	0	0	0	110.5
398	T	34	Very low	36.6	Very low	123 Å²	123	141.5 Å²	141.5	76%	0.755	76%	0.764	S	S	*	*				75.6	106.9	55.6	-53.5	0	0	0	0	114.1
399	I	38	Very low	36.3	Very low	169 Å²	169	142.4 Å²	142.4	87%	0.867	76%	0.764	S	S	*	*			trans	-172.4	151	134.9	-95.4	153.4	0	0	0	109.4
400	N	34	Very low	36.2	Very low	150 Å²	150	142.9 Å²	142.9	80%	0.802	76%	0.762	S	S	*	*			trans	-148.8	-167.2	-175.4	-146.4	-0.5	0	0	0	105.9
401	P	39.4	Very low	36	Very low	94 Å²	94	138.3 Å²	138.3	61%	0.61	75%	0.747	S	S	*	*			cis	-128.1	171.9	-34.7	40.5	-26.3	0	0	0	113.8
402	H	38.5	Very low	35.9	Very low	151 Å²	151	140.3 Å²	140.3	70%	0.699	74%	0.744	S	S	*	*			trans	175	129.4	138.6	-113.9	-89.3	0	0	0	107.8
403	Q	37.5	Very low	35.9	Very low	144 Å²	144	142.6 Å²	142.6	67%	0.673	74%	0.742	S	S	*	*			cis	77.4	101.8	34.6	-168.4	-174.6	7.1	0	0	115
404	F	38.7	Very low	35.7	Very low	194 Å²	194	144.6 Å²	144.6	85%	0.851	74%	0.743	S	S	*	*			trans	-161.5	151.4	136.4	-114.7	-73.6	0	0	0	111.4
405	D	37.3	Very low	35.7	Very low	140 Å²	140	146.4 Å²	146.4	75%	0.749	74%	0.74	S	S	*	*			trans	-102.3	169	-170.6	-57.8	-93.1	0	0	0	114.4
406	G	34.6	Very low	35.7	Very low	61 Å²	61	147.7 Å²	147.7	63%	0.629	74%	0.738	S	S	*	*			trans	132	99.8	134.8	0	0	0	0	0	121.2
407	H	38.5	Very low	35.8	Very low	180 Å²	180	147.4 Å²	147.4	83%	0.833	74%	0.739	S	S	*	*			trans	68	126.9	131.5	-64.1	-70.8	0	0	0	125.2
408	Q	36	Very low	35.9	Very low	160 Å²	160	148.8 Å²	148.8	75%	0.748	74%	0.74	S	S	*	*			trans	79.3	121.4	131.8	-77.6	-165.9	-16.5	0	0	123.8
409	L	34.5	Very low	35.9	Very low	143 Å²	143	148.9 Å²	148.9	75%	0.749	75%	0.745	S	S	*	*				68	155.2	129.4	-61.5	176	0	0	0	119.1
410	H	33.5	Very low	35.6	Very low	147 Å²	147	146.7 Å²	146.7	68%	0.681	74%	0.735	S	S	*	*			cis	-175.2	158.4	-16	168.5	79.8	0	0	0	108.9
411	L	34.6	Very low	35.4	Very low	120 Å²	120	148.3 Å²	148.3	63%	0.628	74%	0.735	S	S	*	*			trans	64.2	124.4	177.3	-100.4	29.6	0	0	0	114.8
412	Q	32.8	Very low	35.4	Very low	153 Å²	153	151.9 Å²	151.9	72%	0.715	74%	0.743	S	S	*	*				94.2	113.9	59.7	179.6	176.9	-2.5	0	0	111.5
413	E	36.6	Very low	35.1	Very low	164 Å²	164	153 Å²	153	77%	0.766	75%	0.749	S	S	*	*			trans	-157.7	135.6	131	-164.7	70.3	136.4	0	0	110.2
414	Q	33.3	Very low	35	Very low	167 Å²	167	150.6 Å²	150.6	78%	0.78	75%	0.748	S	S	*	*			trans	-100.7	135.3	166.1	-68	178.1	-9.4	0	0	108.8
415	Q	36.4	Very low	34.7	Very low	141 Å²	141	145.7 Å²	145.7	66%	0.659	74%	0.738	S	S	*	*			trans	178.8	152.1	136.1	-108.4	164.8	85.7	0	0	116.4
416	R	34.6	Very low	34.6	Very low	202 Å²	202	146.1 Å²	146.1	76%	0.762	74%	0.74	S	S	*	*			trans	70.8	157.6	153.3	-65.7	158.1	-163.7	-153	2.8	118.6
417	N	35	Very low	34.6	Very low	142 Å²	142	151.3 Å²	151.3	76%	0.759	75%	0.752	S	S	*	*			cis	-179.1	143.7	-46.4	-101.3	-5.1	0	0	0	108.3
418	H	36.1	Very low	34.3	Very low	179 Å²	179	154 Å²	154	83%	0.829	76%	0.755	S	S	*	*			trans	25.5	123.8	157.9	-76.6	-34.5	0	0	0	122.7
419	C	34.5	Very low	34.5	Very low	126 Å²	126	151 Å²	151	85%	0.851	75%	0.749	S	S	*	*				-158.8	129.9	115.6	-162	0	0	0	0	107.9
420	N	30.8	Very low	34.4	Very low	123 Å²	123	153.6 Å²	153.6	66%	0.658	76%	0.755	S	S	*	*			cis	108	76.7	16.1	-158.6	36.2	0	0	0	115.9
421	K	31.4	Very low	34.4	Very low	183 Å²	183	152.7 Å²	152.7	80%	0.796	76%	0.76	S	S	*	*				60	116.5	125.9	-169.8	-174.2	-176.6	-179.1	0	121.1
422	Q	37.5	Very low	34.4	Very low	170 Å²	170	153 Å²	153	79%	0.794	77%	0.769	S	S	*	*			trans	-155.8	129.4	146.1	-101.1	154.2	36.3	0	0	107.3
423	Q	33.6	Very low	34.4	Very low	174 Å²	174	150.9 Å²	150.9	81%	0.813	77%	0.771	S	S	*	*				69.9	137.2	80.9	-72.6	-179.8	-19.3	0	0	113.6
424	S	34.2	Very low	34.8	Very low	94 Å²	94	147.5 Å²	147.5	66%	0.657	76%	0.764	S	S	*	*			cis	-166.2	176.4	-4.5	52.5	0	0	0	0	111.1
425	S	33.2	Very low	34.7	Very low	91 Å²	91	147.8 Å²	147.8	64%	0.636	77%	0.765	S	S	*	*			trans	60.3	142.2	148.4	48.5	0	0	0	0	120
426	D	34.1	Very low	34.7	Very low	148 Å²	148	147 Å²	147	79%	0.791	77%	0.769	S	S	*	*			cis	-165.5	-179.2	-6.4	-108.9	-36.2	0	0	0	111.6
427	L	36	Very low	34.5	Very low	171 Å²	171	142.3 Å²	142.3	90%	0.895	77%	0.768	S	S	*	*			trans	91.2	137.9	161.7	-51.4	-174.6	0	0	0	120.5
428	R	32.7	Very low	34.6	Very low	237 Å²	237	141.6 Å²	141.6	89%	0.894	77%	0.768	S	S	*	*			trans	-151.8	-179.7	-179.9	-109.1	-169.7	-180	-152.8	3.2	105.4
429	P	38.8	Very low	34.4	Very low	95 Å²	95	141.3 Å²	141.3	62%	0.617	77%	0.767	S	S	*	*			cis	-123.4	-165.1	-38.2	39.5	-24.1	0	0	0	109.7
430	F	33.4	Very low	34.2	Very low	198 Å²	198	141.1 Å²	141.1	87%	0.868	77%	0.767	S	S	*	*			trans	-174.9	148.7	132.3	-97.3	-60.6	0	0	0	111.7
431	T	33.3	Very low	34.2	Very low	128 Å²	128	138.8 Å²	138.8	79%	0.785	77%	0.773	S	S	*	*			trans	-140.6	153.2	166	52.1	0	0	0	0	108.5
432	P	35.2	Very low	34.4	Very low	126 Å²	126	135.8 Å²	135.8	82%	0.818	77%	0.772	S	S	*	*				-148.1	174	115.2	37.5	-21	0	0	0	115.2
433	S	32	Very low	34.1	Very low	109 Å²	109	136.2 Å²	136.2	76%	0.762	77%	0.771	S	S	*	*			trans	-113.7	-154.5	172.5	-34.3	0	0	0	0	109
434	P	45	Very low	34.1	Very low	94 Å²	94	133.8 Å²	133.8	61%	0.61	77%	0.77	S	S	*	*			cis	-129.4	-146	-36.4	35	-14.9	0	0	0	112.3
435	H	31.9	Very low	33.8	Very low	173 Å²	173	137 Å²	137	80%	0.801	78%	0.775	S	S	*	*			trans	81.8	148.2	173	-40.5	-67.7	0	0	0	116.1
436	T	34.8	Very low	33.8	Very low	123 Å²	123	142.6 Å²	142.6	76%	0.755	79%	0.789	S	S	*	*			cis	-129.5	155.7	6.1	54.3	0	0	0	0	111
437	S	31.6	Very low	33.5	Very low	105 Å²	105	138.6 Å²	138.6	73%	0.734	78%	0.782	S	S	*	*				40.5	140	82.6	-44.4	0	0	0	0	115.2
438	V	36.1	Very low	33	Very low	127 Å²	127	134.6 Å²	134.6	77%	0.77	78%	0.782	S	S	*	*			cis	-129.7	-166.9	13.9	-113.2	0	0	0	0	110.3
439	E	32.5	Very low	32.8	Very low	173 Å²	173	133.5 Å²	133.5	81%	0.808	78%	0.784	S	S	*	*			cis	-151	-158.3	12.6	-153.7	126.8	84.4	0	0	111.8
440	S	29.9	Very low	32.4	Very low	121 Å²	121	133.1 Å²	133.1	85%	0.846	78%	0.784	S	S	*	*			trans	-152	160.2	-178.7	61.7	0	0	0	0	116.1
441	G	32	Very low	32.6	Very low	75 Å²	75	128.7 Å²	128.7	77%	0.773	78%	0.777	S	S	*	*			trans	-162.7	156.3	174.2	0	0	0	0	0	113
442	P	34.2	Very low	33.4	Very low	119 Å²	119	127.8 Å²	127.8	77%	0.773	77%	0.768	S	S	*	*			trans	-115.2	154.5	-153.2	40.4	-32.5	0	0	0	118.2
443	F	32	Very low	34.3	Very low	179 Å²	179	124.8 Å²	124.8	79%	0.785	75%	0.745	S	S	*	*			trans	29.8	139.6	141.4	-84.1	-81.7	0	0	0	121.9	E445	F443-E445 HydrophobicContact CD1-CG 4.08Å; F443-E445 HydrophobicContact CE1-CG 4.17Å
444	P	32.4	Very low	34.7	Very low	123 Å²	123	123.8 Å²	123.8	80%	0.799	73%	0.731	S	S	*	*				-137	172.5	77.8	38.6	-24.5	0	0	0	116.7
445	E	28.5	Very low	34.9	Very low	162 Å²	162	121.6 Å²	121.6	76%	0.757	72%	0.715	S	S	*	*			trans	-83.9	145	-172.8	-52.6	163.1	108.2	0	0	113.5	F443	F443-E445 HydrophobicContact CD1-CG 4.08Å; F443-E445 HydrophobicContact CE1-CG 4.17Å
446	F	32.5	Very low	35.1	Very low	209 Å²	209	122.5 Å²	122.5	92%	0.917	71%	0.712	S	S	*	*			trans	-156.4	134.4	158.2	-97.6	-72.1	0	0	0	113
447	G	28.3	Very low	35	Very low	64 Å²	64	119.3 Å²	119.3	66%	0.66	69%	0.686	S	S	*	*			trans	60.7	111.7	147.6	0	0	0	0	0	119.6
448	G	26.4	Very low	35.2	Very low	86 Å²	86	119.2 Å²	119.2	89%	0.887	68%	0.681	S	S	*	*			trans	-68.5	141.8	172.3	0	0	0	0	0	114.2
449	F	27.3	Very low	35.3	Very low	214 Å²	214	115.4 Å²	115.4	94%	0.939	66%	0.659	S	S	*	*			trans	-86.2	133.6	177.8	-58.1	-91.6	0	0	0	111.6
450	S	31.4	Very low	35.3	Very low	87 Å²	87	113.1 Å²	113.1	61%	0.608	65%	0.652	S	S	*	*			trans	-110.5	136.1	173.3	-140.8	0	0	0	0	110.8	D452	S450-D452 VanDerWaalsContact CB-OD2 3.27Å; S450-D452 WeakPolarHBondContact CB-OD2 3.17Å; S450-D452 PolarHBondContact OG-OD2 2.82Å
451	S	37.6	Very low	35.4	Very low	105 Å²	105	112.6 Å²	112.6	73%	0.734	64%	0.643	S	S	*	*			trans	-100.5	14	-164.1	56.6	0	0	0	0	115.5	N453	S451-N453 VanDerWaalsContact C-N 3.34Å; S451-N453 PolarHBondContact O-N 3.44Å
452	D	49.3	Very low	35.4	Very low	109 Å²	109	116.3 Å²	116.3	58%	0.583	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	1.1	-151.2	-48	-60.8	0	0	0	115.7	S450 L454	S450-D452 VanDerWaalsContact CB-OD2 3.27Å; S450-D452 WeakPolarHBondContact CB-OD2 3.17Å; S450-D452 PolarHBondContact OG-OD2 2.82Å; D452-L454 VanDerWaalsContact C-N 3.35Å; D452-L454 PolarHBondContact O-N 3.08Å
453	N	53.6	Low	35.4	Very low	64 Å²	64	118.3 Å²	118.3	34%	0.342	65%	0.647	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.1	-14.8	-178.6	-70.3	-46.7	0	0	0	114.4	S451	S451-N453 VanDerWaalsContact C-N 3.34Å; S451-N453 PolarHBondContact O-N 3.44Å
454	L	40.8	Very low	35.3	Very low	88 Å²	88	118.5 Å²	118.5	46%	0.461	65%	0.65	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.9	87.8	-176	-170.9	75.9	0	0	0	111.2	L144 V173 D452	L144-L454 HydrophobicContact CB-CD1 4.14Å; L144-L454 HydrophobicContact CD1-CD1 4.42Å; L144-L454 HydrophobicContact CD1-CD2 4.36Å; L144-L454 HydrophobicContact CD2-CD1 4.46Å; L144-L454 HydrophobicContact CD2-CG 4.29Å; V173-L454 HydrophobicContact CG2-CD1 4.11Å; D452-L454 VanDerWaalsContact C-N 3.35Å; D452-L454 PolarHBondContact O-N 3.08Å
455	V	50.1	Low	35.3	Very low	48 Å²	48	120.2 Å²	120.2	29%	0.291	65%	0.652	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.4	141.8	-178.5	-173.7	0	0	0	0	110	F145	F145-V455 HydrophobicContact CE2-CB 3.76Å; F145-V455 HydrophobicContact CE2-CG1 4.33Å; F145-V455 HydrophobicContact CZ-CB 3.99Å; F145-V455 HydrophobicContact CZ-CG1 4.1Å
456	R	36.7	Very low	35.3	Very low	192 Å²	192	119.7 Å²	119.7	73%	0.725	65%	0.654	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-82.4	145.1	169	-82.5	-177	174.9	145.7	3.7	110.4	L144 V458	L144-R456 HydrophobicContact CD2-CG 3.56Å; R456-V458 PolarHBondContact O-N 3.05Å
457	Y	32.1	Very low	35.1	Very low	55 Å²	55	115.4 Å²	115.4	22%	0.216	65%	0.65	C	S	.	*	P	Polyproline II helix	trans	-66.9	133.2	161.7	-165	-93.2	0	0	0	109.5	H27 F145 P459	H27-Y457 PolarHBondContact CD2-OH 3.46Å; F145-Y457 HydrophobicContact CE1-CD2 4.23Å; Y457-P459 HydrophobicContact CE1-CB 3.94Å; Y457-P459 HydrophobicContact CE1-CG 4.17Å
458	V	35.5	Very low	35.2	Very low	104 Å²	104	116.2 Å²	116.2	63%	0.63	65%	0.651	S	S	*	*			trans	-137.4	115.8	167.8	-177.6	0	0	0	0	105.5	R456	R456-V458 PolarHBondContact O-N 3.05Å
459	P	37.2	Very low	35.2	Very low	46 Å²	46	120 Å²	120	30%	0.299	65%	0.651	S	S	.	*			trans	-74	125	167.5	29.1	-27.5	0	0	0	108.1	Y457 V461	Y457-P459 HydrophobicContact CE1-CB 3.94Å; Y457-P459 HydrophobicContact CE1-CG 4.17Å; P459-V461 PolarHBondContact O-N 3.21Å
460	D	33.1	Very low	35.3	Very low	126 Å²	126	117.5 Å²	117.5	67%	0.674	64%	0.644	S	S	*	*			trans	-69.4	95.2	176.2	-76.6	-48.1	0	0	0	110.6	N462	D460-N462 PolarHBondContact O-N 3.11Å
461	V	31.7	Very low	35.1	Very low	109 Å²	109	121.2 Å²	121.2	66%	0.661	65%	0.652	S	S	*	*			trans	-85.4	92.7	171.4	-165.8	0	0	0	0	108	P459	P459-V461 PolarHBondContact O-N 3.21Å
462	N	32.9	Very low	34.4	Very low	154 Å²	154	121 Å²	121	82%	0.824	65%	0.65	S	S	*	*			trans	-116.8	122.5	175.2	-148.9	6.6	0	0	0	111.1	D460	D460-N462 PolarHBondContact O-N 3.11Å
463	M	34.8	Very low	33.3	Very low	160 Å²	160	127.8 Å²	127.8	79%	0.788	67%	0.668	S	S	*	*			trans	-75.8	157.1	177.3	-65.4	-98.4	73.5	0	0	110.2	N465	M463-N465 PolarHBondContact O-N 3.38Å
464	H	30.1	Very low	32	Very low	184 Å²	184	136.4 Å²	136.4	85%	0.852	70%	0.696	S	S	*	*			trans	-67.8	127.7	165.9	-65.9	-53.7	0	0	0	110.3
465	N	31.7	Very low	31.3	Very low	159 Å²	159	137.4 Å²	137.4	85%	0.85	71%	0.71	S	S	*	*			trans	-166.6	163	136.1	-101.9	1.6	0	0	0	111.1	M463	M463-N465 PolarHBondContact O-N 3.38Å
466	D	28.7	Very low	30.3	Very low	150 Å²	150	141.9 Å²	141.9	80%	0.802	74%	0.737	S	S	*	*			trans	-81	146.2	-154.8	-60.8	-82.1	0	0	0	117.8
467	S	28.4	Very low	30	Very low	119 Å²	119	137 Å²	137	83%	0.832	73%	0.733	S	S	*	*			trans	68.4	147.1	139.3	-148.7	0	0	0	0	121.9
468	A	29.1	Very low	29.8	Very low	82 Å²	82	142.1 Å²	142.1	68%	0.678	76%	0.764	S	S	*	*			trans	51.6	86	161.1	0	0	0	0	0	118.9
469	D	28.2	Very low	29.4	Very low	165 Å²	165	141.4 Å²	141.4	88%	0.882	77%	0.769	S	S	*	*				-173.4	144.9	95.7	-110.6	-22	0	0	0	113.9
470	M	29.1	Very low	29	Very low	161 Å²	161	145.9 Å²	145.9	79%	0.793	80%	0.795	S	S	*	*			trans	-149.5	139.4	177.8	-90.1	-136.3	130.3	0	0	108.3
471	Q	26.6	Very low	28.7	Very low	166 Å²	166	151.3 Å²	151.3	78%	0.776	81%	0.806	S	S	*	*			cis	-145.8	148.5	9.8	-93.1	144.2	22.9	0	0	110.6
472	S	23.5	Very low	28.5	Very low	100 Å²	100	153.3 Å²	153.3	70%	0.699	81%	0.812	S	S	*	*			trans	-158.6	101.8	155.8	179.2	0	0	0	0	111
473	W	26	Very low	28.4	Very low	252 Å²	252	152 Å²	152	96%	0.955	81%	0.809	S	S	*	*			trans	-168.3	143.9	139.9	-84.5	116.5	0	0	0	108.3
474	R	25.1	Very low	28.2	Very low	245 Å²	245	152.8 Å²	152.8	93%	0.925	81%	0.811	S	S	*	*			trans	-111.7	162	-172.9	-75.1	-174.2	172.4	-160.1	-1.4	113
475	S	25.8	Very low	28.5	Very low	109 Å²	109	150.4 Å²	150.4	76%	0.762	81%	0.805	S	S	*	*			trans	-62.1	148.3	-179.8	-176.3	0	0	0	0	115.3
476	V	30	Very low	28.6	Very low	142 Å²	142	146.1 Å²	146.1	86%	0.861	80%	0.798	S	S	*	*			trans	-147.4	159.1	164.2	-166.3	0	0	0	0	108.4
477	S	30.9	Very low	29	Very low	90 Å²	90	146.8 Å²	146.8	63%	0.629	80%	0.801	S	S	*	*				-138.8	147.1	-109	-69.7	0	0	0	0	114.1
478	N	26.7	Very low	29.5	Very low	162 Å²	162	149 Å²	149	87%	0.866	80%	0.799	S	S	*	*			trans	24	124	152.2	-56.6	-16.1	0	0	0	121.4
479	A	27.7	Very low	29.8	Very low	89 Å²	89	152.3 Å²	152.3	74%	0.736	81%	0.805	S	S	*	*			trans	-155.4	155.3	147.7	0	0	0	0	0	114
480	V	28.9	Very low	30	Very low	139 Å²	139	150.5 Å²	150.5	84%	0.842	81%	0.805	S	S	*	*			trans	95.4	129.3	173.8	-173.5	0	0	0	0	115.9
481	W	26.3	Very low	30.2	Very low	241 Å²	241	149.9 Å²	149.9	91%	0.913	81%	0.81	S	S	*	*			trans	-101.2	144.7	-159.8	-58.7	76.1	0	0	0	112.7
482	L	28.4	Very low	30.4	Very low	151 Å²	151	150 Å²	150	79%	0.791	82%	0.815	S	S	*	*			trans	-95.1	127.2	155.2	-87.6	166.4	0	0	0	108.5	E484	L482-E484 PolarHBondContact O-N 3.5Å
483	V	30	Very low	30.6	Very low	125 Å²	125	160.1 Å²	160.1	76%	0.758	84%	0.838	S	S	*	*			trans	-84.7	97.5	165.7	179.4	0	0	0	0	107.2	N485	V483-N485 PolarHBondContact O-N 3.06Å
484	E	32	Very low	30.9	Very low	177 Å²	177	155.5 Å²	155.5	83%	0.827	83%	0.832	S	S	*	*			trans	-72.8	107.2	167.2	-68.3	-169.1	141.8	0	0	108.9	L482 G486	L482-E484 PolarHBondContact O-N 3.5Å; E484-G486 PolarHBondContact O-N 3.36Å
485	N	35.9	Very low	31.2	Very low	135 Å²	135	150.8 Å²	150.8	72%	0.722	83%	0.827	S	S	*	*			trans	-70.8	77.5	163.3	-78.6	-10.5	0	0	0	108.4	V483 N487	V483-N485 PolarHBondContact O-N 3.06Å; N485-N487 PolarHBondContact O-N 2.81Å
486	G	33.6	Very low	31.5	Very low	68 Å²	68	153.1 Å²	153.1	70%	0.701	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-61.2	118.8	175.4	0	0	0	0	0	110.3	E484	E484-G486 PolarHBondContact O-N 3.36Å
487	N	37.5	Very low	31.6	Very low	164 Å²	164	153.8 Å²	153.8	88%	0.877	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-102.8	136.1	160.3	-152.2	9.6	0	0	0	107	N485	N485-N487 PolarHBondContact O-N 2.81Å
488	E	38	Very low	31.6	Very low	167 Å²	167	157.8 Å²	157.8	78%	0.78	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-77.6	171.3	-152.9	-58.2	-175.7	132.1	0	0	115.3
489	N	34.8	Very low	31.9	Very low	150 Å²	150	157.5 Å²	157.5	80%	0.802	84%	0.839	S	S	*	*			trans	77.9	90.9	169.6	-55	-61.6	0	0	0	118.2
490	S	34.3	Very low	32.2	Very low	127 Å²	127	162.4 Å²	162.4	89%	0.888	85%	0.847	S	S	*	*				-160.2	126.9	121.9	-81	0	0	0	0	110.5
491	T	32.8	Very low	32.5	Very low	148 Å²	148	164.2 Å²	164.2	91%	0.908	85%	0.847	S	S	*	*			trans	-80.6	145.6	-178.1	25.6	0	0	0	0	113
492	I	29.8	Very low	33	Very low	170 Å²	170	157.8 Å²	157.8	87%	0.872	84%	0.842	S	S	*	*			trans	-68.8	148.5	176.8	-64.1	169.4	0	0	0	110.7
493	R	28.9	Very low	33.4	Very low	311 Å²	311	158.4 Å²	158.4	100%	1.174	85%	0.846	S	S	*	*			trans	-135.8	0	163.6	-133.6	-171	-167.9	-160.3	4.1	110.2

Retrieved 493 of 493 residues in 754.5 ms (Link to these results)

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