A0A3Q0KKI2_SCHMA Loading...

Rna methyltransferase-related

AlphaFold DB , UniProt , Accession A0A3Q0KKI2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 407 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.1	Very low	26.8	Very low	250 Å²	250	171.5 Å²	171.5	100%	1.232	87%	0.865	S	S	*	*				0	81.2	0	-70.9	175.9	-170.2	0	0	108.7
2	K	25.1	Very low	26.9	Very low	205 Å²	205	166.9 Å²	166.9	89%	0.891	86%	0.861	S	S	*	*			trans	-109.1	149.1	-172.9	-83	178.1	171.9	177.2	0	109.9
3	S	26.3	Very low	26.7	Very low	102 Å²	102	167 Å²	167	71%	0.713	86%	0.861	S	S	*	*			trans	82.3	112.5	152	-159.7	0	0	0	0	119.2
4	V	28.5	Very low	26.7	Very low	153 Å²	153	164.1 Å²	164.1	93%	0.927	86%	0.861	S	S	*	*			trans	-131.1	95.1	146.3	-177.8	0	0	0	0	107.2
5	Y	26.5	Very low	26.3	Very low	204 Å²	204	160.6 Å²	160.6	80%	0.8	85%	0.853	S	S	*	*			trans	-120.1	134.8	163.7	-111.8	-88.1	0	0	0	106
6	N	27.4	Very low	26.4	Very low	149 Å²	149	159.2 Å²	159.2	80%	0.797	85%	0.852	S	S	*	*			trans	128.7	106.3	157.8	-73.3	-26.3	0	0	0	113.6
7	L	26.1	Very low	26.2	Very low	165 Å²	165	163.9 Å²	163.9	86%	0.864	86%	0.855	S	S	*	*			trans	-160.7	80.5	151.6	-107.8	149.5	0	0	0	108
8	F	24.6	Very low	26.2	Very low	218 Å²	218	158.6 Å²	158.6	96%	0.956	85%	0.847	S	S	*	*			trans	-161.3	101.3	150.7	-93.2	-67	0	0	0	108.7
9	S	26.5	Very low	26.2	Very low	98 Å²	98	159.7 Å²	159.7	69%	0.685	85%	0.852	S	S	*	*			trans	-157.3	117.2	167.1	151.2	0	0	0	0	109.2
10	R	24.6	Very low	26.3	Very low	231 Å²	231	157.1 Å²	157.1	87%	0.872	85%	0.847	S	S	*	*			trans	68.4	112.9	158.6	-58.4	172.9	-179.7	-163.3	-1.7	114.6
11	S	26	Very low	26.4	Very low	111 Å²	111	155 Å²	155	78%	0.776	84%	0.844	S	S	*	*				179.6	146.3	77.9	-49.5	0	0	0	0	104.6
12	S	27.6	Very low	26.1	Very low	117 Å²	117	147 Å²	147	82%	0.818	83%	0.826	S	S	*	*				-170.9	146.8	55.9	-67.3	0	0	0	0	108.9
13	I	24.6	Very low	26.3	Very low	168 Å²	168	144.6 Å²	144.6	86%	0.862	82%	0.822	S	S	*	*			trans	-64.6	126.1	172.1	-70.4	153.4	0	0	0	109.2
14	C	26.3	Very low	26.4	Very low	127 Å²	127	147.5 Å²	147.5	86%	0.858	83%	0.829	S	S	*	*			trans	-136.8	111.8	153.9	-115.6	0	0	0	0	108.1
15	C	21.4	Very low	26.5	Very low	111 Å²	111	150.2 Å²	150.2	75%	0.75	82%	0.824	S	S	*	*			trans	-80.8	114.8	-179.2	-154	0	0	0	0	108.2
16	V	27.9	Very low	26.6	Very low	138 Å²	138	142.6 Å²	142.6	84%	0.836	81%	0.807	S	S	*	*			trans	-119.7	101.6	162.4	-177.8	0	0	0	0	107	G18	V16-G18 PolarHBondContact O-N 3.04Å
17	R	22.6	Very low	26.9	Very low	239 Å²	239	137.8 Å²	137.8	90%	0.902	78%	0.781	S	S	*	*			trans	-65.9	110.8	169.4	-83.4	175.4	164.4	166.7	-5	108.4
18	G	27.3	Very low	27.2	Very low	69 Å²	69	135.7 Å²	135.7	71%	0.711	77%	0.767	S	S	*	*			trans	-126.4	109.1	162.3	0	0	0	0	0	108.4	V16 S20	V16-G18 PolarHBondContact O-N 3.04Å; G18-S20 PolarHBondContact O-N 3.29Å
19	L	25.5	Very low	27.9	Very low	180 Å²	180	127 Å²	127	94%	0.942	73%	0.731	S	S	*	*			trans	-65.3	121.5	176.9	-77.2	143.8	0	0	0	110.8
20	S	28.1	Very low	28.5	Very low	106 Å²	106	126.2 Å²	126.2	74%	0.741	72%	0.718	S	S	*	*			trans	-160.2	103.1	143	59.7	0	0	0	0	110.6	G18	G18-S20 PolarHBondContact O-N 3.29Å
21	S	29.2	Very low	29.3	Very low	113 Å²	113	117.6 Å²	117.6	79%	0.79	69%	0.691	S	S	*	*			trans	37.1	110.1	151	56.1	0	0	0	0	119.4
22	G	25.2	Very low	29.9	Very low	82 Å²	82	115.2 Å²	115.2	85%	0.845	68%	0.675	S	S	*	*			trans	-66.7	140.5	162.8	0	0	0	0	0	112.8
23	L	29.7	Very low	30.1	Very low	155 Å²	155	115.6 Å²	115.6	81%	0.812	67%	0.667	S	S	*	*			trans	-104.9	118.8	158.9	-100.2	136.4	0	0	0	107.4	Y25	L23-Y25 PolarHBondContact O-N 3.1Å
24	L	29.5	Very low	30.5	Very low	163 Å²	163	115.7 Å²	115.7	85%	0.853	66%	0.661	S	S	*	*			trans	-58.6	121.6	176.1	-76.3	152.5	0	0	0	109.6	G26	L24-G26 PolarHBondContact O-N 2.97Å
25	Y	29.5	Very low	30.6	Very low	211 Å²	211	114.9 Å²	114.9	83%	0.827	66%	0.664	S	S	*	*	S	Bend	trans	-71.7	109.6	170.4	-115.7	-99.9	0	0	0	108.5	L23	L23-Y25 PolarHBondContact O-N 3.1Å
26	G	29.5	Very low	30.9	Very low	44 Å²	44	116.2 Å²	116.2	45%	0.454	66%	0.663	S	S	.	*			trans	172.2	4.4	176.9	0	0	0	0	0	117.9	L24 E28 T61	L24-G26 PolarHBondContact O-N 2.97Å; G26-E28 PolarHBondContact O-N 3.49Å; G26-T61 WeakPolarHBondContact O-CG2 3.26Å
27	D	33.4	Very low	30.8	Very low	47 Å²	47	115.8 Å²	115.8	25%	0.251	66%	0.661	S	S	.	*			trans	-84.4	114.8	-174.2	-65.1	-32	0	0	0	112.5	T61 K62	D27-T61 WeakPolarHBondContact OD1-CA 3.35Å; D27-T61 WeakPolarHBondContact OD1-CB 3.4Å; D27-K62 WeakPolarHBondContact CB-O 3.37Å; D27-K62 PolarHBondContact OD1-N 3.4Å
28	E	33.3	Very low	31	Very low	121 Å²	121	109.5 Å²	109.5	57%	0.565	66%	0.66	S	S	*	*			trans	-66.9	124.6	164.6	-78.6	-174.7	156	0	0	109.9	G26 K63	G26-E28 PolarHBondContact O-N 3.49Å; E28-K63 VanDerWaalsContact OE2-CE 3.26Å; E28-K63 WeakPolarHBondContact OE2-CE 3.16Å; E28-K63 IonicContact OE2-NZ 2.69Å; E28-K63 PolarHBondContact OE2-NZ 3.36Å
29	I	39.1	Very low	31.1	Very low	37 Å²	37	115.6 Å²	115.6	19%	0.19	67%	0.667	C	S	.	*			trans	-98.8	113.9	176.4	-60.4	-156.9	0	0	0	108.9	I64 Y66 Q129	I29-I64 HydrophobicContact CD1-CB 4.27Å; I29-I64 WeakPolarHBondContact CG2-O 3.44Å; I29-Y66 HydrophobicContact CD1-CD2 4.18Å; I29-Y66 HydrophobicContact CD1-CE2 3.38Å; I29-Y66 HydrophobicContact CG2-CD2 3.61Å; I29-Y66 HydrophobicContact CG2-CE2 3.91Å; I29-Q129 VanDerWaalsContact CD1-OE1 3.26Å; I29-Q129 VanDerWaalsContact CG1-NE2 3.29Å
30	L	37.8	Very low	31.2	Very low	80 Å²	80	116.4 Å²	116.4	42%	0.419	66%	0.663	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.1	123.4	175.6	-78.2	166.5	0	0	0	109	K63 F65	L30-K63 HydrophobicContact CD1-CD 3.67Å; L30-K63 HydrophobicContact CG-CD 4.42Å; L30-F65 HydrophobicContact CB-CD1 3.83Å; L30-F65 HydrophobicContact CB-CE1 3.35Å; L30-F65 HydrophobicContact CB-CZ 4.01Å; L30-F65 HydrophobicContact CD1-CE1 3.91Å; L30-F65 HydrophobicContact CD1-CZ 3.85Å; L30-F65 HydrophobicContact CG-CE1 4.28Å; L30-F65 WeakPolarHBondContact O-CD1 3.26Å
31	V	40.9	Very low	31.3	Very low	50 Å²	50	120.5 Å²	120.5	30%	0.303	67%	0.67	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.1	118.6	170.5	-179.2	0	0	0	0	108.2	N33 E68 Y146	V31-N33 PolarHBondContact O-N 2.87Å; V31-E68 HydrophobicContact CG1-CB 3.72Å; V31-E68 HydrophobicContact CG1-CG 4.31Å; V31-E68 VanDerWaalsContact CG1-OE2 3.26Å; V31-E68 WeakPolarHBondContact CG1-OE2 3.14Å; V31-Y146 HydrophobicContact CB-CD1 4.28Å; V31-Y146 HydrophobicContact CG1-CD1 3.39Å; V31-Y146 HydrophobicContact CG1-CE1 3.88Å; V31-Y146 HydrophobicContact CG1-CG 4Å; V31-Y146 HydrophobicContact CG2-CD1 3.85Å; V31-Y146 HydrophobicContact CG2-CD2 4.01Å; V31-Y146 HydrophobicContact CG2-CE1 4.17Å; V31-Y146 HydrophobicContact CG2-CE2 4.3Å; V31-Y146 HydrophobicContact CG2-CG 3.76Å
32	S	40.3	Very low	31.3	Very low	62 Å²	62	125.6 Å²	125.6	43%	0.434	67%	0.672	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80	110.9	178.3	171.2	0	0	0	0	110.3
33	N	30.7	Very low	31.3	Very low	125 Å²	125	130.4 Å²	130.4	67%	0.668	67%	0.669	S	S	*	*			trans	-75.6	123.5	160	-87.4	-60.2	0	0	0	108.8	V31 E68	V31-N33 PolarHBondContact O-N 2.87Å; N33-E68 PolarHBondContact OD1-OE2 3.12Å
34	K	34	Very low	31.2	Very low	169 Å²	169	134.8 Å²	134.8	74%	0.735	68%	0.675	S	S	*	*			trans	96.6	97.9	174.3	-58.5	176.8	176	177.5	0	115.9	L36	K34-L36 VanDerWaalsContact C-N 3.31Å; K34-L36 HydrophobicContact CB-CD1 4.18Å; K34-L36 HydrophobicContact CD-CD1 4.21Å; K34-L36 PolarHBondContact O-N 2.96Å
35	A	27	Very low	31.1	Very low	111 Å²	111	136.1 Å²	136.1	92%	0.917	68%	0.677	S	S	*	*			trans	-56.7	96.2	143.8	0	0	0	0	0	109.1
36	L	27.5	Very low	31.1	Very low	139 Å²	139	132.2 Å²	132.2	73%	0.728	68%	0.675	S	S	*	*			trans	-98.4	106.6	166.1	-108.5	138.8	0	0	0	107.8	K34 A38	K34-L36 VanDerWaalsContact C-N 3.31Å; K34-L36 HydrophobicContact CB-CD1 4.18Å; K34-L36 HydrophobicContact CD-CD1 4.21Å; K34-L36 PolarHBondContact O-N 2.96Å; L36-A38 PolarHBondContact O-N 2.69Å
37	T	26.8	Very low	30.9	Very low	128 Å²	128	137.4 Å²	137.4	79%	0.785	69%	0.692	S	S	*	*			trans	-47.5	105	164	31.5	0	0	0	0	110	K39	T37-K39 VanDerWaalsContact C-N 3.26Å; T37-K39 PolarHBondContact O-N 2.89Å
38	A	26.4	Very low	30.9	Very low	107 Å²	107	142.2 Å²	142.2	88%	0.884	72%	0.716	S	S	*	*			trans	-74.1	79.6	172.8	0	0	0	0	0	110.2	L36	L36-A38 PolarHBondContact O-N 2.69Å
39	K	29.2	Very low	30.5	Very low	198 Å²	198	145.5 Å²	145.5	86%	0.861	73%	0.729	S	S	*	*			trans	-84.2	120.4	153.8	-90.8	-176.7	176.6	176.6	0	108.3	T37 H41	T37-K39 VanDerWaalsContact C-N 3.26Å; T37-K39 PolarHBondContact O-N 2.89Å; K39-H41 PolarHBondContact O-N 3.02Å
40	K	27.7	Very low	30.1	Very low	196 Å²	196	150 Å²	150	85%	0.852	76%	0.758	S	S	*	*			trans	-16.8	120.5	167.6	-69.4	170.7	173.8	174.9	0	114.7
41	H	31.6	Very low	29.5	Very low	193 Å²	193	154 Å²	154	89%	0.894	77%	0.774	S	S	*	*				-173.5	156.8	123.7	-93.8	-45.2	0	0	0	113.9	K39	K39-H41 PolarHBondContact O-N 3.02Å
42	R	28	Very low	28.9	Very low	219 Å²	219	157.8 Å²	157.8	83%	0.826	80%	0.802	S	S	*	*			trans	-75.6	149.1	-162.2	-89.4	168.6	160.6	171.5	-5.6	114.9
43	K	26.6	Very low	28.2	Very low	184 Å²	184	163.1 Å²	163.1	80%	0.8	82%	0.82	S	S	*	*			trans	60.9	114.9	142.3	-69.9	-178	176.7	-172.6	0	118.8
44	R	27.5	Very low	28.2	Very low	247 Å²	247	165.9 Å²	165.9	93%	0.932	83%	0.828	S	S	*	*				-170.2	125.2	113.7	-103.7	170.3	174	-178.8	-2.1	111.4
45	Q	26.4	Very low	27.8	Very low	191 Å²	191	166.2 Å²	166.2	89%	0.893	84%	0.838	S	S	*	*			trans	-70	137.1	167.1	-82.1	167.7	-32.8	0	0	109.5
46	V	30.4	Very low	27.9	Very low	128 Å²	128	166.5 Å²	166.5	78%	0.776	83%	0.828	S	S	*	*			trans	-129.1	112.4	160.2	179.1	0	0	0	0	107.3
47	N	25.3	Very low	27.9	Very low	153 Å²	153	165.1 Å²	165.1	82%	0.818	83%	0.83	S	S	*	*			trans	-76.6	128	170.8	-91.7	-23.8	0	0	0	109.1
48	I	31.9	Very low	27.9	Very low	148 Å²	148	164.9 Å²	164.9	76%	0.759	83%	0.829	S	S	*	*			trans	-117.1	111.3	159.5	-62.1	178.1	0	0	0	106.6
49	K	25.3	Very low	27.9	Very low	190 Å²	190	164.9 Å²	164.9	83%	0.826	82%	0.821	S	S	*	*			trans	-80.4	126.2	169.9	-78.5	-177.8	173.2	-176	0	108.5
50	T	30.9	Very low	27.9	Very low	132 Å²	132	162.7 Å²	162.7	81%	0.81	82%	0.819	S	S	*	*			trans	-132.7	114.4	154.6	35.2	0	0	0	0	108.2
51	H	26.3	Very low	28.4	Very low	164 Å²	164	156.2 Å²	156.2	76%	0.759	80%	0.795	S	S	*	*			trans	-61.6	129	167	-92.9	-90.1	0	0	0	109.6
52	C	27.2	Very low	29.4	Very low	130 Å²	130	155.4 Å²	155.4	88%	0.878	79%	0.789	S	S	*	*			trans	-157	111.4	139.4	-93.7	0	0	0	0	106.5
53	E	25.5	Very low	31	Very low	173 Å²	173	149 Å²	149	81%	0.808	77%	0.768	S	S	*	*			trans	-72.8	118.9	168	-68.1	172.1	161.2	0	0	107.7
54	E	31.1	Very low	33.3	Very low	183 Å²	183	143.8 Å²	143.8	86%	0.855	75%	0.747	S	S	*	*			trans	-163.3	122.2	150.8	-110.3	169.9	-156.8	0	0	108.2	V56	E54-V56 PolarHBondContact O-N 2.96Å
55	N	26	Very low	36	Very low	176 Å²	176	137.6 Å²	137.6	94%	0.941	73%	0.728	S	S	*	*			trans	-63.8	102.4	-177.3	-71.7	-56.1	0	0	0	110.6
56	V	28.2	Very low	39	Very low	117 Å²	117	129.7 Å²	129.7	71%	0.709	69%	0.69	S	S	*	*			trans	-119.9	123.6	165.5	-177.8	0	0	0	0	108.2	E54 V58	E54-V56 PolarHBondContact O-N 2.96Å; V56-V58 PolarHBondContact O-N 3.48Å; V56-V58 VanDerWaalsContact O-N 3.1Å
57	S	26.8	Very low	41.9	Very low	110 Å²	110	126.6 Å²	126.6	77%	0.769	67%	0.672	S	S	*	*			trans	-52.8	113	175.3	52.8	0	0	0	0	110.7	C59	S57-C59 PolarHBondContact O-N 3.06Å
58	V	27.3	Very low	45.1	Very low	124 Å²	124	121.6 Å²	121.6	75%	0.752	64%	0.644	S	S	*	*			trans	-68.2	98.4	174.9	179.9	0	0	0	0	108.5	V56 N60	V56-V58 PolarHBondContact O-N 3.48Å; V56-V58 VanDerWaalsContact O-N 3.1Å; V58-N60 PolarHBondContact O-N 3.35Å
59	C	26.3	Very low	47.9	Very low	106 Å²	106	115 Å²	115	72%	0.716	61%	0.61	S	S	*	*			trans	-73.7	107.3	165.4	-146.6	0	0	0	0	106.9	S57 T61	S57-C59 PolarHBondContact O-N 3.06Å; C59-T61 VanDerWaalsContact C-N 3.26Å; C59-T61 PolarHBondContact O-N 3.31Å
60	N	29.5	Very low	50.8	Low	153 Å²	153	110.6 Å²	110.6	82%	0.818	60%	0.596	S	S	*	*			trans	-69.7	80.2	176.4	-92.3	-18.3	0	0	0	110.1	V58	V58-N60 PolarHBondContact O-N 3.35Å
61	T	38	Very low	53.4	Low	59 Å²	59	107.9 Å²	107.9	36%	0.362	57%	0.574	S	S	.	*			trans	-79.4	122.6	167.3	41.7	0	0	0	0	109.1	G26 D27 C59 K63	G26-T61 WeakPolarHBondContact O-CG2 3.26Å; D27-T61 WeakPolarHBondContact OD1-CA 3.35Å; D27-T61 WeakPolarHBondContact OD1-CB 3.4Å; C59-T61 VanDerWaalsContact C-N 3.26Å; C59-T61 PolarHBondContact O-N 3.31Å; T61-K63 PolarHBondContact O-N 3.43Å; T61-K63 VanDerWaalsContact O-N 3.12Å
62	K	52.6	Low	56.1	Low	176 Å²	176	106 Å²	106	77%	0.765	57%	0.569	S	S	*	*			trans	-76.9	100.7	179.6	-93	-177.3	175.6	177.7	0	107.2	D27 I64	D27-K62 WeakPolarHBondContact CB-O 3.37Å; D27-K62 PolarHBondContact OD1-N 3.4Å; K62-I64 PolarHBondContact O-N 3.45Å
63	K	61.9	Low	59.1	Low	86 Å²	86	101.4 Å²	101.4	37%	0.374	54%	0.536	S	S	.	.			trans	-62.1	112.1	173.6	-62.1	-165.4	177	-163.5	0	110	E28 L30 T61 F65	E28-K63 VanDerWaalsContact OE2-CE 3.26Å; E28-K63 WeakPolarHBondContact OE2-CE 3.16Å; E28-K63 IonicContact OE2-NZ 2.69Å; E28-K63 PolarHBondContact OE2-NZ 3.36Å; L30-K63 HydrophobicContact CD1-CD 3.67Å; L30-K63 HydrophobicContact CG-CD 4.42Å; T61-K63 PolarHBondContact O-N 3.43Å; T61-K63 VanDerWaalsContact O-N 3.12Å; K63-F65 HydrophobicContact CB-CE2 3.83Å; K63-F65 HydrophobicContact CB-CZ 4.32Å; K63-F65 WeakPolarHBondContact O-CD2 3.5Å
64	I	75.9	Confident	62	Low	73 Å²	73	96.8 Å²	96.8	37%	0.374	52%	0.523	S	S	.	.			trans	-83.9	128.7	173.4	-59.3	172.9	0	0	0	107.5	I29 K62 Y66	I29-I64 HydrophobicContact CD1-CB 4.27Å; I29-I64 WeakPolarHBondContact CG2-O 3.44Å; K62-I64 PolarHBondContact O-N 3.45Å; I64-Y66 HydrophobicContact CG2-CD1 4.37Å; I64-Y66 HydrophobicContact CG2-CE1 3.7Å; I64-Y66 HydrophobicContact CG2-CE2 4.06Å
65	F	82.4	Confident	64.6	Low	118 Å²	118	91.3 Å²	91.3	52%	0.518	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	128.8	178.4	-70.3	-96.1	0	0	0	109.5	L30 K63	L30-F65 HydrophobicContact CB-CD1 3.83Å; L30-F65 HydrophobicContact CB-CE1 3.35Å; L30-F65 HydrophobicContact CB-CZ 4.01Å; L30-F65 HydrophobicContact CD1-CE1 3.91Å; L30-F65 HydrophobicContact CD1-CZ 3.85Å; L30-F65 HydrophobicContact CG-CE1 4.28Å; L30-F65 WeakPolarHBondContact O-CD1 3.26Å; K63-F65 HydrophobicContact CB-CE2 3.83Å; K63-F65 HydrophobicContact CB-CZ 4.32Å; K63-F65 WeakPolarHBondContact O-CD2 3.5Å
66	Y	90.1	Very high	67.3	Low	24 Å²	24	83 Å²	83	9%	0.094	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	135.9	171.8	-58.8	-63.9	0	0	0	110.5	I29 I64 E68 F126 L132 I144	I29-Y66 HydrophobicContact CD1-CD2 4.18Å; I29-Y66 HydrophobicContact CD1-CE2 3.38Å; I29-Y66 HydrophobicContact CG2-CD2 3.61Å; I29-Y66 HydrophobicContact CG2-CE2 3.91Å; I64-Y66 HydrophobicContact CG2-CD1 4.37Å; I64-Y66 HydrophobicContact CG2-CE1 3.7Å; I64-Y66 HydrophobicContact CG2-CE2 4.06Å; Y66-E68 PolarHBondContact O-N 3.27Å; Y66-F126 AromaticContact CD2-CE1 3.66Å; Y66-F126 HydrophobicContact CD2-CE1 3.66Å; Y66-F126 AromaticContact CD2-CZ 3.44Å; Y66-F126 HydrophobicContact CD2-CZ 3.44Å; Y66-F126 VanDerWaalsContact CD2-CZ 3.44Å; Y66-F126 HydrophobicContact CE2-CE1 4.26Å; Y66-F126 HydrophobicContact CE2-CZ 4.11Å; Y66-F126 AromaticContact CG-CE1 3.89Å; Y66-F126 HydrophobicContact CG-CE1 3.89Å; Y66-F126 HydrophobicContact CG-CZ 4.05Å; Y66-L132 HydrophobicContact CD2-CD2 4.14Å; Y66-L132 HydrophobicContact CE2-CD2 3.35Å; Y66-I144 HydrophobicContact CD1-CB 3.59Å; Y66-I144 HydrophobicContact CD1-CG2 3.49Å; Y66-I144 VanDerWaalsContact CD1-CG2 3.49Å; Y66-I144 HydrophobicContact CD2-CG2 4.34Å; Y66-I144 HydrophobicContact CE1-CB 3.59Å; Y66-I144 HydrophobicContact CE1-CD1 3.67Å; Y66-I144 HydrophobicContact CE1-CG1 4.25Å; Y66-I144 HydrophobicContact CE1-CG2 3.51Å; Y66-I144 HydrophobicContact CE2-CG2 4.29Å; Y66-I144 HydrophobicContact CG-CB 4.46Å; Y66-I144 HydrophobicContact CG-CG2 3.93Å
67	P	91.7	Very high	69.8	Low	64 Å²	64	80.4 Å²	80.4	42%	0.416	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	131.3	174.4	22.6	-31.8	0	0	0	111.3	Y145 Y146	P67-Y145 HydrophobicContact CB-CD1 4.28Å; P67-Y145 HydrophobicContact CG-CD1 3.55Å; P67-Y145 HydrophobicContact CG-CE1 3.73Å; P67-Y146 PolarHBondContact O-N 2.88Å
68	E	92.6	Very high	72.2	Confident	47 Å²	47	79 Å²	79	22%	0.22	42%	0.423	C	S	.	.	B	Isolated β-bridge	trans	-79.7	128.1	168	-179.2	166.6	-179.9	0	0	109.5	V31 N33 Y66 Y146 K148	V31-E68 HydrophobicContact CG1-CB 3.72Å; V31-E68 HydrophobicContact CG1-CG 4.31Å; V31-E68 VanDerWaalsContact CG1-OE2 3.26Å; V31-E68 WeakPolarHBondContact CG1-OE2 3.14Å; N33-E68 PolarHBondContact OD1-OE2 3.12Å; Y66-E68 PolarHBondContact O-N 3.27Å; E68-Y146 CarbonylContact C-O 3.53Å; E68-Y146 VanDerWaalsContact CA-O 3.32Å; E68-Y146 WeakPolarHBondContact CA-O 3.44Å; E68-Y146 HydrophobicContact CB-CD1 4Å; E68-Y146 HydrophobicContact CG-CD1 3.76Å; E68-Y146 HydrophobicContact CG-CE1 4.23Å; E68-K148 WeakPolarHBondContact OE1-CE 3.29Å; E68-K148 IonicContact OE1-NZ 3.86Å
69	L	91	Very high	74.6	Confident	9 Å²	9	73.2 Å²	73.2	5%	0.047	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-103.2	137.3	171.4	-50.2	-179.7	0	0	0	110.2	D73 K75 I76 F125 Y145 Y146 V147	L69-D73 HydrophobicContact CB-CB 4.1Å; L69-D73 HydrophobicContact CD2-CB 4.47Å; L69-D73 WeakPolarHBondContact CD2-OD2 3.36Å; L69-K75 HydrophobicContact CD1-CB 4.14Å; L69-K75 HydrophobicContact CD1-CD 4.29Å; L69-I76 HydrophobicContact CB-CG1 4.4Å; L69-I76 HydrophobicContact CD1-CD1 4.17Å; L69-I76 HydrophobicContact CD1-CG1 4.35Å; L69-F125 HydrophobicContact CD1-CD1 4.13Å; L69-F125 HydrophobicContact CD1-CE1 3.71Å; L69-Y145 HydrophobicContact CD1-CD1 3.57Å; L69-Y145 HydrophobicContact CD1-CD2 4.21Å; L69-Y145 HydrophobicContact CD1-CE1 4.26Å; L69-Y145 HydrophobicContact CD1-CG 3.57Å; L69-Y145 HydrophobicContact CD2-CD1 3.68Å; L69-Y145 HydrophobicContact CD2-CE1 4.11Å; L69-Y145 HydrophobicContact CD2-CG 4.5Å; L69-Y145 HydrophobicContact CG-CD1 3.67Å; L69-Y145 HydrophobicContact CG-CG 4.03Å; L69-Y146 PolarHBondContact N-O 2.96Å; L69-V147 HydrophobicContact CB-CG1 3.92Å
70	D	86.5	Confident	77	Confident	98 Å²	98	70.4 Å²	70.4	52%	0.524	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-79.2	169.7	167.7	67.7	53.1	0	0	0	111.4	N72 D73	D70-N72 PolarHBondContact O-N 3.45Å; D70-N72 WeakPolarHBondContact OD1-CA 3.49Å; D70-N72 WeakPolarHBondContact OD1-CB 3.28Å; D70-N72 PolarHBondContact OD1-N 3.1Å; D70-D73 PolarHBondContact O-N 2.99Å; D70-D73 PolarHBondContact OD1-N 2.83Å
71	E	83.6	Confident	79.2	Confident	76 Å²	76	67 Å²	67	36%	0.355	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.1	-177.8	59.2	176.2	-128.4	0	0	115	V151 R154	E71-V151 HydrophobicContact CB-CG2 4.09Å; E71-R154 VanDerWaalsContact CD-CZ 3.44Å; E71-R154 IonicContact OE1-CZ 3.39Å; E71-R154 IonicContact OE1-NH1 2.95Å; E71-R154 PolarHBondContact OE1-NH1 3.09Å; E71-R154 IonicContact OE1-NH2 3.95Å; E71-R154 PolarHBondContact OE1-NH2 3.37Å; E71-R154 IonicContact OE2-CZ 3.21Å; E71-R154 IonicContact OE2-NH1 3.32Å; E71-R154 PolarHBondContact OE2-NH1 3.01Å; E71-R154 IonicContact OE2-NH2 2.98Å; E71-R154 PolarHBondContact OE2-NH2 3.35Å
72	N	84.5	Confident	80.9	Confident	123 Å²	123	65.2 Å²	65.2	66%	0.658	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	0.2	-177.9	-61.3	-46.4	0	0	0	112.5	D70 S74	D70-N72 PolarHBondContact O-N 3.45Å; D70-N72 WeakPolarHBondContact OD1-CA 3.49Å; D70-N72 WeakPolarHBondContact OD1-CB 3.28Å; D70-N72 PolarHBondContact OD1-N 3.1Å; N72-S74 PolarHBondContact O-N 2.82Å
73	D	89.6	Confident	81.5	Confident	35 Å²	35	58.6 Å²	58.6	19%	0.187	31%	0.31	C	S	.	.			trans	-61.4	134.5	177.8	-167.3	-65.5	0	0	0	110.3	L69 D70 K75 I76 S77	L69-D73 HydrophobicContact CB-CB 4.1Å; L69-D73 HydrophobicContact CD2-CB 4.47Å; L69-D73 WeakPolarHBondContact CD2-OD2 3.36Å; D70-D73 PolarHBondContact O-N 2.99Å; D70-D73 PolarHBondContact OD1-N 2.83Å; D73-K75 PolarHBondContact O-N 2.93Å; D73-K75 WeakPolarHBondContact OD1-CB 3.38Å; D73-K75 WeakPolarHBondContact OD1-CG 3.32Å; D73-K75 PolarHBondContact OD1-N 2.92Å; D73-K75 IonicContact OD1-NZ 3.03Å; D73-K75 PolarHBondContact OD1-NZ 2.93Å; D73-K75 IonicContact OD2-NZ 3.32Å; D73-K75 PolarHBondContact OD2-NZ 3.38Å; D73-I76 HydrophobicContact CB-CG1 4.38Å; D73-I76 WeakPolarHBondContact O-CB 3.43Å; D73-I76 PolarHBondContact O-N 3.01Å; D73-S77 PolarHBondContact O-N 3.25Å
74	S	86.3	Confident	81.5	Confident	75 Å²	75	61.2 Å²	61.2	52%	0.524	32%	0.322	S	S	.	.	H	α-helix	trans	-46.8	-36.1	175.3	53.6	0	0	0	0	114	N72 I76 S77 D78	N72-S74 PolarHBondContact O-N 2.82Å; S74-I76 VanDerWaalsContact C-N 3.33Å; S74-I76 PolarHBondContact O-N 3.22Å; S74-S77 WeakPolarHBondContact O-CB 3.41Å; S74-S77 PolarHBondContact O-N 2.91Å; S74-D78 PolarHBondContact O-N 3.26Å
75	K	85.4	Confident	80.8	Confident	68 Å²	68	60 Å²	60	30%	0.296	32%	0.315	S	S	.	.	H	α-helix	trans	-68.6	-31.6	-179.3	-63.9	176.1	-149.8	68.2	0	112.6	L69 D73 D78 V79 F125 Y145	L69-K75 HydrophobicContact CD1-CB 4.14Å; L69-K75 HydrophobicContact CD1-CD 4.29Å; D73-K75 PolarHBondContact O-N 2.93Å; D73-K75 WeakPolarHBondContact OD1-CB 3.38Å; D73-K75 WeakPolarHBondContact OD1-CG 3.32Å; D73-K75 PolarHBondContact OD1-N 2.92Å; D73-K75 IonicContact OD1-NZ 3.03Å; D73-K75 PolarHBondContact OD1-NZ 2.93Å; D73-K75 IonicContact OD2-NZ 3.32Å; D73-K75 PolarHBondContact OD2-NZ 3.38Å; K75-D78 PolarHBondContact O-N 3.27Å; K75-V79 WeakPolarHBondContact O-CG2 3.27Å; K75-V79 PolarHBondContact O-N 3.4Å; K75-F125 HydrophobicContact CB-CE1 4.44Å; K75-Y145 HydrophobicContact CD-CE1 3.84Å; K75-Y145 HydrophobicContact CD-CE2 3.9Å; K75-Y145 VanDerWaalsContact CD-CZ 3.44Å; K75-Y145 WeakPolarHBondContact CD-OH 3.46Å; K75-Y145 WeakPolarHBondContact CE-OH 3.31Å
76	I	82.8	Confident	79.3	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-69.3	-44	174.2	-62.1	-60.1	0	0	0	109.3	L69 D73 S74 D78 V79 I80 F125 V147 V151 I155	L69-I76 HydrophobicContact CB-CG1 4.4Å; L69-I76 HydrophobicContact CD1-CD1 4.17Å; L69-I76 HydrophobicContact CD1-CG1 4.35Å; D73-I76 HydrophobicContact CB-CG1 4.38Å; D73-I76 WeakPolarHBondContact O-CB 3.43Å; D73-I76 PolarHBondContact O-N 3.01Å; S74-I76 VanDerWaalsContact C-N 3.33Å; S74-I76 PolarHBondContact O-N 3.22Å; I76-D78 VanDerWaalsContact C-N 3.3Å; I76-D78 PolarHBondContact O-N 3.38Å; I76-V79 PolarHBondContact O-N 2.8Å; I76-I80 HydrophobicContact CG2-CD1 4.05Å; I76-I80 VanDerWaalsContact O-CG1 3.32Å; I76-I80 WeakPolarHBondContact O-CG1 3.41Å; I76-I80 PolarHBondContact O-N 2.99Å; I76-I80 VanDerWaalsContact O-N 3.07Å; I76-F125 HydrophobicContact CD1-CD1 3.73Å; I76-F125 HydrophobicContact CD1-CE1 3.72Å; I76-V147 HydrophobicContact CD1-CG1 3.9Å; I76-V151 HydrophobicContact CD1-CG1 4.14Å; I76-V151 HydrophobicContact CG1-CG1 4.38Å; I76-V151 HydrophobicContact CG2-CG1 4.16Å; I76-I155 HydrophobicContact CG2-CG2 3.59Å
77	S	80.1	Confident	77.3	Confident	64 Å²	64	59.7 Å²	59.7	45%	0.448	32%	0.323	S	S	.	.	H	α-helix	trans	-59.3	-40.2	173.7	-60.9	0	0	0	0	112.3	D73 S74 I80 L81	D73-S77 PolarHBondContact O-N 3.25Å; S74-S77 WeakPolarHBondContact O-CB 3.41Å; S74-S77 PolarHBondContact O-N 2.91Å; S77-I80 PolarHBondContact O-N 3.19Å; S77-L81 WeakPolarHBondContact O-CB 3.1Å; S77-L81 PolarHBondContact O-N 3.03Å
78	D	77.6	Confident	75	Confident	79 Å²	79	60.2 Å²	60.2	42%	0.422	33%	0.328	S	S	.	.	H	α-helix	trans	-62.2	-43.8	176.7	-75.7	-25.9	0	0	0	112.1	S74 K75 I76 I80 L81 Q82	S74-D78 PolarHBondContact O-N 3.26Å; K75-D78 PolarHBondContact O-N 3.27Å; I76-D78 VanDerWaalsContact C-N 3.3Å; I76-D78 PolarHBondContact O-N 3.38Å; D78-I80 PolarHBondContact O-N 3.24Å; D78-L81 WeakPolarHBondContact O-CB 3.31Å; D78-L81 PolarHBondContact O-N 2.85Å; D78-Q82 WeakPolarHBondContact O-CG 2.95Å; D78-Q82 PolarHBondContact O-N 3.32Å
79	V	78.9	Confident	72.7	Confident	4 Å²	4	63.9 Å²	63.9	2%	0.024	35%	0.345	C	S	.	.	H	α-helix	trans	-62	-44.2	175.9	174.8	0	0	0	0	111.2	K75 I76 L81 Q82 S83 I104 F125 I155 I165	K75-V79 WeakPolarHBondContact O-CG2 3.27Å; K75-V79 PolarHBondContact O-N 3.4Å; I76-V79 PolarHBondContact O-N 2.8Å; V79-L81 VanDerWaalsContact C-N 3.25Å; V79-L81 PolarHBondContact O-N 3.06Å; V79-Q82 PolarHBondContact O-N 2.82Å; V79-S83 PolarHBondContact O-N 2.91Å; V79-I104 HydrophobicContact CG1-CD1 4.19Å; V79-F125 HydrophobicContact CG2-CD2 4.16Å; V79-F125 HydrophobicContact CG2-CE1 4.44Å; V79-F125 HydrophobicContact CG2-CE2 3.28Å; V79-F125 HydrophobicContact CG2-CZ 3.44Å; V79-F125 VanDerWaalsContact CG2-CZ 3.44Å; V79-I155 HydrophobicContact CG1-CB 4.35Å; V79-I165 HydrophobicContact CG1-CD1 4.33Å
80	I	76.1	Confident	70	Confident	47 Å²	47	68.3 Å²	68.3	24%	0.241	38%	0.382	C	S	.	.	H	α-helix	trans	-62.6	-35.6	176.8	-65	166.4	0	0	0	111.1	I76 S77 D78 S83 K84 I155	I76-I80 HydrophobicContact CG2-CD1 4.05Å; I76-I80 VanDerWaalsContact O-CG1 3.32Å; I76-I80 WeakPolarHBondContact O-CG1 3.41Å; I76-I80 PolarHBondContact O-N 2.99Å; I76-I80 VanDerWaalsContact O-N 3.07Å; S77-I80 PolarHBondContact O-N 3.19Å; D78-I80 PolarHBondContact O-N 3.24Å; I80-S83 PolarHBondContact O-OG 3.32Å; I80-K84 WeakPolarHBondContact O-CG 3.3Å; I80-I155 HydrophobicContact CD1-CG2 4.13Å; I80-I155 HydrophobicContact CG1-CB 4.49Å; I80-I155 HydrophobicContact CG1-CG2 3.88Å
81	L	76.1	Confident	67.3	Low	82 Å²	82	67 Å²	67	43%	0.429	39%	0.393	S	S	.	.	H	α-helix	trans	-69	-43.4	175.9	-177.5	63.2	0	0	0	111	S77 D78 V79 S83 K84 I85	S77-L81 WeakPolarHBondContact O-CB 3.1Å; S77-L81 PolarHBondContact O-N 3.03Å; D78-L81 WeakPolarHBondContact O-CB 3.31Å; D78-L81 PolarHBondContact O-N 2.85Å; V79-L81 VanDerWaalsContact C-N 3.25Å; V79-L81 PolarHBondContact O-N 3.06Å; L81-S83 PolarHBondContact O-N 3.39Å; L81-K84 PolarHBondContact O-N 3.01Å; L81-I85 HydrophobicContact CD1-CD1 4.14Å; L81-I85 HydrophobicContact CD2-CD1 4.46Å; L81-I85 HydrophobicContact CG-CD1 3.83Å; L81-I85 WeakPolarHBondContact O-CG1 3.4Å; L81-I85 PolarHBondContact O-N 2.93Å
82	Q	72.5	Confident	64.8	Low	20 Å²	20	68.6 Å²	68.6	9%	0.093	41%	0.412	C	S	.	.	H	α-helix	trans	-63.3	-40.6	177.9	-66.6	-61.2	-12.2	0	0	112.4	D78 V79 K84 I85 S86 R98 I104 L167	D78-Q82 WeakPolarHBondContact O-CG 2.95Å; D78-Q82 PolarHBondContact O-N 3.32Å; V79-Q82 PolarHBondContact O-N 2.82Å; Q82-K84 PolarHBondContact O-N 3.35Å; Q82-I85 PolarHBondContact O-N 2.86Å; Q82-S86 PolarHBondContact O-N 3.18Å; Q82-S86 VanDerWaalsContact O-N 3.15Å; Q82-S86 PolarHBondContact O-OG 3.15Å; Q82-R98 VanDerWaalsContact NE2-CZ 3.3Å; Q82-I104 HydrophobicContact CB-CD1 4.19Å; Q82-L167 HydrophobicContact CB-CD1 4.02Å; Q82-L167 HydrophobicContact CG-CD1 4.1Å; Q82-L167 HydrophobicContact CG-CD2 4.16Å
83	S	65.2	Low	62.2	Low	38 Å²	38	72.2 Å²	72.2	27%	0.266	43%	0.425	S	S	.	.	H	α-helix	trans	-59.7	-31.1	179.1	68.6	0	0	0	0	112.5	V79 I80 L81 I104	V79-S83 PolarHBondContact O-N 2.91Å; I80-S83 PolarHBondContact O-OG 3.32Å; L81-S83 PolarHBondContact O-N 3.39Å; S83-I104 VanDerWaalsContact CA-CD1 3.47Å; S83-I104 VanDerWaalsContact CB-CD1 3.47Å
84	K	62.6	Low	59.4	Low	141 Å²	141	79.4 Å²	79.4	61%	0.613	45%	0.454	S	S	*	.	H	α-helix	trans	-78.6	-34.8	175.9	-65.8	176.5	-177.2	-178.9	0	113.1	I80 L81 Q82	I80-K84 WeakPolarHBondContact O-CG 3.3Å; L81-K84 PolarHBondContact O-N 3.01Å; Q82-K84 PolarHBondContact O-N 3.35Å
85	I	60.6	Low	56.7	Low	47 Å²	47	82.2 Å²	82.2	24%	0.241	46%	0.464	C	S	.	.	H	α-helix	trans	-74.9	-34.9	-175.5	-67.9	168.6	0	0	0	111.9	L81 Q82 L87 S88	L81-I85 HydrophobicContact CD1-CD1 4.14Å; L81-I85 HydrophobicContact CD2-CD1 4.46Å; L81-I85 HydrophobicContact CG-CD1 3.83Å; L81-I85 WeakPolarHBondContact O-CG1 3.4Å; L81-I85 PolarHBondContact O-N 2.93Å; Q82-I85 PolarHBondContact O-N 2.86Å; I85-L87 PolarHBondContact O-N 3.21Å; I85-S88 PolarHBondContact O-N 3.1Å; I85-S88 VanDerWaalsContact O-N 3.09Å; I85-S88 PolarHBondContact O-OG 3Å
86	S	51.1	Low	54.2	Low	32 Å²	32	88.6 Å²	88.6	22%	0.224	50%	0.495	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-12.6	-179.5	-55	0	0	0	0	113.8	Q82 A102	Q82-S86 PolarHBondContact O-N 3.18Å; Q82-S86 VanDerWaalsContact O-N 3.15Å; Q82-S86 PolarHBondContact O-OG 3.15Å; S86-A102 PolarHBondContact OG-O 2.81Å
87	L	48.3	Very low	52	Low	104 Å²	104	93.6 Å²	93.6	55%	0.545	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-14.2	178.5	-65.8	166.9	0	0	0	114.5	I85	I85-L87 PolarHBondContact O-N 3.21Å
88	S	43.6	Very low	50	Low	75 Å²	75	97.4 Å²	97.4	52%	0.524	53%	0.534	S	S	.	.			trans	-117.5	7.2	-163.6	66	0	0	0	0	117.1	I85 A90	I85-S88 PolarHBondContact O-N 3.1Å; I85-S88 VanDerWaalsContact O-N 3.09Å; I85-S88 PolarHBondContact O-OG 3Å; S88-A90 PolarHBondContact O-N 3.3Å
89	H	43.6	Very low	48.5	Very low	124 Å²	124	102.9 Å²	102.9	57%	0.574	55%	0.554	S	S	*	*			trans	-80.6	40.5	-175.5	-76.3	26.3	0	0	0	114.9
90	A	36	Very low	47.1	Very low	101 Å²	101	108.5 Å²	108.5	84%	0.835	58%	0.576	S	S	*	*	S	Bend	trans	-101.8	88.2	151.5	0	0	0	0	0	107.4	S88	S88-A90 PolarHBondContact O-N 3.3Å
91	G	28.6	Very low	46.9	Very low	72 Å²	72	109.4 Å²	109.4	74%	0.742	59%	0.585	S	S	*	*	S	Bend	trans	104.5	52.1	159.8	0	0	0	0	0	119.2
92	S	30.6	Very low	47.1	Very low	108 Å²	108	106.3 Å²	106.3	76%	0.755	57%	0.571	S	S	*	*			trans	-147.8	99.3	156.9	-89.1	0	0	0	0	113.4	K94	S92-K94 PolarHBondContact O-N 2.94Å
93	E	31.6	Very low	47.9	Very low	199 Å²	199	105.7 Å²	105.7	93%	0.93	57%	0.568	S	S	*	*			trans	-66.4	29.3	170.3	-63.8	177.8	144.2	0	0	114
94	K	29.3	Very low	49.1	Very low	186 Å²	186	105.2 Å²	105.2	81%	0.809	56%	0.562	S	S	*	*			trans	-121.8	14	-167.8	-76	-167.8	176.4	-178.3	0	117.3	S92	S92-K94 PolarHBondContact O-N 2.94Å
95	N	31.3	Very low	50.6	Low	135 Å²	135	98.5 Å²	98.5	72%	0.722	53%	0.533	S	S	*	.			trans	-121	75.6	171.8	-84.2	-23.6	0	0	0	111.7	S97	N95-S97 PolarHBondContact O-N 3.3Å
96	E	31.7	Very low	52.1	Low	202 Å²	202	98 Å²	98	94%	0.944	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	8.1	177.3	-74.7	-178	141.3	0	0	115.4
97	S	36.6	Very low	54.2	Low	105 Å²	105	97 Å²	97	73%	0.734	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.4	1.2	-166.1	55	0	0	0	0	116.6	N95	N95-S97 PolarHBondContact O-N 3.3Å
98	R	37.9	Very low	56.4	Low	144 Å²	144	93.4 Å²	93.4	54%	0.543	51%	0.508	S	S	.	.			trans	-123.2	121.1	173.4	-80.9	-179.6	174.8	159.2	-6	111.4	Q82 Y100	Q82-R98 VanDerWaalsContact NE2-CZ 3.3Å; R98-Y100 PolarHBondContact O-N 3.31Å; R98-Y100 VanDerWaalsContact O-N 3.14Å
99	K	46.4	Very low	58.8	Low	195 Å²	195	95.4 Å²	95.4	85%	0.848	51%	0.507	S	S	*	.	S	Bend	trans	-59.4	-26.9	-169.9	-112.5	176.8	177.2	179.4	0	114.3
100	Y	49.6	Very low	61.2	Low	121 Å²	121	90.4 Å²	90.4	48%	0.475	49%	0.485	S	S	.	.	S	Bend	trans	-152.1	147.3	172	-63.5	-75	0	0	0	110.2	R98 Q172	R98-Y100 PolarHBondContact O-N 3.31Å; R98-Y100 VanDerWaalsContact O-N 3.14Å; Y100-Q172 PolarHBondContact OH-NE2 2.82Å
101	P	71.4	Confident	64	Low	66 Å²	66	85.6 Å²	85.6	43%	0.429	45%	0.445	S	S	.	.			trans	-60.7	145.5	167.9	27.2	-33.3	0	0	0	109.6	L170	P101-L170 HydrophobicContact CG-CB 4.02Å; P101-L170 HydrophobicContact CG-CD2 3.74Å; P101-L170 HydrophobicContact CG-CG 4.47Å; P101-L170 VanDerWaalsContact O-CB 3.24Å; P101-L170 WeakPolarHBondContact O-CB 3.32Å; P101-L170 PolarHBondContact O-N 3.4Å
102	A	81.8	Confident	67.1	Low	18 Å²	18	83.7 Å²	83.7	15%	0.149	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	148.1	178.1	0	0	0	0	0	110.8	S86 L167 F168	S86-A102 PolarHBondContact OG-O 2.81Å; A102-L167 HydrophobicContact CB-CD1 3.55Å; A102-L167 HydrophobicContact CB-CD2 4.42Å; A102-L167 HydrophobicContact CB-CG 3.99Å; A102-F168 CarbonylContact C-O 3.6Å; A102-F168 VanDerWaalsContact CA-O 3.24Å; A102-F168 WeakPolarHBondContact CA-O 3.49Å
103	I	88.8	Confident	70	Confident	6 Å²	6	79.3 Å²	79.3	3%	0.031	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	145.1	172.5	66.5	177.8	0	0	0	110	L105 F168 L170 P171 W225 F238	I103-L105 HydrophobicContact CD1-CD2 4.14Å; I103-L105 HydrophobicContact CD1-CG 4.46Å; I103-L105 HydrophobicContact CG1-CD2 4.45Å; I103-F168 HydrophobicContact CD1-CB 4.29Å; I103-F168 HydrophobicContact CG1-CB 3.69Å; I103-F168 PolarHBondContact N-O 3.13Å; I103-F168 PolarHBondContact O-N 3.44Å; I103-L170 HydrophobicContact CG2-CD1 3.33Å; I103-P171 HydrophobicContact CD1-CG 4.48Å; I103-W225 HydrophobicContact CD1-CE3 3.78Å; I103-W225 HydrophobicContact CD1-CZ3 3.82Å; I103-W225 HydrophobicContact CG2-CB 4.05Å; I103-W225 HydrophobicContact CG2-CD2 4.43Å; I103-W225 HydrophobicContact CG2-CE3 4.33Å; I103-W225 HydrophobicContact CG2-CG 4.34Å; I103-F238 HydrophobicContact CD1-CZ 4.35Å
104	I	90.1	Very high	72.9	Confident	28 Å²	28	69.9 Å²	69.9	14%	0.144	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.1	176.8	-67.4	179.9	0	0	0	108.5	V79 Q82 S83 E106 I165 L167	V79-I104 HydrophobicContact CG1-CD1 4.19Å; Q82-I104 HydrophobicContact CB-CD1 4.19Å; S83-I104 VanDerWaalsContact CA-CD1 3.47Å; S83-I104 VanDerWaalsContact CB-CD1 3.47Å; I104-E106 HydrophobicContact CG2-CG 4.3Å; I104-I165 HydrophobicContact CG2-CD1 3.47Å; I104-I165 VanDerWaalsContact CG2-CD1 3.47Å; I104-I165 HydrophobicContact CG2-CG1 3.52Å; I104-L167 HydrophobicContact CD1-CD1 4.46Å; I104-L167 HydrophobicContact CG1-CD1 3.69Å
105	L	93.4	Very high	75.9	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.005	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	126.8	174.9	-55.7	-175.1	0	0	0	109.5	I103 L110 I111 A114 I165 A166 F168 I230 F238	I103-L105 HydrophobicContact CD1-CD2 4.14Å; I103-L105 HydrophobicContact CD1-CG 4.46Å; I103-L105 HydrophobicContact CG1-CD2 4.45Å; L105-L110 HydrophobicContact CB-CD2 3.93Å; L105-L110 HydrophobicContact CB-CG 4.12Å; L105-L110 HydrophobicContact CD1-CG 4.35Å; L105-L110 HydrophobicContact CD2-CD2 3.91Å; L105-L110 HydrophobicContact CD2-CG 4.16Å; L105-L110 HydrophobicContact CG-CD2 4.42Å; L105-L110 HydrophobicContact CG-CG 4.44Å; L105-I111 HydrophobicContact CB-CG1 3.96Å; L105-A114 HydrophobicContact CD1-CB 3.42Å; L105-A114 VanDerWaalsContact CD1-CB 3.42Å; L105-I165 CarbonylContact O-C 3.59Å; L105-I165 WeakPolarHBondContact O-CA 3.32Å; L105-A166 PolarHBondContact N-O 2.95Å; L105-A166 PolarHBondContact O-N 3.32Å; L105-F168 HydrophobicContact CB-CD2 4.2Å; L105-F168 HydrophobicContact CB-CE2 4.1Å; L105-F168 HydrophobicContact CD1-CD2 3.59Å; L105-F168 HydrophobicContact CD1-CE2 3.54Å; L105-F168 HydrophobicContact CD1-CG 4.2Å; L105-F168 HydrophobicContact CD1-CZ 4.12Å; L105-F168 HydrophobicContact CG-CD2 3.8Å; L105-F168 HydrophobicContact CG-CE2 4.03Å; L105-I230 HydrophobicContact CD2-CD1 4.08Å; L105-I230 HydrophobicContact CD2-CG2 3.9Å; L105-F238 HydrophobicContact CD1-CE1 4.47Å; L105-F238 HydrophobicContact CD1-CE2 3.74Å; L105-F238 HydrophobicContact CD1-CZ 3.5Å; L105-F238 HydrophobicContact CD2-CE2 4.16Å; L105-F238 HydrophobicContact CD2-CZ 3.95Å; L105-F238 HydrophobicContact CG-CZ 4.4Å
106	E	93.5	Very high	78.7	Confident	37 Å²	37	58.2 Å²	58.2	17%	0.173	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	130.8	178.9	-67.9	-173.2	-139.4	0	0	110.7	I104 S156 S157 L158 P162 I165	I104-E106 HydrophobicContact CG2-CG 4.3Å; E106-S156 WeakPolarHBondContact OE1-CA 3.4Å; E106-S156 VanDerWaalsContact OE2-CB 3.3Å; E106-S156 WeakPolarHBondContact OE2-CB 3.24Å; E106-S156 PolarHBondContact OE2-OG 3.04Å; E106-S157 PolarHBondContact OE1-N 2.95Å; E106-L158 HydrophobicContact CB-CD1 4.18Å; E106-L158 WeakPolarHBondContact OE2-CD1 3.32Å; E106-L158 WeakPolarHBondContact OE2-CG 3.44Å; E106-P162 HydrophobicContact CB-CG 4.06Å; E106-I165 HydrophobicContact CG-CB 4.19Å; E106-I165 HydrophobicContact CG-CD1 3.71Å; E106-I165 HydrophobicContact CG-CG1 3.69Å
107	G	94.2	Very high	81.3	Confident	11 Å²	11	49.8 Å²	49.8	11%	0.113	26%	0.262	C	S	.	.	S	Bend	trans	99.4	142	176.5	0	0	0	0	0	114.6	K109 L110 I111 V164	G107-K109 VanDerWaalsContact C-N 3.35Å; G107-K109 PolarHBondContact O-N 2.98Å; G107-L110 PolarHBondContact O-N 3.31Å; G107-I111 VanDerWaalsContact O-CG1 3.31Å; G107-I111 WeakPolarHBondContact O-CG1 3.35Å; G107-I111 PolarHBondContact O-N 2.88Å; G107-I111 VanDerWaalsContact O-N 3.17Å; G107-V164 PolarHBondContact N-O 3.5Å
108	S	95	Very high	83.7	Confident	28 Å²	28	46.6 Å²	46.6	20%	0.196	25%	0.246	C	C	.	.	H	α-helix	trans	-59.9	-41.1	-168.7	55.3	0	0	0	0	113.5	S112	S108-S112 WeakPolarHBondContact O-CB 3.49Å; S108-S112 PolarHBondContact O-N 2.77Å
109	K	93.3	Very high	86.1	Confident	116 Å²	116	40.1 Å²	40.1	50%	0.504	22%	0.223	S	C	.	.	H	α-helix	trans	-66.3	-43.2	-178	-175.9	55.1	177.7	156.3	0	112.7	G107 S112 D113	G107-K109 VanDerWaalsContact C-N 3.35Å; G107-K109 PolarHBondContact O-N 2.98Å; K109-S112 PolarHBondContact O-N 3.45Å; K109-D113 VanDerWaalsContact CE-OD1 3.29Å; K109-D113 WeakPolarHBondContact CE-OD1 3.38Å; K109-D113 IonicContact NZ-OD1 3.28Å; K109-D113 PolarHBondContact NZ-OD1 3.27Å; K109-D113 IonicContact NZ-OD2 2.72Å; K109-D113 WeakPolarHBondContact O-CB 3.28Å; K109-D113 PolarHBondContact O-N 2.9Å
110	L	93.6	Very high	88.2	Confident	19 Å²	19	36.6 Å²	36.6	10%	0.099	21%	0.208	C	C	.	.	H	α-helix	trans	-66.7	-44.6	-179.3	-176.5	65.6	0	0	0	111.1	L105 G107 D113 A114 I230 F238	L105-L110 HydrophobicContact CB-CD2 3.93Å; L105-L110 HydrophobicContact CB-CG 4.12Å; L105-L110 HydrophobicContact CD1-CG 4.35Å; L105-L110 HydrophobicContact CD2-CD2 3.91Å; L105-L110 HydrophobicContact CD2-CG 4.16Å; L105-L110 HydrophobicContact CG-CD2 4.42Å; L105-L110 HydrophobicContact CG-CG 4.44Å; G107-L110 PolarHBondContact O-N 3.31Å; L110-D113 PolarHBondContact O-N 3.33Å; L110-A114 WeakPolarHBondContact O-CB 3.41Å; L110-A114 PolarHBondContact O-N 3.19Å; L110-I230 HydrophobicContact CD1-CG2 4.09Å; L110-I230 HydrophobicContact CD2-CG2 3.56Å; L110-I230 HydrophobicContact CG-CG2 4.39Å; L110-F238 HydrophobicContact CD1-CD2 4Å; L110-F238 HydrophobicContact CD1-CE2 3.62Å; L110-F238 HydrophobicContact CG-CE2 4.26Å
111	I	95.2	Very high	90.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.2	-45.1	176.2	-63.6	171.9	0	0	0	110.3	L105 G107 A114 L115 L124 V135 V164 A166 F168	L105-I111 HydrophobicContact CB-CG1 3.96Å; G107-I111 VanDerWaalsContact O-CG1 3.31Å; G107-I111 WeakPolarHBondContact O-CG1 3.35Å; G107-I111 PolarHBondContact O-N 2.88Å; G107-I111 VanDerWaalsContact O-N 3.17Å; I111-A114 PolarHBondContact O-N 3.1Å; I111-L115 HydrophobicContact CG2-CD1 3.86Å; I111-L115 HydrophobicContact CG2-CG 4.43Å; I111-L115 VanDerWaalsContact O-CG 3.29Å; I111-L115 WeakPolarHBondContact O-CG 3.43Å; I111-L115 PolarHBondContact O-N 3.17Å; I111-L124 HydrophobicContact CG2-CD1 3.97Å; I111-V135 HydrophobicContact CB-CG1 4.37Å; I111-V135 HydrophobicContact CG2-CG1 3.67Å; I111-V135 HydrophobicContact CG2-CG2 4.46Å; I111-V164 HydrophobicContact CD1-CB 4.34Å; I111-V164 HydrophobicContact CD1-CG1 3.97Å; I111-V164 HydrophobicContact CD1-CG2 3.68Å; I111-A166 HydrophobicContact CD1-CB 3.84Å; I111-A166 HydrophobicContact CG1-CB 4.09Å; I111-A166 HydrophobicContact CG2-CB 4.14Å; I111-F168 HydrophobicContact CG1-CE2 4.41Å; I111-F168 HydrophobicContact CG2-CE2 4.13Å; I111-F168 HydrophobicContact CG2-CZ 3.98Å
112	S	94.4	Very high	91.3	Very high	33 Å²	33	29.4 Å²	29.4	23%	0.231	18%	0.175	C	C	.	.	H	α-helix	trans	-59.9	-48	177.1	-170.3	0	0	0	0	112	S108 K109 A114 L115 A116 V135	S108-S112 WeakPolarHBondContact O-CB 3.49Å; S108-S112 PolarHBondContact O-N 2.77Å; K109-S112 PolarHBondContact O-N 3.45Å; S112-A114 VanDerWaalsContact C-N 3.31Å; S112-A114 PolarHBondContact O-N 2.88Å; S112-L115 PolarHBondContact O-N 3.19Å; S112-A116 WeakPolarHBondContact O-CB 3.46Å; S112-A116 PolarHBondContact O-N 3.25Å; S112-V135 WeakPolarHBondContact CB-O 3.24Å; S112-V135 PolarHBondContact OG-O 2.97Å
113	D	92	Very high	91.9	Very high	16 Å²	16	29.2 Å²	29.2	9%	0.086	17%	0.173	C	C	.	.	H	α-helix	trans	-63.2	-37.8	178.8	-77.8	7	0	0	0	111.2	K109 L110 S235 F238 R239	K109-D113 VanDerWaalsContact CE-OD1 3.29Å; K109-D113 WeakPolarHBondContact CE-OD1 3.38Å; K109-D113 IonicContact NZ-OD1 3.28Å; K109-D113 PolarHBondContact NZ-OD1 3.27Å; K109-D113 IonicContact NZ-OD2 2.72Å; K109-D113 WeakPolarHBondContact O-CB 3.28Å; K109-D113 PolarHBondContact O-N 2.9Å; L110-D113 PolarHBondContact O-N 3.33Å; D113-S235 WeakPolarHBondContact OD2-CB 3.48Å; D113-S235 PolarHBondContact OD2-OG 3.33Å; D113-F238 HydrophobicContact CB-CB 4.4Å; D113-R239 IonicContact OD1-NH2 3.8Å; D113-R239 IonicContact OD2-CZ 3.97Å; D113-R239 IonicContact OD2-NE 2.66Å; D113-R239 PolarHBondContact OD2-NE 2.86Å; D113-R239 IonicContact OD2-NH2 3.36Å; D113-R239 PolarHBondContact OD2-NH2 3.37Å
114	A	91.9	Very high	92.2	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-64.9	-48.6	174.1	0	0	0	0	0	112.3	L105 L110 I111 S112 A116 T117 A119 F168 F238	L105-A114 HydrophobicContact CD1-CB 3.42Å; L105-A114 VanDerWaalsContact CD1-CB 3.42Å; L110-A114 WeakPolarHBondContact O-CB 3.41Å; L110-A114 PolarHBondContact O-N 3.19Å; I111-A114 PolarHBondContact O-N 3.1Å; S112-A114 VanDerWaalsContact C-N 3.31Å; S112-A114 PolarHBondContact O-N 2.88Å; A114-A116 VanDerWaalsContact C-N 3.26Å; A114-A116 PolarHBondContact O-N 3.49Å; A114-T117 WeakPolarHBondContact O-CB 3.33Å; A114-T117 PolarHBondContact O-N 3.4Å; A114-T117 VanDerWaalsContact O-N 3.1Å; A114-T117 PolarHBondContact O-OG1 3.22Å; A114-A119 WeakPolarHBondContact O-CB 3.49Å; A114-F168 HydrophobicContact CB-CD1 4.46Å; A114-F168 HydrophobicContact CB-CE1 3.85Å; A114-F168 HydrophobicContact CB-CE2 4.46Å; A114-F168 HydrophobicContact CB-CZ 3.84Å; A114-F238 HydrophobicContact CB-CD1 3.95Å; A114-F238 HydrophobicContact CB-CD2 4.02Å; A114-F238 HydrophobicContact CB-CE1 3.79Å; A114-F238 HydrophobicContact CB-CE2 3.86Å; A114-F238 HydrophobicContact CB-CG 4.07Å; A114-F238 HydrophobicContact CB-CZ 3.76Å
115	L	92.4	Very high	92.5	Very high	12 Å²	12	27.7 Å²	27.7	6%	0.063	17%	0.165	C	C	.	.	H	α-helix	trans	-60.3	-35.9	179	-68.8	167.6	0	0	0	112	I111 S112 T117 G118 A121 V135 D137 N140 V141 F168	I111-L115 HydrophobicContact CG2-CD1 3.86Å; I111-L115 HydrophobicContact CG2-CG 4.43Å; I111-L115 VanDerWaalsContact O-CG 3.29Å; I111-L115 WeakPolarHBondContact O-CG 3.43Å; I111-L115 PolarHBondContact O-N 3.17Å; S112-L115 PolarHBondContact O-N 3.19Å; L115-T117 PolarHBondContact O-N 2.88Å; L115-G118 PolarHBondContact O-N 3.3Å; L115-A121 HydrophobicContact CD2-CB 4.38Å; L115-V135 HydrophobicContact CD1-CG1 3.76Å; L115-D137 WeakPolarHBondContact CD1-O 3.44Å; L115-N140 HydrophobicContact CD2-CB 3.84Å; L115-V141 HydrophobicContact CD1-CG2 3.82Å; L115-V141 HydrophobicContact CD2-CG2 3.76Å; L115-V141 HydrophobicContact CG-CG2 4.48Å; L115-F168 HydrophobicContact CD2-CE1 3.7Å; L115-F168 HydrophobicContact CD2-CZ 3.94Å; L115-F168 HydrophobicContact CG-CE1 4.01Å; L115-F168 HydrophobicContact CG-CZ 3.89Å
116	A	89.3	Confident	92.6	Very high	64 Å²	64	27.8 Å²	27.8	53%	0.529	17%	0.165	S	C	.	.	H	α-helix	trans	-63.3	-22.4	178.1	0	0	0	0	0	114	S112 A114 G118 K179	S112-A116 WeakPolarHBondContact O-CB 3.46Å; S112-A116 PolarHBondContact O-N 3.25Å; A114-A116 VanDerWaalsContact C-N 3.26Å; A114-A116 PolarHBondContact O-N 3.49Å; A116-G118 VanDerWaalsContact C-N 3.26Å; A116-K179 PolarHBondContact O-NZ 3.41Å; A116-K179 VanDerWaalsContact O-NZ 3.15Å
117	T	86.8	Confident	92.7	Very high	26 Å²	26	26.8 Å²	26.8	16%	0.16	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-14.2	172.5	71	0	0	0	0	113	A114 L115 A119 F238	A114-T117 WeakPolarHBondContact O-CB 3.33Å; A114-T117 PolarHBondContact O-N 3.4Å; A114-T117 VanDerWaalsContact O-N 3.1Å; A114-T117 PolarHBondContact O-OG1 3.22Å; L115-T117 PolarHBondContact O-N 2.88Å; T117-A119 PolarHBondContact OG1-N 3.07Å; T117-F238 HydrophobicContact CG2-CB 3.85Å; T117-F238 HydrophobicContact CG2-CD1 4.42Å; T117-F238 VanDerWaalsContact CG2-O 3.32Å; T117-F238 WeakPolarHBondContact CG2-O 3.35Å
118	G	87.8	Confident	92.7	Very high	38 Å²	38	28.2 Å²	28.2	39%	0.392	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	92.3	3.3	-170.4	0	0	0	0	0	113.8	L115 A116	L115-G118 PolarHBondContact O-N 3.3Å; A116-G118 VanDerWaalsContact C-N 3.26Å
119	A	88.3	Confident	92.5	Very high	8 Å²	8	29.4 Å²	29.4	7%	0.066	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-58.7	143.9	172.6	0	0	0	0	0	110.9	A114 T117 F168	A114-A119 WeakPolarHBondContact O-CB 3.49Å; T117-A119 PolarHBondContact OG1-N 3.07Å; A119-F168 HydrophobicContact CB-CD1 3.98Å; A119-F168 HydrophobicContact CB-CE1 4.21Å
120	K	90.6	Very high	92.5	Very high	120 Å²	120	28.8 Å²	28.8	52%	0.522	18%	0.176	S	C	.	.	P	Polyproline II helix	trans	-102.7	128.8	-177.1	-65.1	-179.1	-178.1	176.3	0	110.5	N140 F168 E169	K120-N140 WeakPolarHBondContact CA-O 3.39Å; K120-F168 WeakPolarHBondContact O-CA 3.24Å; K120-F168 WeakPolarHBondContact O-CD1 3.45Å; K120-E169 PolarHBondContact O-N 3.43Å
121	A	93.3	Very high	92.6	Very high	0 Å²	0	29 Å²	29	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	125.5	170.6	0	0	0	0	0	109.8	L115 S123 N140 V141 L142 A166 L167 F168	L115-A121 HydrophobicContact CD2-CB 4.38Å; A121-S123 VanDerWaalsContact C-N 3.34Å; A121-N140 PolarHBondContact N-O 3.44Å; A121-V141 HydrophobicContact CB-CB 4.41Å; A121-V141 HydrophobicContact CB-CG1 4.17Å; A121-V141 HydrophobicContact CB-CG2 4.13Å; A121-L142 PolarHBondContact O-N 3.45Å; A121-A166 HydrophobicContact CB-CB 4.45Å; A121-L167 CarbonylContact C-O 3.54Å; A121-L167 VanDerWaalsContact CA-O 3.24Å; A121-L167 WeakPolarHBondContact CA-O 3.25Å; A121-F168 HydrophobicContact CB-CD1 4Å; A121-F168 HydrophobicContact CB-CD2 4.27Å; A121-F168 HydrophobicContact CB-CE1 3.84Å; A121-F168 HydrophobicContact CB-CE2 4.11Å; A121-F168 HydrophobicContact CB-CG 4.22Å; A121-F168 HydrophobicContact CB-CZ 3.9Å
122	T	92.5	Very high	92.6	Very high	36 Å²	36	29.2 Å²	29.2	22%	0.221	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	-34.5	174.7	55.3	0	0	0	0	111.7	N143 L167 E169	T122-N143 PolarHBondContact O-N 3.49Å; T122-N143 PolarHBondContact O-ND2 3.47Å; T122-L167 PolarHBondContact N-O 2.95Å; T122-L167 WeakPolarHBondContact OG1-CD2 3.29Å; T122-L167 WeakPolarHBondContact OG1-CG 3.29Å; T122-L167 PolarHBondContact OG1-O 2.89Å; T122-E169 HydrophobicContact CG2-CG 3.93Å
123	S	93.7	Very high	92.6	Very high	14 Å²	14	31.8 Å²	31.8	10%	0.098	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	145.3	-179.8	47.7	0	0	0	0	111.4	A121 F125 N143 A166 L167	A121-S123 VanDerWaalsContact C-N 3.34Å; S123-F125 WeakPolarHBondContact OG-CE2 3.38Å; S123-N143 CarbonylContact C-O 3.57Å; S123-N143 VanDerWaalsContact CA-O 3.27Å; S123-N143 WeakPolarHBondContact CA-O 3.32Å; S123-A166 CarbonylContact O-C 3.47Å; S123-A166 VanDerWaalsContact O-CA 3.25Å; S123-A166 WeakPolarHBondContact O-CA 3.28Å; S123-L167 PolarHBondContact O-N 3.32Å
124	L	95.7	Very high	92.7	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	133.8	172.3	-176.5	151.7	0	0	0	109	I111 F126 L132 V135 L138 V141 N143 I144 Y145 V164 I165 A166	I111-L124 HydrophobicContact CG2-CD1 3.97Å; L124-F126 HydrophobicContact CD2-CB 4.11Å; L124-F126 HydrophobicContact CD2-CD1 4.17Å; L124-L132 HydrophobicContact CD2-CD1 3.47Å; L124-L132 VanDerWaalsContact CD2-CD1 3.47Å; L124-V135 HydrophobicContact CD1-CG1 4.48Å; L124-L138 HydrophobicContact CD1-CD2 4.06Å; L124-V141 HydrophobicContact CB-CG1 3.59Å; L124-V141 HydrophobicContact CD1-CG1 4.49Å; L124-V141 HydrophobicContact CD1-CG2 4.39Å; L124-N143 PolarHBondContact N-O 3.2Å; L124-I144 HydrophobicContact CB-CG1 4.45Å; L124-I144 HydrophobicContact CD2-CG2 4.08Å; L124-I144 CarbonylContact O-C 3.57Å; L124-I144 WeakPolarHBondContact O-CA 3.39Å; L124-Y145 PolarHBondContact O-N 2.76Å; L124-V164 HydrophobicContact CD1-CG2 4.21Å; L124-V164 HydrophobicContact CD2-CG2 3.83Å; L124-V164 HydrophobicContact CG-CG2 3.97Å; L124-I165 CarbonylContact C-O 3.57Å; L124-I165 WeakPolarHBondContact CA-O 3.5Å; L124-A166 HydrophobicContact CB-CB 4.13Å; L124-A166 HydrophobicContact CD1-CB 4.23Å; L124-A166 HydrophobicContact CG-CB 4.15Å
125	F	95.6	Very high	92.9	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.009	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	132	179	-52.2	-100.9	0	0	0	108.2	L69 K75 I76 V79 S123 Y145 V147 M152 I155 V164 I165	L69-F125 HydrophobicContact CD1-CD1 4.13Å; L69-F125 HydrophobicContact CD1-CE1 3.71Å; K75-F125 HydrophobicContact CB-CE1 4.44Å; I76-F125 HydrophobicContact CD1-CD1 3.73Å; I76-F125 HydrophobicContact CD1-CE1 3.72Å; V79-F125 HydrophobicContact CG2-CD2 4.16Å; V79-F125 HydrophobicContact CG2-CE1 4.44Å; V79-F125 HydrophobicContact CG2-CE2 3.28Å; V79-F125 HydrophobicContact CG2-CZ 3.44Å; V79-F125 VanDerWaalsContact CG2-CZ 3.44Å; S123-F125 WeakPolarHBondContact OG-CE2 3.38Å; F125-Y145 VanDerWaalsContact CA-O 3.31Å; F125-Y145 WeakPolarHBondContact CA-O 3.43Å; F125-Y145 HydrophobicContact CD1-CD2 4.12Å; F125-Y145 HydrophobicContact CD1-CG 4.27Å; F125-Y145 AromaticContact CE1-CD2 3.73Å; F125-Y145 HydrophobicContact CE1-CD2 3.73Å; F125-Y145 HydrophobicContact CE1-CG 4.13Å; F125-Y145 HydrophobicContact CZ-CD2 4.07Å; F125-V147 HydrophobicContact CB-CG2 4.43Å; F125-V147 HydrophobicContact CD1-CG1 4.3Å; F125-M152 HydrophobicContact CB-CE 3.65Å; F125-I155 HydrophobicContact CB-CD1 4.36Å; F125-V164 VanDerWaalsContact O-CA 3.28Å; F125-V164 WeakPolarHBondContact O-CA 3.47Å; F125-I165 HydrophobicContact CB-CG2 3.79Å; F125-I165 HydrophobicContact CD2-CG2 4.08Å; F125-I165 HydrophobicContact CG-CG2 4.33Å; F125-I165 PolarHBondContact N-O 3.42Å; F125-I165 PolarHBondContact O-N 2.84Å
126	F	96.6	Very high	92.9	Very high	3 Å²	3	39.3 Å²	39.3	1%	0.013	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	150.8	-177.5	73.1	-78.8	0	0	0	111.5	Y66 L124 S128 L132 I144 Y145 Y146 V147 G163 V164	Y66-F126 AromaticContact CD2-CE1 3.66Å; Y66-F126 HydrophobicContact CD2-CE1 3.66Å; Y66-F126 AromaticContact CD2-CZ 3.44Å; Y66-F126 HydrophobicContact CD2-CZ 3.44Å; Y66-F126 VanDerWaalsContact CD2-CZ 3.44Å; Y66-F126 HydrophobicContact CE2-CE1 4.26Å; Y66-F126 HydrophobicContact CE2-CZ 4.11Å; Y66-F126 AromaticContact CG-CE1 3.89Å; Y66-F126 HydrophobicContact CG-CE1 3.89Å; Y66-F126 HydrophobicContact CG-CZ 4.05Å; L124-F126 HydrophobicContact CD2-CB 4.11Å; L124-F126 HydrophobicContact CD2-CD1 4.17Å; F126-S128 WeakPolarHBondContact CD2-O 3.15Å; F126-L132 HydrophobicContact CB-CB 4.3Å; F126-L132 HydrophobicContact CB-CD1 4.31Å; F126-L132 HydrophobicContact CD1-CD1 4.11Å; F126-L132 HydrophobicContact CD1-CD2 4.06Å; F126-L132 HydrophobicContact CD2-CB 3.81Å; F126-L132 HydrophobicContact CD2-CD2 4.11Å; F126-L132 HydrophobicContact CD2-CG 4.43Å; F126-L132 HydrophobicContact CE1-CD2 3.95Å; F126-L132 HydrophobicContact CE2-CB 4.34Å; F126-L132 HydrophobicContact CE2-CD2 3.97Å; F126-L132 HydrophobicContact CG-CB 4Å; F126-L132 HydrophobicContact CG-CD1 4.11Å; F126-L132 HydrophobicContact CG-CD2 4.17Å; F126-L132 HydrophobicContact CG-CG 4.33Å; F126-L132 HydrophobicContact CZ-CD2 3.92Å; F126-I144 HydrophobicContact CD1-CG2 3.79Å; F126-I144 HydrophobicContact CE1-CG2 3.66Å; F126-Y145 WeakPolarHBondContact CD1-O 3.32Å; F126-Y145 WeakPolarHBondContact CE1-O 3.46Å; F126-Y145 PolarHBondContact N-O 3.21Å; F126-Y146 HydrophobicContact CD2-CD2 4.23Å; F126-Y146 AromaticContact CE2-CD2 3.73Å; F126-Y146 HydrophobicContact CE2-CD2 3.73Å; F126-Y146 AromaticContact CZ-CD2 3.97Å; F126-Y146 HydrophobicContact CZ-CD2 3.97Å; F126-Y146 HydrophobicContact CZ-CG 4.38Å; F126-V147 PolarHBondContact O-N 2.93Å; F126-G163 CarbonylContact C-O 3.55Å; F126-G163 VanDerWaalsContact CA-O 3.29Å; F126-G163 WeakPolarHBondContact CA-O 3.22Å; F126-V164 HydrophobicContact CB-CB 4.48Å; F126-V164 HydrophobicContact CB-CG2 4.24Å
127	S	95.5	Very high	93.1	Very high	16 Å²	16	41.5 Å²	41.5	11%	0.112	24%	0.235	C	C	.	.	S	Bend	trans	-106.9	-12.1	-177.8	65.9	0	0	0	0	115.7	Y146 V147 G163	S127-Y146 WeakPolarHBondContact O-CE2 3.38Å; S127-V147 VanDerWaalsContact CA-O 3.22Å; S127-V147 WeakPolarHBondContact CA-O 3.43Å; S127-V147 WeakPolarHBondContact CB-O 3.25Å; S127-G163 PolarHBondContact N-O 3.38Å; S127-G163 VanDerWaalsContact OG-CA 3.26Å; S127-G163 WeakPolarHBondContact OG-CA 3.47Å; S127-G163 PolarHBondContact OG-O 2.89Å
128	S	94.2	Very high	93.5	Very high	42 Å²	42	41.9 Å²	41.9	29%	0.294	24%	0.236	S	C	.	.			trans	-155.5	155	173.5	70.4	0	0	0	0	111.7	F126 D130 V131 L132	F126-S128 WeakPolarHBondContact CD2-O 3.15Å; S128-D130 VanDerWaalsContact C-N 3.3Å; S128-D130 PolarHBondContact O-N 3.32Å; S128-V131 PolarHBondContact O-N 2.95Å; S128-V131 WeakPolarHBondContact OG-CG2 3.17Å; S128-L132 PolarHBondContact O-N 3.25Å
129	Q	90.7	Very high	93.7	Very high	53 Å²	53	44 Å²	44	25%	0.248	25%	0.245	C	C	.	.	H	α-helix	trans	-59.3	-41.5	-179.7	-176.1	59.9	11	0	0	112.5	I29 V131 L132 Q133	I29-Q129 VanDerWaalsContact CD1-OE1 3.26Å; I29-Q129 VanDerWaalsContact CG1-NE2 3.29Å; Q129-V131 PolarHBondContact O-N 2.98Å; Q129-L132 PolarHBondContact O-N 2.62Å; Q129-Q133 HydrophobicContact CG-CG 4.35Å; Q129-Q133 WeakPolarHBondContact O-CG 3.47Å; Q129-Q133 PolarHBondContact O-N 2.9Å
130	D	93.4	Very high	93.8	Very high	103 Å²	103	46.1 Å²	46.1	55%	0.551	26%	0.255	S	S	*	.	H	α-helix	trans	-60.4	-35.4	-179.3	-58.8	-25.9	0	0	0	112.5	S128 K134	S128-D130 VanDerWaalsContact C-N 3.3Å; S128-D130 PolarHBondContact O-N 3.32Å; D130-K134 WeakPolarHBondContact O-CD 3.26Å; D130-K134 VanDerWaalsContact O-CG 3.28Å; D130-K134 WeakPolarHBondContact O-CG 3.5Å; D130-K134 PolarHBondContact O-N 3.2Å
131	V	93.9	Very high	94	Very high	22 Å²	22	41 Å²	41	13%	0.133	23%	0.234	C	C	.	.	H	α-helix	trans	-75.1	-40.6	179.1	-179.7	0	0	0	0	110.5	S128 Q129 K134 P162 V164	S128-V131 PolarHBondContact O-N 2.95Å; S128-V131 WeakPolarHBondContact OG-CG2 3.17Å; Q129-V131 PolarHBondContact O-N 2.98Å; V131-K134 WeakPolarHBondContact O-CB 3.45Å; V131-K134 PolarHBondContact O-N 2.83Å; V131-P162 WeakPolarHBondContact CG1-O 3.44Å; V131-V164 HydrophobicContact CG1-CB 3.54Å; V131-V164 HydrophobicContact CG1-CG1 3.38Å
132	L	95.4	Very high	94	Very high	5 Å²	5	46.7 Å²	46.7	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-44	176.9	-174.6	66.3	0	0	0	111.4	Y66 L124 F126 S128 Q129 K134 V135 L138 I144	Y66-L132 HydrophobicContact CD2-CD2 4.14Å; Y66-L132 HydrophobicContact CE2-CD2 3.35Å; L124-L132 HydrophobicContact CD2-CD1 3.47Å; L124-L132 VanDerWaalsContact CD2-CD1 3.47Å; F126-L132 HydrophobicContact CB-CB 4.3Å; F126-L132 HydrophobicContact CB-CD1 4.31Å; F126-L132 HydrophobicContact CD1-CD1 4.11Å; F126-L132 HydrophobicContact CD1-CD2 4.06Å; F126-L132 HydrophobicContact CD2-CB 3.81Å; F126-L132 HydrophobicContact CD2-CD2 4.11Å; F126-L132 HydrophobicContact CD2-CG 4.43Å; F126-L132 HydrophobicContact CE1-CD2 3.95Å; F126-L132 HydrophobicContact CE2-CB 4.34Å; F126-L132 HydrophobicContact CE2-CD2 3.97Å; F126-L132 HydrophobicContact CG-CB 4Å; F126-L132 HydrophobicContact CG-CD1 4.11Å; F126-L132 HydrophobicContact CG-CD2 4.17Å; F126-L132 HydrophobicContact CG-CG 4.33Å; F126-L132 HydrophobicContact CZ-CD2 3.92Å; S128-L132 PolarHBondContact O-N 3.25Å; Q129-L132 PolarHBondContact O-N 2.62Å; L132-K134 PolarHBondContact O-N 3Å; L132-V135 VanDerWaalsContact O-CB 3.3Å; L132-V135 WeakPolarHBondContact O-CB 3.5Å; L132-V135 PolarHBondContact O-N 3.41Å; L132-L138 HydrophobicContact CD1-CD1 3.82Å; L132-L138 HydrophobicContact CD1-CD2 4.27Å; L132-L138 HydrophobicContact CD2-CD1 4.36Å; L132-L138 HydrophobicContact CG-CD1 4.06Å; L132-I144 HydrophobicContact CD1-CG2 4.35Å; L132-I144 HydrophobicContact CD2-CG2 4.46Å
133	Q	94.2	Very high	94.1	Very high	87 Å²	87	48.5 Å²	48.5	41%	0.407	27%	0.272	S	S	.	.	H	α-helix	trans	-59.6	-32.8	177.2	-75.3	178.8	-13.8	0	0	112.7	Q129 V135 G136	Q129-Q133 HydrophobicContact CG-CG 4.35Å; Q129-Q133 WeakPolarHBondContact O-CG 3.47Å; Q129-Q133 PolarHBondContact O-N 2.9Å; Q133-V135 PolarHBondContact O-N 3.2Å; Q133-G136 PolarHBondContact O-N 3.22Å
134	K	95.6	Very high	94.2	Very high	139 Å²	139	49 Å²	49	60%	0.604	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-16.9	176	-71.8	168.7	-174	175.5	0	113.8	D130 V131 L132	D130-K134 WeakPolarHBondContact O-CD 3.26Å; D130-K134 VanDerWaalsContact O-CG 3.28Å; D130-K134 WeakPolarHBondContact O-CG 3.5Å; D130-K134 PolarHBondContact O-N 3.2Å; V131-K134 WeakPolarHBondContact O-CB 3.45Å; V131-K134 PolarHBondContact O-N 2.83Å; L132-K134 PolarHBondContact O-N 3Å
135	V	95.5	Very high	94.1	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-36.9	173.1	-178.9	0	0	0	0	110.2	I111 S112 L115 L124 L132 Q133 L138 V164	I111-V135 HydrophobicContact CB-CG1 4.37Å; I111-V135 HydrophobicContact CG2-CG1 3.67Å; I111-V135 HydrophobicContact CG2-CG2 4.46Å; S112-V135 WeakPolarHBondContact CB-O 3.24Å; S112-V135 PolarHBondContact OG-O 2.97Å; L115-V135 HydrophobicContact CD1-CG1 3.76Å; L124-V135 HydrophobicContact CD1-CG1 4.48Å; L132-V135 VanDerWaalsContact O-CB 3.3Å; L132-V135 WeakPolarHBondContact O-CB 3.5Å; L132-V135 PolarHBondContact O-N 3.41Å; Q133-V135 PolarHBondContact O-N 3.2Å; V135-L138 HydrophobicContact CB-CD2 4.1Å; V135-L138 HydrophobicContact CG1-CD2 3.66Å; V135-V164 HydrophobicContact CG2-CG2 4.22Å
136	G	92.8	Very high	94.1	Very high	48 Å²	48	52.6 Å²	52.6	50%	0.495	29%	0.287	S	S	.	.			trans	85.6	-120.8	179.9	0	0	0	0	0	112	Q133 L138	Q133-G136 PolarHBondContact O-N 3.22Å; G136-L138 PolarHBondContact O-N 3.38Å
137	D	92.8	Very high	94	Very high	110 Å²	110	52.4 Å²	52.4	59%	0.588	29%	0.287	S	S	*	.			trans	-68.1	122.3	-176.3	-173.7	5.8	0	0	0	111.8	L115 S139	L115-D137 WeakPolarHBondContact CD1-O 3.44Å; D137-S139 VanDerWaalsContact OD1-CB 3.28Å; D137-S139 WeakPolarHBondContact OD1-CB 3.49Å; D137-S139 PolarHBondContact OD1-N 2.99Å; D137-S139 PolarHBondContact OD1-OG 3.28Å
138	L	94.7	Very high	93.8	Very high	33 Å²	33	56.8 Å²	56.8	17%	0.173	30%	0.304	C	S	.	.			trans	-109	11	-179.3	-59.8	172.8	0	0	0	112.4	L124 L132 V135 G136 N140 V141 I144	L124-L138 HydrophobicContact CD1-CD2 4.06Å; L132-L138 HydrophobicContact CD1-CD1 3.82Å; L132-L138 HydrophobicContact CD1-CD2 4.27Å; L132-L138 HydrophobicContact CD2-CD1 4.36Å; L132-L138 HydrophobicContact CG-CD1 4.06Å; V135-L138 HydrophobicContact CB-CD2 4.1Å; V135-L138 HydrophobicContact CG1-CD2 3.66Å; G136-L138 PolarHBondContact O-N 3.38Å; L138-N140 PolarHBondContact O-N 3.4Å; L138-N140 VanDerWaalsContact O-N 3.1Å; L138-V141 HydrophobicContact CB-CG2 4.25Å; L138-V141 HydrophobicContact CD2-CG2 3.98Å; L138-V141 WeakPolarHBondContact O-CB 3.37Å; L138-V141 PolarHBondContact O-N 2.89Å; L138-I144 HydrophobicContact CB-CD1 4.13Å; L138-I144 HydrophobicContact CD1-CD1 3.88Å; L138-I144 HydrophobicContact CG-CD1 4.48Å
139	S	92.3	Very high	93.6	Very high	83 Å²	83	60.4 Å²	60.4	58%	0.58	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-29.2	-175.7	73.8	0	0	0	0	113.9	D137	D137-S139 VanDerWaalsContact OD1-CB 3.28Å; D137-S139 WeakPolarHBondContact OD1-CB 3.49Å; D137-S139 PolarHBondContact OD1-N 2.99Å; D137-S139 PolarHBondContact OD1-OG 3.28Å
140	N	91.9	Very high	93.6	Very high	52 Å²	52	65.2 Å²	65.2	28%	0.278	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	16.1	-179.6	-67.9	-24.4	0	0	0	113.3	L115 K120 A121 L138	L115-N140 HydrophobicContact CD2-CB 3.84Å; K120-N140 WeakPolarHBondContact CA-O 3.39Å; A121-N140 PolarHBondContact N-O 3.44Å; L138-N140 PolarHBondContact O-N 3.4Å; L138-N140 VanDerWaalsContact O-N 3.1Å
141	V	94.5	Very high	93.5	Very high	14 Å²	14	60.7 Å²	60.7	9%	0.085	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-105.9	115.8	175.8	-172.9	0	0	0	0	109.2	L115 A121 L124 L138 I144	L115-V141 HydrophobicContact CD1-CG2 3.82Å; L115-V141 HydrophobicContact CD2-CG2 3.76Å; L115-V141 HydrophobicContact CG-CG2 4.48Å; A121-V141 HydrophobicContact CB-CB 4.41Å; A121-V141 HydrophobicContact CB-CG1 4.17Å; A121-V141 HydrophobicContact CB-CG2 4.13Å; L124-V141 HydrophobicContact CB-CG1 3.59Å; L124-V141 HydrophobicContact CD1-CG1 4.49Å; L124-V141 HydrophobicContact CD1-CG2 4.39Å; L138-V141 HydrophobicContact CB-CG2 4.25Å; L138-V141 HydrophobicContact CD2-CG2 3.98Å; L138-V141 WeakPolarHBondContact O-CB 3.37Å; L138-V141 PolarHBondContact O-N 2.89Å; V141-I144 HydrophobicContact CB-CD1 4.44Å; V141-I144 HydrophobicContact CB-CG1 4.23Å; V141-I144 HydrophobicContact CG1-CD1 4.32Å; V141-I144 HydrophobicContact CG1-CG1 3.59Å
142	L	93.2	Very high	93.3	Very high	118 Å²	118	59.8 Å²	59.8	62%	0.618	31%	0.308	S	S	*	.	S	Bend	trans	-71.5	-41.1	-175.3	-66.6	-179.9	0	0	0	113	A121	A121-L142 PolarHBondContact O-N 3.45Å
143	N	93.5	Very high	93	Very high	75 Å²	75	61.8 Å²	61.8	40%	0.401	33%	0.331	S	S	.	.			trans	-137.4	135.5	-178	-57.7	-80.9	0	0	0	110.7	T122 S123 L124 Y145	T122-N143 PolarHBondContact O-N 3.49Å; T122-N143 PolarHBondContact O-ND2 3.47Å; S123-N143 CarbonylContact C-O 3.57Å; S123-N143 VanDerWaalsContact CA-O 3.27Å; S123-N143 WeakPolarHBondContact CA-O 3.32Å; L124-N143 PolarHBondContact N-O 3.2Å; N143-Y145 HydrophobicContact CB-CD2 4.33Å; N143-Y145 HydrophobicContact CB-CE2 3.43Å; N143-Y145 VanDerWaalsContact CB-CE2 3.43Å
144	I	95.8	Very high	92.6	Very high	25 Å²	25	64.2 Å²	64.2	13%	0.128	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	128.6	-179.8	-59.6	159	0	0	0	108.6	Y66 L124 F126 L132 L138 V141	Y66-I144 HydrophobicContact CD1-CB 3.59Å; Y66-I144 HydrophobicContact CD1-CG2 3.49Å; Y66-I144 VanDerWaalsContact CD1-CG2 3.49Å; Y66-I144 HydrophobicContact CD2-CG2 4.34Å; Y66-I144 HydrophobicContact CE1-CB 3.59Å; Y66-I144 HydrophobicContact CE1-CD1 3.67Å; Y66-I144 HydrophobicContact CE1-CG1 4.25Å; Y66-I144 HydrophobicContact CE1-CG2 3.51Å; Y66-I144 HydrophobicContact CE2-CG2 4.29Å; Y66-I144 HydrophobicContact CG-CB 4.46Å; Y66-I144 HydrophobicContact CG-CG2 3.93Å; L124-I144 HydrophobicContact CB-CG1 4.45Å; L124-I144 HydrophobicContact CD2-CG2 4.08Å; L124-I144 CarbonylContact O-C 3.57Å; L124-I144 WeakPolarHBondContact O-CA 3.39Å; F126-I144 HydrophobicContact CD1-CG2 3.79Å; F126-I144 HydrophobicContact CE1-CG2 3.66Å; L132-I144 HydrophobicContact CD1-CG2 4.35Å; L132-I144 HydrophobicContact CD2-CG2 4.46Å; L138-I144 HydrophobicContact CB-CD1 4.13Å; L138-I144 HydrophobicContact CD1-CD1 3.88Å; L138-I144 HydrophobicContact CG-CD1 4.48Å; V141-I144 HydrophobicContact CB-CD1 4.44Å; V141-I144 HydrophobicContact CB-CG1 4.23Å; V141-I144 HydrophobicContact CG1-CD1 4.32Å; V141-I144 HydrophobicContact CG1-CG1 3.59Å
145	Y	95.1	Very high	92.2	Very high	27 Å²	27	57.8 Å²	57.8	11%	0.106	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	132.8	-173.4	-62.4	-75.1	0	0	0	110.9	P67 L69 K75 L124 F125 F126 N143	P67-Y145 HydrophobicContact CB-CD1 4.28Å; P67-Y145 HydrophobicContact CG-CD1 3.55Å; P67-Y145 HydrophobicContact CG-CE1 3.73Å; L69-Y145 HydrophobicContact CD1-CD1 3.57Å; L69-Y145 HydrophobicContact CD1-CD2 4.21Å; L69-Y145 HydrophobicContact CD1-CE1 4.26Å; L69-Y145 HydrophobicContact CD1-CG 3.57Å; L69-Y145 HydrophobicContact CD2-CD1 3.68Å; L69-Y145 HydrophobicContact CD2-CE1 4.11Å; L69-Y145 HydrophobicContact CD2-CG 4.5Å; L69-Y145 HydrophobicContact CG-CD1 3.67Å; L69-Y145 HydrophobicContact CG-CG 4.03Å; K75-Y145 HydrophobicContact CD-CE1 3.84Å; K75-Y145 HydrophobicContact CD-CE2 3.9Å; K75-Y145 VanDerWaalsContact CD-CZ 3.44Å; K75-Y145 WeakPolarHBondContact CD-OH 3.46Å; K75-Y145 WeakPolarHBondContact CE-OH 3.31Å; L124-Y145 PolarHBondContact O-N 2.76Å; F125-Y145 VanDerWaalsContact CA-O 3.31Å; F125-Y145 WeakPolarHBondContact CA-O 3.43Å; F125-Y145 HydrophobicContact CD1-CD2 4.12Å; F125-Y145 HydrophobicContact CD1-CG 4.27Å; F125-Y145 AromaticContact CE1-CD2 3.73Å; F125-Y145 HydrophobicContact CE1-CD2 3.73Å; F125-Y145 HydrophobicContact CE1-CG 4.13Å; F125-Y145 HydrophobicContact CZ-CD2 4.07Å; F126-Y145 WeakPolarHBondContact CD1-O 3.32Å; F126-Y145 WeakPolarHBondContact CE1-O 3.46Å; F126-Y145 PolarHBondContact N-O 3.21Å; N143-Y145 HydrophobicContact CB-CD2 4.33Å; N143-Y145 HydrophobicContact CB-CE2 3.43Å; N143-Y145 VanDerWaalsContact CB-CE2 3.43Å
146	Y	95.2	Very high	91.9	Very high	49 Å²	49	58.5 Å²	58.5	19%	0.192	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	137.3	167.8	175.5	-102	0	0	0	109.4	V31 P67 E68 L69 F126 S127	V31-Y146 HydrophobicContact CB-CD1 4.28Å; V31-Y146 HydrophobicContact CG1-CD1 3.39Å; V31-Y146 HydrophobicContact CG1-CE1 3.88Å; V31-Y146 HydrophobicContact CG1-CG 4Å; V31-Y146 HydrophobicContact CG2-CD1 3.85Å; V31-Y146 HydrophobicContact CG2-CD2 4.01Å; V31-Y146 HydrophobicContact CG2-CE1 4.17Å; V31-Y146 HydrophobicContact CG2-CE2 4.3Å; V31-Y146 HydrophobicContact CG2-CG 3.76Å; P67-Y146 PolarHBondContact O-N 2.88Å; E68-Y146 CarbonylContact C-O 3.53Å; E68-Y146 VanDerWaalsContact CA-O 3.32Å; E68-Y146 WeakPolarHBondContact CA-O 3.44Å; E68-Y146 HydrophobicContact CB-CD1 4Å; E68-Y146 HydrophobicContact CG-CD1 3.76Å; E68-Y146 HydrophobicContact CG-CE1 4.23Å; L69-Y146 PolarHBondContact N-O 2.96Å; F126-Y146 HydrophobicContact CD2-CD2 4.23Å; F126-Y146 AromaticContact CE2-CD2 3.73Å; F126-Y146 HydrophobicContact CE2-CD2 3.73Å; F126-Y146 AromaticContact CZ-CD2 3.97Å; F126-Y146 HydrophobicContact CZ-CD2 3.97Å; F126-Y146 HydrophobicContact CZ-CG 4.38Å; S127-Y146 WeakPolarHBondContact O-CE2 3.38Å
147	V	93.8	Very high	91.5	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.307	C	S	.	.			trans	-140.1	149.8	168.8	-58.5	0	0	0	0	110.9	L69 I76 F125 F126 S127 V151 M152	L69-V147 HydrophobicContact CB-CG1 3.92Å; I76-V147 HydrophobicContact CD1-CG1 3.9Å; F125-V147 HydrophobicContact CB-CG2 4.43Å; F125-V147 HydrophobicContact CD1-CG1 4.3Å; F126-V147 PolarHBondContact O-N 2.93Å; S127-V147 VanDerWaalsContact CA-O 3.22Å; S127-V147 WeakPolarHBondContact CA-O 3.43Å; S127-V147 WeakPolarHBondContact CB-O 3.25Å; V147-V151 HydrophobicContact CB-CB 4.02Å; V147-V151 HydrophobicContact CB-CG1 4.15Å; V147-V151 HydrophobicContact CG1-CG1 4.41Å; V147-V151 HydrophobicContact CG2-CB 4.24Å; V147-V151 HydrophobicContact CG2-CG1 4.38Å; V147-M152 HydrophobicContact CG2-CE 3.02Å; V147-M152 HydrophobicContact CG2-CG 4.27Å
148	K	92.1	Very high	91.2	Very high	108 Å²	108	55.5 Å²	55.5	47%	0.47	29%	0.29	S	S	.	.			trans	-63.2	151.4	176.9	-61.4	-178.5	-172.6	176	0	110.8	E68 Q150 V151 M152	E68-K148 WeakPolarHBondContact OE1-CE 3.29Å; E68-K148 IonicContact OE1-NZ 3.86Å; K148-Q150 PolarHBondContact O-N 2.67Å; K148-Q150 VanDerWaalsContact O-N 3.1Å; K148-V151 HydrophobicContact CB-CG2 4.4Å; K148-V151 WeakPolarHBondContact O-CA 3.44Å; K148-V151 WeakPolarHBondContact O-CB 3.14Å; K148-V151 PolarHBondContact O-N 3.46Å; K148-M152 PolarHBondContact O-N 2.91Å
149	H	90.4	Very high	90.9	Very high	117 Å²	117	63 Å²	63	54%	0.542	32%	0.324	S	S	.	.	H	α-helix	trans	-55.1	-31.7	178.8	-174.5	71.3	0	0	0	113.5	V151 M152 G153	H149-V151 VanDerWaalsContact C-N 3.3Å; H149-V151 PolarHBondContact O-N 3.31Å; H149-M152 WeakPolarHBondContact O-CB 3.4Å; H149-M152 PolarHBondContact O-N 3.41Å; H149-G153 PolarHBondContact O-N 3.14Å
150	Q	89.8	Confident	90.8	Very high	155 Å²	155	64 Å²	64	72%	0.724	33%	0.331	S	S	*	.	H	α-helix	trans	-62.8	-35	174.6	-67.5	173.9	-14.1	0	0	112.8	K148 G153	K148-Q150 PolarHBondContact O-N 2.67Å; K148-Q150 VanDerWaalsContact O-N 3.1Å; Q150-G153 PolarHBondContact O-N 3.17Å
151	V	90.7	Very high	90.8	Very high	8 Å²	8	62.7 Å²	62.7	5%	0.048	33%	0.325	C	S	.	.	H	α-helix	trans	-71.7	-35.3	176.6	-174.3	0	0	0	0	110.6	E71 I76 V147 K148 H149 G153 R154 I155	E71-V151 HydrophobicContact CB-CG2 4.09Å; I76-V151 HydrophobicContact CD1-CG1 4.14Å; I76-V151 HydrophobicContact CG1-CG1 4.38Å; I76-V151 HydrophobicContact CG2-CG1 4.16Å; V147-V151 HydrophobicContact CB-CB 4.02Å; V147-V151 HydrophobicContact CB-CG1 4.15Å; V147-V151 HydrophobicContact CG1-CG1 4.41Å; V147-V151 HydrophobicContact CG2-CB 4.24Å; V147-V151 HydrophobicContact CG2-CG1 4.38Å; K148-V151 HydrophobicContact CB-CG2 4.4Å; K148-V151 WeakPolarHBondContact O-CA 3.44Å; K148-V151 WeakPolarHBondContact O-CB 3.14Å; K148-V151 PolarHBondContact O-N 3.46Å; H149-V151 VanDerWaalsContact C-N 3.3Å; H149-V151 PolarHBondContact O-N 3.31Å; V151-G153 PolarHBondContact O-N 3.28Å; V151-R154 PolarHBondContact O-N 2.95Å; V151-I155 PolarHBondContact O-N 3.08Å
152	M	91.3	Very high	90.8	Very high	2 Å²	2	64.4 Å²	64.4	1%	0.01	34%	0.337	C	S	.	.	H	α-helix	trans	-54.2	-42.4	173.6	-78.4	-71.3	125.9	0	0	111.8	F125 V147 K148 H149 R154 I155 S156 P161 I165	F125-M152 HydrophobicContact CB-CE 3.65Å; V147-M152 HydrophobicContact CG2-CE 3.02Å; V147-M152 HydrophobicContact CG2-CG 4.27Å; K148-M152 PolarHBondContact O-N 2.91Å; H149-M152 WeakPolarHBondContact O-CB 3.4Å; H149-M152 PolarHBondContact O-N 3.41Å; M152-R154 PolarHBondContact O-N 3.18Å; M152-I155 HydrophobicContact CE-CD1 3.52Å; M152-I155 HydrophobicContact CE-CG1 4.44Å; M152-I155 WeakPolarHBondContact O-CG1 3.31Å; M152-I155 PolarHBondContact O-N 3.29Å; M152-I155 HydrophobicContact SD-CD1 4.1Å; M152-I155 HydrophobicContact SD-CG1 4.45Å; M152-S156 VanDerWaalsContact O-CB 3.25Å; M152-S156 WeakPolarHBondContact O-CB 3.34Å; M152-S156 PolarHBondContact O-N 3.06Å; M152-P161 HydrophobicContact CB-CB 4.07Å; M152-I165 HydrophobicContact CE-CG2 4.02Å; M152-I165 HydrophobicContact SD-CG2 4.2Å
153	G	87.1	Confident	90.8	Very high	48 Å²	48	58.9 Å²	58.9	50%	0.495	31%	0.309	S	S	.	.	H	α-helix	trans	-62.5	-21.1	177.7	0	0	0	0	0	114.8	H149 Q150 V151	H149-G153 PolarHBondContact O-N 3.14Å; Q150-G153 PolarHBondContact O-N 3.17Å; V151-G153 PolarHBondContact O-N 3.28Å
154	R	86.3	Confident	91	Very high	137 Å²	137	55.4 Å²	55.4	52%	0.517	29%	0.29	S	S	.	.	H	α-helix	trans	-86.3	-27	176.6	-65	-169.8	-178.7	175.6	8.6	113.4	E71 V151 M152	E71-R154 VanDerWaalsContact CD-CZ 3.44Å; E71-R154 IonicContact OE1-CZ 3.39Å; E71-R154 IonicContact OE1-NH1 2.95Å; E71-R154 PolarHBondContact OE1-NH1 3.09Å; E71-R154 IonicContact OE1-NH2 3.95Å; E71-R154 PolarHBondContact OE1-NH2 3.37Å; E71-R154 IonicContact OE2-CZ 3.21Å; E71-R154 IonicContact OE2-NH1 3.32Å; E71-R154 PolarHBondContact OE2-NH1 3.01Å; E71-R154 IonicContact OE2-NH2 2.98Å; E71-R154 PolarHBondContact OE2-NH2 3.35Å; V151-R154 PolarHBondContact O-N 2.95Å; M152-R154 PolarHBondContact O-N 3.18Å
155	I	87.5	Confident	90.9	Very high	4 Å²	4	54.3 Å²	54.3	2%	0.021	28%	0.284	C	S	.	.	H	α-helix	trans	-100.4	-25	-175.4	65.3	-177.6	0	0	0	113.8	I76 V79 I80 F125 V151 M152 I165	I76-I155 HydrophobicContact CG2-CG2 3.59Å; V79-I155 HydrophobicContact CG1-CB 4.35Å; I80-I155 HydrophobicContact CD1-CG2 4.13Å; I80-I155 HydrophobicContact CG1-CB 4.49Å; I80-I155 HydrophobicContact CG1-CG2 3.88Å; F125-I155 HydrophobicContact CB-CD1 4.36Å; V151-I155 PolarHBondContact O-N 3.08Å; M152-I155 HydrophobicContact CE-CD1 3.52Å; M152-I155 HydrophobicContact CE-CG1 4.44Å; M152-I155 WeakPolarHBondContact O-CG1 3.31Å; M152-I155 PolarHBondContact O-N 3.29Å; M152-I155 HydrophobicContact SD-CD1 4.1Å; M152-I155 HydrophobicContact SD-CG1 4.45Å; I155-I165 HydrophobicContact CD1-CG2 3.51Å; I155-I165 HydrophobicContact CG1-CD1 4.39Å; I155-I165 HydrophobicContact CG1-CG2 4.18Å
156	S	89.1	Confident	90.9	Very high	15 Å²	15	53.1 Å²	53.1	11%	0.105	28%	0.28	C	S	.	.			trans	-78.1	141.3	177.7	152.2	0	0	0	0	111.3	E106 M152 L158	E106-S156 WeakPolarHBondContact OE1-CA 3.4Å; E106-S156 VanDerWaalsContact OE2-CB 3.3Å; E106-S156 WeakPolarHBondContact OE2-CB 3.24Å; E106-S156 PolarHBondContact OE2-OG 3.04Å; M152-S156 VanDerWaalsContact O-CB 3.25Å; M152-S156 WeakPolarHBondContact O-CB 3.34Å; M152-S156 PolarHBondContact O-N 3.06Å; S156-L158 VanDerWaalsContact C-N 3.29Å; S156-L158 WeakPolarHBondContact OG-CA 3.32Å; S156-L158 WeakPolarHBondContact OG-CB 3.49Å; S156-L158 PolarHBondContact OG-N 3.24Å; S156-L158 PolarHBondContact OG-O 2.92Å
157	S	84.7	Confident	90.8	Very high	53 Å²	53	51.7 Å²	51.7	37%	0.371	28%	0.275	S	S	.	.	S	Bend	trans	-85.5	-3.8	169.1	76	0	0	0	0	113.5	E106 E227	E106-S157 PolarHBondContact OE1-N 2.95Å; S157-E227 WeakPolarHBondContact CB-OE2 3.41Å; S157-E227 PolarHBondContact OG-OE2 3.25Å
158	L	87.3	Confident	90.6	Very high	43 Å²	43	51.7 Å²	51.7	23%	0.225	28%	0.276	C	S	.	.	S	Bend	trans	-87.4	143.3	179.2	-57.2	175.7	0	0	0	112.3	E106 S156 S160 P162 R231	E106-L158 HydrophobicContact CB-CD1 4.18Å; E106-L158 WeakPolarHBondContact OE2-CD1 3.32Å; E106-L158 WeakPolarHBondContact OE2-CG 3.44Å; S156-L158 VanDerWaalsContact C-N 3.29Å; S156-L158 WeakPolarHBondContact OG-CA 3.32Å; S156-L158 WeakPolarHBondContact OG-CB 3.49Å; S156-L158 PolarHBondContact OG-N 3.24Å; S156-L158 PolarHBondContact OG-O 2.92Å; L158-S160 PolarHBondContact O-N 3.21Å; L158-P162 HydrophobicContact CD1-CG 4.33Å; L158-R231 VanDerWaalsContact CD2-NH1 3.33Å; L158-R231 VanDerWaalsContact CD2-NH2 3.32Å
159	Q	87.6	Confident	90.3	Very high	189 Å²	189	50.5 Å²	50.5	88%	0.883	27%	0.271	S	S	*	.	S	Bend	trans	-61.5	-34	172.1	-66.6	-64.2	-29	0	0	112.3
160	S	90.6	Very high	89.8	Confident	106 Å²	106	47 Å²	47	74%	0.741	26%	0.257	S	S	*	.	S	Bend	trans	-123.2	90.3	175.8	-59.1	0	0	0	0	109.2	L158	L158-S160 PolarHBondContact O-N 3.21Å
161	P	91.9	Very high	88.9	Confident	23 Å²	23	40.3 Å²	40.3	15%	0.149	23%	0.227	C	C	.	.			trans	-59.7	134.5	-177.5	-23	31.5	0	0	0	111.7	M152 G163	M152-P161 HydrophobicContact CB-CB 4.07Å; P161-G163 PolarHBondContact O-N 3.21Å; P161-G163 VanDerWaalsContact O-N 3.08Å
162	P	93	Very high	87.8	Confident	51 Å²	51	44.8 Å²	44.8	33%	0.331	25%	0.247	S	C	.	.			trans	-73.6	-0.8	-177.6	29.8	-36	0	0	0	113.4	E106 V131 L158 V164	E106-P162 HydrophobicContact CB-CG 4.06Å; V131-P162 WeakPolarHBondContact CG1-O 3.44Å; L158-P162 HydrophobicContact CD1-CG 4.33Å; P162-V164 VanDerWaalsContact C-N 3.32Å
163	G	95.1	Very high	86.5	Confident	2 Å²	2	49 Å²	49	2%	0.021	27%	0.266	C	S	.	.	S	Bend	trans	82.2	4.8	179	0	0	0	0	0	114.7	F126 S127 P161	F126-G163 CarbonylContact C-O 3.55Å; F126-G163 VanDerWaalsContact CA-O 3.29Å; F126-G163 WeakPolarHBondContact CA-O 3.22Å; S127-G163 PolarHBondContact N-O 3.38Å; S127-G163 VanDerWaalsContact OG-CA 3.26Å; S127-G163 WeakPolarHBondContact OG-CA 3.47Å; S127-G163 PolarHBondContact OG-O 2.89Å; P161-G163 PolarHBondContact O-N 3.21Å; P161-G163 VanDerWaalsContact O-N 3.08Å
164	V	96	Very high	85.3	Confident	1 Å²	1	53 Å²	53	1%	0.006	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	136.9	172.5	64.3	0	0	0	0	111.3	G107 I111 L124 F125 F126 V131 V135 P162	G107-V164 PolarHBondContact N-O 3.5Å; I111-V164 HydrophobicContact CD1-CB 4.34Å; I111-V164 HydrophobicContact CD1-CG1 3.97Å; I111-V164 HydrophobicContact CD1-CG2 3.68Å; L124-V164 HydrophobicContact CD1-CG2 4.21Å; L124-V164 HydrophobicContact CD2-CG2 3.83Å; L124-V164 HydrophobicContact CG-CG2 3.97Å; F125-V164 VanDerWaalsContact O-CA 3.28Å; F125-V164 WeakPolarHBondContact O-CA 3.47Å; F126-V164 HydrophobicContact CB-CB 4.48Å; F126-V164 HydrophobicContact CB-CG2 4.24Å; V131-V164 HydrophobicContact CG1-CB 3.54Å; V131-V164 HydrophobicContact CG1-CG1 3.38Å; V135-V164 HydrophobicContact CG2-CG2 4.22Å; P162-V164 VanDerWaalsContact C-N 3.32Å
165	I	95.1	Very high	83.8	Confident	3 Å²	3	49 Å²	49	2%	0.015	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	141.8	178.3	-172.8	168.9	0	0	0	108.8	V79 I104 L105 E106 L124 F125 M152 I155	V79-I165 HydrophobicContact CG1-CD1 4.33Å; I104-I165 HydrophobicContact CG2-CD1 3.47Å; I104-I165 VanDerWaalsContact CG2-CD1 3.47Å; I104-I165 HydrophobicContact CG2-CG1 3.52Å; L105-I165 CarbonylContact O-C 3.59Å; L105-I165 WeakPolarHBondContact O-CA 3.32Å; E106-I165 HydrophobicContact CG-CB 4.19Å; E106-I165 HydrophobicContact CG-CD1 3.71Å; E106-I165 HydrophobicContact CG-CG1 3.69Å; L124-I165 CarbonylContact C-O 3.57Å; L124-I165 WeakPolarHBondContact CA-O 3.5Å; F125-I165 HydrophobicContact CB-CG2 3.79Å; F125-I165 HydrophobicContact CD2-CG2 4.08Å; F125-I165 HydrophobicContact CG-CG2 4.33Å; F125-I165 PolarHBondContact N-O 3.42Å; F125-I165 PolarHBondContact O-N 2.84Å; M152-I165 HydrophobicContact CE-CG2 4.02Å; M152-I165 HydrophobicContact SD-CG2 4.2Å; I155-I165 HydrophobicContact CD1-CG2 3.51Å; I155-I165 HydrophobicContact CG1-CD1 4.39Å; I155-I165 HydrophobicContact CG1-CG2 4.18Å
166	A	94.3	Very high	82.5	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.008	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	142	177.7	0	0	0	0	0	111.2	L105 I111 A121 S123 L124 F168	L105-A166 PolarHBondContact N-O 2.95Å; L105-A166 PolarHBondContact O-N 3.32Å; I111-A166 HydrophobicContact CD1-CB 3.84Å; I111-A166 HydrophobicContact CG1-CB 4.09Å; I111-A166 HydrophobicContact CG2-CB 4.14Å; A121-A166 HydrophobicContact CB-CB 4.45Å; S123-A166 CarbonylContact O-C 3.47Å; S123-A166 VanDerWaalsContact O-CA 3.25Å; S123-A166 WeakPolarHBondContact O-CA 3.28Å; L124-A166 HydrophobicContact CB-CB 4.13Å; L124-A166 HydrophobicContact CD1-CB 4.23Å; L124-A166 HydrophobicContact CG-CB 4.15Å; A166-F168 HydrophobicContact CB-CD2 4.04Å; A166-F168 HydrophobicContact CB-CE2 3.53Å; A166-F168 HydrophobicContact CB-CZ 4.41Å
167	L	92.6	Very high	80.8	Confident	19 Å²	19	57.7 Å²	57.7	10%	0.099	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	119.8	173.4	-171.9	67.9	0	0	0	108.1	Q82 A102 I104 A121 T122 S123	Q82-L167 HydrophobicContact CB-CD1 4.02Å; Q82-L167 HydrophobicContact CG-CD1 4.1Å; Q82-L167 HydrophobicContact CG-CD2 4.16Å; A102-L167 HydrophobicContact CB-CD1 3.55Å; A102-L167 HydrophobicContact CB-CD2 4.42Å; A102-L167 HydrophobicContact CB-CG 3.99Å; I104-L167 HydrophobicContact CD1-CD1 4.46Å; I104-L167 HydrophobicContact CG1-CD1 3.69Å; A121-L167 CarbonylContact C-O 3.54Å; A121-L167 VanDerWaalsContact CA-O 3.24Å; A121-L167 WeakPolarHBondContact CA-O 3.25Å; T122-L167 PolarHBondContact N-O 2.95Å; T122-L167 WeakPolarHBondContact OG1-CD2 3.29Å; T122-L167 WeakPolarHBondContact OG1-CG 3.29Å; T122-L167 PolarHBondContact OG1-O 2.89Å; S123-L167 PolarHBondContact O-N 3.32Å
168	F	90.9	Very high	79.5	Confident	1 Å²	1	61.1 Å²	61.1	0%	0.004	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	147.1	178.3	-75.8	-101.1	0	0	0	110.6	A102 I103 L105 I111 A114 L115 A119 K120 A121 A166	A102-F168 CarbonylContact C-O 3.6Å; A102-F168 VanDerWaalsContact CA-O 3.24Å; A102-F168 WeakPolarHBondContact CA-O 3.49Å; I103-F168 HydrophobicContact CD1-CB 4.29Å; I103-F168 HydrophobicContact CG1-CB 3.69Å; I103-F168 PolarHBondContact N-O 3.13Å; I103-F168 PolarHBondContact O-N 3.44Å; L105-F168 HydrophobicContact CB-CD2 4.2Å; L105-F168 HydrophobicContact CB-CE2 4.1Å; L105-F168 HydrophobicContact CD1-CD2 3.59Å; L105-F168 HydrophobicContact CD1-CE2 3.54Å; L105-F168 HydrophobicContact CD1-CG 4.2Å; L105-F168 HydrophobicContact CD1-CZ 4.12Å; L105-F168 HydrophobicContact CG-CD2 3.8Å; L105-F168 HydrophobicContact CG-CE2 4.03Å; I111-F168 HydrophobicContact CG1-CE2 4.41Å; I111-F168 HydrophobicContact CG2-CE2 4.13Å; I111-F168 HydrophobicContact CG2-CZ 3.98Å; A114-F168 HydrophobicContact CB-CD1 4.46Å; A114-F168 HydrophobicContact CB-CE1 3.85Å; A114-F168 HydrophobicContact CB-CE2 4.46Å; A114-F168 HydrophobicContact CB-CZ 3.84Å; L115-F168 HydrophobicContact CD2-CE1 3.7Å; L115-F168 HydrophobicContact CD2-CZ 3.94Å; L115-F168 HydrophobicContact CG-CE1 4.01Å; L115-F168 HydrophobicContact CG-CZ 3.89Å; A119-F168 HydrophobicContact CB-CD1 3.98Å; A119-F168 HydrophobicContact CB-CE1 4.21Å; K120-F168 WeakPolarHBondContact O-CA 3.24Å; K120-F168 WeakPolarHBondContact O-CD1 3.45Å; A121-F168 HydrophobicContact CB-CD1 4Å; A121-F168 HydrophobicContact CB-CD2 4.27Å; A121-F168 HydrophobicContact CB-CE1 3.84Å; A121-F168 HydrophobicContact CB-CE2 4.11Å; A121-F168 HydrophobicContact CB-CG 4.22Å; A121-F168 HydrophobicContact CB-CZ 3.9Å; A166-F168 HydrophobicContact CB-CD2 4.04Å; A166-F168 HydrophobicContact CB-CE2 3.53Å; A166-F168 HydrophobicContact CB-CZ 4.41Å
169	E	85.5	Confident	77.8	Confident	82 Å²	82	66.3 Å²	66.3	38%	0.383	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	137.1	159.1	-63.4	178.5	173.7	0	0	108.1	K120 T122 P171	K120-E169 PolarHBondContact O-N 3.43Å; T122-E169 HydrophobicContact CG2-CG 3.93Å; E169-P171 WeakPolarHBondContact O-CD 3.3Å; E169-P171 VanDerWaalsContact O-N 3.16Å
170	L	78.9	Confident	76.2	Confident	45 Å²	45	65 Å²	65	24%	0.236	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-55.2	125	177.9	-171	72.8	0	0	0	109.4	P101 I103 Q172 W225	P101-L170 HydrophobicContact CG-CB 4.02Å; P101-L170 HydrophobicContact CG-CD2 3.74Å; P101-L170 HydrophobicContact CG-CG 4.47Å; P101-L170 VanDerWaalsContact O-CB 3.24Å; P101-L170 WeakPolarHBondContact O-CB 3.32Å; P101-L170 PolarHBondContact O-N 3.4Å; I103-L170 HydrophobicContact CG2-CD1 3.33Å; L170-Q172 PolarHBondContact O-N 2.88Å; L170-W225 HydrophobicContact CD1-CB 4.3Å; L170-W225 HydrophobicContact CD1-CD2 3.55Å; L170-W225 HydrophobicContact CD1-CE3 4.22Å; L170-W225 HydrophobicContact CD1-CG 3.55Å; L170-W225 HydrophobicContact CD1-CZ2 4.28Å
171	P	72.1	Confident	74.7	Confident	14 Å²	14	62.9 Å²	62.9	9%	0.091	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-58	134.1	179.4	-22	31.3	0	0	0	110.4	I103 E169 F176 W225 F238	I103-P171 HydrophobicContact CD1-CG 4.48Å; E169-P171 WeakPolarHBondContact O-CD 3.3Å; E169-P171 VanDerWaalsContact O-N 3.16Å; P171-F176 HydrophobicContact CB-CZ 4.02Å; P171-W225 HydrophobicContact CG-CH2 4.01Å; P171-F238 HydrophobicContact CG-CE1 4.22Å
172	Q	66.6	Low	73.6	Confident	101 Å²	101	72.3 Å²	72.3	47%	0.472	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-68.1	143	166.6	-65.4	-167.2	-21.7	0	0	109.1	Y100 L170 D174 C175	Y100-Q172 PolarHBondContact OH-NE2 2.82Å; L170-Q172 PolarHBondContact O-N 2.88Å; Q172-D174 PolarHBondContact O-N 3.17Å; Q172-D174 VanDerWaalsContact O-N 3.09Å; Q172-C175 VanDerWaalsContact O-CB 3.31Å; Q172-C175 WeakPolarHBondContact O-CB 3.4Å; Q172-C175 PolarHBondContact O-N 2.9Å
173	Q	64.4	Low	72.8	Confident	90 Å²	90	73.3 Å²	73.3	42%	0.421	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-58.7	-26.5	-174.3	-68.6	177.9	-12.9	0	0	112.7	C175 F176 Y243	Q173-C175 VanDerWaalsContact C-N 3.31Å; Q173-C175 PolarHBondContact O-N 3.28Å; Q173-F176 WeakPolarHBondContact O-CD2 3.37Å; Q173-Y243 HydrophobicContact CB-CD1 4.1Å; Q173-Y243 HydrophobicContact CB-CE1 3.99Å; Q173-Y243 HydrophobicContact CG-CD1 4.28Å
174	D	61.1	Low	72.2	Confident	133 Å²	133	74.3 Å²	74.3	71%	0.711	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-80.8	-6.9	179.9	-57.3	-30.2	0	0	0	114.2	Q172 F176	Q172-D174 PolarHBondContact O-N 3.17Å; Q172-D174 VanDerWaalsContact O-N 3.09Å; D174-F176 PolarHBondContact O-N 3.05Å
175	C	55.4	Low	72	Confident	54 Å²	54	74.3 Å²	74.3	37%	0.365	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-73.6	-14.6	-177.2	-68.8	0	0	0	0	113.4	Q172 Q173 K177	Q172-C175 VanDerWaalsContact O-CB 3.31Å; Q172-C175 WeakPolarHBondContact O-CB 3.4Å; Q172-C175 PolarHBondContact O-N 2.9Å; Q173-C175 VanDerWaalsContact C-N 3.31Å; Q173-C175 PolarHBondContact O-N 3.28Å; C175-K177 PolarHBondContact O-N 3.02Å
176	F	60.4	Low	71.7	Confident	27 Å²	27	74.3 Å²	74.3	12%	0.118	36%	0.364	C	S	.	.			trans	-81.1	69.8	-177.8	-57	-71.7	0	0	0	111.3	P171 Q173 D174 R178 W225 H237 F238 P241	P171-F176 HydrophobicContact CB-CZ 4.02Å; Q173-F176 WeakPolarHBondContact O-CD2 3.37Å; D174-F176 PolarHBondContact O-N 3.05Å; F176-R178 PolarHBondContact O-N 3.02Å; F176-W225 HydrophobicContact CZ-CH2 4.44Å; F176-H237 VanDerWaalsContact CE1-O 3.32Å; F176-H237 WeakPolarHBondContact CE1-O 3.17Å; F176-F238 HydrophobicContact CE1-CD1 4.46Å; F176-P241 HydrophobicContact CB-CB 4.31Å; F176-P241 HydrophobicContact CB-CG 4.03Å
177	K	53.3	Low	71.7	Confident	173 Å²	173	74.3 Å²	74.3	75%	0.752	36%	0.363	S	S	*	.			trans	-69.2	117.1	165.6	-69.1	-171.9	177.8	-176.4	0	108.3	C175 K179	C175-K177 PolarHBondContact O-N 3.02Å; K177-K179 PolarHBondContact O-N 3.42Å
178	R	57.6	Low	71.9	Confident	125 Å²	125	73.4 Å²	73.4	47%	0.472	36%	0.358	S	S	.	.			trans	-53.6	98.1	170.2	-86.3	-173.1	-84.7	-158.8	-10.1	108.9	F176 C184 N213	F176-R178 PolarHBondContact O-N 3.02Å; R178-C184 PolarHBondContact NH1-SG 3.2Å; R178-N213 PolarHBondContact NH1-OD1 2.99Å; R178-N213 PolarHBondContact NH2-OD1 3.21Å
179	K	52.3	Low	72.2	Confident	153 Å²	153	73.3 Å²	73.3	67%	0.665	36%	0.358	S	S	*	.			trans	-89.1	109.3	172	-73.4	-177.1	-176.8	171.4	0	108.1	A116 K177 A181	A116-K179 PolarHBondContact O-NZ 3.41Å; A116-K179 VanDerWaalsContact O-NZ 3.15Å; K177-K179 PolarHBondContact O-N 3.42Å; K179-A181 PolarHBondContact O-N 3.44Å
180	N	52.4	Low	72.8	Confident	160 Å²	160	69.4 Å²	69.4	86%	0.856	34%	0.34	S	S	*	.			trans	48.8	48.8	160.4	-60.5	-15.1	0	0	0	115.9	K182	N180-K182 PolarHBondContact O-N 2.97Å
181	A	59.7	Low	73.7	Confident	63 Å²	63	67.3 Å²	67.3	52%	0.521	33%	0.329	S	S	.	.			trans	-68	122	165.9	0	0	0	0	0	108.3	K179 F183	K179-A181 PolarHBondContact O-N 3.44Å; A181-F183 PolarHBondContact O-N 3.22Å
182	K	68.1	Low	74.8	Confident	221 Å²	221	66.7 Å²	66.7	96%	0.961	33%	0.325	S	S	*	.	S	Bend	trans	-59.7	-23.7	174.7	-71.6	-176.1	176.7	-177.8	0	112.5	N180	N180-K182 PolarHBondContact O-N 2.97Å
183	F	76.5	Confident	76.1	Confident	71 Å²	71	64.8 Å²	64.8	31%	0.311	31%	0.313	S	S	.	.			trans	-149.8	133.8	-178.8	177	-100.7	0	0	0	107.9	A181 L185 Q401 F404 L405	A181-F183 PolarHBondContact O-N 3.22Å; F183-L185 HydrophobicContact CE1-CB 4.04Å; F183-L185 HydrophobicContact CE1-CD1 4.07Å; F183-L185 HydrophobicContact CZ-CB 4.47Å; F183-L185 HydrophobicContact CZ-CD1 3.81Å; F183-Q401 HydrophobicContact CE1-CG 4.16Å; F183-Q401 HydrophobicContact CZ-CG 4.39Å; F183-F404 HydrophobicContact CZ-CB 4.41Å; F183-L405 HydrophobicContact CD2-CD2 3.93Å; F183-L405 HydrophobicContact CE1-CD2 4.4Å; F183-L405 HydrophobicContact CE2-CD2 3.47Å; F183-L405 VanDerWaalsContact CE2-CD2 3.47Å; F183-L405 HydrophobicContact CE2-CG 4.31Å; F183-L405 HydrophobicContact CZ-CD2 3.74Å; F183-L405 HydrophobicContact CZ-CG 4.15Å
184	C	84.1	Confident	77.6	Confident	24 Å²	24	60.5 Å²	60.5	16%	0.162	29%	0.293	C	S	.	.			trans	-130.8	119.1	172.6	-173	0	0	0	0	108.5	R178 G211	R178-C184 PolarHBondContact NH1-SG 3.2Å; C184-G211 CarbonylContact C-O 3.6Å; C184-G211 VanDerWaalsContact CA-O 3.31Å; C184-G211 WeakPolarHBondContact CA-O 3.45Å; C184-G211 PolarHBondContact SG-O 2.85Å; C184-G211 VanDerWaalsContact SG-O 3.41Å
185	L	89.8	Confident	79.2	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	125.6	175.2	-163.1	69	0	0	0	108.1	F183 V187 G211 L212 N213 I400 Q401 F404	F183-L185 HydrophobicContact CE1-CB 4.04Å; F183-L185 HydrophobicContact CE1-CD1 4.07Å; F183-L185 HydrophobicContact CZ-CB 4.47Å; F183-L185 HydrophobicContact CZ-CD1 3.81Å; L185-V187 HydrophobicContact CD2-CB 4.11Å; L185-V187 HydrophobicContact CD2-CG2 3.8Å; L185-V187 HydrophobicContact CG-CB 4.14Å; L185-V187 HydrophobicContact CG-CG2 3.71Å; L185-V187 PolarHBondContact O-N 3.25Å; L185-G211 PolarHBondContact N-O 2.79Å; L185-L212 HydrophobicContact CB-CD2 4.21Å; L185-L212 HydrophobicContact CD2-CD2 3.59Å; L185-L212 HydrophobicContact CG-CD2 4.39Å; L185-L212 CarbonylContact O-C 3.41Å; L185-N213 PolarHBondContact O-N 3.4Å; L185-N213 VanDerWaalsContact O-N 3.08Å; L185-I400 HydrophobicContact CD2-CG2 4.25Å; L185-Q401 HydrophobicContact CD1-CB 4.34Å; L185-Q401 HydrophobicContact CD2-CB 4.13Å; L185-F404 HydrophobicContact CD1-CB 3.7Å; L185-F404 HydrophobicContact CD1-CD2 3.55Å; L185-F404 HydrophobicContact CD1-CE2 4.36Å; L185-F404 HydrophobicContact CD1-CG 3.7Å
186	P	90.7	Very high	81.1	Confident	4 Å²	4	58.9 Å²	58.9	3%	0.026	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	40.9	-175.8	36.8	-41.9	0	0	0	112.4	Y340 R348 L349 F404	P186-Y340 HydrophobicContact CB-CE2 3.74Å; P186-Y340 HydrophobicContact CG-CD2 4.39Å; P186-Y340 HydrophobicContact CG-CE2 3.5Å; P186-Y340 VanDerWaalsContact CG-CE2 3.5Å; P186-R348 PolarHBondContact O-N 3.43Å; P186-L349 PolarHBondContact O-N 3.12Å; P186-F404 HydrophobicContact CG-CD1 4.12Å; P186-F404 HydrophobicContact CG-CE1 3.4Å; P186-F404 HydrophobicContact CG-CE2 4.11Å; P186-F404 HydrophobicContact CG-CZ 3.39Å
187	V	93.7	Very high	82.7	Confident	0 Å²	0	59 Å²	59	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132.8	-174.5	174.3	0	0	0	0	108.8	L185 L212 N213 L349 V351 L397 I400	L185-V187 HydrophobicContact CD2-CB 4.11Å; L185-V187 HydrophobicContact CD2-CG2 3.8Å; L185-V187 HydrophobicContact CG-CB 4.14Å; L185-V187 HydrophobicContact CG-CG2 3.71Å; L185-V187 PolarHBondContact O-N 3.25Å; V187-L212 HydrophobicContact CB-CD2 4.05Å; V187-L212 HydrophobicContact CG1-CD2 4.17Å; V187-L212 WeakPolarHBondContact O-CB 3.23Å; V187-N213 WeakPolarHBondContact O-CB 3.49Å; V187-N213 PolarHBondContact O-N 3.28Å; V187-L349 CarbonylContact C-O 3.54Å; V187-L349 WeakPolarHBondContact CA-O 3.39Å; V187-L349 HydrophobicContact CG2-CB 3.96Å; V187-L349 HydrophobicContact CG2-CD1 3.88Å; V187-V351 HydrophobicContact CG1-CG2 4.3Å; V187-L397 HydrophobicContact CG1-CD2 3.97Å; V187-I400 HydrophobicContact CG2-CG2 3.63Å
188	T	95.4	Very high	84.7	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	130.4	168.4	-70.9	0	0	0	0	110.1	I190 N213 S214 L216 Y254 F255 C347 L349 A350 V351	T188-I190 HydrophobicContact CG2-CG1 4.37Å; T188-N213 PolarHBondContact OG1-ND2 3.32Å; T188-S214 WeakPolarHBondContact CA-O 3.33Å; T188-S214 WeakPolarHBondContact CG2-OG 3.45Å; T188-S214 PolarHBondContact OG1-OG 3.48Å; T188-L216 HydrophobicContact CG2-CD1 3.74Å; T188-L216 HydrophobicContact CG2-CD2 4.49Å; T188-L216 HydrophobicContact CG2-CG 3.6Å; T188-Y254 HydrophobicContact CG2-CE1 4.49Å; T188-F255 HydrophobicContact CG2-CE1 4.27Å; T188-F255 HydrophobicContact CG2-CZ 3.82Å; T188-C347 PolarHBondContact OG1-SG 3.39Å; T188-L349 PolarHBondContact N-O 3.26Å; T188-A350 CarbonylContact O-C 3.52Å; T188-A350 WeakPolarHBondContact O-CA 3.48Å; T188-V351 PolarHBondContact O-N 3.17Å
189	L	97.4	Very high	86.5	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	123.9	175.6	179	64	0	0	0	109.6	L191 L212 S214 I215 L216 I353 L397	L189-L191 HydrophobicContact CD1-CD2 4.1Å; L189-L191 HydrophobicContact CD2-CD2 3.81Å; L189-L191 HydrophobicContact CD2-CG 4.45Å; L189-L191 HydrophobicContact CG-CD2 3.68Å; L189-L191 HydrophobicContact CG-CG 4.27Å; L189-L212 HydrophobicContact CB-CD1 3.68Å; L189-L212 HydrophobicContact CD2-CD1 4.27Å; L189-S214 PolarHBondContact N-O 2.93Å; L189-I215 HydrophobicContact CB-CG1 4.34Å; L189-I215 CarbonylContact O-C 3.58Å; L189-I215 VanDerWaalsContact O-CA 3.3Å; L189-I215 WeakPolarHBondContact O-CA 3.42Å; L189-L216 PolarHBondContact O-N 3.19Å; L189-I353 HydrophobicContact CD1-CB 4.46Å; L189-I353 HydrophobicContact CD1-CG1 3.58Å; L189-L397 HydrophobicContact CD1-CD1 4.4Å; L189-L397 HydrophobicContact CD2-CD1 4.35Å
190	I	98	Very high	88.7	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	119.1	176.8	-50.9	-179.2	0	0	0	108.2	T188 L216 T218 W248 I251 F255 A350 V351 V352 I353 L367	T188-I190 HydrophobicContact CG2-CG1 4.37Å; I190-L216 CarbonylContact C-O 3.57Å; I190-L216 WeakPolarHBondContact CA-O 3.35Å; I190-L216 HydrophobicContact CG1-CB 4.34Å; I190-L216 HydrophobicContact CG1-CD1 4.31Å; I190-T218 HydrophobicContact CG2-CG2 4.36Å; I190-W248 HydrophobicContact CG2-CH2 3.95Å; I190-W248 HydrophobicContact CG2-CZ3 4.18Å; I190-I251 HydrophobicContact CD1-CG2 3.86Å; I190-I251 HydrophobicContact CG2-CD1 3.91Å; I190-F255 HydrophobicContact CD1-CE2 3.77Å; I190-F255 HydrophobicContact CD1-CZ 4.1Å; I190-A350 HydrophobicContact CD1-CB 3.92Å; I190-A350 HydrophobicContact CG1-CB 4.3Å; I190-V351 PolarHBondContact N-O 3.39Å; I190-V352 HydrophobicContact CB-CB 4.39Å; I190-V352 HydrophobicContact CB-CG1 4.39Å; I190-V352 HydrophobicContact CB-CG2 4.06Å; I190-V352 HydrophobicContact CD1-CG2 4.06Å; I190-V352 HydrophobicContact CG1-CG2 4.48Å; I190-V352 HydrophobicContact CG2-CG1 4.37Å; I190-V352 HydrophobicContact CG2-CG2 4.46Å; I190-V352 CarbonylContact O-C 3.48Å; I190-V352 WeakPolarHBondContact O-CA 3.45Å; I190-I353 PolarHBondContact O-N 3Å; I190-L367 HydrophobicContact CD1-CD2 4.31Å
191	L	97.9	Very high	90.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	109	-179	-61.1	-171.1	0	0	0	109.1	L189 I194 M200 L203 I215 L216 V217 T218 I353	L189-L191 HydrophobicContact CD1-CD2 4.1Å; L189-L191 HydrophobicContact CD2-CD2 3.81Å; L189-L191 HydrophobicContact CD2-CG 4.45Å; L189-L191 HydrophobicContact CG-CD2 3.68Å; L189-L191 HydrophobicContact CG-CG 4.27Å; L191-I194 HydrophobicContact CB-CG1 3.81Å; L191-I194 HydrophobicContact CD2-CG1 4.41Å; L191-M200 HydrophobicContact CD1-CE 4.37Å; L191-M200 HydrophobicContact CD1-SD 3.53Å; L191-M200 VanDerWaalsContact CD1-SD 3.53Å; L191-L203 HydrophobicContact CD1-CB 4.05Å; L191-L203 HydrophobicContact CD1-CD1 4.31Å; L191-L203 HydrophobicContact CD2-CB 4.33Å; L191-L203 HydrophobicContact CD2-CD1 3.88Å; L191-L203 HydrophobicContact CD2-CG 4.48Å; L191-I215 HydrophobicContact CD1-CG2 3.83Å; L191-I215 HydrophobicContact CG-CG2 3.98Å; L191-L216 PolarHBondContact N-O 3.31Å; L191-V217 HydrophobicContact CB-CG2 4.25Å; L191-V217 HydrophobicContact CD1-CG2 4.21Å; L191-T218 PolarHBondContact O-N 3.48Å; L191-T218 PolarHBondContact O-OG1 2.92Å; L191-I353 HydrophobicContact CD2-CB 4.22Å
192	D	96.4	Very high	92.6	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	103.4	-172.5	-174.1	18.5	0	0	0	111.7	I194 T218 W248 V352 I353 S355 S361	D192-I194 VanDerWaalsContact C-N 3.31Å; D192-I194 PolarHBondContact O-N 3.18Å; D192-T218 WeakPolarHBondContact CA-OG1 3.48Å; D192-T218 HydrophobicContact CB-CG2 4.38Å; D192-T218 PolarHBondContact OD1-OG1 3.44Å; D192-W248 HydrophobicContact CB-CZ2 4.18Å; D192-V352 HydrophobicContact CB-CG1 4.01Å; D192-I353 PolarHBondContact N-O 2.93Å; D192-S355 PolarHBondContact O-N 3.39Å; D192-S355 VanDerWaalsContact O-N 3.09Å; D192-S361 WeakPolarHBondContact OD2-CA 3.43Å; D192-S361 WeakPolarHBondContact OD2-CB 3.44Å; D192-S361 PolarHBondContact OD2-N 3.2Å; D192-S361 PolarHBondContact OD2-OG 2.81Å
193	R	94.7	Very high	94	Very high	62 Å²	62	20.3 Å²	20.3	23%	0.234	11%	0.113	C	C	.	.	S	Bend	trans	55.9	38	178.3	-61.1	-177.4	-62.1	-106.1	-3.9	114.3	N195 T218 S221 S355	R193-N195 PolarHBondContact O-N 3.15Å; R193-N195 PolarHBondContact O-ND2 3.07Å; R193-N195 VanDerWaalsContact O-ND2 3.15Å; R193-T218 PolarHBondContact N-OG1 3.14Å; R193-S221 VanDerWaalsContact CA-OG 3.26Å; R193-S221 WeakPolarHBondContact CA-OG 3.34Å; R193-S221 PolarHBondContact N-OG 2.85Å; R193-S355 WeakPolarHBondContact O-CB 3.2Å
194	I	95.9	Very high	95	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.099	C	C	.	.			trans	-68.8	114.8	177.2	-55.8	-56.5	0	0	0	109.3	L191 D192 N199 M200 L203 S221 V222 G354 V389	L191-I194 HydrophobicContact CB-CG1 3.81Å; L191-I194 HydrophobicContact CD2-CG1 4.41Å; D192-I194 VanDerWaalsContact C-N 3.31Å; D192-I194 PolarHBondContact O-N 3.18Å; I194-N199 HydrophobicContact CG2-CB 4.44Å; I194-M200 HydrophobicContact CB-CE 3.73Å; I194-M200 HydrophobicContact CG2-CB 4.06Å; I194-M200 HydrophobicContact CG2-CE 4.12Å; I194-L203 HydrophobicContact CD1-CD1 4.48Å; I194-L203 HydrophobicContact CG1-CD1 4.31Å; I194-L203 HydrophobicContact CG2-CD1 4.31Å; I194-S221 PolarHBondContact N-OG 3.06Å; I194-S221 VanDerWaalsContact N-OG 3.17Å; I194-S221 CarbonylContact O-C 3.54Å; I194-S221 VanDerWaalsContact O-CA 3.3Å; I194-S221 WeakPolarHBondContact O-CA 3.46Å; I194-S221 WeakPolarHBondContact O-CB 3.31Å; I194-V222 WeakPolarHBondContact O-CG1 3.47Å; I194-V222 PolarHBondContact O-N 3.27Å; I194-G354 WeakPolarHBondContact CD1-O 3.44Å; I194-V389 HydrophobicContact CD1-CG2 4.11Å
195	N	93.6	Very high	95.5	Very high	84 Å²	84	21.2 Å²	21.2	45%	0.449	11%	0.111	S	C	.	.			trans	-104.8	-22.9	-172.8	-75.5	-47.6	0	0	0	114.3	R193 P197 G220	R193-N195 PolarHBondContact O-N 3.15Å; R193-N195 PolarHBondContact O-ND2 3.07Å; R193-N195 VanDerWaalsContact O-ND2 3.15Å; N195-P197 WeakPolarHBondContact O-CD 3.15Å; N195-G220 PolarHBondContact OD1-O 2.9Å
196	D	94.7	Very high	95.8	Very high	68 Å²	68	22.6 Å²	22.6	36%	0.364	12%	0.121	S	C	.	.			trans	-78	122.1	175.8	-179.1	-94.7	0	0	0	110.7	G198 N199 M200	D196-G198 VanDerWaalsContact C-N 3.29Å; D196-G198 PolarHBondContact O-N 3.18Å; D196-G198 VanDerWaalsContact OD1-CA 3.23Å; D196-G198 WeakPolarHBondContact OD1-CA 3.49Å; D196-G198 PolarHBondContact OD1-N 3.49Å; D196-N199 HydrophobicContact CB-CB 4.1Å; D196-N199 WeakPolarHBondContact CB-ND2 3.35Å; D196-N199 PolarHBondContact O-N 3.07Å; D196-N199 PolarHBondContact OD1-N 3.46Å; D196-N199 PolarHBondContact OD1-ND2 3.27Å; D196-M200 WeakPolarHBondContact O-CB 3.26Å; D196-M200 PolarHBondContact O-N 2.89Å
197	P	94.4	Very high	96	Very high	29 Å²	29	22.4 Å²	22.4	19%	0.188	12%	0.119	C	C	.	.	H	α-helix	trans	-67.7	-27.4	-178.3	23.3	-31.1	0	0	0	113.6	N195 G201 V222 K228 V229	N195-P197 WeakPolarHBondContact O-CD 3.15Å; P197-G201 PolarHBondContact O-N 3.24Å; P197-G201 VanDerWaalsContact O-N 3.07Å; P197-V222 HydrophobicContact CB-CG2 4.25Å; P197-K228 HydrophobicContact CB-CB 3.9Å; P197-K228 HydrophobicContact CG-CB 4.25Å; P197-K228 HydrophobicContact CG-CD 4.16Å; P197-V229 HydrophobicContact CB-CG2 3.49Å; P197-V229 VanDerWaalsContact CB-CG2 3.49Å
198	G	95.4	Very high	96	Very high	29 Å²	29	23.4 Å²	23.4	30%	0.299	13%	0.128	S	C	.	.	H	α-helix	trans	-68.7	-44.6	175.6	0	0	0	0	0	111.8	D196 S202	D196-G198 VanDerWaalsContact C-N 3.29Å; D196-G198 PolarHBondContact O-N 3.18Å; D196-G198 VanDerWaalsContact OD1-CA 3.23Å; D196-G198 WeakPolarHBondContact OD1-CA 3.49Å; D196-G198 PolarHBondContact OD1-N 3.49Å; G198-S202 VanDerWaalsContact O-CB 3.31Å; G198-S202 WeakPolarHBondContact O-CB 3.36Å; G198-S202 PolarHBondContact O-N 2.96Å; G198-S202 PolarHBondContact O-OG 2.9Å
199	N	96	Very high	95.9	Very high	25 Å²	25	27.8 Å²	27.8	13%	0.134	16%	0.158	C	C	.	.	H	α-helix	trans	-67.8	-45.8	176.6	-65	-31	0	0	0	111.2	I194 D196 G201 S202 L203 E356 V389	I194-N199 HydrophobicContact CG2-CB 4.44Å; D196-N199 HydrophobicContact CB-CB 4.1Å; D196-N199 WeakPolarHBondContact CB-ND2 3.35Å; D196-N199 PolarHBondContact O-N 3.07Å; D196-N199 PolarHBondContact OD1-N 3.46Å; D196-N199 PolarHBondContact OD1-ND2 3.27Å; N199-G201 PolarHBondContact O-N 3.41Å; N199-S202 PolarHBondContact O-N 2.91Å; N199-L203 WeakPolarHBondContact O-CB 3.46Å; N199-L203 WeakPolarHBondContact O-CD1 3.48Å; N199-L203 WeakPolarHBondContact O-CG 3.22Å; N199-L203 PolarHBondContact O-N 3.14Å; N199-E356 PolarHBondContact ND2-OE1 2.98Å; N199-V389 HydrophobicContact CB-CG1 3.71Å
200	M	97.3	Very high	95.7	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-53.8	-51.9	174.3	178.7	62.1	78.1	0	0	111.5	L191 I194 D196 S202 L203 I204 V217 V222 I224 V229	L191-M200 HydrophobicContact CD1-CE 4.37Å; L191-M200 HydrophobicContact CD1-SD 3.53Å; L191-M200 VanDerWaalsContact CD1-SD 3.53Å; I194-M200 HydrophobicContact CB-CE 3.73Å; I194-M200 HydrophobicContact CG2-CB 4.06Å; I194-M200 HydrophobicContact CG2-CE 4.12Å; D196-M200 WeakPolarHBondContact O-CB 3.26Å; D196-M200 PolarHBondContact O-N 2.89Å; M200-S202 PolarHBondContact O-N 2.94Å; M200-L203 PolarHBondContact O-N 3.44Å; M200-I204 HydrophobicContact CG-CD1 4.09Å; M200-I204 WeakPolarHBondContact O-CG1 3.06Å; M200-I204 PolarHBondContact O-N 3.16Å; M200-I204 HydrophobicContact SD-CD1 4.05Å; M200-I204 HydrophobicContact SD-CG1 4.44Å; M200-V217 HydrophobicContact CE-CG1 3.55Å; M200-V217 HydrophobicContact CE-CG2 4.38Å; M200-V217 HydrophobicContact SD-CG1 4.44Å; M200-V217 HydrophobicContact SD-CG2 4.23Å; M200-V222 HydrophobicContact CB-CG1 3.57Å; M200-V222 HydrophobicContact CE-CG1 3.94Å; M200-V222 HydrophobicContact CG-CG1 3.78Å; M200-I224 HydrophobicContact CE-CG2 4.47Å; M200-I224 HydrophobicContact CG-CG2 4.33Å; M200-I224 HydrophobicContact SD-CG2 4.09Å; M200-V229 HydrophobicContact CB-CG1 4.13Å; M200-V229 HydrophobicContact CB-CG2 4.28Å; M200-V229 HydrophobicContact CG-CG1 3.58Å; M200-V229 HydrophobicContact CG-CG2 4.25Å
201	G	97.2	Very high	95.4	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.4	-43.2	-179.9	0	0	0	0	0	112	P197 N199 L203 I204 R205 V229 G233	P197-G201 PolarHBondContact O-N 3.24Å; P197-G201 VanDerWaalsContact O-N 3.07Å; N199-G201 PolarHBondContact O-N 3.41Å; G201-L203 PolarHBondContact O-N 2.91Å; G201-I204 PolarHBondContact O-N 2.57Å; G201-R205 WeakPolarHBondContact O-CB 3.34Å; G201-R205 PolarHBondContact O-N 2.99Å; G201-V229 WeakPolarHBondContact CA-O 3.3Å; G201-G233 VanDerWaalsContact O-CA 3.23Å; G201-G233 WeakPolarHBondContact O-CA 3.27Å
202	S	97.3	Very high	95.2	Very high	30 Å²	30	30.3 Å²	30.3	21%	0.21	18%	0.176	C	C	.	.	H	α-helix	trans	-65.4	-37	179	-57.6	0	0	0	0	112.7	G198 N199 M200 R205 S206	G198-S202 VanDerWaalsContact O-CB 3.31Å; G198-S202 WeakPolarHBondContact O-CB 3.36Å; G198-S202 PolarHBondContact O-N 2.96Å; G198-S202 PolarHBondContact O-OG 2.9Å; N199-S202 PolarHBondContact O-N 2.91Å; M200-S202 PolarHBondContact O-N 2.94Å; S202-R205 WeakPolarHBondContact O-CB 3.48Å; S202-R205 PolarHBondContact O-N 2.78Å; S202-S206 WeakPolarHBondContact O-CB 3.39Å; S202-S206 PolarHBondContact O-N 2.86Å; S202-S206 PolarHBondContact O-OG 3.07Å
203	L	97.8	Very high	94.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.9	-43.5	174.1	-73	163	0	0	0	111.4	L191 I194 N199 M200 G201 R205 S206 G207 V389 L390 A393	L191-L203 HydrophobicContact CD1-CB 4.05Å; L191-L203 HydrophobicContact CD1-CD1 4.31Å; L191-L203 HydrophobicContact CD2-CB 4.33Å; L191-L203 HydrophobicContact CD2-CD1 3.88Å; L191-L203 HydrophobicContact CD2-CG 4.48Å; I194-L203 HydrophobicContact CD1-CD1 4.48Å; I194-L203 HydrophobicContact CG1-CD1 4.31Å; I194-L203 HydrophobicContact CG2-CD1 4.31Å; N199-L203 WeakPolarHBondContact O-CB 3.46Å; N199-L203 WeakPolarHBondContact O-CD1 3.48Å; N199-L203 WeakPolarHBondContact O-CG 3.22Å; N199-L203 PolarHBondContact O-N 3.14Å; M200-L203 PolarHBondContact O-N 3.44Å; G201-L203 PolarHBondContact O-N 2.91Å; L203-R205 VanDerWaalsContact C-N 3.32Å; L203-R205 PolarHBondContact O-N 3.08Å; L203-S206 PolarHBondContact O-N 3.04Å; L203-G207 PolarHBondContact O-N 3Å; L203-V389 HydrophobicContact CD1-CG1 4.27Å; L203-V389 HydrophobicContact CD1-CG2 4.32Å; L203-L390 HydrophobicContact CD2-CD1 4.19Å; L203-L390 HydrophobicContact CG-CD1 4.34Å; L203-A393 HydrophobicContact CD2-CB 3.44Å; L203-A393 VanDerWaalsContact CD2-CB 3.44Å
204	I	96.8	Very high	94.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.1	-43.9	173.8	-68.9	169.4	0	0	0	110.8	M200 G201 G207 A208 I215 I224 V229 H237 V242	M200-I204 HydrophobicContact CG-CD1 4.09Å; M200-I204 WeakPolarHBondContact O-CG1 3.06Å; M200-I204 PolarHBondContact O-N 3.16Å; M200-I204 HydrophobicContact SD-CD1 4.05Å; M200-I204 HydrophobicContact SD-CG1 4.44Å; G201-I204 PolarHBondContact O-N 2.57Å; I204-G207 PolarHBondContact O-N 3.14Å; I204-A208 WeakPolarHBondContact O-CB 3.14Å; I204-A208 PolarHBondContact O-N 2.78Å; I204-I215 HydrophobicContact CB-CD1 4.3Å; I204-I215 HydrophobicContact CG1-CD1 4.19Å; I204-I215 HydrophobicContact CG2-CD1 4.48Å; I204-I224 HydrophobicContact CD1-CB 4.22Å; I204-I224 HydrophobicContact CD1-CG2 4.15Å; I204-V229 HydrophobicContact CD1-CG1 4.23Å; I204-H237 VanDerWaalsContact CD1-NE2 3.26Å; I204-H237 WeakPolarHBondContact CD1-NE2 3.37Å; I204-V242 HydrophobicContact CD1-CG1 4.35Å; I204-V242 HydrophobicContact CG2-CG2 4.24Å
205	R	96.1	Very high	94.8	Very high	114 Å²	114	27.7 Å²	27.7	43%	0.43	17%	0.167	S	C	.	.	H	α-helix	trans	-61.3	-47	176.2	-176.6	-177.2	174.4	-177	0.3	111.9	G201 S202 L203 A208 S209 G233 M234	G201-R205 WeakPolarHBondContact O-CB 3.34Å; G201-R205 PolarHBondContact O-N 2.99Å; S202-R205 WeakPolarHBondContact O-CB 3.48Å; S202-R205 PolarHBondContact O-N 2.78Å; L203-R205 VanDerWaalsContact C-N 3.32Å; L203-R205 PolarHBondContact O-N 3.08Å; R205-A208 PolarHBondContact O-N 3.46Å; R205-S209 WeakPolarHBondContact O-CB 3.45Å; R205-S209 PolarHBondContact O-N 3.45Å; R205-S209 PolarHBondContact O-OG 3.45Å; R205-G233 WeakPolarHBondContact CB-O 3.35Å; R205-M234 PolarHBondContact NH1-SD 2.86Å
206	S	95.9	Very high	94.9	Very high	28 Å²	28	23.7 Å²	23.7	20%	0.196	15%	0.145	C	C	.	.	H	α-helix	trans	-62.5	-45.6	178.6	-69.4	0	0	0	0	111	S202 L203 A208 S209 L210	S202-S206 WeakPolarHBondContact O-CB 3.39Å; S202-S206 PolarHBondContact O-N 2.86Å; S202-S206 PolarHBondContact O-OG 3.07Å; L203-S206 PolarHBondContact O-N 3.04Å; S206-A208 PolarHBondContact O-N 3.45Å; S206-S209 PolarHBondContact O-N 3.33Å; S206-S209 VanDerWaalsContact O-N 3.14Å; S206-L210 WeakPolarHBondContact O-CB 3.31Å; S206-L210 WeakPolarHBondContact O-CG 3.37Å; S206-L210 PolarHBondContact O-N 3.29Å
207	G	95	Very high	95	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-60.7	-44.6	177	0	0	0	0	0	113.1	L203 I204 S209 L210 G211 L212	L203-G207 PolarHBondContact O-N 3Å; I204-G207 PolarHBondContact O-N 3.14Å; G207-S209 VanDerWaalsContact C-N 3.33Å; G207-S209 PolarHBondContact O-N 2.9Å; G207-L210 PolarHBondContact O-N 3.32Å; G207-G211 PolarHBondContact O-N 3.37Å; G207-L212 VanDerWaalsContact CA-CD1 3.44Å; G207-L212 WeakPolarHBondContact O-CG 3.17Å; G207-L212 PolarHBondContact O-N 3.42Å; G207-L212 VanDerWaalsContact O-N 3.07Å
208	A	93.5	Very high	95.1	Very high	21 Å²	21	19.3 Å²	19.3	17%	0.174	12%	0.121	C	C	.	.	H	α-helix	trans	-62.9	-38	173.8	0	0	0	0	0	112.8	I204 R205 S206 G211 R239 I240	I204-A208 WeakPolarHBondContact O-CB 3.14Å; I204-A208 PolarHBondContact O-N 2.78Å; R205-A208 PolarHBondContact O-N 3.46Å; S206-A208 PolarHBondContact O-N 3.45Å; A208-G211 PolarHBondContact O-N 2.95Å; A208-R239 HydrophobicContact CB-CB 4.08Å; A208-I240 HydrophobicContact CB-CB 4.3Å; A208-I240 HydrophobicContact CB-CG2 3.87Å
209	S	92.8	Very high	95	Very high	92 Å²	92	24 Å²	24	64%	0.643	13%	0.133	S	C	*	.	H	α-helix	trans	-71.8	-35.4	-178.6	-57.2	0	0	0	0	112.6	R205 S206 G207 G211	R205-S209 WeakPolarHBondContact O-CB 3.45Å; R205-S209 PolarHBondContact O-N 3.45Å; R205-S209 PolarHBondContact O-OG 3.45Å; S206-S209 PolarHBondContact O-N 3.33Å; S206-S209 VanDerWaalsContact O-N 3.14Å; G207-S209 VanDerWaalsContact C-N 3.33Å; G207-S209 PolarHBondContact O-N 2.9Å; S209-G211 VanDerWaalsContact C-N 3.26Å
210	L	93	Very high	94.8	Very high	30 Å²	30	25.3 Å²	25.3	16%	0.157	15%	0.152	C	C	.	.	H	α-helix	trans	-79.2	-10.7	176.7	-66.5	171.1	0	0	0	113	S206 G207 L212 L397 Q401	S206-L210 WeakPolarHBondContact O-CB 3.31Å; S206-L210 WeakPolarHBondContact O-CG 3.37Å; S206-L210 PolarHBondContact O-N 3.29Å; G207-L210 PolarHBondContact O-N 3.32Å; L210-L212 HydrophobicContact CB-CD2 4.15Å; L210-L212 HydrophobicContact CB-CG 4.39Å; L210-L397 HydrophobicContact CD1-CB 3.46Å; L210-L397 VanDerWaalsContact CD1-CB 3.46Å; L210-L397 HydrophobicContact CD1-CD1 3.95Å; L210-L397 HydrophobicContact CD1-CG 4.35Å; L210-Q401 PolarHBondContact O-NE2 3.22Å
211	G	91.2	Very high	94.7	Very high	18 Å²	18	26.2 Å²	26.2	19%	0.186	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	34	-179.8	0	0	0	0	0	113.2	C184 L185 G207 A208 S209	C184-G211 CarbonylContact C-O 3.6Å; C184-G211 VanDerWaalsContact CA-O 3.31Å; C184-G211 WeakPolarHBondContact CA-O 3.45Å; C184-G211 PolarHBondContact SG-O 2.85Å; C184-G211 VanDerWaalsContact SG-O 3.41Å; L185-G211 PolarHBondContact N-O 2.79Å; G207-G211 PolarHBondContact O-N 3.37Å; A208-G211 PolarHBondContact O-N 2.95Å; S209-G211 VanDerWaalsContact C-N 3.26Å
212	L	93.2	Very high	94.5	Very high	5 Å²	5	27.4 Å²	27.4	3%	0.026	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	158.4	178.3	-55.9	-173.7	0	0	0	111.7	L185 V187 L189 G207 L210 I240 L397	L185-L212 HydrophobicContact CB-CD2 4.21Å; L185-L212 HydrophobicContact CD2-CD2 3.59Å; L185-L212 HydrophobicContact CG-CD2 4.39Å; L185-L212 CarbonylContact O-C 3.41Å; V187-L212 HydrophobicContact CB-CD2 4.05Å; V187-L212 HydrophobicContact CG1-CD2 4.17Å; V187-L212 WeakPolarHBondContact O-CB 3.23Å; L189-L212 HydrophobicContact CB-CD1 3.68Å; L189-L212 HydrophobicContact CD2-CD1 4.27Å; G207-L212 VanDerWaalsContact CA-CD1 3.44Å; G207-L212 WeakPolarHBondContact O-CG 3.17Å; G207-L212 PolarHBondContact O-N 3.42Å; G207-L212 VanDerWaalsContact O-N 3.07Å; L210-L212 HydrophobicContact CB-CD2 4.15Å; L210-L212 HydrophobicContact CB-CG 4.39Å; L212-I240 HydrophobicContact CB-CD1 3.51Å; L212-I240 WeakPolarHBondContact O-CD1 3.5Å; L212-L397 HydrophobicContact CD1-CD1 4.09Å; L212-L397 HydrophobicContact CD1-CD2 4.29Å; L212-L397 HydrophobicContact CD2-CD2 4.16Å
213	N	90.7	Very high	94.2	Very high	9 Å²	9	28.7 Å²	28.7	5%	0.048	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	-46.7	179	176.7	76.2	0	0	0	111.6	R178 L185 V187 T188 Y254	R178-N213 PolarHBondContact NH1-OD1 2.99Å; R178-N213 PolarHBondContact NH2-OD1 3.21Å; L185-N213 PolarHBondContact O-N 3.4Å; L185-N213 VanDerWaalsContact O-N 3.08Å; V187-N213 WeakPolarHBondContact O-CB 3.49Å; V187-N213 PolarHBondContact O-N 3.28Å; T188-N213 PolarHBondContact OG1-ND2 3.32Å; N213-Y254 PolarHBondContact ND2-OH 3.11Å
214	S	93	Very high	94	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	167.9	178.2	77.2	0	0	0	0	112.1	T188 L189 P241 Y254	T188-S214 WeakPolarHBondContact CA-O 3.33Å; T188-S214 WeakPolarHBondContact CG2-OG 3.45Å; T188-S214 PolarHBondContact OG1-OG 3.48Å; L189-S214 PolarHBondContact N-O 2.93Å; S214-P241 WeakPolarHBondContact CA-O 3.34Å; S214-Y254 WeakPolarHBondContact CB-OH 3.38Å; S214-Y254 PolarHBondContact OG-OH 3.35Å; S214-Y254 VanDerWaalsContact OG-OH 3.07Å
215	I	95.8	Very high	93.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	127.3	168.9	-54.3	-178.8	0	0	0	108.7	L189 L191 I204 V217 I240 P241 V242 Y243	L189-I215 HydrophobicContact CB-CG1 4.34Å; L189-I215 CarbonylContact O-C 3.58Å; L189-I215 VanDerWaalsContact O-CA 3.3Å; L189-I215 WeakPolarHBondContact O-CA 3.42Å; L191-I215 HydrophobicContact CD1-CG2 3.83Å; L191-I215 HydrophobicContact CG-CG2 3.98Å; I204-I215 HydrophobicContact CB-CD1 4.3Å; I204-I215 HydrophobicContact CG1-CD1 4.19Å; I204-I215 HydrophobicContact CG2-CD1 4.48Å; I215-V217 HydrophobicContact CG2-CG2 4.18Å; I215-I240 HydrophobicContact CD1-CD1 4.28Å; I215-I240 HydrophobicContact CD1-CG2 3.99Å; I215-I240 HydrophobicContact CG1-CD1 3.89Å; I215-I240 HydrophobicContact CG1-CG2 4.37Å; I215-P241 PolarHBondContact N-O 3.14Å; I215-V242 HydrophobicContact CB-CG1 4.19Å; I215-V242 HydrophobicContact CB-CG2 4.23Å; I215-V242 HydrophobicContact CD1-CG2 4.42Å; I215-V242 HydrophobicContact CG2-CG1 4.29Å; I215-V242 WeakPolarHBondContact O-CA 3.47Å; I215-Y243 PolarHBondContact O-N 2.74Å
216	L	96.4	Very high	93.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	128	177.2	-54.6	-175.7	0	0	0	108.6	T188 L189 I190 L191 Y243 L246 I251 Y254 F255	T188-L216 HydrophobicContact CG2-CD1 3.74Å; T188-L216 HydrophobicContact CG2-CD2 4.49Å; T188-L216 HydrophobicContact CG2-CG 3.6Å; L189-L216 PolarHBondContact O-N 3.19Å; I190-L216 CarbonylContact C-O 3.57Å; I190-L216 WeakPolarHBondContact CA-O 3.35Å; I190-L216 HydrophobicContact CG1-CB 4.34Å; I190-L216 HydrophobicContact CG1-CD1 4.31Å; L191-L216 PolarHBondContact N-O 3.31Å; L216-Y243 HydrophobicContact CD2-CD2 3.59Å; L216-Y243 HydrophobicContact CD2-CE2 4.44Å; L216-Y243 HydrophobicContact CD2-CG 4.09Å; L216-L246 HydrophobicContact CB-CD1 3.85Å; L216-L246 HydrophobicContact CD2-CD1 3.86Å; L216-L246 HydrophobicContact CG-CD1 4.29Å; L216-I251 HydrophobicContact CD1-CG1 4.31Å; L216-I251 HydrophobicContact CD1-CG2 4.14Å; L216-Y254 HydrophobicContact CD1-CD1 3.71Å; L216-Y254 HydrophobicContact CD1-CE1 4.15Å; L216-Y254 HydrophobicContact CD1-CG 4.05Å; L216-Y254 HydrophobicContact CD2-CD1 4.34Å; L216-Y254 HydrophobicContact CD2-CD2 4.14Å; L216-Y254 HydrophobicContact CD2-CE1 4.32Å; L216-Y254 HydrophobicContact CD2-CE2 4.12Å; L216-Y254 HydrophobicContact CD2-CG 4.27Å; L216-F255 HydrophobicContact CD1-CE2 4.03Å; L216-F255 HydrophobicContact CD1-CZ 3.92Å
217	V	97	Very high	93	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	117.9	-177.1	-178.4	0	0	0	0	109.4	L191 M200 I215 S221 I224 V242 Y243 Q244 G245 L246	L191-V217 HydrophobicContact CB-CG2 4.25Å; L191-V217 HydrophobicContact CD1-CG2 4.21Å; M200-V217 HydrophobicContact CE-CG1 3.55Å; M200-V217 HydrophobicContact CE-CG2 4.38Å; M200-V217 HydrophobicContact SD-CG1 4.44Å; M200-V217 HydrophobicContact SD-CG2 4.23Å; I215-V217 HydrophobicContact CG2-CG2 4.18Å; V217-S221 VanDerWaalsContact CG1-CB 3.42Å; V217-I224 HydrophobicContact CG1-CG2 4.42Å; V217-I224 HydrophobicContact CG2-CG2 4.09Å; V217-V242 HydrophobicContact CG2-CG1 4.1Å; V217-Y243 WeakPolarHBondContact CB-O 3.31Å; V217-Y243 PolarHBondContact N-O 3.2Å; V217-Q244 HydrophobicContact CB-CB 4.31Å; V217-Q244 HydrophobicContact CG1-CG 4.45Å; V217-G245 PolarHBondContact O-N 3.43Å; V217-L246 PolarHBondContact O-N 3.01Å
218	T	95.9	Very high	92.8	Very high	5 Å²	5	34.1 Å²	34.1	3%	0.031	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	157.8	-177	65.8	0	0	0	0	111.9	I190 L191 D192 R193 S221 L246 W248 I251	I190-T218 HydrophobicContact CG2-CG2 4.36Å; L191-T218 PolarHBondContact O-N 3.48Å; L191-T218 PolarHBondContact O-OG1 2.92Å; D192-T218 WeakPolarHBondContact CA-OG1 3.48Å; D192-T218 HydrophobicContact CB-CG2 4.38Å; D192-T218 PolarHBondContact OD1-OG1 3.44Å; R193-T218 PolarHBondContact N-OG1 3.14Å; T218-S221 WeakPolarHBondContact O-CB 3.37Å; T218-S221 PolarHBondContact O-N 2.69Å; T218-S221 PolarHBondContact O-OG 3.13Å; T218-S221 VanDerWaalsContact O-OG 3.08Å; T218-L246 CarbonylContact C-O 3.59Å; T218-L246 WeakPolarHBondContact CA-O 3.21Å; T218-W248 HydrophobicContact CG2-CH2 4.29Å; T218-W248 HydrophobicContact CG2-CZ2 3.81Å; T218-I251 HydrophobicContact CG2-CD1 3.7Å
219	K	93.2	Very high	92.9	Very high	127 Å²	127	33.1 Å²	33.1	55%	0.552	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	144.7	164.6	-69.1	178.6	-175.1	178.1	0	110.1	G245 L246	K219-G245 WeakPolarHBondContact CE-O 3.31Å; K219-G245 VanDerWaalsContact CG-C 3.49Å; K219-G245 WeakPolarHBondContact CG-O 3.34Å; K219-L246 PolarHBondContact N-O 3.02Å
220	G	91.5	Very high	92.9	Very high	53 Å²	53	29 Å²	29	55%	0.546	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	85	5.3	-176.5	0	0	0	0	0	114.8	N195	N195-G220 PolarHBondContact OD1-O 2.9Å
221	S	94.5	Very high	92.9	Very high	19 Å²	19	33.4 Å²	33.4	13%	0.133	17%	0.172	C	C	.	.	S	Bend	trans	-90	162.7	168.1	-56.7	0	0	0	0	112.1	R193 I194 V217 T218	R193-S221 VanDerWaalsContact CA-OG 3.26Å; R193-S221 WeakPolarHBondContact CA-OG 3.34Å; R193-S221 PolarHBondContact N-OG 2.85Å; I194-S221 PolarHBondContact N-OG 3.06Å; I194-S221 VanDerWaalsContact N-OG 3.17Å; I194-S221 CarbonylContact O-C 3.54Å; I194-S221 VanDerWaalsContact O-CA 3.3Å; I194-S221 WeakPolarHBondContact O-CA 3.46Å; I194-S221 WeakPolarHBondContact O-CB 3.31Å; V217-S221 VanDerWaalsContact CG1-CB 3.42Å; T218-S221 WeakPolarHBondContact O-CB 3.37Å; T218-S221 PolarHBondContact O-N 2.69Å; T218-S221 PolarHBondContact O-OG 3.13Å; T218-S221 VanDerWaalsContact O-OG 3.08Å
222	V	93.5	Very high	93.1	Very high	25 Å²	25	33.8 Å²	33.8	15%	0.152	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-60.5	143	172.5	68.1	0	0	0	0	111.7	I194 P197 M200 I224 V229 Q244	I194-V222 WeakPolarHBondContact O-CG1 3.47Å; I194-V222 PolarHBondContact O-N 3.27Å; P197-V222 HydrophobicContact CB-CG2 4.25Å; M200-V222 HydrophobicContact CB-CG1 3.57Å; M200-V222 HydrophobicContact CE-CG1 3.94Å; M200-V222 HydrophobicContact CG-CG1 3.78Å; V222-I224 PolarHBondContact O-N 2.94Å; V222-V229 HydrophobicContact CG1-CG2 4.08Å; V222-V229 HydrophobicContact CG2-CG2 4.31Å; V222-Q244 PolarHBondContact O-NE2 3.26Å
223	N	91.8	Very high	93.2	Very high	56 Å²	56	33.5 Å²	33.5	30%	0.299	17%	0.172	S	C	.	.	P	Polyproline II helix	trans	-56.3	121.6	175.6	-175.8	-7.9	0	0	0	110.8	W225 N226 Q244	N223-W225 PolarHBondContact O-N 3.17Å; N223-W225 PolarHBondContact OD1-N 3.27Å; N223-N226 VanDerWaalsContact O-CB 3.24Å; N223-N226 WeakPolarHBondContact O-CB 3.44Å; N223-N226 PolarHBondContact O-N 3.4Å; N223-N226 VanDerWaalsContact O-N 3.14Å; N223-Q244 VanDerWaalsContact CA-NE2 3.33Å; N223-Q244 PolarHBondContact OD1-OE1 3.28Å
224	I	93.1	Very high	93.3	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.01	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-22.2	-177.6	71.5	179.8	0	0	0	112.1	M200 I204 V217 V222 N226 V229 H237 V242 Q244	M200-I224 HydrophobicContact CE-CG2 4.47Å; M200-I224 HydrophobicContact CG-CG2 4.33Å; M200-I224 HydrophobicContact SD-CG2 4.09Å; I204-I224 HydrophobicContact CD1-CB 4.22Å; I204-I224 HydrophobicContact CD1-CG2 4.15Å; V217-I224 HydrophobicContact CG1-CG2 4.42Å; V217-I224 HydrophobicContact CG2-CG2 4.09Å; V222-I224 PolarHBondContact O-N 2.94Å; I224-N226 VanDerWaalsContact C-N 3.3Å; I224-V229 WeakPolarHBondContact O-CG1 3.34Å; I224-H237 PolarHBondContact O-NE2 3.46Å; I224-H237 VanDerWaalsContact O-NE2 3.14Å; I224-V242 HydrophobicContact CD1-CB 4.07Å; I224-V242 HydrophobicContact CD1-CG1 3.58Å; I224-V242 HydrophobicContact CG2-CG1 4.49Å; I224-Q244 HydrophobicContact CD1-CB 3.97Å; I224-Q244 HydrophobicContact CG1-CB 4.32Å; I224-Q244 HydrophobicContact CG2-CB 4.31Å; I224-Q244 HydrophobicContact CG2-CG 4.46Å
225	W	91	Very high	93.2	Very high	32 Å²	32	39 Å²	39	12%	0.121	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	9	179.1	-56.6	106.6	0	0	0	113.3	I103 L170 P171 F176 N223 I230 H237 F238	I103-W225 HydrophobicContact CD1-CE3 3.78Å; I103-W225 HydrophobicContact CD1-CZ3 3.82Å; I103-W225 HydrophobicContact CG2-CB 4.05Å; I103-W225 HydrophobicContact CG2-CD2 4.43Å; I103-W225 HydrophobicContact CG2-CE3 4.33Å; I103-W225 HydrophobicContact CG2-CG 4.34Å; L170-W225 HydrophobicContact CD1-CB 4.3Å; L170-W225 HydrophobicContact CD1-CD2 3.55Å; L170-W225 HydrophobicContact CD1-CE3 4.22Å; L170-W225 HydrophobicContact CD1-CG 3.55Å; L170-W225 HydrophobicContact CD1-CZ2 4.28Å; P171-W225 HydrophobicContact CG-CH2 4.01Å; F176-W225 HydrophobicContact CZ-CH2 4.44Å; N223-W225 PolarHBondContact O-N 3.17Å; N223-W225 PolarHBondContact OD1-N 3.27Å; W225-I230 HydrophobicContact CE3-CD1 4.26Å; W225-I230 WeakPolarHBondContact O-CD1 3.48Å; W225-H237 HydrophobicContact CH2-CB 4.38Å; W225-H237 HydrophobicContact CZ3-CB 4.2Å; W225-F238 HydrophobicContact CH2-CE1 4.28Å; W225-F238 AromaticContact CZ3-CE1 3.99Å; W225-F238 HydrophobicContact CZ3-CE1 3.99Å; W225-F238 HydrophobicContact CZ3-CZ 4.07Å
226	N	88.1	Confident	93	Very high	30 Å²	30	39.1 Å²	39.1	16%	0.16	20%	0.201	C	C	.	.	S	Bend	trans	-63.9	140.5	169.3	-179.6	-69.7	0	0	0	110.5	N223 I224 K228 V229 I230	N223-N226 VanDerWaalsContact O-CB 3.24Å; N223-N226 WeakPolarHBondContact O-CB 3.44Å; N223-N226 PolarHBondContact O-N 3.4Å; N223-N226 VanDerWaalsContact O-N 3.14Å; I224-N226 VanDerWaalsContact C-N 3.3Å; N226-K228 VanDerWaalsContact C-N 3.25Å; N226-K228 PolarHBondContact O-N 3Å; N226-K228 VanDerWaalsContact O-N 3.16Å; N226-K228 WeakPolarHBondContact OD1-CB 3.35Å; N226-K228 PolarHBondContact OD1-N 3.11Å; N226-V229 HydrophobicContact CB-CB 4.37Å; N226-V229 HydrophobicContact CB-CG2 3.97Å; N226-V229 WeakPolarHBondContact O-CB 3.24Å; N226-V229 PolarHBondContact O-N 3.05Å; N226-I230 WeakPolarHBondContact O-CG1 3.48Å; N226-I230 PolarHBondContact O-N 3.12Å
227	E	89	Confident	92.8	Very high	70 Å²	70	39.1 Å²	39.1	33%	0.327	20%	0.201	S	C	.	.	H	α-helix	trans	-53	-37.1	-179.6	55.1	168.2	-161.2	0	0	114.4	S157 R231	S157-E227 WeakPolarHBondContact CB-OE2 3.41Å; S157-E227 PolarHBondContact OG-OE2 3.25Å; E227-R231 VanDerWaalsContact O-CB 3.22Å; E227-R231 WeakPolarHBondContact O-CB 3.35Å; E227-R231 PolarHBondContact O-N 3.38Å
228	K	91.5	Very high	92.5	Very high	123 Å²	123	39.7 Å²	39.7	54%	0.535	20%	0.204	S	C	.	.	H	α-helix	trans	-70.6	-40	178.5	-66	-176.9	-178.6	178	0	110.7	P197 N226 R231 A232	P197-K228 HydrophobicContact CB-CB 3.9Å; P197-K228 HydrophobicContact CG-CB 4.25Å; P197-K228 HydrophobicContact CG-CD 4.16Å; N226-K228 VanDerWaalsContact C-N 3.25Å; N226-K228 PolarHBondContact O-N 3Å; N226-K228 VanDerWaalsContact O-N 3.16Å; N226-K228 WeakPolarHBondContact OD1-CB 3.35Å; N226-K228 PolarHBondContact OD1-N 3.11Å; K228-R231 PolarHBondContact O-N 3.21Å; K228-A232 WeakPolarHBondContact O-CB 3.36Å; K228-A232 PolarHBondContact O-N 2.96Å
229	V	94.9	Very high	92.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66.6	-48.8	177.4	-177.7	0	0	0	0	110.2	P197 M200 G201 I204 V222 I224 N226 R231 A232 G233 H237	P197-V229 HydrophobicContact CB-CG2 3.49Å; P197-V229 VanDerWaalsContact CB-CG2 3.49Å; M200-V229 HydrophobicContact CB-CG1 4.13Å; M200-V229 HydrophobicContact CB-CG2 4.28Å; M200-V229 HydrophobicContact CG-CG1 3.58Å; M200-V229 HydrophobicContact CG-CG2 4.25Å; G201-V229 WeakPolarHBondContact CA-O 3.3Å; I204-V229 HydrophobicContact CD1-CG1 4.23Å; V222-V229 HydrophobicContact CG1-CG2 4.08Å; V222-V229 HydrophobicContact CG2-CG2 4.31Å; I224-V229 WeakPolarHBondContact O-CG1 3.34Å; N226-V229 HydrophobicContact CB-CB 4.37Å; N226-V229 HydrophobicContact CB-CG2 3.97Å; N226-V229 WeakPolarHBondContact O-CB 3.24Å; N226-V229 PolarHBondContact O-N 3.05Å; V229-R231 VanDerWaalsContact C-N 3.27Å; V229-R231 PolarHBondContact O-N 2.92Å; V229-A232 PolarHBondContact O-N 3Å; V229-G233 PolarHBondContact O-N 3.44Å; V229-H237 PolarHBondContact O-CE1 2.82Å
230	I	93.5	Very high	91.9	Very high	6 Å²	6	41 Å²	41	3%	0.031	21%	0.205	C	C	.	.	H	α-helix	trans	-55.5	-45.4	176.8	-68.4	173.6	0	0	0	110.7	L105 L110 W225 N226 G233 M234	L105-I230 HydrophobicContact CD2-CD1 4.08Å; L105-I230 HydrophobicContact CD2-CG2 3.9Å; L110-I230 HydrophobicContact CD1-CG2 4.09Å; L110-I230 HydrophobicContact CD2-CG2 3.56Å; L110-I230 HydrophobicContact CG-CG2 4.39Å; W225-I230 HydrophobicContact CE3-CD1 4.26Å; W225-I230 WeakPolarHBondContact O-CD1 3.48Å; N226-I230 WeakPolarHBondContact O-CG1 3.48Å; N226-I230 PolarHBondContact O-N 3.12Å; I230-G233 PolarHBondContact O-N 3.17Å; I230-M234 PolarHBondContact O-N 3.29Å
231	R	92.7	Very high	91.8	Very high	121 Å²	121	39.2 Å²	39.2	46%	0.457	18%	0.184	S	C	.	.	H	α-helix	trans	-65	-48.3	179.5	-163.5	-169.7	-48.7	-179.4	-0.3	112.1	L158 E227 K228 V229 G233 M234	L158-R231 VanDerWaalsContact CD2-NH1 3.33Å; L158-R231 VanDerWaalsContact CD2-NH2 3.32Å; E227-R231 VanDerWaalsContact O-CB 3.22Å; E227-R231 WeakPolarHBondContact O-CB 3.35Å; E227-R231 PolarHBondContact O-N 3.38Å; K228-R231 PolarHBondContact O-N 3.21Å; V229-R231 VanDerWaalsContact C-N 3.27Å; V229-R231 PolarHBondContact O-N 2.92Å; R231-G233 VanDerWaalsContact C-N 3.27Å; R231-G233 PolarHBondContact O-N 2.89Å; R231-M234 WeakPolarHBondContact O-CG 3.41Å; R231-M234 PolarHBondContact O-N 3.44Å
232	A	95.5	Very high	91.7	Very high	26 Å²	26	38.6 Å²	38.6	22%	0.215	18%	0.179	C	C	.	.	H	α-helix	trans	-63.7	-34	176.5	0	0	0	0	0	112.1	K228 V229 M234	K228-A232 WeakPolarHBondContact O-CB 3.36Å; K228-A232 PolarHBondContact O-N 2.96Å; V229-A232 PolarHBondContact O-N 3Å; A232-M234 VanDerWaalsContact C-N 3.25Å; A232-M234 PolarHBondContact O-N 3.03Å
233	G	95.6	Very high	91.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-65.5	-21.7	175.8	0	0	0	0	0	114.8	G201 R205 V229 I230 R231 S235 G236	G201-G233 VanDerWaalsContact O-CA 3.23Å; G201-G233 WeakPolarHBondContact O-CA 3.27Å; R205-G233 WeakPolarHBondContact CB-O 3.35Å; V229-G233 PolarHBondContact O-N 3.44Å; I230-G233 PolarHBondContact O-N 3.17Å; R231-G233 VanDerWaalsContact C-N 3.27Å; R231-G233 PolarHBondContact O-N 2.89Å; G233-S235 VanDerWaalsContact C-N 3.32Å; G233-S235 PolarHBondContact O-N 3.18Å; G233-G236 PolarHBondContact O-N 3.09Å
234	M	91.9	Very high	91.7	Very high	116 Å²	116	39.1 Å²	39.1	57%	0.571	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	44.8	53.1	179.8	-66.8	-170.2	63.5	0	0	113.3	R205 I230 R231 A232 G236	R205-M234 PolarHBondContact NH1-SD 2.86Å; I230-M234 PolarHBondContact O-N 3.29Å; R231-M234 WeakPolarHBondContact O-CG 3.41Å; R231-M234 PolarHBondContact O-N 3.44Å; A232-M234 VanDerWaalsContact C-N 3.25Å; A232-M234 PolarHBondContact O-N 3.03Å; M234-G236 VanDerWaalsContact C-N 3.28Å; M234-G236 PolarHBondContact O-N 2.93Å
235	S	90.9	Very high	91.7	Very high	7 Å²	7	40.6 Å²	40.6	5%	0.049	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	73	3.6	-176.6	-35.2	0	0	0	0	116.2	D113 G233 H237 F238	D113-S235 WeakPolarHBondContact OD2-CB 3.48Å; D113-S235 PolarHBondContact OD2-OG 3.33Å; G233-S235 VanDerWaalsContact C-N 3.32Å; G233-S235 PolarHBondContact O-N 3.18Å; S235-H237 PolarHBondContact O-N 3.49Å; S235-F238 PolarHBondContact O-N 3.26Å
236	G	92.3	Very high	91.8	Very high	3 Å²	3	40.3 Å²	40.3	3%	0.031	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-53.4	-37.9	175.5	0	0	0	0	0	113.6	G233 M234 F238 R239 I240	G233-G236 PolarHBondContact O-N 3.09Å; M234-G236 VanDerWaalsContact C-N 3.28Å; M234-G236 PolarHBondContact O-N 2.93Å; G236-F238 PolarHBondContact O-N 2.77Å; G236-R239 PolarHBondContact O-N 3.23Å; G236-I240 PolarHBondContact O-N 2.79Å
237	H	90.9	Very high	92.1	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-52.8	-27	175.1	-61.2	82.7	0	0	0	114.5	F176 I204 I224 W225 V229 S235	F176-H237 VanDerWaalsContact CE1-O 3.32Å; F176-H237 WeakPolarHBondContact CE1-O 3.17Å; I204-H237 VanDerWaalsContact CD1-NE2 3.26Å; I204-H237 WeakPolarHBondContact CD1-NE2 3.37Å; I224-H237 PolarHBondContact O-NE2 3.46Å; I224-H237 VanDerWaalsContact O-NE2 3.14Å; W225-H237 HydrophobicContact CH2-CB 4.38Å; W225-H237 HydrophobicContact CZ3-CB 4.2Å; V229-H237 PolarHBondContact O-CE1 2.82Å; S235-H237 PolarHBondContact O-N 3.49Å
238	F	90.3	Very high	92.3	Very high	12 Å²	12	38 Å²	38	5%	0.053	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-101.9	8.3	-176.8	-56	-62.1	0	0	0	112.7	I103 L105 L110 D113 A114 T117 P171 F176 W225 S235 G236	I103-F238 HydrophobicContact CD1-CZ 4.35Å; L105-F238 HydrophobicContact CD1-CE1 4.47Å; L105-F238 HydrophobicContact CD1-CE2 3.74Å; L105-F238 HydrophobicContact CD1-CZ 3.5Å; L105-F238 HydrophobicContact CD2-CE2 4.16Å; L105-F238 HydrophobicContact CD2-CZ 3.95Å; L105-F238 HydrophobicContact CG-CZ 4.4Å; L110-F238 HydrophobicContact CD1-CD2 4Å; L110-F238 HydrophobicContact CD1-CE2 3.62Å; L110-F238 HydrophobicContact CG-CE2 4.26Å; D113-F238 HydrophobicContact CB-CB 4.4Å; A114-F238 HydrophobicContact CB-CD1 3.95Å; A114-F238 HydrophobicContact CB-CD2 4.02Å; A114-F238 HydrophobicContact CB-CE1 3.79Å; A114-F238 HydrophobicContact CB-CE2 3.86Å; A114-F238 HydrophobicContact CB-CG 4.07Å; A114-F238 HydrophobicContact CB-CZ 3.76Å; T117-F238 HydrophobicContact CG2-CB 3.85Å; T117-F238 HydrophobicContact CG2-CD1 4.42Å; T117-F238 VanDerWaalsContact CG2-O 3.32Å; T117-F238 WeakPolarHBondContact CG2-O 3.35Å; P171-F238 HydrophobicContact CG-CE1 4.22Å; F176-F238 HydrophobicContact CE1-CD1 4.46Å; W225-F238 HydrophobicContact CH2-CE1 4.28Å; W225-F238 AromaticContact CZ3-CE1 3.99Å; W225-F238 HydrophobicContact CZ3-CE1 3.99Å; W225-F238 HydrophobicContact CZ3-CZ 4.07Å; S235-F238 PolarHBondContact O-N 3.26Å; G236-F238 PolarHBondContact O-N 2.77Å
239	R	88.7	Confident	92.3	Very high	154 Å²	154	33.4 Å²	33.4	58%	0.581	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-121.9	-15.4	-174.9	-64.2	-163.9	-178.4	-158.4	4.7	114.5	D113 A208 G236	D113-R239 IonicContact OD1-NH2 3.8Å; D113-R239 IonicContact OD2-CZ 3.97Å; D113-R239 IonicContact OD2-NE 2.66Å; D113-R239 PolarHBondContact OD2-NE 2.86Å; D113-R239 IonicContact OD2-NH2 3.36Å; D113-R239 PolarHBondContact OD2-NH2 3.37Å; A208-R239 HydrophobicContact CB-CB 4.08Å; G236-R239 PolarHBondContact O-N 3.23Å
240	I	88.4	Confident	92.1	Very high	4 Å²	4	35.9 Å²	35.9	2%	0.021	18%	0.179	C	C	.	.	S	Bend	trans	-139.8	143.6	177.5	-172.1	169	0	0	0	109.1	A208 L212 I215 G236 V242	A208-I240 HydrophobicContact CB-CB 4.3Å; A208-I240 HydrophobicContact CB-CG2 3.87Å; L212-I240 HydrophobicContact CB-CD1 3.51Å; L212-I240 WeakPolarHBondContact O-CD1 3.5Å; I215-I240 HydrophobicContact CD1-CD1 4.28Å; I215-I240 HydrophobicContact CD1-CG2 3.99Å; I215-I240 HydrophobicContact CG1-CD1 3.89Å; I215-I240 HydrophobicContact CG1-CG2 4.37Å; G236-I240 PolarHBondContact O-N 2.79Å; I240-V242 HydrophobicContact CG2-CG2 3.94Å; I240-V242 PolarHBondContact O-N 3.23Å
241	P	90.1	Very high	92.1	Very high	16 Å²	16	35.6 Å²	35.6	10%	0.104	18%	0.178	C	C	.	.			trans	-60.1	124	170.7	-22.7	34.2	0	0	0	110.8	F176 S214 I215 Y243	F176-P241 HydrophobicContact CB-CB 4.31Å; F176-P241 HydrophobicContact CB-CG 4.03Å; S214-P241 WeakPolarHBondContact CA-O 3.34Å; I215-P241 PolarHBondContact N-O 3.14Å; P241-Y243 HydrophobicContact CB-CE2 3.71Å
242	V	92.2	Very high	92	Very high	7 Å²	7	31 Å²	31	4%	0.042	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	120.7	174.8	-170.6	0	0	0	0	109.2	I204 I215 V217 I224 I240	I204-V242 HydrophobicContact CD1-CG1 4.35Å; I204-V242 HydrophobicContact CG2-CG2 4.24Å; I215-V242 HydrophobicContact CB-CG1 4.19Å; I215-V242 HydrophobicContact CB-CG2 4.23Å; I215-V242 HydrophobicContact CD1-CG2 4.42Å; I215-V242 HydrophobicContact CG2-CG1 4.29Å; I215-V242 WeakPolarHBondContact O-CA 3.47Å; V217-V242 HydrophobicContact CG2-CG1 4.1Å; I224-V242 HydrophobicContact CD1-CB 4.07Å; I224-V242 HydrophobicContact CD1-CG1 3.58Å; I224-V242 HydrophobicContact CG2-CG1 4.49Å; I240-V242 HydrophobicContact CG2-CG2 3.94Å; I240-V242 PolarHBondContact O-N 3.23Å
243	Y	92.7	Very high	91.7	Very high	47 Å²	47	37.4 Å²	37.4	18%	0.184	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	128.2	179.4	-57.8	-92.3	0	0	0	109	Q173 I215 L216 V217 P241 Y254	Q173-Y243 HydrophobicContact CB-CD1 4.1Å; Q173-Y243 HydrophobicContact CB-CE1 3.99Å; Q173-Y243 HydrophobicContact CG-CD1 4.28Å; I215-Y243 PolarHBondContact O-N 2.74Å; L216-Y243 HydrophobicContact CD2-CD2 3.59Å; L216-Y243 HydrophobicContact CD2-CE2 4.44Å; L216-Y243 HydrophobicContact CD2-CG 4.09Å; V217-Y243 WeakPolarHBondContact CB-O 3.31Å; V217-Y243 PolarHBondContact N-O 3.2Å; P241-Y243 HydrophobicContact CB-CE2 3.71Å; Y243-Y254 HydrophobicContact CD2-CE2 4.43Å; Y243-Y254 AromaticContact CE2-CE2 3.99Å; Y243-Y254 HydrophobicContact CE2-CE2 3.99Å
244	Q	92.8	Very high	91.4	Very high	44 Å²	44	41.4 Å²	41.4	21%	0.206	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	150.9	-177.3	171.3	165.3	51.1	0	0	112.4	V217 V222 N223 I224	V217-Q244 HydrophobicContact CB-CB 4.31Å; V217-Q244 HydrophobicContact CG1-CG 4.45Å; V222-Q244 PolarHBondContact O-NE2 3.26Å; N223-Q244 VanDerWaalsContact CA-NE2 3.33Å; N223-Q244 PolarHBondContact OD1-OE1 3.28Å; I224-Q244 HydrophobicContact CD1-CB 3.97Å; I224-Q244 HydrophobicContact CG1-CB 4.32Å; I224-Q244 HydrophobicContact CG2-CB 4.31Å; I224-Q244 HydrophobicContact CG2-CG 4.46Å
245	G	91.9	Very high	91.3	Very high	34 Å²	34	36.8 Å²	36.8	35%	0.351	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	85.1	24	170.4	0	0	0	0	0	111.6	V217 K219	V217-G245 PolarHBondContact O-N 3.43Å; K219-G245 WeakPolarHBondContact CE-O 3.31Å; K219-G245 VanDerWaalsContact CG-C 3.49Å; K219-G245 WeakPolarHBondContact CG-O 3.34Å
246	L	93.8	Very high	91	Very high	26 Å²	26	38.3 Å²	38.3	14%	0.136	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	132.5	-175.4	-58.1	178	0	0	0	110.4	L216 V217 T218 K219 D250 I251	L216-L246 HydrophobicContact CB-CD1 3.85Å; L216-L246 HydrophobicContact CD2-CD1 3.86Å; L216-L246 HydrophobicContact CG-CD1 4.29Å; V217-L246 PolarHBondContact O-N 3.01Å; T218-L246 CarbonylContact C-O 3.59Å; T218-L246 WeakPolarHBondContact CA-O 3.21Å; K219-L246 PolarHBondContact N-O 3.02Å; L246-D250 HydrophobicContact CB-CB 4.17Å; L246-D250 HydrophobicContact CD2-CB 3.99Å; L246-I251 HydrophobicContact CB-CD1 4.34Å; L246-I251 HydrophobicContact CB-CG1 3.94Å; L246-I251 HydrophobicContact CD1-CG1 4.08Å
247	S	94.4	Very high	90.5	Very high	29 Å²	29	39.5 Å²	39.5	20%	0.203	20%	0.197	C	C	.	.			trans	-73.8	163.2	159.6	65.9	0	0	0	0	110	T249 D250 I251	S247-T249 PolarHBondContact O-N 3.19Å; S247-D250 WeakPolarHBondContact CB-OD2 3.26Å; S247-D250 PolarHBondContact N-OD2 3.3Å; S247-D250 WeakPolarHBondContact O-CB 3.17Å; S247-D250 PolarHBondContact O-N 2.87Å; S247-D250 PolarHBondContact OG-N 2.97Å; S247-D250 PolarHBondContact OG-OD2 2.83Å; S247-I251 PolarHBondContact O-N 2.88Å; S247-I251 VanDerWaalsContact O-N 3.09Å
248	W	93.1	Very high	89.5	Confident	22 Å²	22	43.1 Å²	43.1	8%	0.083	22%	0.222	C	C	.	.	H	α-helix	trans	-60.5	-31.5	173.3	-74.9	106.7	0	0	0	112.5	I190 D192 T218 D250 I251 S252 L312 V352 S361 E363 A364 L367	I190-W248 HydrophobicContact CG2-CH2 3.95Å; I190-W248 HydrophobicContact CG2-CZ3 4.18Å; D192-W248 HydrophobicContact CB-CZ2 4.18Å; T218-W248 HydrophobicContact CG2-CH2 4.29Å; T218-W248 HydrophobicContact CG2-CZ2 3.81Å; W248-D250 PolarHBondContact O-N 3.02Å; W248-I251 HydrophobicContact CD2-CD1 4.26Å; W248-I251 HydrophobicContact CE3-CB 4.38Å; W248-I251 HydrophobicContact CE3-CD1 3.85Å; W248-I251 HydrophobicContact CE3-CG2 4.3Å; W248-I251 HydrophobicContact CZ3-CD1 4Å; W248-I251 HydrophobicContact CZ3-CG2 4.34Å; W248-I251 PolarHBondContact O-N 3.36Å; W248-S252 PolarHBondContact O-N 2.83Å; W248-S252 PolarHBondContact O-OG 2.94Å; W248-L312 HydrophobicContact CB-CD1 4.07Å; W248-V352 HydrophobicContact CH2-CG1 4Å; W248-V352 HydrophobicContact CH2-CG2 4.41Å; W248-S361 WeakPolarHBondContact CZ2-OG 3.36Å; W248-S361 PolarHBondContact NE1-OG 2.83Å; W248-E363 HydrophobicContact CB-CB 4.04Å; W248-E363 HydrophobicContact CB-CG 4.49Å; W248-E363 HydrophobicContact CD2-CB 3.73Å; W248-E363 HydrophobicContact CG-CB 3.39Å; W248-E363 HydrophobicContact CG-CG 4.06Å; W248-A364 HydrophobicContact CH2-CB 3.42Å; W248-A364 VanDerWaalsContact CH2-CB 3.42Å; W248-A364 HydrophobicContact CZ2-CB 3.69Å; W248-A364 HydrophobicContact CZ3-CB 4.11Å; W248-L367 HydrophobicContact CE3-CD2 4.09Å; W248-L367 HydrophobicContact CZ3-CD2 3.8Å
249	T	90.8	Very high	87.8	Confident	26 Å²	26	45.5 Å²	45.5	16%	0.16	24%	0.235	C	C	.	.	H	α-helix	trans	-61.1	-41.7	170.2	-49.1	0	0	0	0	112.7	S247 I251 S252 R253 V309	S247-T249 PolarHBondContact O-N 3.19Å; T249-I251 VanDerWaalsContact C-N 3.3Å; T249-I251 PolarHBondContact O-N 3.35Å; T249-S252 PolarHBondContact O-N 3.45Å; T249-R253 VanDerWaalsContact CG2-CZ 3.46Å; T249-R253 WeakPolarHBondContact O-CG 3.47Å; T249-R253 PolarHBondContact O-N 3.24Å; T249-V309 HydrophobicContact CG2-CG1 3.6Å
250	D	92.2	Very high	86.1	Confident	52 Å²	52	44.8 Å²	44.8	28%	0.278	25%	0.254	S	S	.	.	H	α-helix	trans	-66.5	-36.4	177.8	-55.9	-45.1	0	0	0	111.2	L246 S247 W248 R253 Y254	L246-D250 HydrophobicContact CB-CB 4.17Å; L246-D250 HydrophobicContact CD2-CB 3.99Å; S247-D250 WeakPolarHBondContact CB-OD2 3.26Å; S247-D250 PolarHBondContact N-OD2 3.3Å; S247-D250 WeakPolarHBondContact O-CB 3.17Å; S247-D250 PolarHBondContact O-N 2.87Å; S247-D250 PolarHBondContact OG-N 2.97Å; S247-D250 PolarHBondContact OG-OD2 2.83Å; W248-D250 PolarHBondContact O-N 3.02Å; D250-R253 PolarHBondContact O-N 3.28Å; D250-R253 IonicContact OD1-NH1 3.69Å; D250-R253 PolarHBondContact OD1-NH1 2.77Å; D250-Y254 WeakPolarHBondContact O-CB 3.18Å; D250-Y254 PolarHBondContact O-N 3.24Å
251	I	92.6	Very high	84.5	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-65.8	-45.7	174.7	-67.1	172.1	0	0	0	110.9	I190 L216 T218 L246 S247 W248 T249 R253 Y254 F255 L367	I190-I251 HydrophobicContact CD1-CG2 3.86Å; I190-I251 HydrophobicContact CG2-CD1 3.91Å; L216-I251 HydrophobicContact CD1-CG1 4.31Å; L216-I251 HydrophobicContact CD1-CG2 4.14Å; T218-I251 HydrophobicContact CG2-CD1 3.7Å; L246-I251 HydrophobicContact CB-CD1 4.34Å; L246-I251 HydrophobicContact CB-CG1 3.94Å; L246-I251 HydrophobicContact CD1-CG1 4.08Å; S247-I251 PolarHBondContact O-N 2.88Å; S247-I251 VanDerWaalsContact O-N 3.09Å; W248-I251 HydrophobicContact CD2-CD1 4.26Å; W248-I251 HydrophobicContact CE3-CB 4.38Å; W248-I251 HydrophobicContact CE3-CD1 3.85Å; W248-I251 HydrophobicContact CE3-CG2 4.3Å; W248-I251 HydrophobicContact CZ3-CD1 4Å; W248-I251 HydrophobicContact CZ3-CG2 4.34Å; W248-I251 PolarHBondContact O-N 3.36Å; T249-I251 VanDerWaalsContact C-N 3.3Å; T249-I251 PolarHBondContact O-N 3.35Å; I251-R253 VanDerWaalsContact C-N 3.32Å; I251-R253 PolarHBondContact O-N 3.07Å; I251-Y254 WeakPolarHBondContact O-CB 3.41Å; I251-Y254 PolarHBondContact O-N 3.16Å; I251-Y254 VanDerWaalsContact O-N 3.17Å; I251-F255 HydrophobicContact CG2-CD2 4.09Å; I251-F255 HydrophobicContact CG2-CE2 3.73Å; I251-F255 VanDerWaalsContact O-CD2 3.22Å; I251-F255 WeakPolarHBondContact O-CD2 3.43Å; I251-F255 PolarHBondContact O-N 3.23Å; I251-L367 HydrophobicContact CG2-CD2 3.84Å
252	S	90.9	Very high	82.9	Confident	25 Å²	25	51.5 Å²	51.5	18%	0.175	30%	0.301	C	S	.	.	H	α-helix	trans	-58.9	-44.2	175	-62.2	0	0	0	0	111.4	W248 T249 Y254 F255 G256 I257	W248-S252 PolarHBondContact O-N 2.83Å; W248-S252 PolarHBondContact O-OG 2.94Å; T249-S252 PolarHBondContact O-N 3.45Å; S252-Y254 VanDerWaalsContact C-N 3.34Å; S252-Y254 PolarHBondContact O-N 3.17Å; S252-F255 CarbonylContact O-C 3.54Å; S252-F255 PolarHBondContact O-N 3.46Å; S252-G256 PolarHBondContact O-N 2.89Å; S252-I257 WeakPolarHBondContact O-CB 3.02Å; S252-I257 PolarHBondContact O-N 3.05Å
253	R	89.2	Confident	81.6	Confident	160 Å²	160	52.7 Å²	52.7	60%	0.604	31%	0.31	S	S	*	.	H	α-helix	trans	-62	-38.8	174.9	-72.5	176.1	-173.4	138.3	0.7	112.7	T249 D250 I251 F255 G256	T249-R253 VanDerWaalsContact CG2-CZ 3.46Å; T249-R253 WeakPolarHBondContact O-CG 3.47Å; T249-R253 PolarHBondContact O-N 3.24Å; D250-R253 PolarHBondContact O-N 3.28Å; D250-R253 IonicContact OD1-NH1 3.69Å; D250-R253 PolarHBondContact OD1-NH1 2.77Å; I251-R253 VanDerWaalsContact C-N 3.32Å; I251-R253 PolarHBondContact O-N 3.07Å; R253-F255 PolarHBondContact O-N 3.4Å; R253-G256 PolarHBondContact O-N 3.48Å
254	Y	89.5	Confident	81.1	Confident	84 Å²	84	56 Å²	56	33%	0.329	33%	0.327	S	S	.	.	H	α-helix	trans	-56.9	-37.4	176.1	179.1	-88.6	0	0	0	111.8	T188 N213 S214 L216 Y243 D250 I251 S252 G256	T188-Y254 HydrophobicContact CG2-CE1 4.49Å; N213-Y254 PolarHBondContact ND2-OH 3.11Å; S214-Y254 WeakPolarHBondContact CB-OH 3.38Å; S214-Y254 PolarHBondContact OG-OH 3.35Å; S214-Y254 VanDerWaalsContact OG-OH 3.07Å; L216-Y254 HydrophobicContact CD1-CD1 3.71Å; L216-Y254 HydrophobicContact CD1-CE1 4.15Å; L216-Y254 HydrophobicContact CD1-CG 4.05Å; L216-Y254 HydrophobicContact CD2-CD1 4.34Å; L216-Y254 HydrophobicContact CD2-CD2 4.14Å; L216-Y254 HydrophobicContact CD2-CE1 4.32Å; L216-Y254 HydrophobicContact CD2-CE2 4.12Å; L216-Y254 HydrophobicContact CD2-CG 4.27Å; Y243-Y254 HydrophobicContact CD2-CE2 4.43Å; Y243-Y254 AromaticContact CE2-CE2 3.99Å; Y243-Y254 HydrophobicContact CE2-CE2 3.99Å; D250-Y254 WeakPolarHBondContact O-CB 3.18Å; D250-Y254 PolarHBondContact O-N 3.24Å; I251-Y254 WeakPolarHBondContact O-CB 3.41Å; I251-Y254 PolarHBondContact O-N 3.16Å; I251-Y254 VanDerWaalsContact O-N 3.17Å; S252-Y254 VanDerWaalsContact C-N 3.34Å; S252-Y254 PolarHBondContact O-N 3.17Å; Y254-G256 VanDerWaalsContact C-N 3.34Å
255	F	89	Confident	80.9	Confident	20 Å²	20	54 Å²	54	9%	0.088	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	6.2	175.9	-63.1	-60	0	0	0	114.5	T188 I190 L216 I251 S252 R253 I257 S263 V265 A350	T188-F255 HydrophobicContact CG2-CE1 4.27Å; T188-F255 HydrophobicContact CG2-CZ 3.82Å; I190-F255 HydrophobicContact CD1-CE2 3.77Å; I190-F255 HydrophobicContact CD1-CZ 4.1Å; L216-F255 HydrophobicContact CD1-CE2 4.03Å; L216-F255 HydrophobicContact CD1-CZ 3.92Å; I251-F255 HydrophobicContact CG2-CD2 4.09Å; I251-F255 HydrophobicContact CG2-CE2 3.73Å; I251-F255 VanDerWaalsContact O-CD2 3.22Å; I251-F255 WeakPolarHBondContact O-CD2 3.43Å; I251-F255 PolarHBondContact O-N 3.23Å; S252-F255 CarbonylContact O-C 3.54Å; S252-F255 PolarHBondContact O-N 3.46Å; R253-F255 PolarHBondContact O-N 3.4Å; F255-I257 HydrophobicContact CB-CD1 3.77Å; F255-I257 HydrophobicContact CB-CG1 3.89Å; F255-I257 HydrophobicContact CD2-CD1 4.4Å; F255-I257 HydrophobicContact CG-CD1 4.49Å; F255-I257 PolarHBondContact O-N 3.28Å; F255-S263 PolarHBondContact O-OG 3.34Å; F255-V265 HydrophobicContact CB-CB 4.48Å; F255-V265 HydrophobicContact CB-CG1 3.8Å; F255-V265 HydrophobicContact CD1-CB 4.07Å; F255-V265 HydrophobicContact CD1-CG1 4.08Å; F255-V265 HydrophobicContact CD1-CG2 3.79Å; F255-V265 HydrophobicContact CD2-CG1 4.42Å; F255-V265 HydrophobicContact CE1-CG2 3.91Å; F255-V265 HydrophobicContact CG-CB 4.36Å; F255-V265 HydrophobicContact CG-CG1 3.86Å; F255-V265 HydrophobicContact CG-CG2 4.35Å; F255-A350 HydrophobicContact CE1-CB 4.29Å; F255-A350 HydrophobicContact CE2-CB 4.24Å; F255-A350 HydrophobicContact CZ-CB 3.66Å
256	G	85.8	Confident	80.9	Confident	39 Å²	39	55.3 Å²	55.3	40%	0.402	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	23.4	-175.8	0	0	0	0	0	113.5	S252 R253 Y254 C258 S261	S252-G256 PolarHBondContact O-N 2.89Å; R253-G256 PolarHBondContact O-N 3.48Å; Y254-G256 VanDerWaalsContact C-N 3.34Å; G256-C258 PolarHBondContact O-N 3.47Å; G256-S261 PolarHBondContact O-OG 2.9Å; G256-S261 VanDerWaalsContact O-OG 3.12Å
257	I	82.1	Confident	81	Confident	28 Å²	28	54 Å²	54	14%	0.144	31%	0.31	C	S	.	.			trans	-76.5	93.7	176.4	-60.8	164	0	0	0	106.9	S252 F255 V265 L367 T371	S252-I257 WeakPolarHBondContact O-CB 3.02Å; S252-I257 PolarHBondContact O-N 3.05Å; F255-I257 HydrophobicContact CB-CD1 3.77Å; F255-I257 HydrophobicContact CB-CG1 3.89Å; F255-I257 HydrophobicContact CD2-CD1 4.4Å; F255-I257 HydrophobicContact CG-CD1 4.49Å; F255-I257 PolarHBondContact O-N 3.28Å; I257-V265 HydrophobicContact CD1-CG1 4.04Å; I257-L367 HydrophobicContact CD1-CD1 3.5Å; I257-T371 HydrophobicContact CD1-CG2 3.57Å; I257-T371 HydrophobicContact CG1-CG2 4.45Å
258	C	69	Low	81.1	Confident	77 Å²	77	53.2 Å²	53.2	52%	0.52	30%	0.302	S	S	.	.			trans	-120.9	152.7	166.7	56.1	0	0	0	0	109.9	G256 S260 S261	G256-C258 PolarHBondContact O-N 3.47Å; C258-S260 PolarHBondContact O-N 3.49Å; C258-S261 PolarHBondContact O-N 2.95Å; C258-S261 VanDerWaalsContact O-N 3.09Å; C258-S261 PolarHBondContact O-OG 2.79Å; C258-S261 VanDerWaalsContact O-OG 3.07Å; C258-S261 PolarHBondContact SG-OG 3.03Å; C258-S261 VanDerWaalsContact SG-OG 3.34Å
259	D	55	Low	81.1	Confident	61 Å²	61	52.1 Å²	52.1	33%	0.326	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.3	126	179.2	-68.2	-45.2	0	0	0	110.1	C306 A308	D259-C306 WeakPolarHBondContact OD2-CA 3.45Å; D259-A308 WeakPolarHBondContact OD1-CB 3.48Å; D259-A308 PolarHBondContact OD1-N 3.41Å
260	S	52.6	Low	81.3	Confident	139 Å²	139	51.6 Å²	51.6	97%	0.972	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	4.9	-179.2	68.6	0	0	0	0	119.4	C258	C258-S260 PolarHBondContact O-N 3.49Å
261	S	55	Low	81	Confident	54 Å²	54	49.6 Å²	49.6	38%	0.378	29%	0.286	S	S	.	.			trans	-100.5	131.4	167.5	70	0	0	0	0	111.8	G256 C258 S263	G256-S261 PolarHBondContact O-OG 2.9Å; G256-S261 VanDerWaalsContact O-OG 3.12Å; C258-S261 PolarHBondContact O-N 2.95Å; C258-S261 VanDerWaalsContact O-N 3.09Å; C258-S261 PolarHBondContact O-OG 2.79Å; C258-S261 VanDerWaalsContact O-OG 3.07Å; C258-S261 PolarHBondContact SG-OG 3.03Å; C258-S261 VanDerWaalsContact SG-OG 3.34Å; S261-S263 PolarHBondContact O-N 2.7Å; S261-S263 VanDerWaalsContact O-N 3.09Å
262	S	56.9	Low	80.4	Confident	107 Å²	107	52.8 Å²	52.8	75%	0.748	31%	0.306	S	S	*	.			trans	-74.1	98.9	167.1	-177.5	0	0	0	0	107.2	H264	S262-H264 PolarHBondContact O-N 3.07Å
263	S	64.5	Low	79.8	Confident	32 Å²	32	55.3 Å²	55.3	22%	0.224	32%	0.316	C	S	.	.			trans	-65.8	135	168.1	-175.5	0	0	0	0	108.5	F255 S261 V265	F255-S263 PolarHBondContact O-OG 3.34Å; S261-S263 PolarHBondContact O-N 2.7Å; S261-S263 VanDerWaalsContact O-N 3.09Å; S263-V265 PolarHBondContact O-N 3.09Å; S263-V265 WeakPolarHBondContact OG-CG1 3.45Å; S263-V265 PolarHBondContact OG-N 3.36Å
264	H	81.2	Confident	79.1	Confident	116 Å²	116	48.9 Å²	48.9	54%	0.537	30%	0.295	S	S	.	.	S	Bend	trans	-79	5.9	177.3	-65.4	-67	0	0	0	113.3	S262 R348	S262-H264 PolarHBondContact O-N 3.07Å; H264-R348 WeakPolarHBondContact O-CD 3.44Å
265	V	89.5	Confident	78.4	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.024	31%	0.312	C	S	.	.			trans	-89.1	137.6	176.9	80.8	0	0	0	0	110.6	F255 I257 S263 V267 R348 A350 T371	F255-V265 HydrophobicContact CB-CB 4.48Å; F255-V265 HydrophobicContact CB-CG1 3.8Å; F255-V265 HydrophobicContact CD1-CB 4.07Å; F255-V265 HydrophobicContact CD1-CG1 4.08Å; F255-V265 HydrophobicContact CD1-CG2 3.79Å; F255-V265 HydrophobicContact CD2-CG1 4.42Å; F255-V265 HydrophobicContact CE1-CG2 3.91Å; F255-V265 HydrophobicContact CG-CB 4.36Å; F255-V265 HydrophobicContact CG-CG1 3.86Å; F255-V265 HydrophobicContact CG-CG2 4.35Å; I257-V265 HydrophobicContact CD1-CG1 4.04Å; S263-V265 PolarHBondContact O-N 3.09Å; S263-V265 WeakPolarHBondContact OG-CG1 3.45Å; S263-V265 PolarHBondContact OG-N 3.36Å; V265-V267 HydrophobicContact CG1-CG2 4.08Å; V265-V267 HydrophobicContact CG2-CG2 4.42Å; V265-R348 CarbonylContact C-O 3.6Å; V265-R348 WeakPolarHBondContact CA-O 3.39Å; V265-A350 HydrophobicContact CG2-CB 4.34Å; V265-T371 HydrophobicContact CG1-CG2 3.92Å; V265-T371 WeakPolarHBondContact O-CB 3.33Å
266	I	92.7	Very high	77.7	Confident	60 Å²	60	53.9 Å²	53.9	31%	0.308	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.3	165.7	-56.4	176.3	0	0	0	107.7	F268 R348 L349 A350	I266-F268 HydrophobicContact CB-CE2 4.11Å; I266-F268 HydrophobicContact CB-CZ 4.42Å; I266-F268 HydrophobicContact CG2-CD2 4.33Å; I266-F268 HydrophobicContact CG2-CE1 4.2Å; I266-F268 HydrophobicContact CG2-CE2 3.57Å; I266-F268 HydrophobicContact CG2-CZ 3.5Å; I266-R348 PolarHBondContact N-O 3.09Å; I266-L349 HydrophobicContact CB-CD2 4.4Å; I266-L349 WeakPolarHBondContact O-CA 3.35Å; I266-A350 PolarHBondContact O-N 3.23Å
267	V	94.7	Very high	77	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	130.6	-178.6	-176.3	0	0	0	0	109.9	V265 A350 V352 L367 V368 T371 G373	V265-V267 HydrophobicContact CG1-CG2 4.08Å; V265-V267 HydrophobicContact CG2-CG2 4.42Å; V267-A350 CarbonylContact C-O 3.54Å; V267-A350 WeakPolarHBondContact CA-O 3.19Å; V267-A350 HydrophobicContact CB-CB 4.49Å; V267-A350 HydrophobicContact CG1-CB 4.27Å; V267-A350 HydrophobicContact CG2-CB 4.03Å; V267-V352 HydrophobicContact CG1-CG2 3.72Å; V267-L367 HydrophobicContact CB-CG 4.38Å; V267-L367 HydrophobicContact CG1-CD2 4.14Å; V267-L367 HydrophobicContact CG1-CG 4.27Å; V267-L367 HydrophobicContact CG2-CD2 4.16Å; V267-L367 HydrophobicContact CG2-CG 4.03Å; V267-V368 HydrophobicContact CB-CG2 4.4Å; V267-V368 HydrophobicContact CG1-CG2 4.02Å; V267-V368 WeakPolarHBondContact O-CG1 3.5Å; V267-V368 WeakPolarHBondContact O-CG2 3.5Å; V267-T371 VanDerWaalsContact CB-OG1 3.3Å; V267-T371 WeakPolarHBondContact CB-OG1 3.22Å; V267-T371 HydrophobicContact CG2-CG2 3.85Å; V267-T371 WeakPolarHBondContact CG2-OG1 3.26Å; V267-T371 PolarHBondContact N-OG1 3.25Å; V267-T371 VanDerWaalsContact N-OG1 3.12Å; V267-G373 VanDerWaalsContact O-CA 3.29Å; V267-G373 WeakPolarHBondContact O-CA 3.36Å
268	F	96	Very high	76.6	Confident	11 Å²	11	54.1 Å²	54.1	5%	0.048	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	148.5	175.5	-63.5	-82.8	0	0	0	110.2	I266 V333 Y335 L349 A350 V351 V352 S374 L376	I266-F268 HydrophobicContact CB-CE2 4.11Å; I266-F268 HydrophobicContact CB-CZ 4.42Å; I266-F268 HydrophobicContact CG2-CD2 4.33Å; I266-F268 HydrophobicContact CG2-CE1 4.2Å; I266-F268 HydrophobicContact CG2-CE2 3.57Å; I266-F268 HydrophobicContact CG2-CZ 3.5Å; F268-V333 HydrophobicContact CE1-CG1 3.86Å; F268-V333 HydrophobicContact CZ-CG1 3.83Å; F268-Y335 HydrophobicContact CD2-CD1 4.38Å; F268-Y335 HydrophobicContact CD2-CE1 4.23Å; F268-Y335 HydrophobicContact CE1-CE1 4.42Å; F268-Y335 AromaticContact CE2-CD1 3.92Å; F268-Y335 HydrophobicContact CE2-CD1 3.92Å; F268-Y335 HydrophobicContact CE2-CE1 4.11Å; F268-Y335 HydrophobicContact CG-CE1 4.45Å; F268-Y335 HydrophobicContact CZ-CD1 4.14Å; F268-Y335 HydrophobicContact CZ-CE1 4.2Å; F268-L349 HydrophobicContact CE2-CD2 3.77Å; F268-A350 PolarHBondContact N-O 3.3Å; F268-V351 CarbonylContact O-C 3.5Å; F268-V351 WeakPolarHBondContact O-CA 3.4Å; F268-V352 PolarHBondContact O-N 3.04Å; F268-S374 WeakPolarHBondContact CA-O 3.22Å; F268-L376 HydrophobicContact CB-CD1 3.56Å; F268-L376 HydrophobicContact CB-CD2 4.45Å; F268-L376 HydrophobicContact CB-CG 3.82Å; F268-L376 HydrophobicContact CD1-CD1 4.2Å; F268-L376 HydrophobicContact CD1-CD2 3.65Å; F268-L376 HydrophobicContact CD1-CG 3.97Å; F268-L376 HydrophobicContact CE1-CD2 4.28Å; F268-L376 HydrophobicContact CG-CD1 3.98Å; F268-L376 HydrophobicContact CG-CD2 4.29Å; F268-L376 HydrophobicContact CG-CG 4.19Å
269	V	94.8	Very high	76.7	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	136.6	172	-72.3	0	0	0	0	110.2	D271 V352 V360 A364 F365 V368 S374 R375 L376	V269-D271 PolarHBondContact O-N 2.88Å; V269-V352 HydrophobicContact CB-CB 4.43Å; V269-V352 HydrophobicContact CG1-CB 3.69Å; V269-V352 HydrophobicContact CG1-CG1 4.33Å; V269-V352 HydrophobicContact CG1-CG2 3.86Å; V269-V360 HydrophobicContact CB-CG1 4.06Å; V269-V360 HydrophobicContact CB-CG2 4.45Å; V269-V360 HydrophobicContact CG1-CG1 3.68Å; V269-A364 HydrophobicContact CG1-CB 3.97Å; V269-F365 HydrophobicContact CG2-CD1 3.95Å; V269-F365 HydrophobicContact CG2-CE1 3.67Å; V269-F365 HydrophobicContact CG2-CZ 4.47Å; V269-V368 HydrophobicContact CB-CG2 4.07Å; V269-V368 HydrophobicContact CG1-CG2 3.28Å; V269-V368 HydrophobicContact CG2-CG2 3.95Å; V269-S374 PolarHBondContact N-O 3.31Å; V269-R375 HydrophobicContact CG2-CB 4.14Å; V269-R375 HydrophobicContact CG2-CG 3.76Å; V269-L376 PolarHBondContact O-N 2.99Å
270	A	93.4	Very high	77.3	Confident	15 Å²	15	58.4 Å²	58.4	12%	0.124	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	107.8	171.1	0	0	0	0	0	109.9	V352 I353 V360 L396	A270-V352 PolarHBondContact N-O 2.69Å; A270-I353 HydrophobicContact CB-CD1 3.51Å; A270-V360 WeakPolarHBondContact O-CG2 3.43Å; A270-L396 HydrophobicContact CB-CD1 3.42Å; A270-L396 VanDerWaalsContact CB-CD1 3.42Å
271	D	86.5	Confident	78	Confident	9 Å²	9	53.4 Å²	53.4	5%	0.048	29%	0.292	C	S	.	.			trans	-115.8	105.5	-180	-171.8	-6.7	0	0	0	109.5	V269 E273 P274 T277 R375 L376	V269-D271 PolarHBondContact O-N 2.88Å; D271-E273 VanDerWaalsContact C-N 3.3Å; D271-E273 PolarHBondContact O-N 3.42Å; D271-E273 PolarHBondContact OD1-N 3.18Å; D271-E273 VanDerWaalsContact OD1-N 3.14Å; D271-P274 WeakPolarHBondContact OD2-CA 3.35Å; D271-T277 PolarHBondContact OD1-OG1 3.27Å; D271-T277 VanDerWaalsContact OD1-OG1 3.08Å; D271-T277 WeakPolarHBondContact OD2-CB 3.3Å; D271-T277 PolarHBondContact OD2-OG1 3.09Å; D271-R375 HydrophobicContact CB-CB 4.33Å; D271-R375 IonicContact OD2-NH1 3.55Å; D271-L376 PolarHBondContact N-O 3Å
272	P	79.7	Confident	78.6	Confident	67 Å²	67	56 Å²	56	44%	0.435	30%	0.298	S	S	.	.	S	Bend	trans	-72.4	-23.8	-178.5	30	-34.2	0	0	0	112.9
273	E	77.7	Confident	79	Confident	79 Å²	79	53.4 Å²	53.4	37%	0.369	28%	0.281	S	S	.	.			trans	-136.7	66.6	-172.1	-65.6	-170.2	92.8	0	0	111	D271 L275 L276 T277 S385	D271-E273 VanDerWaalsContact C-N 3.3Å; D271-E273 PolarHBondContact O-N 3.42Å; D271-E273 PolarHBondContact OD1-N 3.18Å; D271-E273 VanDerWaalsContact OD1-N 3.14Å; E273-L275 PolarHBondContact O-N 3.18Å; E273-L275 VanDerWaalsContact O-N 3.09Å; E273-L276 HydrophobicContact CB-CB 3.81Å; E273-L276 HydrophobicContact CB-CD2 4.48Å; E273-L276 WeakPolarHBondContact O-CA 3.38Å; E273-L276 WeakPolarHBondContact O-CB 3.3Å; E273-L276 PolarHBondContact O-N 3.39Å; E273-T277 PolarHBondContact O-N 2.9Å; E273-T277 PolarHBondContact O-OG1 3.48Å; E273-S385 WeakPolarHBondContact CG-O 3.36Å
274	P	76	Confident	79	Confident	25 Å²	25	52.8 Å²	52.8	16%	0.162	28%	0.278	C	S	.	.	H	α-helix	trans	-56.9	-34.4	-175.2	24.6	-37	0	0	0	112.9	D271 T277 D278 T327 V377	D271-P274 WeakPolarHBondContact OD2-CA 3.35Å; P274-T277 WeakPolarHBondContact O-CB 3.46Å; P274-T277 PolarHBondContact O-N 3.49Å; P274-D278 WeakPolarHBondContact O-CB 3.37Å; P274-D278 PolarHBondContact O-N 3.24Å; P274-T327 HydrophobicContact CB-CG2 3.82Å; P274-T327 HydrophobicContact CG-CG2 3.99Å; P274-V377 HydrophobicContact CB-CG2 4.46Å; P274-V377 HydrophobicContact CG-CG2 3.83Å
275	L	74.9	Confident	77.8	Confident	131 Å²	131	54.5 Å²	54.5	69%	0.686	28%	0.279	S	S	*	.	H	α-helix	trans	-67.8	-33.7	176.4	-65.4	175.9	0	0	0	113	E273 K279	E273-L275 PolarHBondContact O-N 3.18Å; E273-L275 VanDerWaalsContact O-N 3.09Å; L275-K279 WeakPolarHBondContact O-CG 3.41Å; L275-K279 PolarHBondContact O-N 3.3Å; L275-K279 VanDerWaalsContact O-N 3.11Å
276	L	74	Confident	76.5	Confident	78 Å²	78	60.8 Å²	60.8	41%	0.408	31%	0.306	S	S	.	.	H	α-helix	trans	-72.7	-43.9	174.6	179.2	61.4	0	0	0	109.6	E273 D278 K279 L280	E273-L276 HydrophobicContact CB-CB 3.81Å; E273-L276 HydrophobicContact CB-CD2 4.48Å; E273-L276 WeakPolarHBondContact O-CA 3.38Å; E273-L276 WeakPolarHBondContact O-CB 3.3Å; E273-L276 PolarHBondContact O-N 3.39Å; L276-D278 VanDerWaalsContact C-N 3.32Å; L276-D278 PolarHBondContact O-N 3.01Å; L276-K279 WeakPolarHBondContact O-CB 3.48Å; L276-K279 PolarHBondContact O-N 2.62Å; L276-K279 VanDerWaalsContact O-N 3.13Å; L276-L280 HydrophobicContact CG-CD1 4.35Å; L276-L280 WeakPolarHBondContact O-CG 3.42Å; L276-L280 PolarHBondContact O-N 2.87Å
277	T	71.4	Confident	74.9	Confident	17 Å²	17	64.9 Å²	64.9	10%	0.104	32%	0.322	C	S	.	.	H	α-helix	trans	-54.9	-48.5	172.9	-53.3	0	0	0	0	110.3	D271 E273 P274 K279 L280 I281 Y321 F365	D271-T277 PolarHBondContact OD1-OG1 3.27Å; D271-T277 VanDerWaalsContact OD1-OG1 3.08Å; D271-T277 WeakPolarHBondContact OD2-CB 3.3Å; D271-T277 PolarHBondContact OD2-OG1 3.09Å; E273-T277 PolarHBondContact O-N 2.9Å; E273-T277 PolarHBondContact O-OG1 3.48Å; P274-T277 WeakPolarHBondContact O-CB 3.46Å; P274-T277 PolarHBondContact O-N 3.49Å; T277-K279 VanDerWaalsContact C-N 3.34Å; T277-K279 PolarHBondContact O-N 2.85Å; T277-L280 WeakPolarHBondContact O-CB 3.38Å; T277-L280 PolarHBondContact O-N 3.21Å; T277-L280 VanDerWaalsContact O-N 3.11Å; T277-I281 HydrophobicContact CG2-CD1 4Å; T277-I281 WeakPolarHBondContact O-CD1 3.5Å; T277-I281 WeakPolarHBondContact O-CG1 3.22Å; T277-I281 PolarHBondContact O-N 3.24Å; T277-Y321 HydrophobicContact CG2-CE1 4.42Å; T277-F365 HydrophobicContact CG2-CE1 4.35Å; T277-F365 HydrophobicContact CG2-CE2 4.18Å; T277-F365 HydrophobicContact CG2-CZ 3.74Å
278	D	72.6	Confident	73	Confident	54 Å²	54	67.4 Å²	67.4	29%	0.289	34%	0.335	S	S	.	.	H	α-helix	trans	-58.2	-42	175.8	-67.5	-18.6	0	0	0	111.9	P274 L276 I281 E282 R375	P274-D278 WeakPolarHBondContact O-CB 3.37Å; P274-D278 PolarHBondContact O-N 3.24Å; L276-D278 VanDerWaalsContact C-N 3.32Å; L276-D278 PolarHBondContact O-N 3.01Å; D278-I281 WeakPolarHBondContact O-CB 3.44Å; D278-I281 PolarHBondContact O-N 3.39Å; D278-E282 WeakPolarHBondContact O-CG 3.38Å; D278-E282 PolarHBondContact O-N 2.85Å; D278-R375 IonicContact OD1-CZ 2.74Å; D278-R375 IonicContact OD1-NH1 2.79Å; D278-R375 PolarHBondContact OD1-NH1 3.06Å; D278-R375 IonicContact OD1-NH2 3.56Å; D278-R375 PolarHBondContact OD1-NH2 2.72Å; D278-R375 VanDerWaalsContact OD1-NH2 3.09Å; D278-R375 IonicContact OD2-NH2 3.54Å
279	K	71.6	Confident	70.9	Confident	136 Å²	136	72.1 Å²	72.1	59%	0.591	36%	0.358	S	S	*	.	H	α-helix	trans	-66.3	-37.8	174.7	-75.4	174.2	-175.8	176.5	0	113.1	L275 L276 T277 I281 E282 S283	L275-K279 WeakPolarHBondContact O-CG 3.41Å; L275-K279 PolarHBondContact O-N 3.3Å; L275-K279 VanDerWaalsContact O-N 3.11Å; L276-K279 WeakPolarHBondContact O-CB 3.48Å; L276-K279 PolarHBondContact O-N 2.62Å; L276-K279 VanDerWaalsContact O-N 3.13Å; T277-K279 VanDerWaalsContact C-N 3.34Å; T277-K279 PolarHBondContact O-N 2.85Å; K279-I281 VanDerWaalsContact C-N 3.35Å; K279-E282 PolarHBondContact O-N 3.12Å; K279-S283 WeakPolarHBondContact O-CB 3.49Å; K279-S283 PolarHBondContact O-N 2.9Å
280	L	68.3	Low	68.9	Low	93 Å²	93	77.2 Å²	77.2	49%	0.487	39%	0.389	S	S	.	.	H	α-helix	trans	-64.3	-44.2	175.7	-71.1	171.3	0	0	0	110.1	L276 T277 E282 S283 A284	L276-L280 HydrophobicContact CG-CD1 4.35Å; L276-L280 WeakPolarHBondContact O-CG 3.42Å; L276-L280 PolarHBondContact O-N 2.87Å; T277-L280 WeakPolarHBondContact O-CB 3.38Å; T277-L280 PolarHBondContact O-N 3.21Å; T277-L280 VanDerWaalsContact O-N 3.11Å; L280-E282 PolarHBondContact O-N 3Å; L280-S283 PolarHBondContact O-N 3.08Å; L280-S283 PolarHBondContact O-OG 3.17Å; L280-A284 PolarHBondContact O-N 2.84Å
281	I	66.4	Low	66.8	Low	33 Å²	33	82.2 Å²	82.2	17%	0.169	41%	0.413	C	S	.	.	H	α-helix	trans	-55	-50.7	171.8	-62.2	161.3	0	0	0	110.3	T277 D278 K279 S283 A284 W285 Y321	T277-I281 HydrophobicContact CG2-CD1 4Å; T277-I281 WeakPolarHBondContact O-CD1 3.5Å; T277-I281 WeakPolarHBondContact O-CG1 3.22Å; T277-I281 PolarHBondContact O-N 3.24Å; D278-I281 WeakPolarHBondContact O-CB 3.44Å; D278-I281 PolarHBondContact O-N 3.39Å; K279-I281 VanDerWaalsContact C-N 3.35Å; I281-S283 VanDerWaalsContact C-N 3.34Å; I281-S283 PolarHBondContact O-N 2.83Å; I281-A284 PolarHBondContact O-N 2.94Å; I281-W285 PolarHBondContact O-N 2.76Å; I281-Y321 HydrophobicContact CD1-CD1 4.22Å; I281-Y321 WeakPolarHBondContact CD1-O 3.5Å; I281-Y321 HydrophobicContact CG1-CD1 3.65Å; I281-Y321 HydrophobicContact CG1-CG 3.92Å; I281-Y321 WeakPolarHBondContact CG1-O 3.15Å; I281-Y321 WeakPolarHBondContact CG2-O 3.38Å
282	E	67.2	Low	64.8	Low	108 Å²	108	87 Å²	87	51%	0.505	44%	0.435	S	S	.	.	H	α-helix	trans	-62.6	-37.2	177.7	-76.2	-179.3	-174.1	0	0	113	D278 K279 L280 W285 K286	D278-E282 WeakPolarHBondContact O-CG 3.38Å; D278-E282 PolarHBondContact O-N 2.85Å; K279-E282 PolarHBondContact O-N 3.12Å; L280-E282 PolarHBondContact O-N 3Å; E282-W285 WeakPolarHBondContact O-CB 3.23Å; E282-W285 PolarHBondContact O-N 2.95Å; E282-K286 PolarHBondContact O-N 3.37Å; E282-K286 VanDerWaalsContact O-N 3.08Å
283	S	66.1	Low	62.8	Low	54 Å²	54	93 Å²	93	38%	0.378	46%	0.457	S	S	.	.	H	α-helix	trans	-69.9	-38.6	179.6	78	0	0	0	0	112.1	K279 L280 I281 W285 K286 K287	K279-S283 WeakPolarHBondContact O-CB 3.49Å; K279-S283 PolarHBondContact O-N 2.9Å; L280-S283 PolarHBondContact O-N 3.08Å; L280-S283 PolarHBondContact O-OG 3.17Å; I281-S283 VanDerWaalsContact C-N 3.34Å; I281-S283 PolarHBondContact O-N 2.83Å; S283-W285 VanDerWaalsContact C-N 3.28Å; S283-K286 PolarHBondContact O-N 2.77Å; S283-K287 PolarHBondContact O-N 2.78Å
284	A	63.4	Low	60.7	Low	19 Å²	19	92.5 Å²	92.5	16%	0.157	46%	0.463	C	S	.	.	H	α-helix	trans	-62.3	-40	171.4	0	0	0	0	0	110.2	L280 I281 K286 K287 D288	L280-A284 PolarHBondContact O-N 2.84Å; I281-A284 PolarHBondContact O-N 2.94Å; A284-K286 PolarHBondContact O-N 3.37Å; A284-K287 PolarHBondContact O-N 2.8Å; A284-D288 PolarHBondContact O-N 2.88Å; A284-D288 VanDerWaalsContact O-N 3.12Å
285	W	55.7	Low	58.7	Low	151 Å²	151	100.2 Å²	100.2	57%	0.572	50%	0.497	S	S	*	.	H	α-helix	trans	-59.6	-43.5	176	-167.7	37.6	0	0	0	113.1	I281 E282 S283 D288 Q289	I281-W285 PolarHBondContact O-N 2.76Å; E282-W285 WeakPolarHBondContact O-CB 3.23Å; E282-W285 PolarHBondContact O-N 2.95Å; S283-W285 VanDerWaalsContact C-N 3.28Å; W285-D288 PolarHBondContact O-N 3.4Å; W285-Q289 VanDerWaalsContact CE2-NE2 3.35Å; W285-Q289 WeakPolarHBondContact O-CG 3.33Å; W285-Q289 PolarHBondContact O-N 3.43Å
286	K	62.3	Low	57	Low	136 Å²	136	103.1 Å²	103.1	59%	0.591	50%	0.5	S	S	*	.	H	α-helix	trans	-65.6	-39.4	177.9	-73	177.2	-178.8	171.3	0	112.8	E282 S283 A284 D288 Q289 T290	E282-K286 PolarHBondContact O-N 3.37Å; E282-K286 VanDerWaalsContact O-N 3.08Å; S283-K286 PolarHBondContact O-N 2.77Å; A284-K286 PolarHBondContact O-N 3.37Å; K286-D288 VanDerWaalsContact C-N 3.35Å; K286-Q289 PolarHBondContact O-N 2.66Å; K286-T290 PolarHBondContact O-N 2.9Å; K286-T290 PolarHBondContact O-OG1 2.93Å
287	K	59.8	Low	55.2	Low	146 Å²	146	107.2 Å²	107.2	64%	0.635	52%	0.521	S	S	*	.	H	α-helix	trans	-65.1	-39.1	178	-75.9	-178.8	179	176.5	0	112.1	S283 A284 T290 N291	S283-K287 PolarHBondContact O-N 2.78Å; A284-K287 PolarHBondContact O-N 2.8Å; K287-T290 WeakPolarHBondContact CA-OG1 3.46Å; K287-T290 PolarHBondContact O-N 3.48Å; K287-T290 PolarHBondContact O-OG1 2.83Å; K287-N291 PolarHBondContact O-N 3.17Å; K287-N291 VanDerWaalsContact O-N 3.09Å
288	D	54.5	Low	53.5	Low	53 Å²	53	114.2 Å²	114.2	28%	0.283	56%	0.557	S	S	.	*	H	α-helix	trans	-67.9	-39.3	179.8	-140.7	31.3	0	0	0	111.6	A284 W285 K286 T290 N291 H292 R322	A284-D288 PolarHBondContact O-N 2.88Å; A284-D288 VanDerWaalsContact O-N 3.12Å; W285-D288 PolarHBondContact O-N 3.4Å; K286-D288 VanDerWaalsContact C-N 3.35Å; D288-T290 VanDerWaalsContact C-N 3.28Å; D288-T290 PolarHBondContact O-N 3.49Å; D288-N291 PolarHBondContact O-N 3.48Å; D288-H292 PolarHBondContact O-N 3.37Å; D288-H292 IonicContact OD1-CD2 3.09Å; D288-H292 PolarHBondContact OD1-CD2 2.84Å; D288-H292 VanDerWaalsContact OD1-CD2 3.28Å; D288-H292 IonicContact OD1-NE2 3.37Å; D288-R322 IonicContact OD2-CZ 3.36Å; D288-R322 IonicContact OD2-NH1 2.72Å; D288-R322 PolarHBondContact OD2-NH1 2.8Å; D288-R322 IonicContact OD2-NH2 3.46Å; D288-R322 PolarHBondContact OD2-NH2 3.31Å
289	Q	51.6	Low	51.5	Low	111 Å²	111	120.1 Å²	120.1	52%	0.519	58%	0.581	S	S	.	*	H	α-helix	trans	-63.5	-31.6	173.6	-72.2	-175.8	4.5	0	0	113.2	W285 K286	W285-Q289 VanDerWaalsContact CE2-NE2 3.35Å; W285-Q289 WeakPolarHBondContact O-CG 3.33Å; W285-Q289 PolarHBondContact O-N 3.43Å; K286-Q289 PolarHBondContact O-N 2.66Å
290	T	54.1	Low	49.5	Very low	107 Å²	107	119 Å²	119	66%	0.656	59%	0.588	S	S	*	*	H	α-helix	trans	-79.2	-26.4	176.4	49.7	0	0	0	0	113.6	K286 K287 D288	K286-T290 PolarHBondContact O-N 2.9Å; K286-T290 PolarHBondContact O-OG1 2.93Å; K287-T290 WeakPolarHBondContact CA-OG1 3.46Å; K287-T290 PolarHBondContact O-N 3.48Å; K287-T290 PolarHBondContact O-OG1 2.83Å; D288-T290 VanDerWaalsContact C-N 3.28Å; D288-T290 PolarHBondContact O-N 3.49Å
291	N	49.9	Very low	47.6	Very low	119 Å²	119	124.6 Å²	124.6	64%	0.636	61%	0.609	S	S	*	*	H	α-helix	trans	-94	-22.4	-178.7	-77.2	-12.7	0	0	0	113.6	K287 D288	K287-N291 PolarHBondContact O-N 3.17Å; K287-N291 VanDerWaalsContact O-N 3.09Å; D288-N291 PolarHBondContact O-N 3.48Å
292	H	42.8	Very low	46	Very low	110 Å²	110	128 Å²	128	51%	0.509	63%	0.626	S	S	.	*			trans	-115.1	65	-180	-69.3	-66.9	0	0	0	112.8	D288	D288-H292 PolarHBondContact O-N 3.37Å; D288-H292 IonicContact OD1-CD2 3.09Å; D288-H292 PolarHBondContact OD1-CD2 2.84Å; D288-H292 VanDerWaalsContact OD1-CD2 3.28Å; D288-H292 IonicContact OD1-NE2 3.37Å
293	Q	37.7	Very low	44.2	Very low	192 Å²	192	126.4 Å²	126.4	90%	0.897	63%	0.627	S	S	*	*	S	Bend	trans	-85.3	12.5	155.4	-87.2	-169.6	-9.4	0	0	113
294	S	35	Very low	42.6	Very low	70 Å²	70	131.2 Å²	131.2	49%	0.49	65%	0.654	S	S	.	*	S	Bend	trans	-136.6	117.5	-178.8	44.4	0	0	0	0	113.2
295	Q	34	Very low	40.9	Very low	186 Å²	186	137.7 Å²	137.7	87%	0.869	68%	0.681	S	S	*	*	S	Bend	trans	86.1	-1	140.9	-68.9	-178.7	-21.9	0	0	123.7
296	Y	38.4	Very low	39.8	Very low	192 Å²	192	135.1 Å²	135.1	75%	0.753	69%	0.685	S	S	*	*			trans	-112.1	-0.6	-179.9	-74.7	-82.1	0	0	0	117.8	N298	Y296-N298 VanDerWaalsContact C-N 3.28Å; Y296-N298 PolarHBondContact O-N 2.87Å
297	I	37	Very low	38.5	Very low	164 Å²	164	133 Å²	133	84%	0.841	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-8.4	-174.3	-66.3	174.7	0	0	0	114.2
298	N	34.5	Very low	37.6	Very low	164 Å²	164	127.5 Å²	127.5	88%	0.877	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.7	20.4	-173.7	-91	-14.7	0	0	0	116.4	Y296	Y296-N298 VanDerWaalsContact C-N 3.28Å; Y296-N298 PolarHBondContact O-N 2.87Å
299	K	31.2	Very low	37.2	Very low	179 Å²	179	128 Å²	128	78%	0.778	66%	0.664	S	S	*	*			trans	-129.2	0.3	-178.4	-108.4	-177.8	179.8	-178.1	0	119.5	K301	K299-K301 VanDerWaalsContact C-N 3.35Å; K299-K301 PolarHBondContact O-N 3.03Å
300	C	30.5	Very low	36.7	Very low	111 Å²	111	129.2 Å²	129.2	75%	0.75	67%	0.674	S	S	*	*			trans	-91	71.1	166.1	-81.2	0	0	0	0	111.8	I302	C300-I302 VanDerWaalsContact C-N 3.28Å
301	K	27.6	Very low	36.2	Very low	211 Å²	211	128.4 Å²	128.4	92%	0.917	66%	0.661	S	S	*	*			trans	-91.2	75	139.9	-87.6	-176.3	174.1	179.4	0	105.5	K299	K299-K301 VanDerWaalsContact C-N 3.35Å; K299-K301 PolarHBondContact O-N 3.03Å
302	I	33	Very low	36	Very low	104 Å²	104	125.5 Å²	125.5	53%	0.533	65%	0.646	S	S	.	*			trans	-127.6	125.8	177.6	-61.4	177.3	0	0	0	106.7	C300	C300-I302 VanDerWaalsContact C-N 3.28Å
303	S	28.4	Very low	36.1	Very low	75 Å²	75	123.2 Å²	123.2	52%	0.524	64%	0.639	S	S	.	*			trans	-48.6	148.1	179.2	37.3	0	0	0	0	112.7	E305	S303-E305 PolarHBondContact O-N 3.23Å
304	V	34.1	Very low	36.3	Very low	156 Å²	156	119.2 Å²	119.2	95%	0.945	63%	0.63	S	S	*	*	S	Bend	trans	-72.6	40.4	179.5	-172.7	0	0	0	0	111.2
305	E	28.1	Very low	36.8	Very low	155 Å²	155	123.7 Å²	123.7	72%	0.724	64%	0.644	S	S	*	*	S	Bend	trans	-136.5	109.7	-169.3	-68.1	175.5	175	0	0	108.5	S303	S303-E305 PolarHBondContact O-N 3.23Å
306	C	31.8	Very low	37.6	Very low	96 Å²	96	115.2 Å²	115.2	65%	0.649	61%	0.605	S	S	*	*	S	Bend	trans	80.5	51.4	169.6	-59.9	0	0	0	0	119.5	D259	D259-C306 WeakPolarHBondContact OD2-CA 3.45Å
307	E	35.1	Very low	38.2	Very low	91 Å²	91	107 Å²	107	43%	0.425	58%	0.575	S	S	.	*			trans	-116.5	-13.5	171.3	-78.4	-172.8	170.6	0	0	115.7	V309 D310 F311	E307-V309 PolarHBondContact O-N 3.31Å; E307-D310 PolarHBondContact O-N 3.3Å; E307-F311 HydrophobicContact CB-CD2 4.17Å; E307-F311 WeakPolarHBondContact O-CB 3.36Å; E307-F311 PolarHBondContact O-N 3.04Å; E307-F311 VanDerWaalsContact O-N 3.12Å
308	A	40.5	Very low	39	Very low	32 Å²	32	103.3 Å²	103.3	26%	0.264	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.5	-12.2	-166.9	0	0	0	0	0	115.5	D259	D259-A308 WeakPolarHBondContact OD1-CB 3.48Å; D259-A308 PolarHBondContact OD1-N 3.41Å
309	V	45.6	Very low	40	Very low	64 Å²	64	96.6 Å²	96.6	39%	0.388	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-28.1	178.9	-168.3	0	0	0	0	112.6	T249 E307	T249-V309 HydrophobicContact CG2-CG1 3.6Å; E307-V309 PolarHBondContact O-N 3.31Å
310	D	40.8	Very low	41.2	Very low	136 Å²	136	88.3 Å²	88.3	73%	0.727	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-8.5	179.7	-72.8	-21.3	0	0	0	112.6	E307 L312	E307-D310 PolarHBondContact O-N 3.3Å; D310-L312 PolarHBondContact O-N 2.89Å; D310-L312 VanDerWaalsContact O-N 3.14Å
311	F	44.2	Very low	42.6	Very low	89 Å²	89	85.2 Å²	85.2	39%	0.39	46%	0.46	S	S	.	.			trans	-80.7	28.3	174.2	-122.4	-100	0	0	0	114.6	E307 S316	E307-F311 HydrophobicContact CB-CD2 4.17Å; E307-F311 WeakPolarHBondContact O-CB 3.36Å; E307-F311 PolarHBondContact O-N 3.04Å; E307-F311 VanDerWaalsContact O-N 3.12Å; F311-S316 WeakPolarHBondContact O-CB 3.22Å; F311-S316 PolarHBondContact O-OG 3.18Å
312	L	45.7	Very low	44.2	Very low	58 Å²	58	80.4 Å²	80.4	30%	0.304	44%	0.436	S	S	.	.			trans	-111.6	40.6	170.6	-64.6	176.8	0	0	0	111.5	W248 D310 S316 E363	W248-L312 HydrophobicContact CB-CD1 4.07Å; D310-L312 PolarHBondContact O-N 2.89Å; D310-L312 VanDerWaalsContact O-N 3.14Å; L312-S316 PolarHBondContact N-OG 3.46Å; L312-E363 HydrophobicContact CD2-CB 4.28Å; L312-E363 HydrophobicContact CD2-CG 3.69Å
313	T	45.1	Very low	45.9	Very low	62 Å²	62	77.8 Å²	77.8	38%	0.38	42%	0.423	S	S	.	.	S	Bend	trans	-77.2	153.7	164.2	66.3	0	0	0	0	109.3	E315 S316 T317	T313-E315 PolarHBondContact O-N 2.94Å; T313-S316 PolarHBondContact N-OG 2.72Å; T313-S316 PolarHBondContact O-N 3.46Å; T313-S316 PolarHBondContact O-OG 3.01Å; T313-S316 PolarHBondContact OG1-N 3.04Å; T313-S316 PolarHBondContact OG1-OG 3.39Å; T313-T317 WeakPolarHBondContact O-CG2 3.5Å; T313-T317 PolarHBondContact O-N 3.31Å
314	P	42.8	Very low	48	Very low	108 Å²	108	79.1 Å²	79.1	70%	0.701	43%	0.43	S	S	*	.	H	α-helix	trans	-52	-33.6	175.9	-27.7	35.3	0	0	0	113.2	T317 D318	P314-T317 WeakPolarHBondContact CA-OG1 3.21Å; P314-T317 PolarHBondContact O-N 3.34Å; P314-T317 PolarHBondContact O-OG1 3.28Å; P314-D318 PolarHBondContact O-N 3.32Å
315	E	44.3	Very low	50.3	Low	165 Å²	165	72.4 Å²	72.4	77%	0.771	39%	0.39	S	S	*	.	H	α-helix	trans	-68.3	-39.5	177.3	-65.5	156.5	-176	0	0	112.1	T313	T313-E315 PolarHBondContact O-N 2.94Å
316	S	50.4	Low	53.2	Low	8 Å²	8	71.4 Å²	71.4	6%	0.056	39%	0.385	C	S	.	.	H	α-helix	trans	-79.2	-24.7	177	64.6	0	0	0	0	113	F311 L312 T313 S319 A320	F311-S316 WeakPolarHBondContact O-CB 3.22Å; F311-S316 PolarHBondContact O-OG 3.18Å; L312-S316 PolarHBondContact N-OG 3.46Å; T313-S316 PolarHBondContact N-OG 2.72Å; T313-S316 PolarHBondContact O-N 3.46Å; T313-S316 PolarHBondContact O-OG 3.01Å; T313-S316 PolarHBondContact OG1-N 3.04Å; T313-S316 PolarHBondContact OG1-OG 3.39Å; S316-S319 WeakPolarHBondContact CA-OG 3.49Å; S316-S319 CarbonylContact O-C 3.56Å; S316-S319 WeakPolarHBondContact O-CA 3.43Å; S316-S319 WeakPolarHBondContact O-CB 3.39Å; S316-S319 PolarHBondContact O-N 2.94Å; S316-S319 PolarHBondContact O-OG 3.26Å; S316-A320 PolarHBondContact O-N 3.44Å
317	T	52.2	Low	56	Low	20 Å²	20	69.3 Å²	69.3	12%	0.123	37%	0.369	C	S	.	.	H	α-helix	trans	-64.1	-40.8	174	57.7	0	0	0	0	111.8	T313 P314 S319 A320 P362 E363	T313-T317 WeakPolarHBondContact O-CG2 3.5Å; T313-T317 PolarHBondContact O-N 3.31Å; P314-T317 WeakPolarHBondContact CA-OG1 3.21Å; P314-T317 PolarHBondContact O-N 3.34Å; P314-T317 PolarHBondContact O-OG1 3.28Å; T317-S319 PolarHBondContact O-N 2.96Å; T317-A320 WeakPolarHBondContact O-CB 3.4Å; T317-A320 PolarHBondContact O-N 2.92Å; T317-A320 VanDerWaalsContact O-N 3.1Å; T317-P362 WeakPolarHBondContact O-CB 3.26Å; T317-E363 HydrophobicContact CG2-CG 3.82Å; T317-E363 WeakPolarHBondContact CG2-OE1 3.31Å
318	D	53.1	Low	58.7	Low	86 Å²	86	66.4 Å²	66.4	46%	0.46	36%	0.356	S	S	.	.	H	α-helix	trans	-64.6	-23.2	171.8	-89.8	0.3	0	0	0	112.1	P314	P314-D318 PolarHBondContact O-N 3.32Å
319	S	54.9	Low	61.2	Low	22 Å²	22	67.3 Å²	67.3	15%	0.154	36%	0.359	C	S	.	.	H	α-helix	trans	-81.1	-22.7	175	87.4	0	0	0	0	114.3	S316 T317 Y321 R322	S316-S319 WeakPolarHBondContact CA-OG 3.49Å; S316-S319 CarbonylContact O-C 3.56Å; S316-S319 WeakPolarHBondContact O-CA 3.43Å; S316-S319 WeakPolarHBondContact O-CB 3.39Å; S316-S319 PolarHBondContact O-N 2.94Å; S316-S319 PolarHBondContact O-OG 3.26Å; T317-S319 PolarHBondContact O-N 2.96Å; S319-Y321 PolarHBondContact O-N 3.23Å; S319-R322 WeakPolarHBondContact O-CA 3.44Å; S319-R322 WeakPolarHBondContact O-CB 3.05Å; S319-R322 WeakPolarHBondContact O-CG 3.43Å; S319-R322 PolarHBondContact O-N 3.2Å
320	A	57.9	Low	63.6	Low	6 Å²	6	65.1 Å²	65.1	5%	0.05	35%	0.345	C	S	.	.	H	α-helix	trans	-62.7	-33	179.2	0	0	0	0	0	112.5	S316 T317 R322 L323 P362 H366	S316-A320 PolarHBondContact O-N 3.44Å; T317-A320 WeakPolarHBondContact O-CB 3.4Å; T317-A320 PolarHBondContact O-N 2.92Å; T317-A320 VanDerWaalsContact O-N 3.1Å; A320-R322 PolarHBondContact O-N 3.25Å; A320-R322 VanDerWaalsContact O-N 3.15Å; A320-L323 WeakPolarHBondContact O-CB 3.32Å; A320-L323 PolarHBondContact O-N 3.2Å; A320-L323 VanDerWaalsContact O-N 3.14Å; A320-P362 HydrophobicContact CB-CB 3.93Å; A320-P362 WeakPolarHBondContact CB-O 3.41Å; A320-H366 HydrophobicContact CB-CB 3.81Å
321	Y	59.7	Low	66.1	Low	46 Å²	46	63.9 Å²	63.9	18%	0.18	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-24.1	168	-86.5	-50.8	0	0	0	113.8	T277 I281 S319 L323 P362 F365	T277-Y321 HydrophobicContact CG2-CE1 4.42Å; I281-Y321 HydrophobicContact CD1-CD1 4.22Å; I281-Y321 WeakPolarHBondContact CD1-O 3.5Å; I281-Y321 HydrophobicContact CG1-CD1 3.65Å; I281-Y321 HydrophobicContact CG1-CG 3.92Å; I281-Y321 WeakPolarHBondContact CG1-O 3.15Å; I281-Y321 WeakPolarHBondContact CG2-O 3.38Å; S319-Y321 PolarHBondContact O-N 3.23Å; Y321-L323 VanDerWaalsContact C-N 3.31Å; Y321-L323 PolarHBondContact O-N 3.16Å; Y321-P362 HydrophobicContact CD2-CB 3.69Å; Y321-P362 HydrophobicContact CD2-CG 4.04Å; Y321-P362 HydrophobicContact CE2-CB 3.51Å; Y321-P362 HydrophobicContact CE2-CG 3.41Å; Y321-P362 VanDerWaalsContact CE2-CG 3.41Å; Y321-P362 HydrophobicContact CG-CB 4.29Å; Y321-P362 WeakPolarHBondContact OH-CD 3.23Å; Y321-F365 HydrophobicContact CD1-CD2 4.06Å; Y321-F365 HydrophobicContact CD1-CE2 4.34Å; Y321-F365 AromaticContact CE1-CD2 3.7Å; Y321-F365 HydrophobicContact CE1-CD2 3.7Å; Y321-F365 AromaticContact CE1-CE2 3.69Å; Y321-F365 HydrophobicContact CE1-CE2 3.69Å
322	R	60	Low	68.5	Low	109 Å²	109	63.1 Å²	63.1	41%	0.411	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-9.7	-178.8	-51	170.8	-169.6	175.6	1.6	113	D288 S319 A320	D288-R322 IonicContact OD2-CZ 3.36Å; D288-R322 IonicContact OD2-NH1 2.72Å; D288-R322 PolarHBondContact OD2-NH1 2.8Å; D288-R322 IonicContact OD2-NH2 3.46Å; D288-R322 PolarHBondContact OD2-NH2 3.31Å; S319-R322 WeakPolarHBondContact O-CA 3.44Å; S319-R322 WeakPolarHBondContact O-CB 3.05Å; S319-R322 WeakPolarHBondContact O-CG 3.43Å; S319-R322 PolarHBondContact O-N 3.2Å; A320-R322 PolarHBondContact O-N 3.25Å; A320-R322 VanDerWaalsContact O-N 3.15Å
323	L	69.6	Low	70.7	Confident	50 Å²	50	61.1 Å²	61.1	26%	0.262	33%	0.329	S	S	.	.	S	Bend	trans	-78.9	132.8	-175.2	-65.2	171.4	0	0	0	110.6	A320 Y321 V325 H366 H369	A320-L323 WeakPolarHBondContact O-CB 3.32Å; A320-L323 PolarHBondContact O-N 3.2Å; A320-L323 VanDerWaalsContact O-N 3.14Å; Y321-L323 VanDerWaalsContact C-N 3.31Å; Y321-L323 PolarHBondContact O-N 3.16Å; L323-V325 PolarHBondContact O-N 2.93Å; L323-V325 VanDerWaalsContact O-N 3.09Å; L323-H366 HydrophobicContact CD1-CB 4.35Å; L323-H366 WeakPolarHBondContact CD1-ND1 3.43Å; L323-H369 HydrophobicContact CB-CB 3.88Å; L323-H369 HydrophobicContact CD1-CB 3.99Å
324	P	72	Confident	73	Confident	103 Å²	103	64.1 Å²	64.1	67%	0.669	34%	0.343	S	S	*	.			trans	-66.6	115.9	-179.2	27	-33.1	0	0	0	109.3	H369	P324-H369 PolarHBondContact O-ND1 3.19Å
325	V	83.1	Confident	75.4	Confident	15 Å²	15	59 Å²	59	9%	0.091	31%	0.31	C	S	.	.			trans	-126.1	121.1	171.5	-173.3	0	0	0	0	109.1	L323 V368 H369 R375	L323-V325 PolarHBondContact O-N 2.93Å; L323-V325 VanDerWaalsContact O-N 3.09Å; V325-V368 HydrophobicContact CB-CG1 4.48Å; V325-V368 HydrophobicContact CG1-CB 4.38Å; V325-V368 HydrophobicContact CG1-CG1 3.36Å; V325-V368 HydrophobicContact CG2-CG1 4.25Å; V325-H369 HydrophobicContact CG2-CB 4.14Å; V325-R375 HydrophobicContact CB-CG 4.08Å; V325-R375 HydrophobicContact CG1-CG 3.61Å; V325-R375 PolarHBondContact O-NE 3.36Å; V325-R375 VanDerWaalsContact O-NE 3.12Å; V325-R375 PolarHBondContact O-NH2 2.78Å
326	Q	88.7	Confident	77.5	Confident	134 Å²	134	52.7 Å²	52.7	63%	0.626	28%	0.28	S	S	*	.			trans	-65.5	137.7	180	-169.9	178.1	2.9	0	0	110.8	I328 S374 R375	Q326-I328 HydrophobicContact CB-CG1 4.4Å; Q326-I328 HydrophobicContact CG-CD1 4.11Å; Q326-I328 HydrophobicContact CG-CG1 3.77Å; Q326-S374 CarbonylContact O-C 3.57Å; Q326-S374 WeakPolarHBondContact O-CA 3.44Å; Q326-S374 WeakPolarHBondContact O-CB 3.38Å; Q326-R375 PolarHBondContact O-N 2.86Å
327	T	90.6	Very high	78.9	Confident	52 Å²	52	53.3 Å²	53.3	32%	0.319	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	124.9	171.8	-54.7	0	0	0	0	109.5	P274 R375 V377	P274-T327 HydrophobicContact CB-CG2 3.82Å; P274-T327 HydrophobicContact CG-CG2 3.99Å; T327-R375 WeakPolarHBondContact CA-O 3.4Å; T327-R375 HydrophobicContact CG2-CB 4.49Å; T327-R375 PolarHBondContact OG1-NE 3.09Å; T327-R375 PolarHBondContact OG1-NH2 3.01Å; T327-V377 HydrophobicContact CG2-CG2 3.28Å
328	I	92.3	Very high	80.3	Confident	30 Å²	30	58.9 Å²	58.9	15%	0.154	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	136.2	-176	-49.9	-179.6	0	0	0	109.1	Q326 H330 V333 S374 R375 L376 V377	Q326-I328 HydrophobicContact CB-CG1 4.4Å; Q326-I328 HydrophobicContact CG-CD1 4.11Å; Q326-I328 HydrophobicContact CG-CG1 3.77Å; I328-H330 PolarHBondContact O-N 3.33Å; I328-V333 HydrophobicContact CB-CG2 4.05Å; I328-V333 HydrophobicContact CD1-CG2 4.42Å; I328-V333 HydrophobicContact CG2-CG2 3.66Å; I328-S374 WeakPolarHBondContact CD1-OG 3.06Å; I328-R375 PolarHBondContact N-O 3.12Å; I328-L376 WeakPolarHBondContact O-CA 2.94Å; I328-V377 PolarHBondContact O-N 3.08Å
329	P	92.8	Very high	81.4	Confident	51 Å²	51	58.8 Å²	58.8	33%	0.331	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	132.9	167.7	-22	32.9	0	0	0	110.3	F331 S332 V377	P329-F331 HydrophobicContact CB-CD1 4.35Å; P329-F331 HydrophobicContact CB-CE1 3.9Å; P329-F331 HydrophobicContact CB-CE2 4.07Å; P329-F331 HydrophobicContact CB-CZ 3.73Å; P329-F331 PolarHBondContact O-N 3.09Å; P329-S332 WeakPolarHBondContact O-CB 3.44Å; P329-S332 PolarHBondContact O-N 3.19Å; P329-V377 WeakPolarHBondContact CA-O 3.48Å
330	H	94.3	Very high	82.4	Confident	18 Å²	18	60.3 Å²	60.3	8%	0.083	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-56.1	-31.2	-172.5	68.6	-75.4	0	0	0	114.7	I328 S332 Y335 L376 V377 V395 L396	I328-H330 PolarHBondContact O-N 3.33Å; H330-S332 VanDerWaalsContact C-N 3.33Å; H330-Y335 WeakPolarHBondContact O-CE2 3.49Å; H330-Y335 PolarHBondContact O-OH 3.41Å; H330-L376 HydrophobicContact CB-CB 4.32Å; H330-V377 PolarHBondContact N-O 3.15Å; H330-V377 PolarHBondContact ND1-O 3.19Å; H330-V395 WeakPolarHBondContact NE2-CG1 3.45Å; H330-L396 HydrophobicContact CB-CD2 3.24Å
331	F	93.5	Very high	83.1	Confident	110 Å²	110	63 Å²	63	48%	0.482	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-79.9	-11.7	178.5	58.4	-105.2	0	0	0	114	P329 P379	P329-F331 HydrophobicContact CB-CD1 4.35Å; P329-F331 HydrophobicContact CB-CE1 3.9Å; P329-F331 HydrophobicContact CB-CE2 4.07Å; P329-F331 HydrophobicContact CB-CZ 3.73Å; P329-F331 PolarHBondContact O-N 3.09Å; F331-P379 HydrophobicContact CE1-CG 3.8Å; F331-P379 HydrophobicContact CZ-CG 4.45Å
332	S	94.5	Very high	83.7	Confident	73 Å²	73	64.3 Å²	64.3	51%	0.51	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-90.1	-5.5	-179.1	-61.6	0	0	0	0	113.1	P329 H330	P329-S332 WeakPolarHBondContact O-CB 3.44Å; P329-S332 PolarHBondContact O-N 3.19Å; H330-S332 VanDerWaalsContact C-N 3.33Å
333	V	93.6	Very high	84.1	Confident	16 Å²	16	66.7 Å²	66.7	10%	0.097	37%	0.372	C	S	.	.	S	Bend	trans	-87.4	132.6	179.4	179.5	0	0	0	0	109.3	F268 I328 Y335 L376 Q403	F268-V333 HydrophobicContact CE1-CG1 3.86Å; F268-V333 HydrophobicContact CZ-CG1 3.83Å; I328-V333 HydrophobicContact CB-CG2 4.05Å; I328-V333 HydrophobicContact CD1-CG2 4.42Å; I328-V333 HydrophobicContact CG2-CG2 3.66Å; V333-Y335 HydrophobicContact CB-CD1 4.36Å; V333-Y335 HydrophobicContact CB-CD2 4.35Å; V333-Y335 HydrophobicContact CB-CE1 3.9Å; V333-Y335 HydrophobicContact CB-CE2 3.86Å; V333-Y335 HydrophobicContact CG1-CD1 3.71Å; V333-Y335 HydrophobicContact CG1-CD2 4.36Å; V333-Y335 HydrophobicContact CG1-CE1 3.6Å; V333-Y335 HydrophobicContact CG1-CE2 4.25Å; V333-Y335 HydrophobicContact CG1-CG 4.11Å; V333-Y335 WeakPolarHBondContact O-CD2 3.33Å; V333-Y335 PolarHBondContact O-N 2.97Å; V333-L376 HydrophobicContact CG2-CD2 3.73Å; V333-Q403 PolarHBondContact O-NE2 2.89Å; V333-Q403 PolarHBondContact O-OE1 3.25Å
334	N	92.9	Very high	83.9	Confident	124 Å²	124	68.6 Å²	68.6	66%	0.663	38%	0.379	S	S	*	.			trans	-83.1	104.4	163.2	179.1	17.1	0	0	0	108.2	I336	N334-I336 VanDerWaalsContact C-N 3.3Å; N334-I336 PolarHBondContact OD1-N 2.78Å
335	Y	92.9	Very high	83.3	Confident	2 Å²	2	68.8 Å²	68.8	1%	0.008	37%	0.371	C	S	.	.			trans	-80.2	-12.2	-176.3	-66.7	-76.8	0	0	0	113	F268 H330 V333 P337 L349 L376 E399 I400	F268-Y335 HydrophobicContact CD2-CD1 4.38Å; F268-Y335 HydrophobicContact CD2-CE1 4.23Å; F268-Y335 HydrophobicContact CE1-CE1 4.42Å; F268-Y335 AromaticContact CE2-CD1 3.92Å; F268-Y335 HydrophobicContact CE2-CD1 3.92Å; F268-Y335 HydrophobicContact CE2-CE1 4.11Å; F268-Y335 HydrophobicContact CG-CE1 4.45Å; F268-Y335 HydrophobicContact CZ-CD1 4.14Å; F268-Y335 HydrophobicContact CZ-CE1 4.2Å; H330-Y335 WeakPolarHBondContact O-CE2 3.49Å; H330-Y335 PolarHBondContact O-OH 3.41Å; V333-Y335 HydrophobicContact CB-CD1 4.36Å; V333-Y335 HydrophobicContact CB-CD2 4.35Å; V333-Y335 HydrophobicContact CB-CE1 3.9Å; V333-Y335 HydrophobicContact CB-CE2 3.86Å; V333-Y335 HydrophobicContact CG1-CD1 3.71Å; V333-Y335 HydrophobicContact CG1-CD2 4.36Å; V333-Y335 HydrophobicContact CG1-CE1 3.6Å; V333-Y335 HydrophobicContact CG1-CE2 4.25Å; V333-Y335 HydrophobicContact CG1-CG 4.11Å; V333-Y335 WeakPolarHBondContact O-CD2 3.33Å; V333-Y335 PolarHBondContact O-N 2.97Å; Y335-P337 WeakPolarHBondContact O-CD 3.38Å; Y335-L349 WeakPolarHBondContact O-CD1 3.48Å; Y335-L349 WeakPolarHBondContact O-CD2 3.46Å; Y335-L376 HydrophobicContact CE1-CD1 4.13Å; Y335-L376 HydrophobicContact CE1-CD2 4.41Å; Y335-L376 WeakPolarHBondContact OH-CD1 3.17Å; Y335-L376 WeakPolarHBondContact OH-CD2 3.29Å; Y335-E399 HydrophobicContact CE2-CG 4.18Å; Y335-I400 HydrophobicContact CD1-CD1 4.18Å; Y335-I400 HydrophobicContact CD1-CG1 3.77Å; Y335-I400 HydrophobicContact CD2-CB 4.4Å; Y335-I400 HydrophobicContact CD2-CG1 3.68Å; Y335-I400 HydrophobicContact CE1-CD1 4.11Å; Y335-I400 HydrophobicContact CE1-CG1 3.87Å; Y335-I400 HydrophobicContact CE2-CG1 3.8Å; Y335-I400 HydrophobicContact CG-CB 4.42Å; Y335-I400 HydrophobicContact CG-CG1 3.67Å; Y335-I400 HydrophobicContact CG-CG2 4.35Å
336	I	88.6	Confident	82.5	Confident	31 Å²	31	71.9 Å²	71.9	16%	0.159	39%	0.387	C	S	.	.	S	Bend	trans	-88.5	113.1	-177.3	-54.7	179.3	0	0	0	108.4	N334 Y340 Q403 F404 S407	N334-I336 VanDerWaalsContact C-N 3.3Å; N334-I336 PolarHBondContact OD1-N 2.78Å; I336-Y340 HydrophobicContact CG2-CD1 4.17Å; I336-Y340 HydrophobicContact CG2-CG 4.31Å; I336-Q403 HydrophobicContact CD1-CB 4.24Å; I336-Q403 HydrophobicContact CG1-CB 4.36Å; I336-F404 HydrophobicContact CG1-CD1 4.3Å; I336-F404 HydrophobicContact CG1-CD2 4.34Å; I336-F404 HydrophobicContact CG1-CE1 4.16Å; I336-F404 HydrophobicContact CG1-CE2 4.22Å; I336-F404 HydrophobicContact CG1-CG 4.38Å; I336-F404 HydrophobicContact CG1-CZ 4.12Å; I336-F404 HydrophobicContact CG2-CE1 4.43Å; I336-S407 WeakPolarHBondContact CD1-OG 3.42Å
337	P	80.3	Confident	81.6	Confident	21 Å²	21	66.9 Å²	66.9	14%	0.136	37%	0.366	C	S	.	.			trans	-56.3	142.1	172.4	-21.2	31.3	0	0	0	110.7	Y335 D339 Y340 R348	Y335-P337 WeakPolarHBondContact O-CD 3.38Å; P337-D339 VanDerWaalsContact CB-OD1 3.27Å; P337-D339 WeakPolarHBondContact CB-OD1 3.37Å; P337-D339 PolarHBondContact O-N 2.6Å; P337-Y340 WeakPolarHBondContact O-CB 3.36Å; P337-Y340 PolarHBondContact O-N 2.93Å; P337-R348 HydrophobicContact CG-CB 3.78Å; P337-R348 HydrophobicContact CG-CG 4.3Å
338	S	80	Confident	81.2	Confident	137 Å²	137	65.3 Å²	65.3	96%	0.958	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-24.8	179.5	49	0	0	0	0	113.3
339	D	76.8	Confident	81.3	Confident	85 Å²	85	64 Å²	64	46%	0.455	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	13.4	176.3	71.2	-35.1	0	0	0	113	P337 N341 R348	P337-D339 VanDerWaalsContact CB-OD1 3.27Å; P337-D339 WeakPolarHBondContact CB-OD1 3.37Å; P337-D339 PolarHBondContact O-N 2.6Å; D339-N341 PolarHBondContact O-N 2.97Å; D339-N341 VanDerWaalsContact O-N 3.14Å; D339-R348 IonicContact OD1-NH1 3.42Å; D339-R348 IonicContact OD2-CZ 2.89Å; D339-R348 IonicContact OD2-NH1 2.76Å; D339-R348 PolarHBondContact OD2-NH1 3.33Å; D339-R348 IonicContact OD2-NH2 3.69Å
340	Y	76.9	Confident	81.4	Confident	54 Å²	54	61.5 Å²	61.5	21%	0.212	33%	0.332	C	S	.	.			trans	-64.6	115.7	-178.1	178.9	-109	0	0	0	111.9	P186 I336 P337 R348 F404	P186-Y340 HydrophobicContact CB-CE2 3.74Å; P186-Y340 HydrophobicContact CG-CD2 4.39Å; P186-Y340 HydrophobicContact CG-CE2 3.5Å; P186-Y340 VanDerWaalsContact CG-CE2 3.5Å; I336-Y340 HydrophobicContact CG2-CD1 4.17Å; I336-Y340 HydrophobicContact CG2-CG 4.31Å; P337-Y340 WeakPolarHBondContact O-CB 3.36Å; P337-Y340 PolarHBondContact O-N 2.93Å; Y340-R348 HydrophobicContact CD2-CG 4.46Å; Y340-F404 HydrophobicContact CD1-CD1 4.39Å; Y340-F404 AromaticContact CD1-CE1 3.82Å; Y340-F404 HydrophobicContact CD1-CE1 3.82Å; Y340-F404 HydrophobicContact CD2-CE1 4.18Å; Y340-F404 AromaticContact CE1-CD1 3.85Å; Y340-F404 HydrophobicContact CE1-CD1 3.85Å; Y340-F404 AromaticContact CE1-CE1 3.53Å; Y340-F404 HydrophobicContact CE1-CE1 3.53Å; Y340-F404 AromaticContact CE2-CE1 3.94Å; Y340-F404 HydrophobicContact CE2-CE1 3.94Å; Y340-F404 HydrophobicContact CG-CE1 4.13Å; Y340-F404 AromaticContact CZ-CE1 3.59Å
341	N	72.7	Confident	81.5	Confident	61 Å²	61	60.7 Å²	60.7	33%	0.326	33%	0.328	S	S	.	.			trans	-107	115.9	171.3	-174.3	-8	0	0	0	110.5	D339 E343 E344	D339-N341 PolarHBondContact O-N 2.97Å; D339-N341 VanDerWaalsContact O-N 3.14Å; N341-E343 PolarHBondContact O-N 2.9Å; N341-E343 WeakPolarHBondContact OD1-CB 2.95Å; N341-E343 PolarHBondContact OD1-N 3.06Å; N341-E344 HydrophobicContact CB-CB 4.42Å; N341-E344 HydrophobicContact CB-CG 4.02Å; N341-E344 PolarHBondContact O-N 2.91Å
342	S	71.8	Confident	81.7	Confident	74 Å²	74	55.4 Å²	55.4	52%	0.517	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-24.5	179.7	69.2	0	0	0	0	114.1	H345	S342-H345 PolarHBondContact O-CE1 3.14Å; S342-H345 PolarHBondContact O-ND1 3.12Å
343	E	67.6	Low	81.8	Confident	159 Å²	159	52.1 Å²	52.1	74%	0.743	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-24.9	-179.5	-60.5	-171.6	165.4	0	0	112.6	N341 H345	N341-E343 PolarHBondContact O-N 2.9Å; N341-E343 WeakPolarHBondContact OD1-CB 2.95Å; N341-E343 PolarHBondContact OD1-N 3.06Å; E343-H345 VanDerWaalsContact C-N 3.32Å; E343-H345 PolarHBondContact O-N 3.37Å
344	E	65.6	Low	81.8	Confident	90 Å²	90	51.9 Å²	51.9	42%	0.421	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-18.4	-176.7	-72.8	-178	-165	0	0	113	N341 N346 R348	N341-E344 HydrophobicContact CB-CB 4.42Å; N341-E344 HydrophobicContact CB-CG 4.02Å; N341-E344 PolarHBondContact O-N 2.91Å; E344-N346 HydrophobicContact CB-CB 4.39Å; E344-N346 PolarHBondContact O-N 2.86Å; E344-N346 PolarHBondContact O-OD1 3.45Å; E344-N346 PolarHBondContact OE2-ND2 3.02Å; E344-N346 VanDerWaalsContact OE2-ND2 3.13Å; E344-R348 IonicContact OE2-NH2 3.28Å; E344-R348 PolarHBondContact OE2-NH2 2.82Å
345	H	59.2	Low	81.6	Confident	108 Å²	108	46.2 Å²	46.2	50%	0.5	25%	0.253	S	S	.	.			trans	49.1	21.9	-177.3	-62.4	-56.2	0	0	0	114.7	S342 E343	S342-H345 PolarHBondContact O-CE1 3.14Å; S342-H345 PolarHBondContact O-ND1 3.12Å; E343-H345 VanDerWaalsContact C-N 3.32Å; E343-H345 PolarHBondContact O-N 3.37Å
346	N	66.5	Low	81.2	Confident	80 Å²	80	50.6 Å²	50.6	43%	0.428	27%	0.273	S	S	.	.			trans	-74.8	132.6	-176.4	-78.5	-28.8	0	0	0	109.6	E344 R348	E344-N346 HydrophobicContact CB-CB 4.39Å; E344-N346 PolarHBondContact O-N 2.86Å; E344-N346 PolarHBondContact O-OD1 3.45Å; E344-N346 PolarHBondContact OE2-ND2 3.02Å; E344-N346 VanDerWaalsContact OE2-ND2 3.13Å; N346-R348 PolarHBondContact O-N 2.93Å
347	C	69.6	Low	80.9	Confident	28 Å²	28	53.1 Å²	53.1	19%	0.189	30%	0.299	C	S	.	.			trans	-67.3	115.6	173.3	-176.3	0	0	0	0	108.8	T188 L349	T188-C347 PolarHBondContact OG1-SG 3.39Å; C347-L349 PolarHBondContact SG-O 3.14Å
348	R	82.7	Confident	80.9	Confident	19 Å²	19	58.1 Å²	58.1	7%	0.072	32%	0.32	C	S	.	.			trans	-113.9	-8.7	-179.2	-61.7	-63.5	-174.2	121	-0.8	113	P186 H264 V265 I266 P337 D339 Y340 E344 N346	P186-R348 PolarHBondContact O-N 3.43Å; H264-R348 WeakPolarHBondContact O-CD 3.44Å; V265-R348 CarbonylContact C-O 3.6Å; V265-R348 WeakPolarHBondContact CA-O 3.39Å; I266-R348 PolarHBondContact N-O 3.09Å; P337-R348 HydrophobicContact CG-CB 3.78Å; P337-R348 HydrophobicContact CG-CG 4.3Å; D339-R348 IonicContact OD1-NH1 3.42Å; D339-R348 IonicContact OD2-CZ 2.89Å; D339-R348 IonicContact OD2-NH1 2.76Å; D339-R348 PolarHBondContact OD2-NH1 3.33Å; D339-R348 IonicContact OD2-NH2 3.69Å; Y340-R348 HydrophobicContact CD2-CG 4.46Å; E344-R348 IonicContact OE2-NH2 3.28Å; E344-R348 PolarHBondContact OE2-NH2 2.82Å; N346-R348 PolarHBondContact O-N 2.93Å
349	L	93.4	Very high	81.1	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.01	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	140.7	-175	-61.7	160.9	0	0	0	110	P186 V187 T188 I266 F268 Y335 C347 I400 F404	P186-L349 PolarHBondContact O-N 3.12Å; V187-L349 CarbonylContact C-O 3.54Å; V187-L349 WeakPolarHBondContact CA-O 3.39Å; V187-L349 HydrophobicContact CG2-CB 3.96Å; V187-L349 HydrophobicContact CG2-CD1 3.88Å; T188-L349 PolarHBondContact N-O 3.26Å; I266-L349 HydrophobicContact CB-CD2 4.4Å; I266-L349 WeakPolarHBondContact O-CA 3.35Å; F268-L349 HydrophobicContact CE2-CD2 3.77Å; Y335-L349 WeakPolarHBondContact O-CD1 3.48Å; Y335-L349 WeakPolarHBondContact O-CD2 3.46Å; C347-L349 PolarHBondContact SG-O 3.14Å; L349-I400 HydrophobicContact CD1-CG2 4.38Å; L349-F404 HydrophobicContact CD1-CE2 3.49Å; L349-F404 VanDerWaalsContact CD1-CE2 3.49Å; L349-F404 HydrophobicContact CD1-CZ 3.62Å
350	A	95.7	Very high	81.7	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	145.3	164.1	0	0	0	0	0	111.3	T188 I190 F255 V265 I266 V267 F268	T188-A350 CarbonylContact O-C 3.52Å; T188-A350 WeakPolarHBondContact O-CA 3.48Å; I190-A350 HydrophobicContact CD1-CB 3.92Å; I190-A350 HydrophobicContact CG1-CB 4.3Å; F255-A350 HydrophobicContact CE1-CB 4.29Å; F255-A350 HydrophobicContact CE2-CB 4.24Å; F255-A350 HydrophobicContact CZ-CB 3.66Å; V265-A350 HydrophobicContact CG2-CB 4.34Å; I266-A350 PolarHBondContact O-N 3.23Å; V267-A350 CarbonylContact C-O 3.54Å; V267-A350 WeakPolarHBondContact CA-O 3.19Å; V267-A350 HydrophobicContact CB-CB 4.49Å; V267-A350 HydrophobicContact CG1-CB 4.27Å; V267-A350 HydrophobicContact CG2-CB 4.03Å; F268-A350 PolarHBondContact N-O 3.3Å
351	V	97.2	Very high	82.3	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	123.1	173.6	-178.7	0	0	0	0	108.2	V187 T188 I190 F268 I353 L396 L397 I400	V187-V351 HydrophobicContact CG1-CG2 4.3Å; T188-V351 PolarHBondContact O-N 3.17Å; I190-V351 PolarHBondContact N-O 3.39Å; F268-V351 CarbonylContact O-C 3.5Å; F268-V351 WeakPolarHBondContact O-CA 3.4Å; V351-I353 HydrophobicContact CG1-CD1 3.97Å; V351-I353 HydrophobicContact CG1-CG1 4.42Å; V351-L396 HydrophobicContact CG1-CD1 4.26Å; V351-L397 HydrophobicContact CG2-CD2 4.42Å; V351-I400 HydrophobicContact CG2-CD1 3.54Å
352	V	97.3	Very high	82.9	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	128.4	175.9	-171.4	0	0	0	0	109.5	I190 D192 W248 V267 F268 V269 A270 V360 A364	I190-V352 HydrophobicContact CB-CB 4.39Å; I190-V352 HydrophobicContact CB-CG1 4.39Å; I190-V352 HydrophobicContact CB-CG2 4.06Å; I190-V352 HydrophobicContact CD1-CG2 4.06Å; I190-V352 HydrophobicContact CG1-CG2 4.48Å; I190-V352 HydrophobicContact CG2-CG1 4.37Å; I190-V352 HydrophobicContact CG2-CG2 4.46Å; I190-V352 CarbonylContact O-C 3.48Å; I190-V352 WeakPolarHBondContact O-CA 3.45Å; D192-V352 HydrophobicContact CB-CG1 4.01Å; W248-V352 HydrophobicContact CH2-CG1 4Å; W248-V352 HydrophobicContact CH2-CG2 4.41Å; V267-V352 HydrophobicContact CG1-CG2 3.72Å; F268-V352 PolarHBondContact O-N 3.04Å; V269-V352 HydrophobicContact CB-CB 4.43Å; V269-V352 HydrophobicContact CG1-CB 3.69Å; V269-V352 HydrophobicContact CG1-CG1 4.33Å; V269-V352 HydrophobicContact CG1-CG2 3.86Å; A270-V352 PolarHBondContact N-O 2.69Å; V352-V360 HydrophobicContact CG1-CG1 4.28Å; V352-A364 HydrophobicContact CG1-CB 3.91Å; V352-A364 HydrophobicContact CG2-CB 4.38Å
353	I	96.2	Very high	83.8	Confident	4 Å²	4	43 Å²	43	2%	0.021	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	119.4	175.3	-58.5	-60.2	0	0	0	108.4	L189 I190 L191 D192 A270 V351 V389 A393 L396	L189-I353 HydrophobicContact CD1-CB 4.46Å; L189-I353 HydrophobicContact CD1-CG1 3.58Å; I190-I353 PolarHBondContact O-N 3Å; L191-I353 HydrophobicContact CD2-CB 4.22Å; D192-I353 PolarHBondContact N-O 2.93Å; A270-I353 HydrophobicContact CB-CD1 3.51Å; V351-I353 HydrophobicContact CG1-CD1 3.97Å; V351-I353 HydrophobicContact CG1-CG1 4.42Å; I353-V389 HydrophobicContact CG2-CG2 3.1Å; I353-A393 HydrophobicContact CD1-CB 4.19Å; I353-A393 HydrophobicContact CG1-CB 4.16Å; I353-L396 HydrophobicContact CD1-CD1 4.01Å
354	G	93.5	Very high	84.9	Confident	11 Å²	11	35.5 Å²	35.5	11%	0.113	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	168	178.7	0	0	0	0	0	114.1	I194 G359 V389	I194-G354 WeakPolarHBondContact CD1-O 3.44Å; G354-G359 VanDerWaalsContact CA-O 3.28Å; G354-G359 WeakPolarHBondContact CA-O 3.21Å; G354-V389 WeakPolarHBondContact O-CG2 3.39Å
355	S	90.1	Very high	86.1	Confident	5 Å²	5	31.6 Å²	31.6	4%	0.035	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-68.4	154.4	174.5	75.3	0	0	0	0	112.4	D192 R193 A357 H358 G359	D192-S355 PolarHBondContact O-N 3.39Å; D192-S355 VanDerWaalsContact O-N 3.09Å; R193-S355 WeakPolarHBondContact O-CB 3.2Å; S355-A357 PolarHBondContact O-N 3.18Å; S355-H358 WeakPolarHBondContact OG-CB 3.11Å; S355-H358 PolarHBondContact OG-N 3.33Å; S355-H358 PolarHBondContact OG-ND1 3.26Å; S355-G359 PolarHBondContact N-O 3.05Å; S355-G359 WeakPolarHBondContact O-CA 3.44Å; S355-G359 PolarHBondContact O-N 3.5Å
356	E	84	Confident	87.4	Confident	94 Å²	94	27.9 Å²	27.9	44%	0.439	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-30.1	175.9	-61.1	85.8	164.9	0	0	112.9	N199 V389	N199-E356 PolarHBondContact ND2-OE1 2.98Å; E356-V389 HydrophobicContact CG-CB 4.32Å; E356-V389 WeakPolarHBondContact OE1-CG1 3.33Å
357	A	81.9	Confident	88.5	Confident	84 Å²	84	24.2 Å²	24.2	69%	0.694	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-35.7	-175	0	0	0	0	0	113.3	S355	S355-A357 PolarHBondContact O-N 3.18Å
358	H	80	Confident	89.6	Confident	125 Å²	125	22.9 Å²	22.9	58%	0.579	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.7	-7.5	-172.3	-54	93.1	0	0	0	113.8	S355	S355-H358 WeakPolarHBondContact OG-CB 3.11Å; S355-H358 PolarHBondContact OG-N 3.33Å; S355-H358 PolarHBondContact OG-ND1 3.26Å
359	G	85.4	Confident	89.8	Confident	28 Å²	28	25.4 Å²	25.4	29%	0.289	15%	0.146	S	C	.	.	B	Isolated β-bridge	trans	60.5	-148.7	-168.9	0	0	0	0	0	112.1	G354 S355	G354-G359 VanDerWaalsContact CA-O 3.28Å; G354-G359 WeakPolarHBondContact CA-O 3.21Å; S355-G359 PolarHBondContact N-O 3.05Å; S355-G359 WeakPolarHBondContact O-CA 3.44Å; S355-G359 PolarHBondContact O-N 3.5Å
360	V	88.7	Confident	89.5	Confident	11 Å²	11	28.8 Å²	28.8	7%	0.067	16%	0.163	C	C	.	.	S	Bend	trans	-86.5	140.1	-179.2	173.3	0	0	0	0	110.2	V269 A270 V352 A364 F365	V269-V360 HydrophobicContact CB-CG1 4.06Å; V269-V360 HydrophobicContact CB-CG2 4.45Å; V269-V360 HydrophobicContact CG1-CG1 3.68Å; A270-V360 WeakPolarHBondContact O-CG2 3.43Å; V352-V360 HydrophobicContact CG1-CG1 4.28Å; V360-A364 HydrophobicContact CG1-CB 3.33Å; V360-F365 HydrophobicContact CB-CE2 4.12Å; V360-F365 HydrophobicContact CB-CZ 4.31Å; V360-F365 HydrophobicContact CG1-CD2 4.29Å; V360-F365 HydrophobicContact CG1-CE2 3.93Å; V360-F365 HydrophobicContact CG1-CZ 4.25Å
361	S	88.8	Confident	89.2	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.169	C	C	.	.			trans	-72.5	154.8	-179.9	64.5	0	0	0	0	114.6	D192 W248 E363 A364 F365	D192-S361 WeakPolarHBondContact OD2-CA 3.43Å; D192-S361 WeakPolarHBondContact OD2-CB 3.44Å; D192-S361 PolarHBondContact OD2-N 3.2Å; D192-S361 PolarHBondContact OD2-OG 2.81Å; W248-S361 WeakPolarHBondContact CZ2-OG 3.36Å; W248-S361 PolarHBondContact NE1-OG 2.83Å; S361-E363 VanDerWaalsContact CB-OE2 3.26Å; S361-E363 WeakPolarHBondContact CB-OE2 3.47Å; S361-E363 PolarHBondContact O-N 3.28Å; S361-A364 WeakPolarHBondContact O-CB 3.39Å; S361-A364 PolarHBondContact O-N 2.85Å; S361-A364 VanDerWaalsContact O-N 3.12Å; S361-A364 PolarHBondContact OG-N 3.02Å; S361-F365 VanDerWaalsContact O-CD2 3.23Å; S361-F365 WeakPolarHBondContact O-CD2 3.33Å; S361-F365 PolarHBondContact O-N 3.19Å
362	P	86.6	Confident	88.8	Confident	15 Å²	15	32.8 Å²	32.8	10%	0.097	20%	0.201	C	C	.	.	H	α-helix	trans	-54.3	-39.5	171	2.9	-7.9	0	0	0	113.1	T317 A320 Y321 A364 F365 H366	T317-P362 WeakPolarHBondContact O-CB 3.26Å; A320-P362 HydrophobicContact CB-CB 3.93Å; A320-P362 WeakPolarHBondContact CB-O 3.41Å; Y321-P362 HydrophobicContact CD2-CB 3.69Å; Y321-P362 HydrophobicContact CD2-CG 4.04Å; Y321-P362 HydrophobicContact CE2-CB 3.51Å; Y321-P362 HydrophobicContact CE2-CG 3.41Å; Y321-P362 VanDerWaalsContact CE2-CG 3.41Å; Y321-P362 HydrophobicContact CG-CB 4.29Å; Y321-P362 WeakPolarHBondContact OH-CD 3.23Å; P362-A364 VanDerWaalsContact C-N 3.26Å; P362-A364 PolarHBondContact O-N 3.49Å; P362-F365 WeakPolarHBondContact O-CB 2.99Å; P362-F365 PolarHBondContact O-N 2.82Å; P362-H366 PolarHBondContact O-N 3.18Å
363	E	89.3	Confident	88.6	Confident	41 Å²	41	33.2 Å²	33.2	19%	0.192	21%	0.206	C	C	.	.	H	α-helix	trans	-62.4	-33.4	179.1	-61.4	91.5	150.5	0	0	112.5	W248 L312 T317 S361 H366 L367	W248-E363 HydrophobicContact CB-CB 4.04Å; W248-E363 HydrophobicContact CB-CG 4.49Å; W248-E363 HydrophobicContact CD2-CB 3.73Å; W248-E363 HydrophobicContact CG-CB 3.39Å; W248-E363 HydrophobicContact CG-CG 4.06Å; L312-E363 HydrophobicContact CD2-CB 4.28Å; L312-E363 HydrophobicContact CD2-CG 3.69Å; T317-E363 HydrophobicContact CG2-CG 3.82Å; T317-E363 WeakPolarHBondContact CG2-OE1 3.31Å; S361-E363 VanDerWaalsContact CB-OE2 3.26Å; S361-E363 WeakPolarHBondContact CB-OE2 3.47Å; S361-E363 PolarHBondContact O-N 3.28Å; E363-H366 WeakPolarHBondContact O-CB 3.28Å; E363-H366 PolarHBondContact O-N 3.04Å; E363-L367 PolarHBondContact O-N 3.27Å
364	A	92	Very high	88.4	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65.8	-42.8	171.7	0	0	0	0	0	111.6	W248 V269 V352 V360 S361 P362 H366 L367 V368	W248-A364 HydrophobicContact CH2-CB 3.42Å; W248-A364 VanDerWaalsContact CH2-CB 3.42Å; W248-A364 HydrophobicContact CZ2-CB 3.69Å; W248-A364 HydrophobicContact CZ3-CB 4.11Å; V269-A364 HydrophobicContact CG1-CB 3.97Å; V352-A364 HydrophobicContact CG1-CB 3.91Å; V352-A364 HydrophobicContact CG2-CB 4.38Å; V360-A364 HydrophobicContact CG1-CB 3.33Å; S361-A364 WeakPolarHBondContact O-CB 3.39Å; S361-A364 PolarHBondContact O-N 2.85Å; S361-A364 VanDerWaalsContact O-N 3.12Å; S361-A364 PolarHBondContact OG-N 3.02Å; P362-A364 VanDerWaalsContact C-N 3.26Å; P362-A364 PolarHBondContact O-N 3.49Å; A364-H366 VanDerWaalsContact C-N 3.28Å; A364-H366 PolarHBondContact O-N 2.8Å; A364-L367 WeakPolarHBondContact O-CB 3.43Å; A364-L367 PolarHBondContact O-N 2.91Å; A364-V368 WeakPolarHBondContact O-CG2 3.42Å; A364-V368 PolarHBondContact O-N 2.96Å
365	F	89.2	Confident	88.4	Confident	9 Å²	9	34.1 Å²	34.1	4%	0.039	21%	0.207	C	C	.	.	H	α-helix	trans	-62.5	-37.1	175.1	-70.7	-74.9	0	0	0	111.8	V269 T277 Y321 V360 S361 P362 V368 H369 R375	V269-F365 HydrophobicContact CG2-CD1 3.95Å; V269-F365 HydrophobicContact CG2-CE1 3.67Å; V269-F365 HydrophobicContact CG2-CZ 4.47Å; T277-F365 HydrophobicContact CG2-CE1 4.35Å; T277-F365 HydrophobicContact CG2-CE2 4.18Å; T277-F365 HydrophobicContact CG2-CZ 3.74Å; Y321-F365 HydrophobicContact CD1-CD2 4.06Å; Y321-F365 HydrophobicContact CD1-CE2 4.34Å; Y321-F365 AromaticContact CE1-CD2 3.7Å; Y321-F365 HydrophobicContact CE1-CD2 3.7Å; Y321-F365 AromaticContact CE1-CE2 3.69Å; Y321-F365 HydrophobicContact CE1-CE2 3.69Å; V360-F365 HydrophobicContact CB-CE2 4.12Å; V360-F365 HydrophobicContact CB-CZ 4.31Å; V360-F365 HydrophobicContact CG1-CD2 4.29Å; V360-F365 HydrophobicContact CG1-CE2 3.93Å; V360-F365 HydrophobicContact CG1-CZ 4.25Å; S361-F365 VanDerWaalsContact O-CD2 3.23Å; S361-F365 WeakPolarHBondContact O-CD2 3.33Å; S361-F365 PolarHBondContact O-N 3.19Å; P362-F365 WeakPolarHBondContact O-CB 2.99Å; P362-F365 PolarHBondContact O-N 2.82Å; F365-V368 PolarHBondContact O-N 2.62Å; F365-H369 PolarHBondContact O-N 2.99Å; F365-R375 HydrophobicContact CD1-CG 4.21Å; F365-R375 HydrophobicContact CE1-CG 3.82Å
366	H	87.4	Confident	88.6	Confident	30 Å²	30	34 Å²	34	14%	0.139	21%	0.206	C	C	.	.	H	α-helix	trans	-58.6	-49	171.7	-172.8	59.5	0	0	0	111.6	A320 L323 P362 E363 A364 V368 H369 L370	A320-H366 HydrophobicContact CB-CB 3.81Å; L323-H366 HydrophobicContact CD1-CB 4.35Å; L323-H366 WeakPolarHBondContact CD1-ND1 3.43Å; P362-H366 PolarHBondContact O-N 3.18Å; E363-H366 WeakPolarHBondContact O-CB 3.28Å; E363-H366 PolarHBondContact O-N 3.04Å; A364-H366 VanDerWaalsContact C-N 3.28Å; A364-H366 PolarHBondContact O-N 2.8Å; H366-V368 VanDerWaalsContact C-N 3.31Å; H366-V368 PolarHBondContact O-N 2.52Å; H366-H369 WeakPolarHBondContact O-CB 3.43Å; H366-H369 PolarHBondContact O-N 3.06Å; H366-H369 VanDerWaalsContact O-N 3.14Å; H366-L370 WeakPolarHBondContact NE2-CD1 3.22Å; H366-L370 WeakPolarHBondContact O-CG 3.41Å; H366-L370 PolarHBondContact O-N 3.47Å
367	L	89.8	Confident	89	Confident	3 Å²	3	30.7 Å²	30.7	2%	0.016	19%	0.192	C	C	.	.	H	α-helix	trans	-61.8	-39.3	179.1	-173.8	64.1	0	0	0	112.3	I190 W248 I251 I257 V267 E363 A364 L370 T371	I190-L367 HydrophobicContact CD1-CD2 4.31Å; W248-L367 HydrophobicContact CE3-CD2 4.09Å; W248-L367 HydrophobicContact CZ3-CD2 3.8Å; I251-L367 HydrophobicContact CG2-CD2 3.84Å; I257-L367 HydrophobicContact CD1-CD1 3.5Å; V267-L367 HydrophobicContact CB-CG 4.38Å; V267-L367 HydrophobicContact CG1-CD2 4.14Å; V267-L367 HydrophobicContact CG1-CG 4.27Å; V267-L367 HydrophobicContact CG2-CD2 4.16Å; V267-L367 HydrophobicContact CG2-CG 4.03Å; E363-L367 PolarHBondContact O-N 3.27Å; A364-L367 WeakPolarHBondContact O-CB 3.43Å; A364-L367 PolarHBondContact O-N 2.91Å; L367-L370 PolarHBondContact O-N 2.72Å; L367-T371 HydrophobicContact CD1-CG2 4.42Å; L367-T371 WeakPolarHBondContact O-CB 3.42Å; L367-T371 WeakPolarHBondContact O-CG2 3.34Å; L367-T371 PolarHBondContact O-N 3.47Å; L367-T371 VanDerWaalsContact O-N 3.16Å; L367-T371 PolarHBondContact O-OG1 3.49Å
368	V	91.9	Very high	89.5	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.6	-45.9	173.7	174.7	0	0	0	0	111	V267 V269 V325 A364 F365 H366 T371 G372 G373 S374	V267-V368 HydrophobicContact CB-CG2 4.4Å; V267-V368 HydrophobicContact CG1-CG2 4.02Å; V267-V368 WeakPolarHBondContact O-CG1 3.5Å; V267-V368 WeakPolarHBondContact O-CG2 3.5Å; V269-V368 HydrophobicContact CB-CG2 4.07Å; V269-V368 HydrophobicContact CG1-CG2 3.28Å; V269-V368 HydrophobicContact CG2-CG2 3.95Å; V325-V368 HydrophobicContact CB-CG1 4.48Å; V325-V368 HydrophobicContact CG1-CB 4.38Å; V325-V368 HydrophobicContact CG1-CG1 3.36Å; V325-V368 HydrophobicContact CG2-CG1 4.25Å; A364-V368 WeakPolarHBondContact O-CG2 3.42Å; A364-V368 PolarHBondContact O-N 2.96Å; F365-V368 PolarHBondContact O-N 2.62Å; H366-V368 VanDerWaalsContact C-N 3.31Å; H366-V368 PolarHBondContact O-N 2.52Å; V368-T371 PolarHBondContact O-N 3Å; V368-T371 PolarHBondContact O-OG1 3.15Å; V368-G372 PolarHBondContact O-N 2.82Å; V368-G373 VanDerWaalsContact CG1-C 3.4Å; V368-G373 PolarHBondContact O-N 3.1Å; V368-S374 VanDerWaalsContact CG1-N 3.31Å
369	H	88.1	Confident	89.9	Confident	71 Å²	71	26.1 Å²	26.1	33%	0.329	16%	0.164	S	C	.	.	H	α-helix	trans	-61.1	-47.3	177.9	179	78.6	0	0	0	111.9	L323 P324 V325 F365 H366 T371 G372	L323-H369 HydrophobicContact CB-CB 3.88Å; L323-H369 HydrophobicContact CD1-CB 3.99Å; P324-H369 PolarHBondContact O-ND1 3.19Å; V325-H369 HydrophobicContact CG2-CB 4.14Å; F365-H369 PolarHBondContact O-N 2.99Å; H366-H369 WeakPolarHBondContact O-CB 3.43Å; H366-H369 PolarHBondContact O-N 3.06Å; H366-H369 VanDerWaalsContact O-N 3.14Å; H369-T371 PolarHBondContact O-N 3.14Å; H369-G372 PolarHBondContact O-N 3.29Å
370	L	86.9	Confident	89.8	Confident	73 Å²	73	28.1 Å²	28.1	38%	0.382	17%	0.174	S	C	.	.	H	α-helix	trans	-61.3	-26.8	179.7	-70.9	-178.5	0	0	0	113.7	H366 L367	H366-L370 WeakPolarHBondContact NE2-CD1 3.22Å; H366-L370 WeakPolarHBondContact O-CG 3.41Å; H366-L370 PolarHBondContact O-N 3.47Å; L367-L370 PolarHBondContact O-N 2.72Å
371	T	89.4	Confident	89.5	Confident	19 Å²	19	30.8 Å²	30.8	12%	0.117	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	7.8	-176.6	57.9	0	0	0	0	113.2	I257 V265 V267 L367 V368 H369 G373	I257-T371 HydrophobicContact CD1-CG2 3.57Å; I257-T371 HydrophobicContact CG1-CG2 4.45Å; V265-T371 HydrophobicContact CG1-CG2 3.92Å; V265-T371 WeakPolarHBondContact O-CB 3.33Å; V267-T371 VanDerWaalsContact CB-OG1 3.3Å; V267-T371 WeakPolarHBondContact CB-OG1 3.22Å; V267-T371 HydrophobicContact CG2-CG2 3.85Å; V267-T371 WeakPolarHBondContact CG2-OG1 3.26Å; V267-T371 PolarHBondContact N-OG1 3.25Å; V267-T371 VanDerWaalsContact N-OG1 3.12Å; L367-T371 HydrophobicContact CD1-CG2 4.42Å; L367-T371 WeakPolarHBondContact O-CB 3.42Å; L367-T371 WeakPolarHBondContact O-CG2 3.34Å; L367-T371 PolarHBondContact O-N 3.47Å; L367-T371 VanDerWaalsContact O-N 3.16Å; L367-T371 PolarHBondContact O-OG1 3.49Å; V368-T371 PolarHBondContact O-N 3Å; V368-T371 PolarHBondContact O-OG1 3.15Å; H369-T371 PolarHBondContact O-N 3.14Å; T371-G373 PolarHBondContact O-N 3.09Å
372	G	88.5	Confident	88.8	Confident	66 Å²	66	37.8 Å²	37.8	68%	0.68	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.1	23	-179.4	0	0	0	0	0	113.7	V368 H369	V368-G372 PolarHBondContact O-N 2.82Å; H369-G372 PolarHBondContact O-N 3.29Å
373	G	92.1	Very high	88.1	Confident	9 Å²	9	49.1 Å²	49.1	9%	0.093	28%	0.275	C	S	.	.			trans	-83.7	-160.8	-176.9	0	0	0	0	0	114.1	V267 V368 T371	V267-G373 VanDerWaalsContact O-CA 3.29Å; V267-G373 WeakPolarHBondContact O-CA 3.36Å; V368-G373 VanDerWaalsContact CG1-C 3.4Å; V368-G373 PolarHBondContact O-N 3.1Å; T371-G373 PolarHBondContact O-N 3.09Å
374	S	92.7	Very high	87.4	Confident	10 Å²	10	51.6 Å²	51.6	7%	0.07	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	160.1	-174	-64.9	0	0	0	0	113.5	F268 V269 Q326 I328 V368	F268-S374 WeakPolarHBondContact CA-O 3.22Å; V269-S374 PolarHBondContact N-O 3.31Å; Q326-S374 CarbonylContact O-C 3.57Å; Q326-S374 WeakPolarHBondContact O-CA 3.44Å; Q326-S374 WeakPolarHBondContact O-CB 3.38Å; I328-S374 WeakPolarHBondContact CD1-OG 3.06Å; V368-S374 VanDerWaalsContact CG1-N 3.31Å
375	R	93.3	Very high	86.3	Confident	23 Å²	23	55.1 Å²	55.1	9%	0.087	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	120.5	167.7	-56.7	-176.5	-77.4	173.9	-6.9	108.8	V269 D271 D278 V325 Q326 T327 I328 F365	V269-R375 HydrophobicContact CG2-CB 4.14Å; V269-R375 HydrophobicContact CG2-CG 3.76Å; D271-R375 HydrophobicContact CB-CB 4.33Å; D271-R375 IonicContact OD2-NH1 3.55Å; D278-R375 IonicContact OD1-CZ 2.74Å; D278-R375 IonicContact OD1-NH1 2.79Å; D278-R375 PolarHBondContact OD1-NH1 3.06Å; D278-R375 IonicContact OD1-NH2 3.56Å; D278-R375 PolarHBondContact OD1-NH2 2.72Å; D278-R375 VanDerWaalsContact OD1-NH2 3.09Å; D278-R375 IonicContact OD2-NH2 3.54Å; V325-R375 HydrophobicContact CB-CG 4.08Å; V325-R375 HydrophobicContact CG1-CG 3.61Å; V325-R375 PolarHBondContact O-NE 3.36Å; V325-R375 VanDerWaalsContact O-NE 3.12Å; V325-R375 PolarHBondContact O-NH2 2.78Å; Q326-R375 PolarHBondContact O-N 2.86Å; T327-R375 WeakPolarHBondContact CA-O 3.4Å; T327-R375 HydrophobicContact CG2-CB 4.49Å; T327-R375 PolarHBondContact OG1-NE 3.09Å; T327-R375 PolarHBondContact OG1-NH2 3.01Å; I328-R375 PolarHBondContact N-O 3.12Å; F365-R375 HydrophobicContact CD1-CG 4.21Å; F365-R375 HydrophobicContact CE1-CG 3.82Å
376	L	94.5	Very high	86	Confident	2 Å²	2	57.5 Å²	57.5	1%	0.01	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	129.6	178.3	-58.2	-179.7	0	0	0	110.1	F268 V269 D271 I328 H330 V333 Y335 L396	F268-L376 HydrophobicContact CB-CD1 3.56Å; F268-L376 HydrophobicContact CB-CD2 4.45Å; F268-L376 HydrophobicContact CB-CG 3.82Å; F268-L376 HydrophobicContact CD1-CD1 4.2Å; F268-L376 HydrophobicContact CD1-CD2 3.65Å; F268-L376 HydrophobicContact CD1-CG 3.97Å; F268-L376 HydrophobicContact CE1-CD2 4.28Å; F268-L376 HydrophobicContact CG-CD1 3.98Å; F268-L376 HydrophobicContact CG-CD2 4.29Å; F268-L376 HydrophobicContact CG-CG 4.19Å; V269-L376 PolarHBondContact O-N 2.99Å; D271-L376 PolarHBondContact N-O 3Å; I328-L376 WeakPolarHBondContact O-CA 2.94Å; H330-L376 HydrophobicContact CB-CB 4.32Å; V333-L376 HydrophobicContact CG2-CD2 3.73Å; Y335-L376 HydrophobicContact CE1-CD1 4.13Å; Y335-L376 HydrophobicContact CE1-CD2 4.41Å; Y335-L376 WeakPolarHBondContact OH-CD1 3.17Å; Y335-L376 WeakPolarHBondContact OH-CD2 3.29Å; L376-L396 HydrophobicContact CB-CD2 4.15Å; L376-L396 HydrophobicContact CD1-CD2 4.19Å
377	V	92.1	Very high	85.8	Confident	26 Å²	26	59.8 Å²	59.8	16%	0.158	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	134.7	175.3	-178.2	0	0	0	0	109.9	P274 T327 I328 P329 H330 P379	P274-V377 HydrophobicContact CB-CG2 4.46Å; P274-V377 HydrophobicContact CG-CG2 3.83Å; T327-V377 HydrophobicContact CG2-CG2 3.28Å; I328-V377 PolarHBondContact O-N 3.08Å; P329-V377 WeakPolarHBondContact CA-O 3.48Å; H330-V377 PolarHBondContact N-O 3.15Å; H330-V377 PolarHBondContact ND1-O 3.19Å; V377-P379 WeakPolarHBondContact O-CD 3.17Å
378	I	92.2	Very high	85.9	Confident	33 Å²	33	63.1 Å²	63.1	17%	0.169	36%	0.362	C	S	.	.			trans	-95.4	114.2	165	-58.8	167.9	0	0	0	106.7	S380 L387 A392 V395 L396	I378-S380 PolarHBondContact O-N 3.22Å; I378-L387 HydrophobicContact CB-CD1 4.48Å; I378-L387 HydrophobicContact CD1-CD1 3.96Å; I378-L387 HydrophobicContact CG2-CD1 3.96Å; I378-A392 HydrophobicContact CD1-CB 3.9Å; I378-V395 HydrophobicContact CD1-CB 3.9Å; I378-V395 HydrophobicContact CD1-CG1 3.93Å; I378-V395 HydrophobicContact CG1-CG1 4.06Å; I378-V395 HydrophobicContact CG2-CG1 4.15Å; I378-L396 HydrophobicContact CD1-CD2 4.16Å; I378-L396 HydrophobicContact CD1-CG 4.09Å; I378-L396 HydrophobicContact CG1-CD2 3.84Å; I378-L396 HydrophobicContact CG1-CG 4.33Å
379	P	88.1	Confident	85.9	Confident	80 Å²	80	63.5 Å²	63.5	52%	0.519	36%	0.364	S	S	.	.			trans	-58.9	125.3	177.6	-28.4	39.6	0	0	0	111.1	F331 V377	F331-P379 HydrophobicContact CE1-CG 3.8Å; F331-P379 HydrophobicContact CZ-CG 4.45Å; V377-P379 WeakPolarHBondContact O-CD 3.17Å
380	S	84.1	Confident	86.1	Confident	69 Å²	69	62 Å²	62	48%	0.483	36%	0.359	S	S	.	.			trans	-107.5	154.8	177.4	58.1	0	0	0	0	110.5	I378 I384	I378-S380 PolarHBondContact O-N 3.22Å; S380-I384 PolarHBondContact OG-O 3.09Å
381	A	81.9	Confident	86.4	Confident	67 Å²	67	61.3 Å²	61.3	55%	0.554	36%	0.36	S	S	*	.			trans	-72.3	154.1	170.9	0	0	0	0	0	110.7	R383 I384	A381-R383 PolarHBondContact O-N 3.14Å; A381-I384 HydrophobicContact CB-CD1 4.27Å; A381-I384 PolarHBondContact O-N 2.89Å; A381-I384 VanDerWaalsContact O-N 3.17Å
382	D	73.8	Confident	86.7	Confident	148 Å²	148	61.2 Å²	61.2	79%	0.791	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	135.2	179.5	-67.2	-18.8	0	0	0	112.2	I384	D382-I384 VanDerWaalsContact C-N 3.34Å
383	R	72.9	Confident	87	Confident	253 Å²	253	58.1 Å²	58.1	96%	0.955	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	3.5	-179.6	-55.1	176	-87.4	-125.7	-3.7	116.6	A381	A381-R383 PolarHBondContact O-N 3.14Å
384	I	74.4	Confident	87.2	Confident	92 Å²	92	60 Å²	60	47%	0.472	34%	0.341	S	S	.	.			trans	-94	113.5	168.2	-57.6	178.7	0	0	0	108.4	S380 A381 D382	S380-I384 PolarHBondContact OG-O 3.09Å; A381-I384 HydrophobicContact CB-CD1 4.27Å; A381-I384 PolarHBondContact O-N 2.89Å; A381-I384 VanDerWaalsContact O-N 3.17Å; D382-I384 VanDerWaalsContact C-N 3.34Å
385	S	69.7	Low	87.3	Confident	75 Å²	75	62.3 Å²	62.3	52%	0.524	35%	0.354	S	S	.	.			trans	-70.1	-46	-177.2	53.1	0	0	0	0	112.6	E273	E273-S385 WeakPolarHBondContact CG-O 3.36Å
386	S	81.5	Confident	87.5	Confident	59 Å²	59	61.2 Å²	61.2	41%	0.413	35%	0.35	S	S	.	.			trans	-160.3	157.6	-179.4	60.4	0	0	0	0	111.8
387	L	84.9	Confident	87.6	Confident	77 Å²	77	61.2 Å²	61.2	40%	0.403	35%	0.35	S	S	.	.			trans	-80.8	153.9	166.9	-68.8	175.6	0	0	0	109.8	I378 A392	I378-L387 HydrophobicContact CB-CD1 4.48Å; I378-L387 HydrophobicContact CD1-CD1 3.96Å; I378-L387 HydrophobicContact CG2-CD1 3.96Å; L387-A392 HydrophobicContact CB-CB 4.27Å
388	N	90	Very high	87.7	Confident	73 Å²	73	61.2 Å²	61.2	39%	0.39	36%	0.356	S	S	.	.			trans	-53.5	142.7	162.5	171.3	-75.8	0	0	0	109.8	L390 S391 A392	N388-L390 VanDerWaalsContact C-N 3.25Å; N388-L390 PolarHBondContact O-N 3.21Å; N388-L390 VanDerWaalsContact O-N 3.17Å; N388-L390 WeakPolarHBondContact OD1-CB 3.49Å; N388-L390 PolarHBondContact OD1-N 2.66Å; N388-S391 WeakPolarHBondContact O-CA 3.33Å; N388-S391 WeakPolarHBondContact O-CB 3.38Å; N388-S391 PolarHBondContact O-N 3.44Å; N388-A392 PolarHBondContact O-N 3.4Å
389	V	92.6	Very high	87.9	Confident	9 Å²	9	60.9 Å²	60.9	6%	0.055	35%	0.353	C	S	.	.	H	α-helix	trans	-52	-40.3	-175.8	73.8	0	0	0	0	113.6	I194 N199 L203 I353 G354 E356 A392 A393	I194-V389 HydrophobicContact CD1-CG2 4.11Å; N199-V389 HydrophobicContact CB-CG1 3.71Å; L203-V389 HydrophobicContact CD1-CG1 4.27Å; L203-V389 HydrophobicContact CD1-CG2 4.32Å; I353-V389 HydrophobicContact CG2-CG2 3.1Å; G354-V389 WeakPolarHBondContact O-CG2 3.39Å; E356-V389 HydrophobicContact CG-CB 4.32Å; E356-V389 WeakPolarHBondContact OE1-CG1 3.33Å; V389-A392 PolarHBondContact O-N 3.17Å; V389-A393 WeakPolarHBondContact O-CB 3.49Å; V389-A393 PolarHBondContact O-N 3.28Å
390	L	93.4	Very high	88.3	Confident	40 Å²	40	57.1 Å²	57.1	21%	0.209	33%	0.329	C	S	.	.	H	α-helix	trans	-68.8	-41.4	178.8	180	65.9	0	0	0	111.2	L203 N388 A393 S394	L203-L390 HydrophobicContact CD2-CD1 4.19Å; L203-L390 HydrophobicContact CG-CD1 4.34Å; N388-L390 VanDerWaalsContact C-N 3.25Å; N388-L390 PolarHBondContact O-N 3.21Å; N388-L390 VanDerWaalsContact O-N 3.17Å; N388-L390 WeakPolarHBondContact OD1-CB 3.49Å; N388-L390 PolarHBondContact OD1-N 2.66Å; L390-A393 PolarHBondContact O-N 3.37Å; L390-S394 VanDerWaalsContact O-CB 3.31Å; L390-S394 WeakPolarHBondContact O-CB 3.44Å; L390-S394 PolarHBondContact O-N 3.19Å; L390-S394 PolarHBondContact O-OG 3.11Å
391	S	93.3	Very high	88.7	Confident	57 Å²	57	56 Å²	56	40%	0.399	32%	0.316	S	S	.	.	H	α-helix	trans	-64.2	-44.8	176.9	-60.6	0	0	0	0	110.6	N388 S394 V395	N388-S391 WeakPolarHBondContact O-CA 3.33Å; N388-S391 WeakPolarHBondContact O-CB 3.38Å; N388-S391 PolarHBondContact O-N 3.44Å; S391-S394 PolarHBondContact O-N 3.48Å; S391-V395 WeakPolarHBondContact O-CG2 3.42Å; S391-V395 PolarHBondContact O-N 2.87Å
392	A	93.7	Very high	89.3	Confident	17 Å²	17	58.6 Å²	58.6	14%	0.14	31%	0.311	C	S	.	.	H	α-helix	trans	-60	-51.1	175.6	0	0	0	0	0	111.4	I378 L387 N388 V389 S394 V395 L396	I378-A392 HydrophobicContact CD1-CB 3.9Å; L387-A392 HydrophobicContact CB-CB 4.27Å; N388-A392 PolarHBondContact O-N 3.4Å; V389-A392 PolarHBondContact O-N 3.17Å; A392-S394 VanDerWaalsContact C-N 3.28Å; A392-S394 PolarHBondContact O-N 2.76Å; A392-V395 PolarHBondContact O-N 3.37Å; A392-L396 WeakPolarHBondContact O-CG 3.13Å; A392-L396 PolarHBondContact O-N 3.11Å
393	A	96.2	Very high	90.3	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-58.1	-40.2	177	0	0	0	0	0	112.3	L203 I353 V389 L390 L396 L397	L203-A393 HydrophobicContact CD2-CB 3.44Å; L203-A393 VanDerWaalsContact CD2-CB 3.44Å; I353-A393 HydrophobicContact CD1-CB 4.19Å; I353-A393 HydrophobicContact CG1-CB 4.16Å; V389-A393 WeakPolarHBondContact O-CB 3.49Å; V389-A393 PolarHBondContact O-N 3.28Å; L390-A393 PolarHBondContact O-N 3.37Å; A393-L396 PolarHBondContact O-N 2.9Å; A393-L397 HydrophobicContact CB-CD1 4.48Å; A393-L397 VanDerWaalsContact O-CB 3.26Å; A393-L397 WeakPolarHBondContact O-CB 3.38Å; A393-L397 WeakPolarHBondContact O-CG 3.39Å; A393-L397 PolarHBondContact O-N 3.13Å
394	S	95.5	Very high	91.1	Very high	50 Å²	50	41.2 Å²	41.2	35%	0.35	24%	0.236	S	C	.	.	H	α-helix	trans	-66	-40	179.6	-58.4	0	0	0	0	112.5	L390 S391 A392 G398	L390-S394 VanDerWaalsContact O-CB 3.31Å; L390-S394 WeakPolarHBondContact O-CB 3.44Å; L390-S394 PolarHBondContact O-N 3.19Å; L390-S394 PolarHBondContact O-OG 3.11Å; S391-S394 PolarHBondContact O-N 3.48Å; A392-S394 VanDerWaalsContact C-N 3.28Å; A392-S394 PolarHBondContact O-N 2.76Å; S394-G398 WeakPolarHBondContact O-CA 3.47Å; S394-G398 PolarHBondContact O-N 2.8Å
395	V	95.5	Very high	91.8	Very high	57 Å²	57	41.7 Å²	41.7	35%	0.345	24%	0.239	S	C	.	.	H	α-helix	trans	-65.6	-49	175.9	170.4	0	0	0	0	110.7	H330 I378 S391 A392 G398 E399	H330-V395 WeakPolarHBondContact NE2-CG1 3.45Å; I378-V395 HydrophobicContact CD1-CB 3.9Å; I378-V395 HydrophobicContact CD1-CG1 3.93Å; I378-V395 HydrophobicContact CG1-CG1 4.06Å; I378-V395 HydrophobicContact CG2-CG1 4.15Å; S391-V395 WeakPolarHBondContact O-CG2 3.42Å; S391-V395 PolarHBondContact O-N 2.87Å; A392-V395 PolarHBondContact O-N 3.37Å; V395-G398 PolarHBondContact O-N 3.44Å; V395-E399 PolarHBondContact O-N 2.97Å
396	L	96.5	Very high	92.6	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-63.6	-53	-178.7	-63.8	177.9	0	0	0	111.9	A270 H330 V351 I353 L376 I378 A392 A393 G398 E399 I400	A270-L396 HydrophobicContact CB-CD1 3.42Å; A270-L396 VanDerWaalsContact CB-CD1 3.42Å; H330-L396 HydrophobicContact CB-CD2 3.24Å; V351-L396 HydrophobicContact CG1-CD1 4.26Å; I353-L396 HydrophobicContact CD1-CD1 4.01Å; L376-L396 HydrophobicContact CB-CD2 4.15Å; L376-L396 HydrophobicContact CD1-CD2 4.19Å; I378-L396 HydrophobicContact CD1-CD2 4.16Å; I378-L396 HydrophobicContact CD1-CG 4.09Å; I378-L396 HydrophobicContact CG1-CD2 3.84Å; I378-L396 HydrophobicContact CG1-CG 4.33Å; A392-L396 WeakPolarHBondContact O-CG 3.13Å; A392-L396 PolarHBondContact O-N 3.11Å; A393-L396 PolarHBondContact O-N 2.9Å; L396-G398 VanDerWaalsContact C-N 3.29Å; L396-G398 PolarHBondContact O-N 3.38Å; L396-E399 PolarHBondContact O-N 3.22Å; L396-I400 WeakPolarHBondContact O-CG1 3.47Å; L396-I400 PolarHBondContact O-N 3.28Å
397	L	96.3	Very high	92.5	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-68.6	-31.5	-178	-61.2	170.2	0	0	0	111.8	V187 L189 L210 L212 V351 A393 Q401	V187-L397 HydrophobicContact CG1-CD2 3.97Å; L189-L397 HydrophobicContact CD1-CD1 4.4Å; L189-L397 HydrophobicContact CD2-CD1 4.35Å; L210-L397 HydrophobicContact CD1-CB 3.46Å; L210-L397 VanDerWaalsContact CD1-CB 3.46Å; L210-L397 HydrophobicContact CD1-CD1 3.95Å; L210-L397 HydrophobicContact CD1-CG 4.35Å; L212-L397 HydrophobicContact CD1-CD1 4.09Å; L212-L397 HydrophobicContact CD1-CD2 4.29Å; L212-L397 HydrophobicContact CD2-CD2 4.16Å; V351-L397 HydrophobicContact CG2-CD2 4.42Å; A393-L397 HydrophobicContact CB-CD1 4.48Å; A393-L397 VanDerWaalsContact O-CB 3.26Å; A393-L397 WeakPolarHBondContact O-CB 3.38Å; A393-L397 WeakPolarHBondContact O-CG 3.39Å; A393-L397 PolarHBondContact O-N 3.13Å; L397-Q401 VanDerWaalsContact O-CB 3.31Å; L397-Q401 WeakPolarHBondContact O-CB 3.48Å; L397-Q401 PolarHBondContact O-N 3.44Å
398	G	95.7	Very high	92.9	Very high	27 Å²	27	43.9 Å²	43.9	28%	0.278	26%	0.257	S	S	.	.	H	α-helix	trans	-64.2	-42.6	173.6	0	0	0	0	0	112.4	S394 V395 L396 Q401 R402	S394-G398 WeakPolarHBondContact O-CA 3.47Å; S394-G398 PolarHBondContact O-N 2.8Å; V395-G398 PolarHBondContact O-N 3.44Å; L396-G398 VanDerWaalsContact C-N 3.29Å; L396-G398 PolarHBondContact O-N 3.38Å; G398-Q401 PolarHBondContact O-N 3.12Å; G398-R402 WeakPolarHBondContact O-CB 3.41Å; G398-R402 PolarHBondContact O-N 3.08Å
399	E	96.4	Very high	93	Very high	26 Å²	26	42.4 Å²	42.4	12%	0.121	25%	0.25	C	S	.	.	H	α-helix	trans	-65.7	-43.6	175	173.7	52.9	-157.1	0	0	111.9	Y335 V395 L396 Q401 R402 Q403	Y335-E399 HydrophobicContact CE2-CG 4.18Å; V395-E399 PolarHBondContact O-N 2.97Å; L396-E399 PolarHBondContact O-N 3.22Å; E399-Q401 PolarHBondContact O-N 3.43Å; E399-R402 WeakPolarHBondContact O-CB 3.37Å; E399-R402 PolarHBondContact O-N 3.29Å; E399-R402 IonicContact OE1-CZ 2.67Å; E399-R402 IonicContact OE1-NE 3.44Å; E399-R402 IonicContact OE1-NH2 3.63Å; E399-R402 PolarHBondContact OE1-NH2 3.37Å; E399-R402 IonicContact OE2-CZ 3.21Å; E399-R402 IonicContact OE2-NE 3.7Å; E399-R402 PolarHBondContact OE2-NE 3.3Å; E399-R402 IonicContact OE2-NH2 3.82Å; E399-R402 PolarHBondContact OE2-NH2 2.94Å; E399-Q403 PolarHBondContact O-N 3.21Å; E399-Q403 VanDerWaalsContact O-N 3.11Å; E399-Q403 PolarHBondContact OE1-NE2 2.92Å
400	I	95.1	Very high	93	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-59.9	-49.5	175.8	-62.6	164.5	0	0	0	110	L185 V187 Y335 L349 V351 L396 R402 Q403 F404	L185-I400 HydrophobicContact CD2-CG2 4.25Å; V187-I400 HydrophobicContact CG2-CG2 3.63Å; Y335-I400 HydrophobicContact CD1-CD1 4.18Å; Y335-I400 HydrophobicContact CD1-CG1 3.77Å; Y335-I400 HydrophobicContact CD2-CB 4.4Å; Y335-I400 HydrophobicContact CD2-CG1 3.68Å; Y335-I400 HydrophobicContact CE1-CD1 4.11Å; Y335-I400 HydrophobicContact CE1-CG1 3.87Å; Y335-I400 HydrophobicContact CE2-CG1 3.8Å; Y335-I400 HydrophobicContact CG-CB 4.42Å; Y335-I400 HydrophobicContact CG-CG1 3.67Å; Y335-I400 HydrophobicContact CG-CG2 4.35Å; L349-I400 HydrophobicContact CD1-CG2 4.38Å; V351-I400 HydrophobicContact CG2-CD1 3.54Å; L396-I400 WeakPolarHBondContact O-CG1 3.47Å; L396-I400 PolarHBondContact O-N 3.28Å; I400-R402 VanDerWaalsContact C-N 3.3Å; I400-R402 PolarHBondContact O-N 3.02Å; I400-Q403 PolarHBondContact O-N 3.41Å; I400-Q403 VanDerWaalsContact O-N 3.17Å; I400-F404 HydrophobicContact CG2-CD2 3.82Å; I400-F404 HydrophobicContact CG2-CE2 3.78Å; I400-F404 WeakPolarHBondContact O-CD2 3.49Å; I400-F404 PolarHBondContact O-N 3.09Å
401	Q	93.7	Very high	93	Very high	46 Å²	46	44.5 Å²	44.5	22%	0.215	26%	0.264	C	S	.	.	H	α-helix	trans	-58.4	-42.1	177.5	-175.2	-176.2	65.4	0	0	111.8	F183 L185 L210 L397 G398 E399 Q403 F404 L405	F183-Q401 HydrophobicContact CE1-CG 4.16Å; F183-Q401 HydrophobicContact CZ-CG 4.39Å; L185-Q401 HydrophobicContact CD1-CB 4.34Å; L185-Q401 HydrophobicContact CD2-CB 4.13Å; L210-Q401 PolarHBondContact O-NE2 3.22Å; L397-Q401 VanDerWaalsContact O-CB 3.31Å; L397-Q401 WeakPolarHBondContact O-CB 3.48Å; L397-Q401 PolarHBondContact O-N 3.44Å; G398-Q401 PolarHBondContact O-N 3.12Å; E399-Q401 PolarHBondContact O-N 3.43Å; Q401-Q403 VanDerWaalsContact C-N 3.3Å; Q401-Q403 PolarHBondContact O-N 3.36Å; Q401-F404 PolarHBondContact O-N 2.75Å; Q401-L405 HydrophobicContact CG-CD1 3.73Å; Q401-L405 HydrophobicContact CG-CG 4.11Å; Q401-L405 WeakPolarHBondContact O-CB 3.33Å; Q401-L405 VanDerWaalsContact O-CG 3.31Å; Q401-L405 WeakPolarHBondContact O-CG 3.34Å; Q401-L405 PolarHBondContact O-N 3.29Å
402	R	94.7	Very high	93	Very high	122 Å²	122	43.7 Å²	43.7	46%	0.46	26%	0.256	S	S	.	.	H	α-helix	trans	-56.3	-44.8	177	-171.8	-163.1	65.8	72	-0.4	111.2	G398 E399 I400 L405 C406	G398-R402 WeakPolarHBondContact O-CB 3.41Å; G398-R402 PolarHBondContact O-N 3.08Å; E399-R402 WeakPolarHBondContact O-CB 3.37Å; E399-R402 PolarHBondContact O-N 3.29Å; E399-R402 IonicContact OE1-CZ 2.67Å; E399-R402 IonicContact OE1-NE 3.44Å; E399-R402 IonicContact OE1-NH2 3.63Å; E399-R402 PolarHBondContact OE1-NH2 3.37Å; E399-R402 IonicContact OE2-CZ 3.21Å; E399-R402 IonicContact OE2-NE 3.7Å; E399-R402 PolarHBondContact OE2-NE 3.3Å; E399-R402 IonicContact OE2-NH2 3.82Å; E399-R402 PolarHBondContact OE2-NH2 2.94Å; I400-R402 VanDerWaalsContact C-N 3.3Å; I400-R402 PolarHBondContact O-N 3.02Å; R402-L405 PolarHBondContact O-N 3.36Å; R402-C406 WeakPolarHBondContact O-CB 3.33Å; R402-C406 PolarHBondContact O-N 3.24Å; R402-C406 VanDerWaalsContact O-N 3.11Å; R402-C406 PolarHBondContact O-SG 3.48Å
403	Q	93.8	Very high	93	Very high	23 Å²	23	45.5 Å²	45.5	11%	0.107	26%	0.264	C	S	.	.	H	α-helix	trans	-62.4	-49.4	177.8	-66.1	-173.2	18.9	0	0	111.5	V333 I336 E399 I400 Q401 L405 C406 S407	V333-Q403 PolarHBondContact O-NE2 2.89Å; V333-Q403 PolarHBondContact O-OE1 3.25Å; I336-Q403 HydrophobicContact CD1-CB 4.24Å; I336-Q403 HydrophobicContact CG1-CB 4.36Å; E399-Q403 PolarHBondContact O-N 3.21Å; E399-Q403 VanDerWaalsContact O-N 3.11Å; E399-Q403 PolarHBondContact OE1-NE2 2.92Å; I400-Q403 PolarHBondContact O-N 3.41Å; I400-Q403 VanDerWaalsContact O-N 3.17Å; Q401-Q403 VanDerWaalsContact C-N 3.3Å; Q401-Q403 PolarHBondContact O-N 3.36Å; Q403-L405 VanDerWaalsContact C-N 3.26Å; Q403-L405 PolarHBondContact O-N 3.25Å; Q403-C406 PolarHBondContact O-N 2.85Å; Q403-S407 PolarHBondContact O-N 3.37Å
404	F	90.5	Very high	92.7	Very high	13 Å²	13	48.6 Å²	48.6	6%	0.057	28%	0.282	C	S	.	.	H	α-helix	trans	-63.9	-25.5	178.7	-83.5	-81.5	0	0	0	114.6	F183 L185 P186 I336 Y340 L349 I400 Q401 S407	F183-F404 HydrophobicContact CZ-CB 4.41Å; L185-F404 HydrophobicContact CD1-CB 3.7Å; L185-F404 HydrophobicContact CD1-CD2 3.55Å; L185-F404 HydrophobicContact CD1-CE2 4.36Å; L185-F404 HydrophobicContact CD1-CG 3.7Å; P186-F404 HydrophobicContact CG-CD1 4.12Å; P186-F404 HydrophobicContact CG-CE1 3.4Å; P186-F404 HydrophobicContact CG-CE2 4.11Å; P186-F404 HydrophobicContact CG-CZ 3.39Å; I336-F404 HydrophobicContact CG1-CD1 4.3Å; I336-F404 HydrophobicContact CG1-CD2 4.34Å; I336-F404 HydrophobicContact CG1-CE1 4.16Å; I336-F404 HydrophobicContact CG1-CE2 4.22Å; I336-F404 HydrophobicContact CG1-CG 4.38Å; I336-F404 HydrophobicContact CG1-CZ 4.12Å; I336-F404 HydrophobicContact CG2-CE1 4.43Å; Y340-F404 HydrophobicContact CD1-CD1 4.39Å; Y340-F404 AromaticContact CD1-CE1 3.82Å; Y340-F404 HydrophobicContact CD1-CE1 3.82Å; Y340-F404 HydrophobicContact CD2-CE1 4.18Å; Y340-F404 AromaticContact CE1-CD1 3.85Å; Y340-F404 HydrophobicContact CE1-CD1 3.85Å; Y340-F404 AromaticContact CE1-CE1 3.53Å; Y340-F404 HydrophobicContact CE1-CE1 3.53Å; Y340-F404 AromaticContact CE2-CE1 3.94Å; Y340-F404 HydrophobicContact CE2-CE1 3.94Å; Y340-F404 HydrophobicContact CG-CE1 4.13Å; Y340-F404 AromaticContact CZ-CE1 3.59Å; L349-F404 HydrophobicContact CD1-CE2 3.49Å; L349-F404 VanDerWaalsContact CD1-CE2 3.49Å; L349-F404 HydrophobicContact CD1-CZ 3.62Å; I400-F404 HydrophobicContact CG2-CD2 3.82Å; I400-F404 HydrophobicContact CG2-CE2 3.78Å; I400-F404 WeakPolarHBondContact O-CD2 3.49Å; I400-F404 PolarHBondContact O-N 3.09Å; Q401-F404 PolarHBondContact O-N 2.75Å; F404-S407 PolarHBondContact O-OG 3.2Å; F404-S407 VanDerWaalsContact O-OG 3.13Å
405	L	88.7	Confident	92.5	Very high	102 Å²	102	48.5 Å²	48.5	53%	0.534	28%	0.277	S	S	.	.	H	α-helix	trans	-85.5	-16.7	175.1	-69	176.9	0	0	0	113	F183 Q401 R402 Q403	F183-L405 HydrophobicContact CD2-CD2 3.93Å; F183-L405 HydrophobicContact CE1-CD2 4.4Å; F183-L405 HydrophobicContact CE2-CD2 3.47Å; F183-L405 VanDerWaalsContact CE2-CD2 3.47Å; F183-L405 HydrophobicContact CE2-CG 4.31Å; F183-L405 HydrophobicContact CZ-CD2 3.74Å; F183-L405 HydrophobicContact CZ-CG 4.15Å; Q401-L405 HydrophobicContact CG-CD1 3.73Å; Q401-L405 HydrophobicContact CG-CG 4.11Å; Q401-L405 WeakPolarHBondContact O-CB 3.33Å; Q401-L405 VanDerWaalsContact O-CG 3.31Å; Q401-L405 WeakPolarHBondContact O-CG 3.34Å; Q401-L405 PolarHBondContact O-N 3.29Å; R402-L405 PolarHBondContact O-N 3.36Å; Q403-L405 VanDerWaalsContact C-N 3.26Å; Q403-L405 PolarHBondContact O-N 3.25Å
406	C	87.6	Confident	92.3	Very high	95 Å²	95	47.8 Å²	47.8	64%	0.642	27%	0.271	S	S	*	.	H	α-helix	trans	-100.2	-16.2	179.4	-71.4	0	0	0	0	113.8	R402 Q403	R402-C406 WeakPolarHBondContact O-CB 3.33Å; R402-C406 PolarHBondContact O-N 3.24Å; R402-C406 VanDerWaalsContact O-N 3.11Å; R402-C406 PolarHBondContact O-SG 3.48Å; Q403-C406 PolarHBondContact O-N 2.85Å
407	S	78.1	Confident	91.9	Very high	118 Å²	118	52.1 Å²	52.1	83%	0.825	30%	0.295	S	S	*	.			trans	-74.6	0	168	60.2	0	0	0	0	111.4	I336 Q403 F404	I336-S407 WeakPolarHBondContact CD1-OG 3.42Å; Q403-S407 PolarHBondContact O-N 3.37Å; F404-S407 PolarHBondContact O-OG 3.2Å; F404-S407 VanDerWaalsContact O-OG 3.13Å

Retrieved 407 of 407 residues in 236.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).