A0A087XQJ4_POEFO Loading...

Kinesin-like protein

AlphaFold DB , UniProt , Accession A0A087XQJ4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 780 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	37.2	Very low	37.3	Very low	251 Å²	251	174.5 Å²	174.5	100%	1.236	90%	0.903	S	S	*	*				0	94.3	0	-82.9	174.5	149.2	0	0	109.4
2	Q	33.3	Very low	36.7	Very low	200 Å²	200	179.5 Å²	179.5	94%	0.935	90%	0.901	S	S	*	*	P	Polyproline II helix	trans	-98.3	130.7	171.5	-77.2	173.2	-1.5	0	0	108.3
3	R	34.9	Very low	36.6	Very low	258 Å²	258	174.7 Å²	174.7	97%	0.974	89%	0.89	S	S	*	*	P	Polyproline II helix	trans	-88.5	127.8	178	-101.3	-179.8	169.6	-178.7	-2.4	110.1
4	A	39.2	Very low	36.6	Very low	100 Å²	100	176.8 Å²	176.8	83%	0.826	89%	0.89	S	S	*	*	P	Polyproline II helix	trans	-66	138.4	-176.9	0	0	0	0	0	113.7
5	G	35.6	Very low	36.1	Very low	80 Å²	80	177.9 Å²	177.9	83%	0.825	89%	0.887	S	S	*	*	P	Polyproline II helix	trans	-76.2	135	172.4	0	0	0	0	0	112.2
6	K	41.1	Very low	36.1	Very low	211 Å²	211	174 Å²	174	92%	0.917	88%	0.878	S	S	*	*	P	Polyproline II helix	trans	-78.9	117.9	169.4	-78.4	-179.9	174.2	-179.7	0	109.4
7	G	35.7	Very low	36.6	Very low	74 Å²	74	168.6 Å²	168.6	76%	0.763	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-64.3	140.1	177	0	0	0	0	0	112.9
8	R	41.2	Very low	37	Very low	248 Å²	248	168.5 Å²	168.5	94%	0.936	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-71.8	120.8	165.1	-75.8	178.2	168.7	-178.4	-3.4	108.3
9	T	37	Very low	38.5	Very low	130 Å²	130	163.9 Å²	163.9	80%	0.798	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-60.5	131.6	167.2	33.6	0	0	0	0	110	R11	T9-R11 PolarHBondContact O-N 3.16Å
10	P	37.4	Very low	40.2	Very low	122 Å²	122	161.9 Å²	161.9	79%	0.792	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-66.5	129.3	175	10.7	-5.7	0	0	0	109.6	R12	P10-R12 PolarHBondContact O-N 3.3Å; P10-R12 VanDerWaalsContact O-N 3.11Å
11	R	37.7	Very low	42.1	Very low	246 Å²	246	159.3 Å²	159.3	93%	0.928	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-58.6	116.4	168.3	-85.8	-176.9	172.9	-175.4	-2.3	107.7	T9	T9-R11 PolarHBondContact O-N 3.16Å
12	R	30.8	Very low	44.2	Very low	234 Å²	234	149.6 Å²	149.6	88%	0.883	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-53.3	128.9	168.9	-128.6	177.7	-179.5	-174.9	0.5	107.8	P10 K14	P10-R12 PolarHBondContact O-N 3.3Å; P10-R12 VanDerWaalsContact O-N 3.11Å; R12-K14 PolarHBondContact O-N 2.69Å
13	P	35.3	Very low	46.9	Very low	117 Å²	117	144 Å²	144	76%	0.76	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-58.4	126.5	169.9	7.6	-5.2	0	0	0	107.6	K15	P13-K15 PolarHBondContact O-N 3.07Å; P13-K15 VanDerWaalsContact O-N 3.09Å
14	K	36	Very low	49.6	Very low	204 Å²	204	132 Å²	132	89%	0.887	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-56.7	117.6	168	-78.8	-176.6	173.7	-175.8	0	106.1	R12	R12-K14 PolarHBondContact O-N 2.69Å
15	K	28.7	Very low	52.2	Low	193 Å²	193	127.5 Å²	127.5	84%	0.839	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-54.9	132.2	167	-75.9	-176.9	174.2	-175	0	106.9	P13 S17	P13-K15 PolarHBondContact O-N 3.07Å; P13-K15 VanDerWaalsContact O-N 3.09Å; K15-S17 PolarHBondContact O-N 3.23Å; K15-S17 VanDerWaalsContact O-N 3.07Å
16	P	36.7	Very low	55.1	Low	116 Å²	116	123.8 Å²	123.8	75%	0.753	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-60.1	118.2	171	25.6	-30.4	0	0	0	106.7	N18	P16-N18 PolarHBondContact O-N 2.7Å
17	S	43.9	Very low	57.8	Low	83 Å²	83	114 Å²	114	58%	0.58	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-57.8	124.3	162.6	43.7	0	0	0	0	106.4	K15 I19	K15-S17 PolarHBondContact O-N 3.23Å; K15-S17 VanDerWaalsContact O-N 3.07Å; S17-I19 PolarHBondContact O-N 3.14Å; S17-I19 VanDerWaalsContact OG-CD1 3.24Å; S17-I19 WeakPolarHBondContact OG-CD1 3.42Å; S17-I19 WeakPolarHBondContact OG-CG1 3.21Å
18	N	44.8	Very low	60.7	Low	166 Å²	166	110.5 Å²	110.5	89%	0.888	54%	0.544	S	S	*	.			trans	-64.8	75.1	168.3	-87.4	-5.9	0	0	0	108.1	P16 E20	P16-N18 PolarHBondContact O-N 2.7Å; N18-E20 PolarHBondContact O-N 3.27Å
19	I	65.4	Low	63.3	Low	82 Å²	82	99.5 Å²	99.5	42%	0.421	50%	0.502	S	S	.	.			trans	-82.3	111.8	169.8	-61.5	167.1	0	0	0	104.4	S17 K21 A438	S17-I19 PolarHBondContact O-N 3.14Å; S17-I19 VanDerWaalsContact OG-CD1 3.24Å; S17-I19 WeakPolarHBondContact OG-CD1 3.42Å; S17-I19 WeakPolarHBondContact OG-CG1 3.21Å; I19-K21 PolarHBondContact O-N 2.88Å; I19-A438 HydrophobicContact CG2-CB 3.82Å
20	E	71.9	Confident	66	Low	123 Å²	123	93.7 Å²	93.7	58%	0.575	47%	0.467	S	S	*	.			trans	-55	139.1	171.1	-68.2	176.7	141.4	0	0	108.6	N18 R439	N18-E20 PolarHBondContact O-N 3.27Å; E20-R439 HydrophobicContact CB-CB 4.27Å; E20-R439 VanDerWaalsContact CD-NH1 3.29Å; E20-R439 WeakPolarHBondContact O-CB 3.23Å; E20-R439 PolarHBondContact O-N 3.27Å; E20-R439 IonicContact OE1-NH1 3.42Å; E20-R439 IonicContact OE2-CZ 2.71Å; E20-R439 IonicContact OE2-NE 2.95Å; E20-R439 IonicContact OE2-NH1 3.72Å; E20-R439 PolarHBondContact OE2-NH1 2.89Å
21	K	80.3	Confident	68.5	Low	107 Å²	107	93.5 Å²	93.5	47%	0.465	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	143.6	178.6	-55	-179.7	-177.8	173.8	0	109	I19 E436 V437	I19-K21 PolarHBondContact O-N 2.88Å; K21-E436 HydrophobicContact CB-CB 3.92Å; K21-E436 HydrophobicContact CD-CB 3.96Å; K21-E436 WeakPolarHBondContact CD-OE2 3.29Å; K21-V437 CarbonylContact C-O 3.55Å; K21-V437 VanDerWaalsContact CA-O 3.31Å; K21-V437 WeakPolarHBondContact CA-O 3.48Å
22	D	81.8	Confident	70.8	Confident	48 Å²	48	85.1 Å²	85.1	26%	0.257	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	136.4	175.9	-67.9	-45.1	0	0	0	109.1	V437 R439	D22-V437 PolarHBondContact N-O 3.37Å; D22-V437 PolarHBondContact O-N 3.12Å; D22-R439 IonicContact OD1-CZ 3.48Å; D22-R439 IonicContact OD1-NE 2.56Å; D22-R439 IonicContact OD1-NH2 3.96Å; D22-R439 PolarHBondContact OD1-NH2 3.05Å; D22-R439 IonicContact OD2-CZ 2.61Å; D22-R439 IonicContact OD2-NE 3.14Å; D22-R439 PolarHBondContact OD2-NE 3.45Å; D22-R439 IonicContact OD2-NH2 3.91Å
23	P	88.5	Confident	73.1	Confident	81 Å²	81	76.5 Å²	76.5	53%	0.526	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	152.1	174.2	26.4	-33.4	0	0	0	110.9	G25 Q433 V435	P23-G25 PolarHBondContact O-N 3.49Å; P23-Q433 VanDerWaalsContact CB-O 3.27Å; P23-Q433 WeakPolarHBondContact CB-O 3.39Å; P23-V435 WeakPolarHBondContact CA-O 3.35Å
24	V	91.8	Very high	74.6	Confident	7 Å²	7	74.9 Å²	74.9	4%	0.042	40%	0.403	C	S	.	.			trans	-56.7	126.8	171.8	177.6	0	0	0	0	109.3	V26 V406 T432 V435 V437	V24-V26 HydrophobicContact CG1-CG2 4.12Å; V24-V26 PolarHBondContact O-N 3.47Å; V24-V406 HydrophobicContact CG1-CB 4.27Å; V24-V406 HydrophobicContact CG1-CG1 3.98Å; V24-V406 HydrophobicContact CG2-CB 4.42Å; V24-T432 HydrophobicContact CB-CG2 4.28Å; V24-T432 HydrophobicContact CG1-CG2 3.94Å; V24-V435 HydrophobicContact CG2-CB 4.16Å; V24-V435 HydrophobicContact CG2-CG1 4.4Å; V24-V435 PolarHBondContact N-O 2.87Å; V24-V437 HydrophobicContact CG2-CG2 3.77Å
25	G	94.4	Very high	76	Confident	6 Å²	6	66.9 Å²	66.9	6%	0.062	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	96.5	-179.8	0	0	0	0	0	111.2	P23 Y27 V406 R407 M408	P23-G25 PolarHBondContact O-N 3.49Å; G25-Y27 VanDerWaalsContact O-CD2 3.31Å; G25-Y27 WeakPolarHBondContact O-CD2 3.42Å; G25-Y27 WeakPolarHBondContact O-CE2 3.46Å; G25-V406 PolarHBondContact N-O 3.23Å; G25-R407 CarbonylContact O-C 3.48Å; G25-R407 VanDerWaalsContact O-CA 3.24Å; G25-R407 WeakPolarHBondContact O-CA 3.39Å; G25-M408 PolarHBondContact O-N 3.09Å
26	V	96.6	Very high	77.5	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.006	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	124.8	178.3	-173.3	0	0	0	0	110.8	V24 F73 K74 M408 V410 A429 T432 Q433	V24-V26 HydrophobicContact CG1-CG2 4.12Å; V24-V26 PolarHBondContact O-N 3.47Å; V26-F73 HydrophobicContact CB-CD1 4.37Å; V26-F73 HydrophobicContact CG1-CD1 3.72Å; V26-F73 HydrophobicContact CG1-CE1 4.05Å; V26-K74 VanDerWaalsContact O-CB 3.25Å; V26-K74 WeakPolarHBondContact O-CB 3.33Å; V26-K74 PolarHBondContact O-N 2.86Å; V26-M408 WeakPolarHBondContact CA-O 3.3Å; V26-M408 HydrophobicContact CG1-CE 3.83Å; V26-M408 HydrophobicContact CG2-CE 3.92Å; V26-V410 HydrophobicContact CG1-CG2 3.86Å; V26-A429 HydrophobicContact CG1-CB 4.03Å; V26-T432 HydrophobicContact CG2-CG2 4.24Å; V26-Q433 HydrophobicContact CB-CB 4.15Å; V26-Q433 HydrophobicContact CG2-CB 3.79Å
27	Y	97.3	Very high	78.5	Confident	7 Å²	7	69.8 Å²	69.8	3%	0.027	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	145.1	-179.4	-58.6	-100.6	0	0	0	108.9	G25 K74 K75 F77 D89 V90 R407 M408 V409 V410	G25-Y27 VanDerWaalsContact O-CD2 3.31Å; G25-Y27 WeakPolarHBondContact O-CD2 3.42Å; G25-Y27 WeakPolarHBondContact O-CE2 3.46Å; Y27-K74 HydrophobicContact CE1-CB 4.45Å; Y27-K74 HydrophobicContact CE1-CD 4.19Å; Y27-K74 HydrophobicContact CE1-CG 4.23Å; Y27-K74 HydrophobicContact CE2-CD 4.32Å; Y27-K75 WeakPolarHBondContact CA-O 3.33Å; Y27-K75 HydrophobicContact CD1-CB 3.86Å; Y27-K75 HydrophobicContact CE1-CB 4.3Å; Y27-F77 AromaticContact CD1-CE2 3.9Å; Y27-F77 HydrophobicContact CD1-CE2 3.9Å; Y27-F77 HydrophobicContact CD1-CZ 4.2Å; Y27-F77 HydrophobicContact CG-CE2 4.33Å; Y27-D89 PolarHBondContact OH-O 2.99Å; Y27-V90 HydrophobicContact CD1-CG2 3.73Å; Y27-V90 HydrophobicContact CD2-CG1 4.19Å; Y27-V90 HydrophobicContact CD2-CG2 4.22Å; Y27-V90 HydrophobicContact CE1-CG2 3.95Å; Y27-V90 HydrophobicContact CE2-CG1 4.25Å; Y27-V90 HydrophobicContact CE2-CG2 4.44Å; Y27-V90 HydrophobicContact CG-CG2 3.87Å; Y27-R407 HydrophobicContact CE2-CB 4.39Å; Y27-R407 HydrophobicContact CE2-CG 4.22Å; Y27-R407 PolarHBondContact OH-NH1 2.89Å; Y27-M408 PolarHBondContact N-O 3.49Å; Y27-V409 CarbonylContact O-C 3.56Å; Y27-V409 WeakPolarHBondContact O-CA 3.25Å; Y27-V410 PolarHBondContact O-N 3.31Å
28	C	97.1	Very high	79.6	Confident	0 Å²	0	69 Å²	69	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	137.6	177.8	179.9	0	0	0	0	110.4	F73 K75 V76 F77 V410	C28-F73 HydrophobicContact CB-CD2 3.49Å; C28-F73 VanDerWaalsContact CB-CD2 3.49Å; C28-F73 HydrophobicContact CB-CE2 3.83Å; C28-F73 HydrophobicContact CB-CG 4.04Å; C28-K75 PolarHBondContact N-O 3.4Å; C28-V76 HydrophobicContact CB-CG2 4.24Å; C28-V76 CarbonylContact O-C 3.5Å; C28-V76 WeakPolarHBondContact O-CA 3.37Å; C28-F77 WeakPolarHBondContact O-CD2 3.4Å; C28-F77 PolarHBondContact O-N 3.27Å; C28-V410 CarbonylContact C-O 3.57Å; C28-V410 WeakPolarHBondContact CA-O 3.46Å
29	R	95.9	Very high	80.9	Confident	16 Å²	16	66.2 Å²	66.2	6%	0.06	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	123.9	176.7	-175.1	-176.2	-172.5	176.5	13	111	F77 L86 Y118 T119 V409 V410 C411 V412	R29-F77 HydrophobicContact CB-CB 4.25Å; R29-F77 HydrophobicContact CG-CB 4.09Å; R29-L86 VanDerWaalsContact NH1-CD2 3.33Å; R29-Y118 VanDerWaalsContact NH2-CE1 3.3Å; R29-T119 WeakPolarHBondContact CD-OG1 3.47Å; R29-T119 PolarHBondContact NH1-OG1 2.85Å; R29-V409 HydrophobicContact CB-CG1 4.3Å; R29-V410 PolarHBondContact N-O 2.88Å; R29-C411 WeakPolarHBondContact O-CA 3.49Å; R29-V412 PolarHBondContact O-N 3.12Å
30	I	94	Very high	81.7	Confident	9 Å²	9	65.2 Å²	65.2	5%	0.046	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	126.3	178.9	-51.4	174.4	0	0	0	109.2	V42 M44 I50 V76 F77 I79 V412 P414	I30-V42 HydrophobicContact CD1-CG1 4.2Å; I30-V42 HydrophobicContact CG1-CG1 4.44Å; I30-M44 HydrophobicContact CD1-CB 3.9Å; I30-I50 HydrophobicContact CD1-CD1 3.66Å; I30-I50 HydrophobicContact CD1-CG1 4.26Å; I30-I50 HydrophobicContact CG1-CD1 3.81Å; I30-V76 HydrophobicContact CD1-CG1 4.26Å; I30-F77 PolarHBondContact N-O 2.85Å; I30-I79 HydrophobicContact CB-CG2 4.49Å; I30-I79 HydrophobicContact CG2-CG2 4.04Å; I30-V412 HydrophobicContact CB-CG2 4.37Å; I30-V412 HydrophobicContact CG1-CG2 4Å; I30-P414 HydrophobicContact CG2-CB 4.26Å; I30-P414 HydrophobicContact CG2-CG 4.05Å
31	R	90.1	Very high	82.3	Confident	117 Å²	117	59.4 Å²	59.4	44%	0.442	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-72.2	139.1	173.3	-178.1	-176.8	168.7	164.3	1.1	110.5	G113 V412 P414	R31-G113 WeakPolarHBondContact CD-O 3.38Å; R31-G113 PolarHBondContact NH1-O 2.97Å; R31-V412 WeakPolarHBondContact CB-O 3.2Å; R31-V412 PolarHBondContact N-O 3.17Å; R31-P414 VanDerWaalsContact O-CD 3.25Å; R31-P414 WeakPolarHBondContact O-CD 3.46Å; R31-P414 WeakPolarHBondContact O-CG 3.39Å
32	P	85.7	Confident	82.7	Confident	71 Å²	71	54.6 Å²	54.6	46%	0.461	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-62.3	137	169.6	-20.1	31.8	0	0	0	112.7	I79	P32-I79 HydrophobicContact CB-CB 4.28Å; P32-I79 HydrophobicContact CG-CB 4.22Å
33	L	78.9	Confident	83	Confident	53 Å²	53	57 Å²	57	28%	0.277	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-73.1	145.8	169.5	-69.8	168.8	0	0	0	110.2	E38 C40 P414 K415	L33-E38 HydrophobicContact CD1-CB 4.36Å; L33-E38 HydrophobicContact CD2-CB 4.16Å; L33-E38 VanDerWaalsContact CD2-OE2 3.29Å; L33-E38 WeakPolarHBondContact CD2-OE2 3.42Å; L33-C40 HydrophobicContact CD1-CB 3.99Å; L33-P414 HydrophobicContact CD1-CB 4.4Å; L33-P414 HydrophobicContact CD1-CG 4.21Å; L33-P414 HydrophobicContact CD2-CB 4.28Å; L33-P414 HydrophobicContact CD2-CG 3.62Å; L33-P414 HydrophobicContact CG-CB 4.3Å; L33-P414 HydrophobicContact CG-CG 3.61Å; L33-K415 HydrophobicContact CD2-CG 3.69Å
34	G	66.3	Low	83.1	Confident	82 Å²	82	56.5 Å²	56.5	85%	0.845	31%	0.313	S	S	*	.	S	Bend	trans	-87.3	-11.6	-175.4	0	0	0	0	0	114.7
35	G	65.9	Low	83	Confident	37 Å²	37	60.1 Å²	60.1	38%	0.381	33%	0.331	S	S	.	.	S	Bend	trans	-146.1	152.5	-179.3	0	0	0	0	0	112.2	D37	G35-D37 VanDerWaalsContact C-N 3.28Å; G35-D37 PolarHBondContact O-N 3.33Å
36	E	59.5	Low	82.9	Confident	201 Å²	201	61.7 Å²	61.7	94%	0.939	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-19.9	-177.8	-64.3	-175.7	157.7	0	0	113.2
37	D	57.5	Low	82.7	Confident	169 Å²	169	65.4 Å²	65.4	90%	0.904	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	9.7	-176.8	-65.7	-38.5	0	0	0	114.4	G35	G35-D37 VanDerWaalsContact C-N 3.28Å; G35-D37 PolarHBondContact O-N 3.33Å
38	E	68.5	Low	82.5	Confident	67 Å²	67	67.1 Å²	67.1	31%	0.313	38%	0.38	S	S	.	.	S	Bend	trans	-84.3	123.2	179	-67.2	-166.6	142.4	0	0	111.6	L33 C40 K415	L33-E38 HydrophobicContact CD1-CB 4.36Å; L33-E38 HydrophobicContact CD2-CB 4.16Å; L33-E38 VanDerWaalsContact CD2-OE2 3.29Å; L33-E38 WeakPolarHBondContact CD2-OE2 3.42Å; E38-C40 PolarHBondContact O-N 3.28Å; E38-K415 WeakPolarHBondContact OE1-CE 3.23Å; E38-K415 IonicContact OE1-NZ 3.7Å; E38-K415 PolarHBondContact OE1-NZ 3.37Å; E38-K415 WeakPolarHBondContact OE2-CE 3.45Å; E38-K415 IonicContact OE2-NZ 3.6Å
39	E	71.8	Confident	82.4	Confident	107 Å²	107	68.1 Å²	68.1	50%	0.5	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-61.4	118.5	176.2	-168.6	-177.7	-179.1	0	0	110.7	A416	E39-A416 HydrophobicContact CB-CB 3.99Å; E39-A416 HydrophobicContact CG-CB 4.07Å; E39-A416 PolarHBondContact O-N 3.08Å
40	C	81.8	Confident	82.3	Confident	60 Å²	60	67.4 Å²	67.4	41%	0.405	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-97	117.9	-174.4	-171.9	0	0	0	0	110.7	L33 E38 V42 P414	L33-C40 HydrophobicContact CD1-CB 3.99Å; E38-C40 PolarHBondContact O-N 3.28Å; C40-V42 PolarHBondContact SG-O 2.85Å; C40-P414 CarbonylContact C-O 3.49Å; C40-P414 WeakPolarHBondContact CA-O 3.29Å
41	C	84.5	Confident	82.1	Confident	2 Å²	2	67.8 Å²	67.8	1%	0.014	39%	0.385	C	S	.	.			trans	-95.8	2.9	178.1	71.7	0	0	0	0	113.6	L52 H53 P414 K415 Y419	C41-L52 CarbonylContact O-C 3.57Å; C41-L52 VanDerWaalsContact O-CA 3.3Å; C41-L52 WeakPolarHBondContact O-CA 3.5Å; C41-H53 VanDerWaalsContact CB-O 3.31Å; C41-H53 WeakPolarHBondContact CB-O 3.34Å; C41-H53 PolarHBondContact O-N 3.44Å; C41-P414 PolarHBondContact N-O 3.18Å; C41-P414 PolarHBondContact SG-O 3.33Å; C41-P414 VanDerWaalsContact SG-O 3.37Å; C41-K415 PolarHBondContact SG-O 2.91Å; C41-Y419 HydrophobicContact CB-CD2 3.95Å
42	V	88.4	Confident	82.1	Confident	6 Å²	6	62.2 Å²	62.2	4%	0.036	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	120.7	-173.5	-174.9	0	0	0	0	110.8	I30 C40 I50 Q51 L52 V412 P414 T422	I30-V42 HydrophobicContact CD1-CG1 4.2Å; I30-V42 HydrophobicContact CG1-CG1 4.44Å; C40-V42 PolarHBondContact SG-O 2.85Å; V42-I50 HydrophobicContact CG1-CD1 3.13Å; V42-I50 HydrophobicContact CG1-CG1 3.52Å; V42-Q51 WeakPolarHBondContact CA-O 3.32Å; V42-L52 HydrophobicContact CB-CD2 4.27Å; V42-L52 HydrophobicContact CG1-CD2 4.18Å; V42-L52 HydrophobicContact CG2-CD2 3.64Å; V42-V412 HydrophobicContact CG1-CG2 4.45Å; V42-P414 HydrophobicContact CB-CB 4.03Å; V42-P414 HydrophobicContact CG2-CB 4.31Å; V42-T422 HydrophobicContact CG2-CG2 4.12Å
43	E	88.1	Confident	82.1	Confident	98 Å²	98	61.2 Å²	61.2	46%	0.458	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	135.3	178.4	-173.5	175.5	-175.9	0	0	111.6	I50 Q51 H53	E43-I50 CarbonylContact O-C 3.59Å; E43-I50 WeakPolarHBondContact O-CA 3.44Å; E43-I50 VanDerWaalsContact O-CG1 3.27Å; E43-I50 WeakPolarHBondContact O-CG1 3.36Å; E43-Q51 PolarHBondContact N-O 3.03Å; E43-Q51 PolarHBondContact O-N 2.85Å; E43-H53 IonicContact OE2-CD2 3.67Å; E43-H53 IonicContact OE2-CE1 3.34Å; E43-H53 IonicContact OE2-NE2 2.84Å; E43-H53 PolarHBondContact OE2-NE2 3.44Å
44	M	90.4	Very high	82.2	Confident	70 Å²	70	60.4 Å²	60.4	35%	0.345	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	106.3	173.9	-177.2	179	-179.9	0	0	109.6	I30 S46 V76	I30-M44 HydrophobicContact CD1-CB 3.9Å; M44-S46 WeakPolarHBondContact CE-O 3.38Å; M44-S46 WeakPolarHBondContact CG-O 3.48Å; M44-V76 HydrophobicContact CE-CB 4.06Å; M44-V76 HydrophobicContact CE-CG1 4.13Å; M44-V76 WeakPolarHBondContact CE-O 3.48Å; M44-V76 HydrophobicContact CG-CG1 3.91Å; M44-V76 HydrophobicContact SD-CG1 4.04Å
45	I	91.1	Very high	82.8	Confident	83 Å²	83	57.2 Å²	57.2	43%	0.426	32%	0.319	S	S	.	.			trans	-76.1	-42.3	176.3	-59.7	178.7	0	0	0	110.5	T49 Q51 Q70	I45-T49 HydrophobicContact CB-CG2 4.49Å; I45-T49 HydrophobicContact CD1-CG2 4.37Å; I45-T49 PolarHBondContact N-O 2.69Å; I45-T49 VanDerWaalsContact N-O 3.07Å; I45-Q51 HydrophobicContact CD1-CB 3.7Å; I45-Q51 HydrophobicContact CD1-CG 4.34Å; I45-Q51 HydrophobicContact CG1-CB 3.96Å; I45-Q70 HydrophobicContact CD1-CG 4.09Å
46	S	92.6	Very high	82.8	Confident	40 Å²	40	62.1 Å²	62.1	28%	0.28	34%	0.336	S	S	.	.	S	Bend	trans	-146.7	174.1	-175.7	86.3	0	0	0	0	111.6	M44 S48 T49	M44-S46 WeakPolarHBondContact CE-O 3.38Å; M44-S46 WeakPolarHBondContact CG-O 3.48Å; S46-S48 PolarHBondContact O-N 3.29Å; S46-S48 PolarHBondContact OG-N 3.46Å; S46-S48 VanDerWaalsContact OG-N 3.11Å; S46-S48 PolarHBondContact OG-OG 3.35Å; S46-T49 PolarHBondContact N-O 3.49Å; S46-T49 PolarHBondContact O-N 3.46Å; S46-T49 WeakPolarHBondContact OG-CB 3.49Å; S46-T49 PolarHBondContact OG-N 2.67Å; S46-T49 PolarHBondContact OG-OG1 3.25Å
47	S	91.4	Very high	82.9	Confident	78 Å²	78	55.9 Å²	55.9	55%	0.545	33%	0.326	S	S	.	.	S	Bend	trans	-61.9	-6.5	173.1	58.1	0	0	0	0	114.5	K75 V76	S47-K75 CarbonylContact O-C 3.52Å; S47-K75 VanDerWaalsContact O-CA 3.31Å; S47-K75 WeakPolarHBondContact O-CA 3.36Å; S47-V76 PolarHBondContact O-N 3.48Å
48	S	94.2	Very high	83.2	Confident	44 Å²	44	51.6 Å²	51.6	31%	0.308	30%	0.302	S	S	.	.	S	Bend	trans	-130.2	-10.9	179	61.2	0	0	0	0	113.7	S46 C72 F73 V76	S46-S48 PolarHBondContact O-N 3.29Å; S46-S48 PolarHBondContact OG-N 3.46Å; S46-S48 VanDerWaalsContact OG-N 3.11Å; S46-S48 PolarHBondContact OG-OG 3.35Å; S48-C72 CarbonylContact O-C 3.56Å; S48-C72 WeakPolarHBondContact O-CA 3.37Å; S48-F73 WeakPolarHBondContact CB-O 3.42Å; S48-F73 PolarHBondContact O-N 2.96Å; S48-V76 VanDerWaalsContact C-CG2 3.49Å
49	T	93.6	Very high	82.3	Confident	21 Å²	21	58 Å²	58	13%	0.129	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	132.9	-169.7	-46	0	0	0	0	111.4	I45 S46 Q70 Y71	I45-T49 HydrophobicContact CB-CG2 4.49Å; I45-T49 HydrophobicContact CD1-CG2 4.37Å; I45-T49 PolarHBondContact N-O 2.69Å; I45-T49 VanDerWaalsContact N-O 3.07Å; S46-T49 PolarHBondContact N-O 3.49Å; S46-T49 PolarHBondContact O-N 3.46Å; S46-T49 WeakPolarHBondContact OG-CB 3.49Å; S46-T49 PolarHBondContact OG-N 2.67Å; S46-T49 PolarHBondContact OG-OG1 3.25Å; T49-Q70 HydrophobicContact CG2-CB 4.36Å; T49-Y71 WeakPolarHBondContact CA-O 3.31Å
50	I	93.6	Very high	81.2	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	144.3	175.5	-160.6	171.9	0	0	0	109.9	I30 V42 E43 Q70 Y71 F73 V76 V412 M426	I30-I50 HydrophobicContact CD1-CD1 3.66Å; I30-I50 HydrophobicContact CD1-CG1 4.26Å; I30-I50 HydrophobicContact CG1-CD1 3.81Å; V42-I50 HydrophobicContact CG1-CD1 3.13Å; V42-I50 HydrophobicContact CG1-CG1 3.52Å; E43-I50 CarbonylContact O-C 3.59Å; E43-I50 WeakPolarHBondContact O-CA 3.44Å; E43-I50 VanDerWaalsContact O-CG1 3.27Å; E43-I50 WeakPolarHBondContact O-CG1 3.36Å; I50-Q70 CarbonylContact O-C 3.58Å; I50-Q70 WeakPolarHBondContact O-CA 3.34Å; I50-Y71 PolarHBondContact N-O 3.42Å; I50-Y71 PolarHBondContact O-N 3.44Å; I50-F73 HydrophobicContact CG2-CD2 4.23Å; I50-F73 HydrophobicContact CG2-CE2 3.73Å; I50-V76 HydrophobicContact CD1-CG1 4.44Å; I50-V412 HydrophobicContact CD1-CG2 4.37Å; I50-M426 HydrophobicContact CD1-CE 3.7Å; I50-M426 HydrophobicContact CG2-CE 3.9Å
51	Q	91	Very high	79.8	Confident	18 Å²	18	57.9 Å²	57.9	8%	0.084	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.2	179.3	-173.4	168.5	33.5	0	0	110	V42 E43 I45 E68 Q70	V42-Q51 WeakPolarHBondContact CA-O 3.32Å; E43-Q51 PolarHBondContact N-O 3.03Å; E43-Q51 PolarHBondContact O-N 2.85Å; I45-Q51 HydrophobicContact CD1-CB 3.7Å; I45-Q51 HydrophobicContact CD1-CG 4.34Å; I45-Q51 HydrophobicContact CG1-CB 3.96Å; Q51-E68 HydrophobicContact CG-CB 4.46Å; Q51-E68 PolarHBondContact NE2-OE2 3.41Å; Q51-Q70 HydrophobicContact CB-CG 4.23Å; Q51-Q70 HydrophobicContact CG-CG 4.07Å
52	L	90.3	Very high	78.4	Confident	0 Å²	0	70 Å²	70	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	127.7	173	-59.2	-174.9	0	0	0	110.3	C41 V42 T69 Y71 Y419 T422 L423 M426	C41-L52 CarbonylContact O-C 3.57Å; C41-L52 VanDerWaalsContact O-CA 3.3Å; C41-L52 WeakPolarHBondContact O-CA 3.5Å; V42-L52 HydrophobicContact CB-CD2 4.27Å; V42-L52 HydrophobicContact CG1-CD2 4.18Å; V42-L52 HydrophobicContact CG2-CD2 3.64Å; L52-T69 PolarHBondContact N-O 3.36Å; L52-T69 PolarHBondContact O-N 2.96Å; L52-Y71 HydrophobicContact CD1-CD2 4.21Å; L52-Y71 HydrophobicContact CD1-CE2 3.59Å; L52-Y71 HydrophobicContact CG-CD2 4.24Å; L52-Y71 HydrophobicContact CG-CE2 4.01Å; L52-Y419 HydrophobicContact CB-CE2 3.92Å; L52-T422 HydrophobicContact CD1-CG2 4.29Å; L52-T422 HydrophobicContact CD2-CG2 3.82Å; L52-L423 HydrophobicContact CD1-CB 4.3Å; L52-L423 HydrophobicContact CD1-CD1 3.86Å; L52-M426 HydrophobicContact CD1-CB 4.49Å; L52-M426 HydrophobicContact CD1-CG 4Å; L52-M426 HydrophobicContact CD2-CE 4.4Å
53	H	85.8	Confident	76.8	Confident	50 Å²	50	76.4 Å²	76.4	23%	0.231	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-102.9	124.4	176.5	-63.3	-58.3	0	0	0	109.2	C41 E43 Y419	C41-H53 VanDerWaalsContact CB-O 3.31Å; C41-H53 WeakPolarHBondContact CB-O 3.34Å; C41-H53 PolarHBondContact O-N 3.44Å; E43-H53 IonicContact OE2-CD2 3.67Å; E43-H53 IonicContact OE2-CE1 3.34Å; E43-H53 IonicContact OE2-NE2 2.84Å; E43-H53 PolarHBondContact OE2-NE2 3.44Å; H53-Y419 WeakPolarHBondContact O-CD2 3.44Å; H53-Y419 WeakPolarHBondContact O-CE2 3.43Å
54	A	80.5	Confident	75.1	Confident	35 Å²	35	74.2 Å²	74.2	29%	0.289	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-74.4	128.7	178.1	0	0	0	0	0	109.7	Y419	A54-Y419 HydrophobicContact CB-CE1 4.15Å; A54-Y419 HydrophobicContact CB-CE2 4.34Å
55	P	77.6	Confident	73.1	Confident	16 Å²	16	78 Å²	78	10%	0.104	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-68.8	154.1	-179.5	25.2	-31.9	0	0	0	112.8	G57 L58 A416 Y419	P55-G57 PolarHBondContact O-N 3.36Å; P55-L58 HydrophobicContact CG-CD1 4.46Å; P55-L58 PolarHBondContact O-N 2.91Å; P55-A416 HydrophobicContact CB-CB 3.9Å; P55-A416 HydrophobicContact CG-CB 4.34Å; P55-Y419 HydrophobicContact CG-CD1 4.48Å; P55-Y419 HydrophobicContact CG-CG 4.35Å
56	D	66.8	Low	71.4	Confident	139 Å²	139	81.1 Å²	81.1	74%	0.743	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	115.2	-175.5	-79.1	-30	0	0	0	111.6
57	G	61.9	Low	69.9	Low	70 Å²	70	87.1 Å²	87.1	72%	0.722	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	116.2	-11.6	177.1	0	0	0	0	0	115.9	P55 K59	P55-G57 PolarHBondContact O-N 3.36Å; G57-K59 PolarHBondContact O-N 3.38Å
58	L	62.7	Low	69	Low	79 Å²	79	89 Å²	89	41%	0.414	46%	0.462	S	S	.	.	S	Bend	trans	-74.9	104	166.4	-115.1	94.9	0	0	0	108.9	P55 A60 Y419 E420	P55-L58 HydrophobicContact CG-CD1 4.46Å; P55-L58 PolarHBondContact O-N 2.91Å; L58-A60 PolarHBondContact O-N 2.95Å; L58-Y419 HydrophobicContact CD2-CD1 4.4Å; L58-Y419 HydrophobicContact CD2-CE1 4.38Å; L58-E420 HydrophobicContact CD2-CG 4.25Å
59	K	50.8	Low	68.6	Low	202 Å²	202	88.7 Å²	88.7	88%	0.878	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-46.5	123.2	-173.5	-67.4	-176.6	179.1	-179.7	0	112.2	G57	G57-K59 PolarHBondContact O-N 3.38Å
60	A	48.4	Very low	68.5	Low	42 Å²	42	92.7 Å²	92.7	35%	0.347	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-46.3	147.2	163.9	0	0	0	0	0	110.6	L58	L58-A60 PolarHBondContact O-N 2.95Å
61	N	52.9	Low	68.5	Low	122 Å²	122	92.9 Å²	92.9	65%	0.652	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-50.6	162	165.2	-69.8	-36.6	0	0	0	109.6	N63 G64	N61-N63 PolarHBondContact O-N 3.48Å; N61-G64 PolarHBondContact O-N 2.94Å
62	R	53.6	Low	68.6	Low	258 Å²	258	95 Å²	95	97%	0.974	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.1	-9	-179.3	-86.6	177.8	153.7	-176.9	-6.9	116.7
63	N	56.3	Low	68.8	Low	139 Å²	139	95.5 Å²	95.5	74%	0.743	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	-1.7	-175.9	-53.2	5.2	0	0	0	114.1	N61 E65	N61-N63 PolarHBondContact O-N 3.48Å; N63-E65 VanDerWaalsContact C-N 3.31Å; N63-E65 PolarHBondContact O-N 2.93Å
64	G	51.2	Low	69.2	Low	52 Å²	52	99.2 Å²	99.2	54%	0.536	51%	0.51	S	S	.	.			trans	76	3.3	174.6	0	0	0	0	0	116.9	N61	N61-G64 PolarHBondContact O-N 2.94Å
65	E	49.5	Very low	70	Confident	151 Å²	151	100.7 Å²	100.7	71%	0.706	51%	0.51	S	S	*	.			trans	-85.3	125.3	174.9	-80	-179.5	160.5	0	0	111.8	N63 K67	N63-E65 VanDerWaalsContact C-N 3.31Å; N63-E65 PolarHBondContact O-N 2.93Å; E65-K67 PolarHBondContact O-N 3.28Å
66	Y	54.5	Low	70.9	Confident	147 Å²	147	100.1 Å²	100.1	58%	0.576	51%	0.507	S	S	*	.			trans	-74	109.5	163.3	-69	-94.5	0	0	0	107.9	E68	Y66-E68 PolarHBondContact O-N 3.42Å
67	K	61.2	Low	72.2	Confident	166 Å²	166	93.7 Å²	93.7	72%	0.722	47%	0.472	S	S	*	.			trans	-87.9	86.1	178.3	-152.3	176.6	-172	-178.4	0	109	E65 T69	E65-K67 PolarHBondContact O-N 3.28Å; K67-T69 PolarHBondContact O-N 3.22Å; K67-T69 PolarHBondContact O-OG1 3.19Å; K67-T69 VanDerWaalsContact O-OG1 3.13Å
68	E	72.8	Confident	73.6	Confident	118 Å²	118	91 Å²	91	55%	0.551	44%	0.444	S	S	*	.			trans	-51.9	123.2	163.6	-67	175.7	-177.3	0	0	108.1	Q51 Y66	Q51-E68 HydrophobicContact CG-CB 4.46Å; Q51-E68 PolarHBondContact NE2-OE2 3.41Å; Y66-E68 PolarHBondContact O-N 3.42Å
69	T	85.5	Confident	74.9	Confident	37 Å²	37	92 Å²	92	23%	0.227	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	120.9	-176.4	-49.4	0	0	0	0	109	L52 K67 Y71	L52-T69 PolarHBondContact N-O 3.36Å; L52-T69 PolarHBondContact O-N 2.96Å; K67-T69 PolarHBondContact O-N 3.22Å; K67-T69 PolarHBondContact O-OG1 3.19Å; K67-T69 VanDerWaalsContact O-OG1 3.13Å; T69-Y71 HydrophobicContact CG2-CD2 4.36Å; T69-Y71 HydrophobicContact CG2-CE1 4.24Å; T69-Y71 HydrophobicContact CG2-CE2 3.54Å; T69-Y71 VanDerWaalsContact CG2-CZ 3.48Å; T69-Y71 WeakPolarHBondContact CG2-OH 3.38Å
70	Q	91.5	Very high	76.7	Confident	105 Å²	105	91.4 Å²	91.4	49%	0.491	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	141	176.8	-65.3	-179.6	3.4	0	0	109.8	I45 T49 I50 Q51	I45-Q70 HydrophobicContact CD1-CG 4.09Å; T49-Q70 HydrophobicContact CG2-CB 4.36Å; I50-Q70 CarbonylContact O-C 3.58Å; I50-Q70 WeakPolarHBondContact O-CA 3.34Å; Q51-Q70 HydrophobicContact CB-CG 4.23Å; Q51-Q70 HydrophobicContact CG-CG 4.07Å
71	Y	93.2	Very high	78.8	Confident	5 Å²	5	90.7 Å²	90.7	2%	0.02	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	138.9	175.8	-62.5	-85.6	0	0	0	109.6	T49 I50 L52 T69 L423 M426 R427 E430	T49-Y71 WeakPolarHBondContact CA-O 3.31Å; I50-Y71 PolarHBondContact N-O 3.42Å; I50-Y71 PolarHBondContact O-N 3.44Å; L52-Y71 HydrophobicContact CD1-CD2 4.21Å; L52-Y71 HydrophobicContact CD1-CE2 3.59Å; L52-Y71 HydrophobicContact CG-CD2 4.24Å; L52-Y71 HydrophobicContact CG-CE2 4.01Å; T69-Y71 HydrophobicContact CG2-CD2 4.36Å; T69-Y71 HydrophobicContact CG2-CE1 4.24Å; T69-Y71 HydrophobicContact CG2-CE2 3.54Å; T69-Y71 VanDerWaalsContact CG2-CZ 3.48Å; T69-Y71 WeakPolarHBondContact CG2-OH 3.38Å; Y71-L423 HydrophobicContact CE2-CD1 4.38Å; Y71-L423 WeakPolarHBondContact OH-CD1 3.4Å; Y71-M426 HydrophobicContact CD1-CB 3.86Å; Y71-M426 HydrophobicContact CD2-CB 3.69Å; Y71-M426 HydrophobicContact CD2-CG 3.94Å; Y71-M426 HydrophobicContact CE1-CB 3.79Å; Y71-M426 HydrophobicContact CE2-CB 3.63Å; Y71-M426 HydrophobicContact CE2-CG 4.12Å; Y71-M426 HydrophobicContact CG-CB 3.8Å; Y71-M426 HydrophobicContact CG-CG 4.31Å; Y71-R427 HydrophobicContact CE1-CG 4.16Å; Y71-E430 HydrophobicContact CD1-CB 4.13Å
72	C	93.3	Very high	80.7	Confident	63 Å²	63	87.6 Å²	87.6	43%	0.426	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	134.9	178.1	-69	0	0	0	0	110.5	S48 Q433	S48-C72 CarbonylContact O-C 3.56Å; S48-C72 WeakPolarHBondContact O-CA 3.37Å; C72-Q433 PolarHBondContact O-NE2 3.32Å; C72-Q433 PolarHBondContact O-OE1 3.35Å
73	F	95.3	Very high	82.5	Confident	9 Å²	9	75.4 Å²	75.4	4%	0.039	38%	0.378	C	S	.	.			trans	-131.7	167.9	179.2	-60.9	-65.4	0	0	0	110.5	V26 C28 S48 I50 K75 V76 M426 A429	V26-F73 HydrophobicContact CB-CD1 4.37Å; V26-F73 HydrophobicContact CG1-CD1 3.72Å; V26-F73 HydrophobicContact CG1-CE1 4.05Å; C28-F73 HydrophobicContact CB-CD2 3.49Å; C28-F73 VanDerWaalsContact CB-CD2 3.49Å; C28-F73 HydrophobicContact CB-CE2 3.83Å; C28-F73 HydrophobicContact CB-CG 4.04Å; S48-F73 WeakPolarHBondContact CB-O 3.42Å; S48-F73 PolarHBondContact O-N 2.96Å; I50-F73 HydrophobicContact CG2-CD2 4.23Å; I50-F73 HydrophobicContact CG2-CE2 3.73Å; F73-K75 VanDerWaalsContact C-N 3.26Å; F73-K75 PolarHBondContact O-N 2.9Å; F73-V76 HydrophobicContact CB-CG2 4.31Å; F73-V76 HydrophobicContact CD2-CG2 4.04Å; F73-M426 HydrophobicContact CE2-CE 4.47Å; F73-M426 HydrophobicContact CE2-SD 3.73Å; F73-M426 HydrophobicContact CZ-SD 3.6Å; F73-A429 HydrophobicContact CE1-CB 3.53Å; F73-A429 HydrophobicContact CZ-CB 3.99Å
74	K	94.6	Very high	84.2	Confident	128 Å²	128	71 Å²	71	56%	0.557	35%	0.353	S	S	*	.	S	Bend	trans	-59	-39.7	177.4	-173	168.4	-179.1	177.6	0	112.2	V26 Y27	V26-K74 VanDerWaalsContact O-CB 3.25Å; V26-K74 WeakPolarHBondContact O-CB 3.33Å; V26-K74 PolarHBondContact O-N 2.86Å; Y27-K74 HydrophobicContact CE1-CB 4.45Å; Y27-K74 HydrophobicContact CE1-CD 4.19Å; Y27-K74 HydrophobicContact CE1-CG 4.23Å; Y27-K74 HydrophobicContact CE2-CD 4.32Å
75	K	95.9	Very high	86.2	Confident	67 Å²	67	72.7 Å²	72.7	29%	0.291	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	143.8	169	-159.8	171.4	-174.6	177.2	0	110.1	Y27 C28 S47 F73 F77 D89	Y27-K75 WeakPolarHBondContact CA-O 3.33Å; Y27-K75 HydrophobicContact CD1-CB 3.86Å; Y27-K75 HydrophobicContact CE1-CB 4.3Å; C28-K75 PolarHBondContact N-O 3.4Å; S47-K75 CarbonylContact O-C 3.52Å; S47-K75 VanDerWaalsContact O-CA 3.31Å; S47-K75 WeakPolarHBondContact O-CA 3.36Å; F73-K75 VanDerWaalsContact C-N 3.26Å; F73-K75 PolarHBondContact O-N 2.9Å; K75-F77 HydrophobicContact CB-CE2 4.47Å; K75-F77 HydrophobicContact CB-CZ 4.31Å; K75-F77 HydrophobicContact CD-CE1 3.73Å; K75-F77 HydrophobicContact CD-CZ 3.86Å; K75-F77 HydrophobicContact CG-CE1 4.23Å; K75-F77 HydrophobicContact CG-CZ 4.23Å; K75-D89 HydrophobicContact CD-CB 4.28Å; K75-D89 WeakPolarHBondContact CE-OD2 3.34Å; K75-D89 IonicContact NZ-OD1 3.89Å; K75-D89 PolarHBondContact NZ-OD1 3.02Å; K75-D89 IonicContact NZ-OD2 3.15Å; K75-D89 PolarHBondContact NZ-OD2 2.93Å
76	V	96.4	Very high	88.4	Confident	4 Å²	4	65.5 Å²	65.5	2%	0.024	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	128.6	172.8	-179.1	0	0	0	0	108	C28 I30 M44 S47 S48 I50 F73	C28-V76 HydrophobicContact CB-CG2 4.24Å; C28-V76 CarbonylContact O-C 3.5Å; C28-V76 WeakPolarHBondContact O-CA 3.37Å; I30-V76 HydrophobicContact CD1-CG1 4.26Å; M44-V76 HydrophobicContact CE-CB 4.06Å; M44-V76 HydrophobicContact CE-CG1 4.13Å; M44-V76 WeakPolarHBondContact CE-O 3.48Å; M44-V76 HydrophobicContact CG-CG1 3.91Å; M44-V76 HydrophobicContact SD-CG1 4.04Å; S47-V76 PolarHBondContact O-N 3.48Å; S48-V76 VanDerWaalsContact C-CG2 3.49Å; I50-V76 HydrophobicContact CD1-CG1 4.44Å; F73-V76 HydrophobicContact CB-CG2 4.31Å; F73-V76 HydrophobicContact CD2-CG2 4.04Å
77	F	95.8	Very high	90.3	Very high	3 Å²	3	58.7 Å²	58.7	1%	0.013	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	115.4	178.5	-60.2	-73.5	0	0	0	109.1	Y27 C28 R29 I30 K75 T81 L86 D89 V90	Y27-F77 AromaticContact CD1-CE2 3.9Å; Y27-F77 HydrophobicContact CD1-CE2 3.9Å; Y27-F77 HydrophobicContact CD1-CZ 4.2Å; Y27-F77 HydrophobicContact CG-CE2 4.33Å; C28-F77 WeakPolarHBondContact O-CD2 3.4Å; C28-F77 PolarHBondContact O-N 3.27Å; R29-F77 HydrophobicContact CB-CB 4.25Å; R29-F77 HydrophobicContact CG-CB 4.09Å; I30-F77 PolarHBondContact N-O 2.85Å; K75-F77 HydrophobicContact CB-CE2 4.47Å; K75-F77 HydrophobicContact CB-CZ 4.31Å; K75-F77 HydrophobicContact CD-CE1 3.73Å; K75-F77 HydrophobicContact CD-CZ 3.86Å; K75-F77 HydrophobicContact CG-CE1 4.23Å; K75-F77 HydrophobicContact CG-CZ 4.23Å; F77-T81 HydrophobicContact CB-CG2 3.94Å; F77-T81 HydrophobicContact CD1-CG2 3.43Å; F77-T81 VanDerWaalsContact CD1-CG2 3.43Å; F77-T81 HydrophobicContact CE1-CG2 4.27Å; F77-T81 HydrophobicContact CG-CG2 4.05Å; F77-L86 HydrophobicContact CD1-CD1 4.24Å; F77-L86 HydrophobicContact CD2-CD1 3.39Å; F77-L86 HydrophobicContact CE1-CD1 4.09Å; F77-L86 HydrophobicContact CE2-CD1 3.24Å; F77-L86 HydrophobicContact CG-CD1 3.89Å; F77-L86 HydrophobicContact CZ-CD1 3.61Å; F77-D89 HydrophobicContact CE1-CB 4.17Å; F77-D89 WeakPolarHBondContact CE1-OD2 3.47Å; F77-D89 HydrophobicContact CZ-CB 3.77Å; F77-V90 HydrophobicContact CE2-CG2 3.82Å; F77-V90 HydrophobicContact CZ-CG2 3.83Å
78	G	91.4	Very high	91.9	Very high	14 Å²	14	55.6 Å²	55.6	14%	0.144	28%	0.275	C	S	.	.			trans	-77.4	178.5	179.1	0	0	0	0	0	112.5	K80 T81	G78-K80 PolarHBondContact O-N 3.43Å; G78-K80 VanDerWaalsContact O-N 3.1Å; G78-T81 PolarHBondContact N-OG1 3.32Å; G78-T81 WeakPolarHBondContact O-CB 3.32Å; G78-T81 PolarHBondContact O-N 3.42Å; G78-T81 VanDerWaalsContact O-N 3.09Å; G78-T81 PolarHBondContact O-OG1 2.83Å
79	I	88.9	Confident	92.9	Very high	100 Å²	100	52.6 Å²	52.6	51%	0.513	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-19.7	-177.2	64.4	176.8	0	0	0	114.3	I30 P32	I30-I79 HydrophobicContact CB-CG2 4.49Å; I30-I79 HydrophobicContact CG2-CG2 4.04Å; P32-I79 HydrophobicContact CB-CB 4.28Å; P32-I79 HydrophobicContact CG-CB 4.22Å
80	K	89.2	Confident	93.4	Very high	190 Å²	190	50.8 Å²	50.8	83%	0.826	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-8.4	180	-60.1	-176	-178.4	177.9	0	113.2	G78 T82	G78-K80 PolarHBondContact O-N 3.43Å; G78-K80 VanDerWaalsContact O-N 3.1Å; K80-T82 PolarHBondContact O-N 3.49Å
81	T	92.1	Very high	93.6	Very high	27 Å²	27	45.9 Å²	45.9	17%	0.166	23%	0.229	C	C	.	.			trans	-68.8	127	-177.9	-60.7	0	0	0	0	110.4	F77 G78 E85	F77-T81 HydrophobicContact CB-CG2 3.94Å; F77-T81 HydrophobicContact CD1-CG2 3.43Å; F77-T81 VanDerWaalsContact CD1-CG2 3.43Å; F77-T81 HydrophobicContact CE1-CG2 4.27Å; F77-T81 HydrophobicContact CG-CG2 4.05Å; G78-T81 PolarHBondContact N-OG1 3.32Å; G78-T81 WeakPolarHBondContact O-CB 3.32Å; G78-T81 PolarHBondContact O-N 3.42Å; G78-T81 VanDerWaalsContact O-N 3.09Å; G78-T81 PolarHBondContact O-OG1 2.83Å; T81-E85 HydrophobicContact CG2-CB 3.91Å; T81-E85 WeakPolarHBondContact CG2-OE2 3.25Å
82	T	92.4	Very high	93.7	Very high	56 Å²	56	49 Å²	49	34%	0.344	24%	0.243	S	C	.	.			trans	-78.7	162.4	178.6	63.7	0	0	0	0	112.3	K80 I84 E85 L86	K80-T82 PolarHBondContact O-N 3.49Å; T82-I84 PolarHBondContact O-N 3.35Å; T82-I84 WeakPolarHBondContact OG1-CG2 3.37Å; T82-E85 PolarHBondContact O-N 3.41Å; T82-E85 WeakPolarHBondContact OG1-CG 3.34Å; T82-E85 PolarHBondContact OG1-N 2.62Å; T82-L86 PolarHBondContact O-N 2.98Å
83	Q	92.6	Very high	93.7	Very high	3 Å²	3	48 Å²	48	1%	0.014	24%	0.235	C	C	.	.	H	α-helix	trans	-63.8	-29.4	176.4	-63.4	-82.4	79.6	0	0	112.9	F87 Y118 E126 G127	Q83-F87 WeakPolarHBondContact O-CB 3.34Å; Q83-F87 PolarHBondContact O-N 3.3Å; Q83-Y118 PolarHBondContact NE2-O 3.2Å; Q83-E126 HydrophobicContact CG-CB 4.1Å; Q83-E126 PolarHBondContact NE2-O 3.49Å; Q83-G127 VanDerWaalsContact CB-O 3.27Å; Q83-G127 WeakPolarHBondContact CB-O 3.46Å
84	I	91.6	Very high	93.7	Very high	46 Å²	46	47.6 Å²	47.6	24%	0.236	23%	0.233	C	C	.	.	H	α-helix	trans	-71.5	-45.7	179.3	-172.5	169.2	0	0	0	111.3	T82 L86 F87 E88 Q202	T82-I84 PolarHBondContact O-N 3.35Å; T82-I84 WeakPolarHBondContact OG1-CG2 3.37Å; I84-L86 VanDerWaalsContact C-N 3.29Å; I84-L86 PolarHBondContact O-N 3.26Å; I84-F87 WeakPolarHBondContact O-CB 3.38Å; I84-F87 PolarHBondContact O-N 3.24Å; I84-F87 VanDerWaalsContact O-N 3.09Å; I84-E88 WeakPolarHBondContact O-CG 3.2Å; I84-E88 PolarHBondContact O-N 3.41Å; I84-Q202 HydrophobicContact CD1-CB 4.12Å; I84-Q202 HydrophobicContact CD1-CG 4.25Å
85	E	93	Very high	93.7	Very high	87 Å²	87	41.6 Å²	41.6	41%	0.407	21%	0.207	S	C	.	.	H	α-helix	trans	-57.6	-45.3	174.4	-73.4	168.1	-160.5	0	0	110.9	T81 T82 F87 E88 D89	T81-E85 HydrophobicContact CG2-CB 3.91Å; T81-E85 WeakPolarHBondContact CG2-OE2 3.25Å; T82-E85 PolarHBondContact O-N 3.41Å; T82-E85 WeakPolarHBondContact OG1-CG 3.34Å; T82-E85 PolarHBondContact OG1-N 2.62Å; E85-F87 VanDerWaalsContact C-N 3.3Å; E85-F87 PolarHBondContact O-N 3.49Å; E85-E88 PolarHBondContact O-N 3.28Å; E85-D89 PolarHBondContact O-N 3.08Å
86	L	94.8	Very high	93.6	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.4	-41.3	176.3	-177.4	65.4	0	0	0	112.3	R29 F77 T82 I84 V90 T119 L129	R29-L86 VanDerWaalsContact NH1-CD2 3.33Å; F77-L86 HydrophobicContact CD1-CD1 4.24Å; F77-L86 HydrophobicContact CD2-CD1 3.39Å; F77-L86 HydrophobicContact CE1-CD1 4.09Å; F77-L86 HydrophobicContact CE2-CD1 3.24Å; F77-L86 HydrophobicContact CG-CD1 3.89Å; F77-L86 HydrophobicContact CZ-CD1 3.61Å; T82-L86 PolarHBondContact O-N 2.98Å; I84-L86 VanDerWaalsContact C-N 3.29Å; I84-L86 PolarHBondContact O-N 3.26Å; L86-V90 HydrophobicContact CD1-CG2 3.86Å; L86-V90 VanDerWaalsContact O-CB 3.28Å; L86-V90 WeakPolarHBondContact O-CB 3.45Å; L86-V90 VanDerWaalsContact O-CG2 3.28Å; L86-V90 WeakPolarHBondContact O-CG2 3.13Å; L86-V90 PolarHBondContact O-N 3.26Å; L86-V90 VanDerWaalsContact O-N 3.12Å; L86-T119 HydrophobicContact CD2-CG2 3.62Å; L86-L129 HydrophobicContact CG-CD2 4.16Å
87	F	95.4	Very high	93.4	Very high	5 Å²	5	41 Å²	41	2%	0.022	21%	0.206	C	C	.	.	H	α-helix	trans	-64.1	-44.8	177.2	168	-98.5	0	0	0	112.2	Q83 I84 E85 D89 V90 A91 K92 L129 R132 M136 C204	Q83-F87 WeakPolarHBondContact O-CB 3.34Å; Q83-F87 PolarHBondContact O-N 3.3Å; I84-F87 WeakPolarHBondContact O-CB 3.38Å; I84-F87 PolarHBondContact O-N 3.24Å; I84-F87 VanDerWaalsContact O-N 3.09Å; E85-F87 VanDerWaalsContact C-N 3.3Å; E85-F87 PolarHBondContact O-N 3.49Å; F87-D89 PolarHBondContact O-N 3.37Å; F87-V90 PolarHBondContact O-N 3.29Å; F87-A91 HydrophobicContact CD2-CB 3.59Å; F87-A91 HydrophobicContact CE2-CB 3.81Å; F87-A91 PolarHBondContact O-N 3.46Å; F87-K92 HydrophobicContact CE1-CB 4.35Å; F87-K92 PolarHBondContact O-N 3.14Å; F87-L129 HydrophobicContact CB-CD2 4.24Å; F87-R132 HydrophobicContact CB-CB 4.29Å; F87-R132 HydrophobicContact CD1-CB 4.2Å; F87-R132 HydrophobicContact CD2-CB 3.41Å; F87-R132 VanDerWaalsContact CD2-CB 3.41Å; F87-R132 HydrophobicContact CE1-CB 4.43Å; F87-R132 VanDerWaalsContact CE2-C 3.48Å; F87-R132 HydrophobicContact CE2-CB 3.71Å; F87-R132 HydrophobicContact CG-CB 3.69Å; F87-R132 HydrophobicContact CG-CG 4.45Å; F87-R132 HydrophobicContact CZ-CB 4.2Å; F87-M136 HydrophobicContact CE1-SD 4.09Å; F87-M136 HydrophobicContact CZ-CB 3.85Å; F87-M136 HydrophobicContact CZ-CG 4.33Å; F87-M136 HydrophobicContact CZ-SD 3.59Å; F87-M136 VanDerWaalsContact CZ-SD 3.59Å; F87-C204 HydrophobicContact CE1-CB 4.31Å
88	E	94.3	Very high	93.3	Very high	101 Å²	101	41 Å²	41	47%	0.472	21%	0.205	S	C	.	.	H	α-helix	trans	-61	-42.5	-178.9	-72.9	-176.2	167.1	0	0	112.5	I84 E85 K92	I84-E88 WeakPolarHBondContact O-CG 3.2Å; I84-E88 PolarHBondContact O-N 3.41Å; E85-E88 PolarHBondContact O-N 3.28Å; E88-K92 WeakPolarHBondContact O-CB 3.33Å
89	D	94.3	Very high	93.4	Very high	54 Å²	54	40.5 Å²	40.5	29%	0.289	20%	0.199	S	C	.	.	H	α-helix	trans	-78.3	-32	-179.1	-71.5	-66	0	0	0	113.8	Y27 K75 F77 E85 F87 R407	Y27-D89 PolarHBondContact OH-O 2.99Å; K75-D89 HydrophobicContact CD-CB 4.28Å; K75-D89 WeakPolarHBondContact CE-OD2 3.34Å; K75-D89 IonicContact NZ-OD1 3.89Å; K75-D89 PolarHBondContact NZ-OD1 3.02Å; K75-D89 IonicContact NZ-OD2 3.15Å; K75-D89 PolarHBondContact NZ-OD2 2.93Å; F77-D89 HydrophobicContact CE1-CB 4.17Å; F77-D89 WeakPolarHBondContact CE1-OD2 3.47Å; F77-D89 HydrophobicContact CZ-CB 3.77Å; E85-D89 PolarHBondContact O-N 3.08Å; F87-D89 PolarHBondContact O-N 3.37Å; D89-R407 PolarHBondContact O-NH1 2.88Å
90	V	95.4	Very high	93.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-108.6	-45.5	-167.4	-171.9	0	0	0	0	113.3	Y27 F77 L86 F87 L106 R407 V409	Y27-V90 HydrophobicContact CD1-CG2 3.73Å; Y27-V90 HydrophobicContact CD2-CG1 4.19Å; Y27-V90 HydrophobicContact CD2-CG2 4.22Å; Y27-V90 HydrophobicContact CE1-CG2 3.95Å; Y27-V90 HydrophobicContact CE2-CG1 4.25Å; Y27-V90 HydrophobicContact CE2-CG2 4.44Å; Y27-V90 HydrophobicContact CG-CG2 3.87Å; F77-V90 HydrophobicContact CE2-CG2 3.82Å; F77-V90 HydrophobicContact CZ-CG2 3.83Å; L86-V90 HydrophobicContact CD1-CG2 3.86Å; L86-V90 VanDerWaalsContact O-CB 3.28Å; L86-V90 WeakPolarHBondContact O-CB 3.45Å; L86-V90 VanDerWaalsContact O-CG2 3.28Å; L86-V90 WeakPolarHBondContact O-CG2 3.13Å; L86-V90 PolarHBondContact O-N 3.26Å; L86-V90 VanDerWaalsContact O-N 3.12Å; F87-V90 PolarHBondContact O-N 3.29Å; V90-L106 HydrophobicContact CG1-CD1 3.7Å; V90-R407 VanDerWaalsContact C-NH1 3.3Å; V90-R407 WeakPolarHBondContact O-CD 3.39Å; V90-R407 PolarHBondContact O-NH1 3.32Å; V90-V409 HydrophobicContact CG1-CG2 3.63Å; V90-V409 HydrophobicContact CG2-CG2 4.46Å
91	A	95.5	Very high	93.4	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.008	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-33.5	-171.1	0	0	0	0	0	113.4	F87 T93 L94 I95 L106 L129	F87-A91 HydrophobicContact CD2-CB 3.59Å; F87-A91 HydrophobicContact CE2-CB 3.81Å; F87-A91 PolarHBondContact O-N 3.46Å; A91-T93 PolarHBondContact O-N 3.05Å; A91-L94 WeakPolarHBondContact O-CA 3.24Å; A91-L94 VanDerWaalsContact O-CB 3.3Å; A91-L94 WeakPolarHBondContact O-CB 3.49Å; A91-L94 PolarHBondContact O-N 2.81Å; A91-I95 PolarHBondContact O-N 3.36Å; A91-L106 HydrophobicContact CB-CD1 4.36Å; A91-L129 HydrophobicContact CB-CD2 3.94Å
92	K	94.9	Very high	93.4	Very high	72 Å²	72	31.9 Å²	31.9	31%	0.313	16%	0.16	S	C	.	.	H	α-helix	trans	-46.2	-55.3	-176.2	-179.6	-179.9	177.3	177.1	0	113.2	F87 E88 L94 I95 E96 M136	F87-K92 HydrophobicContact CE1-CB 4.35Å; F87-K92 PolarHBondContact O-N 3.14Å; E88-K92 WeakPolarHBondContact O-CB 3.33Å; K92-L94 VanDerWaalsContact C-N 3.25Å; K92-L94 PolarHBondContact O-N 3.35Å; K92-I95 WeakPolarHBondContact O-CB 3.44Å; K92-I95 PolarHBondContact O-N 3.49Å; K92-E96 VanDerWaalsContact CE-OE1 3.27Å; K92-E96 WeakPolarHBondContact CE-OE1 3.4Å; K92-E96 WeakPolarHBondContact O-CG 3.34Å; K92-E96 PolarHBondContact O-N 3.46Å; K92-E96 VanDerWaalsContact O-N 3.08Å; K92-M136 HydrophobicContact CB-SD 4.42Å; K92-M136 HydrophobicContact CG-CE 3.83Å; K92-M136 HydrophobicContact CG-SD 3.95Å
93	T	93.5	Very high	93.4	Very high	41 Å²	41	30.7 Å²	30.7	25%	0.252	15%	0.151	S	C	.	.	H	α-helix	trans	-65.8	-26.7	-179.4	59.4	0	0	0	0	113.2	A91 I95 E96 D97 R407	A91-T93 PolarHBondContact O-N 3.05Å; T93-I95 VanDerWaalsContact C-N 3.29Å; T93-E96 PolarHBondContact O-N 3.24Å; T93-D97 VanDerWaalsContact O-CB 3.32Å; T93-D97 WeakPolarHBondContact O-CB 3.39Å; T93-D97 PolarHBondContact O-N 2.91Å; T93-R407 PolarHBondContact OG1-NH1 2.79Å; T93-R407 PolarHBondContact OG1-NH2 3.16Å
94	L	94.9	Very high	93.4	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-69.1	-31.1	174.4	-63.5	179.1	0	0	0	111.1	A91 K92 L98 L106 L332 K405 R407	A91-L94 WeakPolarHBondContact O-CA 3.24Å; A91-L94 VanDerWaalsContact O-CB 3.3Å; A91-L94 WeakPolarHBondContact O-CB 3.49Å; A91-L94 PolarHBondContact O-N 2.81Å; K92-L94 VanDerWaalsContact C-N 3.25Å; K92-L94 PolarHBondContact O-N 3.35Å; L94-L98 WeakPolarHBondContact O-CB 3.38Å; L94-L98 PolarHBondContact O-N 3.28Å; L94-L106 HydrophobicContact CD1-CB 3.97Å; L94-L106 HydrophobicContact CD1-CD1 3.78Å; L94-L106 HydrophobicContact CD1-CG 4.44Å; L94-L332 HydrophobicContact CB-CD1 3.99Å; L94-L332 HydrophobicContact CD1-CD1 4.07Å; L94-K405 HydrophobicContact CD2-CB 3.95Å; L94-R407 HydrophobicContact CD1-CG 4.38Å; L94-R407 HydrophobicContact CD2-CG 4.34Å
95	I	95.5	Very high	93.7	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-71.9	-42.4	173.5	-49.9	-52.7	0	0	0	110.6	A91 K92 T93 D97 L98 I99 M136 L137 L332	A91-I95 PolarHBondContact O-N 3.36Å; K92-I95 WeakPolarHBondContact O-CB 3.44Å; K92-I95 PolarHBondContact O-N 3.49Å; T93-I95 VanDerWaalsContact C-N 3.29Å; I95-D97 VanDerWaalsContact C-N 3.32Å; I95-D97 PolarHBondContact O-N 3.14Å; I95-L98 WeakPolarHBondContact O-CB 3.46Å; I95-L98 PolarHBondContact O-N 3.45Å; I95-I99 HydrophobicContact CG2-CD1 4.36Å; I95-I99 WeakPolarHBondContact O-CG1 3.42Å; I95-I99 PolarHBondContact O-N 3.07Å; I95-M136 HydrophobicContact CB-CE 4.15Å; I95-M136 HydrophobicContact CB-SD 3.88Å; I95-M136 HydrophobicContact CG1-SD 4.09Å; I95-M136 HydrophobicContact CG2-CB 4.46Å; I95-M136 HydrophobicContact CG2-CE 4.3Å; I95-M136 HydrophobicContact CG2-CG 4.1Å; I95-M136 HydrophobicContact CG2-SD 4.08Å; I95-L137 HydrophobicContact CG2-CB 4.16Å; I95-L137 HydrophobicContact CG2-CD1 4.46Å; I95-L332 HydrophobicContact CD1-CD2 3.38Å
96	E	94.2	Very high	93.9	Very high	47 Å²	47	24.2 Å²	24.2	22%	0.22	12%	0.12	C	C	.	.	H	α-helix	trans	-58.2	-47.1	173	-61.6	172.5	179.4	0	0	110.4	K92 T93 L98 I99 H100 M136 F206	K92-E96 VanDerWaalsContact CE-OE1 3.27Å; K92-E96 WeakPolarHBondContact CE-OE1 3.4Å; K92-E96 WeakPolarHBondContact O-CG 3.34Å; K92-E96 PolarHBondContact O-N 3.46Å; K92-E96 VanDerWaalsContact O-N 3.08Å; T93-E96 PolarHBondContact O-N 3.24Å; E96-L98 PolarHBondContact O-N 3.49Å; E96-I99 PolarHBondContact O-N 2.99Å; E96-H100 PolarHBondContact O-N 2.95Å; E96-H100 VanDerWaalsContact O-N 3.13Å; E96-H100 PolarHBondContact O-ND1 3.34Å; E96-M136 HydrophobicContact CG-CE 3.86Å; E96-F206 HydrophobicContact CB-CD2 4.46Å; E96-F206 HydrophobicContact CB-CE2 4.38Å; E96-F206 HydrophobicContact CG-CD2 3.6Å; E96-F206 HydrophobicContact CG-CE2 3.85Å; E96-F206 HydrophobicContact CG-CG 4.01Å; E96-F206 HydrophobicContact CG-CZ 4.45Å
97	D	92.2	Very high	93.9	Very high	13 Å²	13	24.6 Å²	24.6	7%	0.07	12%	0.122	C	C	.	.	H	α-helix	trans	-60.5	-42.4	175.1	-74.8	-41.4	0	0	0	112	T93 I95 I99 H100 C101 K102 K405	T93-D97 VanDerWaalsContact O-CB 3.32Å; T93-D97 WeakPolarHBondContact O-CB 3.39Å; T93-D97 PolarHBondContact O-N 2.91Å; I95-D97 VanDerWaalsContact C-N 3.32Å; I95-D97 PolarHBondContact O-N 3.14Å; D97-I99 VanDerWaalsContact C-N 3.32Å; D97-I99 PolarHBondContact O-N 3.35Å; D97-H100 CarbonylContact O-C 3.54Å; D97-H100 WeakPolarHBondContact O-CA 3.43Å; D97-H100 PolarHBondContact O-N 2.94Å; D97-C101 PolarHBondContact O-N 3.01Å; D97-K102 HydrophobicContact CB-CB 3.91Å; D97-K102 HydrophobicContact CB-CD 4.31Å; D97-K102 WeakPolarHBondContact O-CA 2.86Å; D97-K102 WeakPolarHBondContact O-CB 3.43Å; D97-K102 PolarHBondContact O-N 2.74Å; D97-K405 IonicContact OD1-NZ 3.63Å; D97-K405 PolarHBondContact OD1-NZ 2.85Å; D97-K405 WeakPolarHBondContact OD2-CD 3.31Å; D97-K405 WeakPolarHBondContact OD2-CE 3.35Å; D97-K405 IonicContact OD2-NZ 2.82Å; D97-K405 PolarHBondContact OD2-NZ 3.32Å
98	L	93.9	Very high	93.9	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-57.5	-45.3	177.5	-176.4	70.7	0	0	0	111.3	L94 I95 E96 H100 C101 K102 L137 V306 L308 S330 L332	L94-L98 WeakPolarHBondContact O-CB 3.38Å; L94-L98 PolarHBondContact O-N 3.28Å; I95-L98 WeakPolarHBondContact O-CB 3.46Å; I95-L98 PolarHBondContact O-N 3.45Å; E96-L98 PolarHBondContact O-N 3.49Å; L98-H100 VanDerWaalsContact C-N 3.28Å; L98-H100 PolarHBondContact O-N 2.88Å; L98-C101 PolarHBondContact O-N 3.34Å; L98-K102 WeakPolarHBondContact CA-O 3.22Å; L98-L137 HydrophobicContact CD2-CD1 4.18Å; L98-L137 HydrophobicContact CD2-CD2 4.16Å; L98-V306 HydrophobicContact CD2-CG1 4.37Å; L98-L308 HydrophobicContact CD1-CB 4.26Å; L98-L308 HydrophobicContact CD2-CB 4.42Å; L98-L308 HydrophobicContact CG-CB 4.11Å; L98-L308 HydrophobicContact CG-CD2 4.22Å; L98-S330 WeakPolarHBondContact CD1-OG 3.45Å; L98-S330 WeakPolarHBondContact O-CB 3.34Å; L98-S330 PolarHBondContact O-OG 2.92Å; L98-L332 HydrophobicContact CD1-CB 4.04Å; L98-L332 HydrophobicContact CD2-CB 4.03Å
99	I	92.4	Very high	93.9	Very high	4 Å²	4	20.5 Å²	20.5	2%	0.021	10%	0.102	C	C	.	.	H	α-helix	trans	-63.7	-34.8	176.9	-66.1	167.2	0	0	0	111	I95 E96 D97 C101 L137 I141 F206 V209 L308	I95-I99 HydrophobicContact CG2-CD1 4.36Å; I95-I99 WeakPolarHBondContact O-CG1 3.42Å; I95-I99 PolarHBondContact O-N 3.07Å; E96-I99 PolarHBondContact O-N 2.99Å; D97-I99 VanDerWaalsContact C-N 3.32Å; D97-I99 PolarHBondContact O-N 3.35Å; I99-C101 PolarHBondContact O-N 3.5Å; I99-L137 HydrophobicContact CG1-CD1 4.18Å; I99-I141 HydrophobicContact CG1-CG2 4.39Å; I99-F206 HydrophobicContact CD1-CB 4.26Å; I99-F206 HydrophobicContact CD1-CD1 3.95Å; I99-F206 HydrophobicContact CG2-CD1 4.47Å; I99-V209 HydrophobicContact CD1-CG2 4.4Å; I99-V209 HydrophobicContact CG2-CB 4.46Å; I99-V209 HydrophobicContact CG2-CG1 4.38Å; I99-V209 HydrophobicContact CG2-CG2 4.16Å; I99-L308 HydrophobicContact CG1-CD2 4.4Å
100	H	89.8	Confident	93.8	Very high	81 Å²	81	18 Å²	18	38%	0.375	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	28.8	175	-64.8	97.7	0	0	0	114	E96 D97 L98 K102 F206	E96-H100 PolarHBondContact O-N 2.95Å; E96-H100 VanDerWaalsContact O-N 3.13Å; E96-H100 PolarHBondContact O-ND1 3.34Å; D97-H100 CarbonylContact O-C 3.54Å; D97-H100 WeakPolarHBondContact O-CA 3.43Å; D97-H100 PolarHBondContact O-N 2.94Å; L98-H100 VanDerWaalsContact C-N 3.28Å; L98-H100 PolarHBondContact O-N 2.88Å; H100-K102 VanDerWaalsContact C-N 3.26Å; H100-K102 PolarHBondContact O-N 3.32Å; H100-F206 AromaticContact CE1-CE1 3.37Å; H100-F206 WeakPolarHBondContact CE1-CE1 3.24Å; H100-F206 AromaticContact CE1-CZ 3.47Å; H100-F206 VanDerWaalsContact CE1-CZ 3.47Å; H100-F206 WeakPolarHBondContact CE1-CZ 3.07Å
101	C	89.7	Confident	93.5	Very high	22 Å²	22	18 Å²	18	15%	0.149	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	25.2	177.5	-65.9	0	0	0	0	115.5	D97 L98 I99 Q310 N328	D97-C101 PolarHBondContact O-N 3.01Å; L98-C101 PolarHBondContact O-N 3.34Å; I99-C101 PolarHBondContact O-N 3.5Å; C101-Q310 PolarHBondContact SG-OE1 3.03Å; C101-N328 HydrophobicContact CB-CB 4.34Å; C101-N328 WeakPolarHBondContact SG-CB 3.4Å
102	K	90.3	Very high	93.1	Very high	34 Å²	34	19.1 Å²	19.1	15%	0.148	10%	0.095	C	C	.	.			trans	-106.3	138.9	177.5	-63.1	169.5	-179	168.2	0	110.7	D97 L98 H100 P440 D442	D97-K102 HydrophobicContact CB-CB 3.91Å; D97-K102 HydrophobicContact CB-CD 4.31Å; D97-K102 WeakPolarHBondContact O-CA 2.86Å; D97-K102 WeakPolarHBondContact O-CB 3.43Å; D97-K102 PolarHBondContact O-N 2.74Å; L98-K102 WeakPolarHBondContact CA-O 3.22Å; H100-K102 VanDerWaalsContact C-N 3.26Å; H100-K102 PolarHBondContact O-N 3.32Å; K102-P440 HydrophobicContact CB-CB 4.16Å; K102-P440 HydrophobicContact CD-CB 4.03Å; K102-P440 HydrophobicContact CG-CB 3.81Å; K102-D442 WeakPolarHBondContact CE-OD1 3.4Å; K102-D442 IonicContact NZ-OD1 2.65Å; K102-D442 PolarHBondContact NZ-OD1 2.79Å
103	N	92.4	Very high	92.5	Very high	30 Å²	30	17.5 Å²	17.5	16%	0.16	10%	0.099	C	C	.	.			trans	-78.5	147.2	177.5	-63.5	-27	0	0	0	111.2	S330 Q331 Y399 E403 G404 K405	N103-S330 WeakPolarHBondContact OD1-CA 3.29Å; N103-Q331 CarbonylContact C-O 3.32Å; N103-Q331 VanDerWaalsContact CA-O 3.28Å; N103-Q331 WeakPolarHBondContact CA-O 3.33Å; N103-Q331 PolarHBondContact OD1-N 3.41Å; N103-Y399 HydrophobicContact CB-CD1 4.47Å; N103-Y399 HydrophobicContact CB-CE1 3.72Å; N103-E403 WeakPolarHBondContact CB-O 3.45Å; N103-G404 CarbonylContact O-C 3.51Å; N103-G404 WeakPolarHBondContact O-CA 3.29Å; N103-K405 PolarHBondContact O-N 3.4Å
104	G	94.3	Very high	92.3	Very high	1 Å²	1	15.7 Å²	15.7	1%	0.01	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	142.7	178.7	0	0	0	0	0	111.8	Q331 L332 C333 K405	G104-Q331 PolarHBondContact N-O 3.44Å; G104-L332 WeakPolarHBondContact O-CA 3.3Å; G104-C333 PolarHBondContact O-N 2.92Å; G104-K405 WeakPolarHBondContact CA-O 3.44Å
105	L	96	Very high	92.1	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	123.5	176.3	177.3	59.8	0	0	0	109.5	F107 C333 V335 F396 Y399 F400 K405 V406 R407	L105-F107 HydrophobicContact CD1-CE1 3.94Å; L105-F107 HydrophobicContact CD1-CE2 4.03Å; L105-F107 HydrophobicContact CD1-CZ 3.69Å; L105-F107 HydrophobicContact CD2-CD2 4.48Å; L105-F107 HydrophobicContact CD2-CE1 4.35Å; L105-F107 HydrophobicContact CD2-CE2 3.38Å; L105-F107 HydrophobicContact CD2-CZ 3.32Å; L105-F107 HydrophobicContact CG-CD2 4.09Å; L105-F107 HydrophobicContact CG-CE1 4.25Å; L105-F107 HydrophobicContact CG-CE2 3.41Å; L105-F107 VanDerWaalsContact CG-CE2 3.41Å; L105-F107 HydrophobicContact CG-CZ 3.53Å; L105-C333 HydrophobicContact CD1-CB 3.6Å; L105-V335 HydrophobicContact CD1-CG2 3.77Å; L105-F396 HydrophobicContact CD1-CD1 3.62Å; L105-F396 HydrophobicContact CD1-CE1 3.61Å; L105-F396 HydrophobicContact CD1-CG 4.18Å; L105-F396 HydrophobicContact CD1-CZ 4.15Å; L105-F396 HydrophobicContact CD2-CB 3.88Å; L105-F396 HydrophobicContact CD2-CD1 3.87Å; L105-F396 HydrophobicContact CD2-CG 3.93Å; L105-F396 HydrophobicContact CG-CD1 4.42Å; L105-Y399 HydrophobicContact CB-CD1 3.53Å; L105-Y399 HydrophobicContact CB-CE1 3.87Å; L105-Y399 HydrophobicContact CB-CG 3.93Å; L105-Y399 VanDerWaalsContact CD2-CB 3.45Å; L105-Y399 HydrophobicContact CD2-CD1 4.09Å; L105-Y399 HydrophobicContact CD2-CD2 3.96Å; L105-Y399 HydrophobicContact CD2-CG 3.59Å; L105-Y399 HydrophobicContact CG-CD1 4.45Å; L105-Y399 HydrophobicContact CG-CG 4.39Å; L105-F400 HydrophobicContact CD2-CE1 4.29Å; L105-K405 PolarHBondContact N-O 2.92Å; L105-V406 HydrophobicContact CB-CG2 4.47Å; L105-V406 HydrophobicContact CD2-CG1 4.4Å; L105-V406 HydrophobicContact CD2-CG2 4.38Å; L105-V406 CarbonylContact O-C 3.58Å; L105-V406 WeakPolarHBondContact O-CA 3.46Å; L105-R407 PolarHBondContact O-N 3.26Å
106	L	97.4	Very high	91.9	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	121.1	-179.7	-171.9	150.3	0	0	0	110.2	V90 A91 L94 M120 L129 C333 L334 V335 R407	V90-L106 HydrophobicContact CG1-CD1 3.7Å; A91-L106 HydrophobicContact CB-CD1 4.36Å; L94-L106 HydrophobicContact CD1-CB 3.97Å; L94-L106 HydrophobicContact CD1-CD1 3.78Å; L94-L106 HydrophobicContact CD1-CG 4.44Å; L106-M120 HydrophobicContact CD2-CE 3.71Å; L106-L129 HydrophobicContact CD1-CD1 4.07Å; L106-L129 HydrophobicContact CD2-CD1 3.72Å; L106-C333 PolarHBondContact N-O 3.11Å; L106-L334 HydrophobicContact CB-CD2 3.93Å; L106-L334 HydrophobicContact CD1-CD2 4.49Å; L106-L334 HydrophobicContact CD2-CD2 4.34Å; L106-L334 HydrophobicContact CG-CD2 4.48Å; L106-V335 PolarHBondContact O-N 2.94Å; L106-R407 WeakPolarHBondContact CA-O 3.33Å
107	F	95.1	Very high	91.7	Very high	7 Å²	7	17 Å²	17	3%	0.031	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	140.1	176.6	-60	-77.9	0	0	0	111.6	L105 V335 L337 F396 F400 V406 R407 M408 V409	L105-F107 HydrophobicContact CD1-CE1 3.94Å; L105-F107 HydrophobicContact CD1-CE2 4.03Å; L105-F107 HydrophobicContact CD1-CZ 3.69Å; L105-F107 HydrophobicContact CD2-CD2 4.48Å; L105-F107 HydrophobicContact CD2-CE1 4.35Å; L105-F107 HydrophobicContact CD2-CE2 3.38Å; L105-F107 HydrophobicContact CD2-CZ 3.32Å; L105-F107 HydrophobicContact CG-CD2 4.09Å; L105-F107 HydrophobicContact CG-CE1 4.25Å; L105-F107 HydrophobicContact CG-CE2 3.41Å; L105-F107 VanDerWaalsContact CG-CE2 3.41Å; L105-F107 HydrophobicContact CG-CZ 3.53Å; F107-V335 WeakPolarHBondContact CA-O 3.4Å; F107-V335 HydrophobicContact CD1-CB 3.57Å; F107-V335 HydrophobicContact CD1-CG1 3.73Å; F107-V335 HydrophobicContact CD1-CG2 4.01Å; F107-V335 HydrophobicContact CE1-CB 4Å; F107-V335 HydrophobicContact CE1-CG1 4.01Å; F107-V335 HydrophobicContact CE1-CG2 3.96Å; F107-L337 HydrophobicContact CB-CD1 4.24Å; F107-L337 HydrophobicContact CD1-CD1 4Å; F107-L337 HydrophobicContact CD1-CD2 4.22Å; F107-L337 HydrophobicContact CD1-CG 4.15Å; F107-L337 HydrophobicContact CG-CD1 4.42Å; F107-F396 AromaticContact CE1-CD2 3.84Å; F107-F396 HydrophobicContact CE1-CD2 3.84Å; F107-F396 AromaticContact CE1-CE2 3.91Å; F107-F396 HydrophobicContact CE1-CE2 3.91Å; F107-F396 HydrophobicContact CE1-CG 4.46Å; F107-F396 HydrophobicContact CZ-CB 4.49Å; F107-F396 AromaticContact CZ-CD2 3.94Å; F107-F396 HydrophobicContact CZ-CD2 3.94Å; F107-F396 HydrophobicContact CZ-CE2 4.43Å; F107-F396 HydrophobicContact CZ-CG 4.18Å; F107-F400 AromaticContact CE2-CE1 3.94Å; F107-F400 HydrophobicContact CE2-CE1 3.94Å; F107-F400 HydrophobicContact CE2-CZ 4.01Å; F107-F400 HydrophobicContact CZ-CE1 4.16Å; F107-F400 AromaticContact CZ-CZ 3.78Å; F107-F400 HydrophobicContact CZ-CZ 3.78Å; F107-V406 HydrophobicContact CD2-CG1 4.23Å; F107-V406 HydrophobicContact CE2-CG1 3.9Å; F107-R407 PolarHBondContact N-O 3.14Å; F107-M408 HydrophobicContact CB-CG 4.35Å; F107-V409 PolarHBondContact O-N 3.08Å
108	T	96.2	Very high	91.7	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	126	155.3	44.7	0	0	0	0	109.6	T119 M120 V335 D336 L337 V409	T108-T119 HydrophobicContact CG2-CG2 3.79Å; T108-M120 HydrophobicContact CG2-CB 4.36Å; T108-M120 HydrophobicContact CG2-CE 3.98Å; T108-V335 PolarHBondContact N-O 3.3Å; T108-V335 PolarHBondContact OG1-O 2.67Å; T108-D336 WeakPolarHBondContact OG1-CA 3.36Å; T108-D336 PolarHBondContact OG1-OD1 3.46Å; T108-L337 WeakPolarHBondContact O-CB 3.37Å; T108-L337 PolarHBondContact O-N 3.11Å; T108-V409 CarbonylContact C-O 3.54Å; T108-V409 WeakPolarHBondContact CA-O 3.5Å; T108-V409 HydrophobicContact CG2-CB 4.31Å
109	Y	94.7	Very high	91.8	Very high	21 Å²	21	20.2 Å²	20.2	8%	0.082	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	147.3	-177.3	-178.5	-103.2	0	0	0	111	L337 S340 L363 M408 V409 V410 C411 V425 F428	Y109-L337 HydrophobicContact CD2-CD1 3.94Å; Y109-S340 WeakPolarHBondContact OH-CB 3.47Å; Y109-L363 HydrophobicContact CD2-CD2 4.36Å; Y109-L363 HydrophobicContact CE2-CD1 4.26Å; Y109-L363 HydrophobicContact CE2-CD2 4.04Å; Y109-M408 HydrophobicContact CG-SD 4.42Å; Y109-V409 PolarHBondContact N-O 3.45Å; Y109-V410 CarbonylContact O-C 3.6Å; Y109-V410 WeakPolarHBondContact O-CA 3.36Å; Y109-C411 PolarHBondContact O-N 3.44Å; Y109-V425 HydrophobicContact CD1-CG1 3.98Å; Y109-V425 HydrophobicContact CE1-CB 4.16Å; Y109-V425 HydrophobicContact CE1-CG1 3.83Å; Y109-V425 HydrophobicContact CE1-CG2 3.87Å; Y109-F428 HydrophobicContact CD1-CD1 4.04Å; Y109-F428 HydrophobicContact CD1-CE1 4.28Å; Y109-F428 AromaticContact CE1-CD1 3.49Å; Y109-F428 HydrophobicContact CE1-CD1 3.49Å; Y109-F428 VanDerWaalsContact CE1-CD1 3.49Å; Y109-F428 HydrophobicContact CE1-CE1 4.04Å; Y109-F428 HydrophobicContact CE2-CD1 4.44Å; Y109-F428 HydrophobicContact CE2-CE1 4.35Å; Y109-F428 AromaticContact CZ-CD1 3.71Å
110	G	92.4	Very high	91.8	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.114	C	C	.	.	S	Bend	trans	148.6	177.5	-179.4	0	0	0	0	0	113.1	K116 S340 C411	G110-K116 PolarHBondContact O-NZ 2.91Å; G110-S340 PolarHBondContact O-N 2.94Å; G110-S340 PolarHBondContact O-OG 3.32Å; G110-C411 WeakPolarHBondContact CA-O 3.32Å
111	V	88.7	Confident	91.9	Very high	2 Å²	2	17 Å²	17	1%	0.012	10%	0.1	C	C	.	.	S	Bend	trans	-70.1	158	179.2	-60.9	0	0	0	0	111.9	G113 S114 K116 S340 N413 E421 V425	V111-G113 PolarHBondContact O-N 2.86Å; V111-S114 VanDerWaalsContact O-CB 3.27Å; V111-S114 WeakPolarHBondContact O-CB 3.47Å; V111-S114 PolarHBondContact O-N 3.37Å; V111-S114 PolarHBondContact O-OG 3.18Å; V111-K116 PolarHBondContact O-NZ 2.84Å; V111-S340 PolarHBondContact N-OG 2.8Å; V111-N413 HydrophobicContact CG2-CB 4.45Å; V111-E421 HydrophobicContact CG1-CB 3.55Å; V111-E421 HydrophobicContact CG1-CG 4.45Å; V111-V425 HydrophobicContact CG1-CG2 4.31Å
112	T	86.3	Confident	91.9	Very high	24 Å²	24	16.8 Å²	16.8	15%	0.147	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	137.4	170.9	-68.4	0	0	0	0	111	S114 E296 S298 E341	T112-S114 VanDerWaalsContact C-N 3.27Å; T112-S114 PolarHBondContact O-N 3.41Å; T112-E296 WeakPolarHBondContact CG2-OE1 3.38Å; T112-S298 WeakPolarHBondContact OG1-CB 3.33Å; T112-E341 WeakPolarHBondContact CB-OE1 3.35Å; T112-E341 PolarHBondContact N-OE2 3.43Å; T112-E341 PolarHBondContact OG1-OE1 3.26Å; T112-E341 PolarHBondContact OG1-OE2 3.37Å
113	G	83.1	Confident	91.7	Very high	38 Å²	38	17.1 Å²	17.1	39%	0.392	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	-0.1	-173.3	0	0	0	0	0	115	R31 V111 G115	R31-G113 WeakPolarHBondContact CD-O 3.38Å; R31-G113 PolarHBondContact NH1-O 2.97Å; V111-G113 PolarHBondContact O-N 2.86Å; G113-G115 PolarHBondContact O-N 2.97Å
114	S	88.9	Confident	91.1	Very high	3 Å²	3	18.5 Å²	18.5	2%	0.021	12%	0.119	C	C	.	.	S	Bend	trans	-76	-2.5	178.4	74.6	0	0	0	0	115.4	V111 T112 C411	V111-S114 VanDerWaalsContact O-CB 3.27Å; V111-S114 WeakPolarHBondContact O-CB 3.47Å; V111-S114 PolarHBondContact O-N 3.37Å; V111-S114 PolarHBondContact O-OG 3.18Å; T112-S114 VanDerWaalsContact C-N 3.27Å; T112-S114 PolarHBondContact O-N 3.41Å; S114-C411 WeakPolarHBondContact CB-O 3.3Å; S114-C411 WeakPolarHBondContact O-CB 3.47Å; S114-C411 VanDerWaalsContact OG-CB 3.29Å; S114-C411 WeakPolarHBondContact OG-CB 3.44Å; S114-C411 PolarHBondContact OG-O 3.22Å
115	G	89.9	Confident	90.4	Very high	18 Å²	18	20.7 Å²	20.7	19%	0.186	14%	0.141	C	C	.	.	S	Bend	trans	94.5	18.7	179.5	0	0	0	0	0	115.4	G113 Y118 T119	G113-G115 PolarHBondContact O-N 2.97Å; G115-Y118 PolarHBondContact O-N 3.49Å; G115-T119 WeakPolarHBondContact O-CB 3.49Å; G115-T119 PolarHBondContact O-N 3.38Å; G115-T119 PolarHBondContact O-OG1 3.27Å
116	K	92.6	Very high	89.9	Confident	11 Å²	11	25 Å²	25	5%	0.048	16%	0.161	C	C	.	.	H	α-helix	trans	-54.3	-55.9	174.8	-60.7	-173	-67.7	-77.5	0	113	G110 V111 Y118 T119 M120 D336 L337 C411	G110-K116 PolarHBondContact O-NZ 2.91Å; V111-K116 PolarHBondContact O-NZ 2.84Å; K116-Y118 VanDerWaalsContact C-N 3.33Å; K116-Y118 PolarHBondContact O-N 2.91Å; K116-T119 WeakPolarHBondContact O-CA 3.45Å; K116-T119 WeakPolarHBondContact O-CB 3.42Å; K116-T119 PolarHBondContact O-N 2.72Å; K116-M120 PolarHBondContact O-N 3.42Å; K116-D336 VanDerWaalsContact CB-OD1 3.31Å; K116-D336 WeakPolarHBondContact CB-OD1 3.36Å; K116-L337 WeakPolarHBondContact CE-O 3.35Å; K116-C411 HydrophobicContact CG-CB 4.01Å
117	T	90.3	Very high	89.5	Confident	47 Å²	47	25 Å²	25	29%	0.288	16%	0.161	S	C	.	.	H	α-helix	trans	-65.6	-33.8	-179.8	-51.4	0	0	0	0	112.5	T119 M120 T121 G122 D336	T117-T119 VanDerWaalsContact C-N 3.34Å; T117-M120 PolarHBondContact O-N 3.08Å; T117-T121 WeakPolarHBondContact O-CA 3.32Å; T117-T121 WeakPolarHBondContact O-CB 3.33Å; T117-T121 PolarHBondContact O-N 3.27Å; T117-G122 PolarHBondContact O-N 3.39Å; T117-D336 PolarHBondContact OG1-OD2 2.82Å
118	Y	91.4	Very high	89.4	Confident	81 Å²	81	24.7 Å²	24.7	32%	0.318	16%	0.16	S	C	.	.	H	α-helix	trans	-66.2	-36.7	171.9	174.8	-102.5	0	0	0	111.6	R29 Q83 G115 K116 G122 E126	R29-Y118 VanDerWaalsContact NH2-CE1 3.3Å; Q83-Y118 PolarHBondContact NE2-O 3.2Å; G115-Y118 PolarHBondContact O-N 3.49Å; K116-Y118 VanDerWaalsContact C-N 3.33Å; K116-Y118 PolarHBondContact O-N 2.91Å; Y118-G122 WeakPolarHBondContact O-CA 3.27Å; Y118-G122 PolarHBondContact O-N 3.16Å; Y118-E126 PolarHBondContact OH-OE2 3.38Å
119	T	95.2	Very high	89.4	Confident	1 Å²	1	24.8 Å²	24.8	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-66.8	-46	173.8	-60.9	0	0	0	0	112.1	R29 L86 T108 G115 K116 T117 L129 V409 C411	R29-T119 WeakPolarHBondContact CD-OG1 3.47Å; R29-T119 PolarHBondContact NH1-OG1 2.85Å; L86-T119 HydrophobicContact CD2-CG2 3.62Å; T108-T119 HydrophobicContact CG2-CG2 3.79Å; G115-T119 WeakPolarHBondContact O-CB 3.49Å; G115-T119 PolarHBondContact O-N 3.38Å; G115-T119 PolarHBondContact O-OG1 3.27Å; K116-T119 WeakPolarHBondContact O-CA 3.45Å; K116-T119 WeakPolarHBondContact O-CB 3.42Å; K116-T119 PolarHBondContact O-N 2.72Å; T117-T119 VanDerWaalsContact C-N 3.34Å; T119-L129 HydrophobicContact CG2-CD1 3.83Å; T119-L129 HydrophobicContact CG2-CG 4.37Å; T119-L129 WeakPolarHBondContact O-CG 3.48Å; T119-L129 PolarHBondContact O-N 2.87Å; T119-V409 HydrophobicContact CG2-CG1 3.96Å; T119-C411 PolarHBondContact OG1-SG 2.98Å; T119-C411 VanDerWaalsContact OG1-SG 3.41Å
120	M	94.3	Very high	89.4	Confident	5 Å²	5	23.9 Å²	23.9	3%	0.025	16%	0.157	C	C	.	.	H	α-helix	trans	-72.6	-52.5	-177.8	-173.9	59.6	72.8	0	0	112.4	L106 T108 K116 T117 L129 L130 L334 V335 D336	L106-M120 HydrophobicContact CD2-CE 3.71Å; T108-M120 HydrophobicContact CG2-CB 4.36Å; T108-M120 HydrophobicContact CG2-CE 3.98Å; K116-M120 PolarHBondContact O-N 3.42Å; T117-M120 PolarHBondContact O-N 3.08Å; M120-L129 PolarHBondContact O-N 3.48Å; M120-L130 VanDerWaalsContact O-CB 3.26Å; M120-L130 WeakPolarHBondContact O-CB 3.41Å; M120-L130 PolarHBondContact O-N 3.36Å; M120-L130 HydrophobicContact SD-CB 4.3Å; M120-L334 HydrophobicContact CE-CB 4.25Å; M120-L334 HydrophobicContact SD-CB 3.82Å; M120-V335 WeakPolarHBondContact CE-O 3.36Å; M120-D336 HydrophobicContact CB-CB 4.42Å; M120-D336 HydrophobicContact CG-CB 4.32Å
121	T	91.6	Very high	89.4	Confident	13 Å²	13	23.9 Å²	23.9	8%	0.08	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-43.9	-172.6	-49.7	0	0	0	0	111.8	T117 G128 P131 M197 F279	T117-T121 WeakPolarHBondContact O-CA 3.32Å; T117-T121 WeakPolarHBondContact O-CB 3.33Å; T117-T121 PolarHBondContact O-N 3.27Å; T121-G128 PolarHBondContact O-N 3.1Å; T121-P131 WeakPolarHBondContact O-CG 3.36Å; T121-M197 HydrophobicContact CG2-CE 4.06Å; T121-M197 WeakPolarHBondContact O-CE 3.31Å; T121-F279 HydrophobicContact CG2-CE1 3.75Å; T121-F279 HydrophobicContact CG2-CZ 3.92Å
122	G	89.6	Confident	89.6	Confident	17 Å²	17	25.3 Å²	25.3	18%	0.175	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	85.3	-169.4	-172.1	0	0	0	0	0	113.5	T117 Y118 E126	T117-G122 PolarHBondContact O-N 3.39Å; Y118-G122 WeakPolarHBondContact O-CA 3.27Å; Y118-G122 PolarHBondContact O-N 3.16Å; G122-E126 VanDerWaalsContact CA-O 3.31Å; G122-E126 WeakPolarHBondContact CA-O 3.5Å
123	S	84.8	Confident	90	Very high	40 Å²	40	24.3 Å²	24.3	28%	0.28	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	163.9	172	50.2	0	0	0	0	109.8	G125 E126	S123-G125 PolarHBondContact O-N 2.86Å; S123-E126 PolarHBondContact N-O 2.93Å; S123-E126 CarbonylContact O-C 3.59Å; S123-E126 WeakPolarHBondContact O-CA 3.49Å; S123-E126 PolarHBondContact O-N 2.91Å
124	P	81.5	Confident	90.6	Very high	60 Å²	60	22.5 Å²	22.5	39%	0.39	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	134	168.9	-24.8	35.4	0	0	0	110.4	E126 E193 D196	P124-E126 VanDerWaalsContact C-N 3.26Å; P124-E126 PolarHBondContact O-N 3.45Å; P124-E193 HydrophobicContact CG-CG 3.53Å; P124-D196 HydrophobicContact CB-CB 4.18Å
125	G	79.6	Confident	90.7	Very high	47 Å²	47	23.3 Å²	23.3	49%	0.485	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.4	-28.4	-171.4	0	0	0	0	0	114.5	S123 D196	S123-G125 PolarHBondContact O-N 2.86Å; G125-D196 WeakPolarHBondContact CA-O 3.46Å; G125-D196 PolarHBondContact N-O 3.46Å
126	E	84.5	Confident	90.9	Very high	91 Å²	91	22.5 Å²	22.5	43%	0.425	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	61.6	-171.5	-65.2	-166.8	144.9	0	0	111.3	Q83 Y118 G122 S123 P124 G128	Q83-E126 HydrophobicContact CG-CB 4.1Å; Q83-E126 PolarHBondContact NE2-O 3.49Å; Y118-E126 PolarHBondContact OH-OE2 3.38Å; G122-E126 VanDerWaalsContact CA-O 3.31Å; G122-E126 WeakPolarHBondContact CA-O 3.5Å; S123-E126 PolarHBondContact N-O 2.93Å; S123-E126 CarbonylContact O-C 3.59Å; S123-E126 WeakPolarHBondContact O-CA 3.49Å; S123-E126 PolarHBondContact O-N 2.91Å; P124-E126 VanDerWaalsContact C-N 3.26Å; P124-E126 PolarHBondContact O-N 3.45Å; E126-G128 PolarHBondContact O-N 2.9Å
127	G	89.3	Confident	91.1	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.1	134.6	176.5	0	0	0	0	0	112.1	Q83 R132 M197	Q83-G127 VanDerWaalsContact CB-O 3.27Å; Q83-G127 WeakPolarHBondContact CB-O 3.46Å; G127-R132 PolarHBondContact O-NE 2.91Å; G127-M197 VanDerWaalsContact CA-O 3.29Å; G127-M197 WeakPolarHBondContact CA-O 3.33Å; G127-M197 PolarHBondContact N-O 2.9Å
128	G	93.2	Very high	91.3	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.119	C	C	.	.			trans	-82.3	-157.7	178.7	0	0	0	0	0	114.1	T121 E126 L130 P131 R132	T121-G128 PolarHBondContact O-N 3.1Å; E126-G128 PolarHBondContact O-N 2.9Å; G128-L130 PolarHBondContact O-N 2.92Å; G128-P131 VanDerWaalsContact N-CG 3.33Å; G128-P131 WeakPolarHBondContact O-CD 3.31Å; G128-P131 WeakPolarHBondContact O-CG 3.39Å; G128-R132 WeakPolarHBondContact O-CB 3.37Å; G128-R132 WeakPolarHBondContact O-CG 3.23Å; G128-R132 PolarHBondContact O-N 2.93Å
129	L	95.3	Very high	91.3	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-61.9	-40.9	-176.8	-65.4	175.4	0	0	0	112.7	L86 F87 A91 L106 T119 M120 S133 V409	L86-L129 HydrophobicContact CG-CD2 4.16Å; F87-L129 HydrophobicContact CB-CD2 4.24Å; A91-L129 HydrophobicContact CB-CD2 3.94Å; L106-L129 HydrophobicContact CD1-CD1 4.07Å; L106-L129 HydrophobicContact CD2-CD1 3.72Å; T119-L129 HydrophobicContact CG2-CD1 3.83Å; T119-L129 HydrophobicContact CG2-CG 4.37Å; T119-L129 WeakPolarHBondContact O-CG 3.48Å; T119-L129 PolarHBondContact O-N 2.87Å; M120-L129 PolarHBondContact O-N 3.48Å; L129-S133 WeakPolarHBondContact O-CB 3.39Å; L129-S133 PolarHBondContact O-N 3.39Å; L129-S133 PolarHBondContact O-OG 3.23Å; L129-V409 HydrophobicContact CD1-CG2 4.3Å
130	L	94.6	Very high	91.2	Very high	2 Å²	2	19.1 Å²	19.1	1%	0.01	12%	0.119	C	C	.	.	H	α-helix	trans	-64.9	-55.8	-177.8	-169.5	161.6	0	0	0	113.3	M120 G128 R132 S133 L134 F276 F279 F304 L334	M120-L130 VanDerWaalsContact O-CB 3.26Å; M120-L130 WeakPolarHBondContact O-CB 3.41Å; M120-L130 PolarHBondContact O-N 3.36Å; M120-L130 HydrophobicContact SD-CB 4.3Å; G128-L130 PolarHBondContact O-N 2.92Å; L130-R132 PolarHBondContact O-N 3.3Å; L130-S133 WeakPolarHBondContact O-CB 3.27Å; L130-S133 PolarHBondContact O-N 3.49Å; L130-L134 HydrophobicContact CD2-CD1 3.66Å; L130-L134 HydrophobicContact CD2-CG 4.44Å; L130-L134 PolarHBondContact O-N 3.32Å; L130-L134 VanDerWaalsContact O-N 3.09Å; L130-F276 HydrophobicContact CD2-CD2 4.17Å; L130-F276 HydrophobicContact CD2-CE2 3.35Å; L130-F276 HydrophobicContact CD2-CZ 3.91Å; L130-F279 HydrophobicContact CD1-CD2 3.75Å; L130-F279 HydrophobicContact CD1-CE2 3.51Å; L130-F279 HydrophobicContact CD1-CZ 4.09Å; L130-F279 HydrophobicContact CD2-CD2 4.33Å; L130-F279 HydrophobicContact CD2-CG 4.32Å; L130-F304 HydrophobicContact CD1-CB 3.96Å; L130-F304 HydrophobicContact CD1-CD1 3.88Å; L130-F304 HydrophobicContact CD1-CG 3.9Å; L130-F304 HydrophobicContact CD2-CD1 4.46Å; L130-F304 HydrophobicContact CD2-CE1 4.34Å; L130-F304 HydrophobicContact CG-CD1 4.14Å; L130-F304 HydrophobicContact CG-CE1 4.47Å; L130-L334 HydrophobicContact CB-CD1 3.89Å; L130-L334 HydrophobicContact CD1-CD1 4.34Å; L130-L334 HydrophobicContact CG-CD1 3.76Å
131	P	92.9	Very high	91.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59	-43.3	177.3	17.4	-27.9	0	0	0	113.1	T121 G128 S133 L134 D135 M197 I198 F276	T121-P131 WeakPolarHBondContact O-CG 3.36Å; G128-P131 VanDerWaalsContact N-CG 3.33Å; G128-P131 WeakPolarHBondContact O-CD 3.31Å; G128-P131 WeakPolarHBondContact O-CG 3.39Å; P131-S133 VanDerWaalsContact C-N 3.33Å; P131-S133 PolarHBondContact O-N 2.99Å; P131-L134 PolarHBondContact O-N 3.02Å; P131-D135 WeakPolarHBondContact O-CB 3.4Å; P131-D135 PolarHBondContact O-N 2.61Å; P131-M197 HydrophobicContact CG-CE 4.12Å; P131-I198 HydrophobicContact CB-CD1 4.02Å; P131-I198 HydrophobicContact CB-CG1 3.93Å; P131-F276 HydrophobicContact CB-CD2 4.26Å; P131-F276 HydrophobicContact CB-CE2 3.36Å; P131-F276 HydrophobicContact CB-CZ 3.57Å; P131-F276 HydrophobicContact CG-CE2 4.06Å; P131-F276 HydrophobicContact CG-CZ 3.86Å
132	R	92.9	Very high	91.1	Very high	32 Å²	32	19.9 Å²	19.9	12%	0.121	13%	0.13	C	C	.	.	H	α-helix	trans	-67.5	-34.1	179.8	-65.5	179.7	-175.7	-82.9	-2.1	112.6	F87 G127 G128 L130 M136	F87-R132 HydrophobicContact CB-CB 4.29Å; F87-R132 HydrophobicContact CD1-CB 4.2Å; F87-R132 HydrophobicContact CD2-CB 3.41Å; F87-R132 VanDerWaalsContact CD2-CB 3.41Å; F87-R132 HydrophobicContact CE1-CB 4.43Å; F87-R132 VanDerWaalsContact CE2-C 3.48Å; F87-R132 HydrophobicContact CE2-CB 3.71Å; F87-R132 HydrophobicContact CG-CB 3.69Å; F87-R132 HydrophobicContact CG-CG 4.45Å; F87-R132 HydrophobicContact CZ-CB 4.2Å; G127-R132 PolarHBondContact O-NE 2.91Å; G128-R132 WeakPolarHBondContact O-CB 3.37Å; G128-R132 WeakPolarHBondContact O-CG 3.23Å; G128-R132 PolarHBondContact O-N 2.93Å; L130-R132 PolarHBondContact O-N 3.3Å; R132-M136 WeakPolarHBondContact O-CB 3.42Å; R132-M136 PolarHBondContact O-N 3.26Å
133	S	95.1	Very high	91.1	Very high	3 Å²	3	23 Å²	23	2%	0.021	15%	0.148	C	C	.	.	H	α-helix	trans	-64.5	-44.8	174.3	-67	0	0	0	0	112.1	L129 L130 P131 L137	L129-S133 WeakPolarHBondContact O-CB 3.39Å; L129-S133 PolarHBondContact O-N 3.39Å; L129-S133 PolarHBondContact O-OG 3.23Å; L130-S133 WeakPolarHBondContact O-CB 3.27Å; L130-S133 PolarHBondContact O-N 3.49Å; P131-S133 VanDerWaalsContact C-N 3.33Å; P131-S133 PolarHBondContact O-N 2.99Å; S133-L137 WeakPolarHBondContact O-CB 3.32Å; S133-L137 PolarHBondContact O-N 3.27Å
134	L	94.3	Very high	91.4	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-65.8	-44.4	176.6	-69.8	172.9	0	0	0	111	L130 P131 L137 F138 T272 A275 F276 F304 V306	L130-L134 HydrophobicContact CD2-CD1 3.66Å; L130-L134 HydrophobicContact CD2-CG 4.44Å; L130-L134 PolarHBondContact O-N 3.32Å; L130-L134 VanDerWaalsContact O-N 3.09Å; P131-L134 PolarHBondContact O-N 3.02Å; L134-L137 PolarHBondContact O-N 2.83Å; L134-F138 HydrophobicContact CD2-CE2 4.44Å; L134-F138 VanDerWaalsContact O-CD2 3.25Å; L134-F138 WeakPolarHBondContact O-CD2 3.48Å; L134-F138 PolarHBondContact O-N 3.15Å; L134-T272 HydrophobicContact CB-CG2 4.01Å; L134-A275 HydrophobicContact CD1-CB 3.82Å; L134-A275 HydrophobicContact CD2-CB 3.98Å; L134-A275 HydrophobicContact CG-CB 4.43Å; L134-F276 HydrophobicContact CD1-CD2 3.75Å; L134-F276 HydrophobicContact CD1-CE2 4.08Å; L134-F304 HydrophobicContact CD1-CE1 4.19Å; L134-F304 HydrophobicContact CD1-CZ 4.41Å; L134-F304 HydrophobicContact CD2-CE1 4.28Å; L134-V306 HydrophobicContact CD2-CG1 4.48Å; L134-V306 HydrophobicContact CD2-CG2 3.83Å
135	D	92.7	Very high	91.9	Very high	19 Å²	19	21.9 Å²	21.9	10%	0.102	13%	0.132	C	C	.	.	H	α-helix	trans	-57.8	-53.1	178	-172.3	54.8	0	0	0	111.8	P131 L137 F138 N139 I198 T272	P131-D135 WeakPolarHBondContact O-CB 3.4Å; P131-D135 PolarHBondContact O-N 2.61Å; D135-L137 VanDerWaalsContact C-N 3.3Å; D135-L137 PolarHBondContact O-N 3.14Å; D135-F138 PolarHBondContact O-N 3.28Å; D135-N139 VanDerWaalsContact CG-ND2 3.25Å; D135-N139 VanDerWaalsContact O-CB 3.3Å; D135-N139 WeakPolarHBondContact O-CB 3.2Å; D135-N139 PolarHBondContact O-N 3.11Å; D135-N139 PolarHBondContact O-ND2 3.05Å; D135-N139 VanDerWaalsContact O-ND2 3.09Å; D135-N139 PolarHBondContact OD1-ND2 2.94Å; D135-N139 VanDerWaalsContact OD1-ND2 3.08Å; D135-N139 PolarHBondContact OD2-ND2 2.66Å; D135-N139 VanDerWaalsContact OD2-ND2 3.15Å; D135-I198 HydrophobicContact CB-CD1 4.34Å; D135-I198 HydrophobicContact CB-CG2 4.15Å; D135-T272 HydrophobicContact CB-CG2 4.09Å
136	M	94.1	Very high	92.4	Very high	1 Å²	1	20 Å²	20	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-59.1	-41.4	177.4	-178.2	-175.6	169.6	0	0	112.2	F87 K92 I95 E96 R132 S140 C204 F206	F87-M136 HydrophobicContact CE1-SD 4.09Å; F87-M136 HydrophobicContact CZ-CB 3.85Å; F87-M136 HydrophobicContact CZ-CG 4.33Å; F87-M136 HydrophobicContact CZ-SD 3.59Å; F87-M136 VanDerWaalsContact CZ-SD 3.59Å; K92-M136 HydrophobicContact CB-SD 4.42Å; K92-M136 HydrophobicContact CG-CE 3.83Å; K92-M136 HydrophobicContact CG-SD 3.95Å; I95-M136 HydrophobicContact CB-CE 4.15Å; I95-M136 HydrophobicContact CB-SD 3.88Å; I95-M136 HydrophobicContact CG1-SD 4.09Å; I95-M136 HydrophobicContact CG2-CB 4.46Å; I95-M136 HydrophobicContact CG2-CE 4.3Å; I95-M136 HydrophobicContact CG2-CG 4.1Å; I95-M136 HydrophobicContact CG2-SD 4.08Å; E96-M136 HydrophobicContact CG-CE 3.86Å; R132-M136 WeakPolarHBondContact O-CB 3.42Å; R132-M136 PolarHBondContact O-N 3.26Å; M136-S140 WeakPolarHBondContact O-CB 3.34Å; M136-S140 PolarHBondContact O-N 3.4Å; M136-S140 PolarHBondContact O-OG 3.41Å; M136-C204 WeakPolarHBondContact CA-O 3.17Å; M136-C204 HydrophobicContact CB-CB 4.37Å; M136-C204 HydrophobicContact CG-CB 4.25Å; M136-F206 HydrophobicContact CE-CB 3.81Å
137	L	95.4	Very high	92.6	Very high	2 Å²	2	23 Å²	23	1%	0.01	12%	0.124	C	C	.	.	H	α-helix	trans	-60.1	-54.2	179.1	177.2	62.1	0	0	0	111.2	I95 L98 I99 S133 L134 D135 S140 I141 V217 V306 L308	I95-L137 HydrophobicContact CG2-CB 4.16Å; I95-L137 HydrophobicContact CG2-CD1 4.46Å; L98-L137 HydrophobicContact CD2-CD1 4.18Å; L98-L137 HydrophobicContact CD2-CD2 4.16Å; I99-L137 HydrophobicContact CG1-CD1 4.18Å; S133-L137 WeakPolarHBondContact O-CB 3.32Å; S133-L137 PolarHBondContact O-N 3.27Å; L134-L137 PolarHBondContact O-N 2.83Å; D135-L137 VanDerWaalsContact C-N 3.3Å; D135-L137 PolarHBondContact O-N 3.14Å; L137-S140 WeakPolarHBondContact O-CB 3.39Å; L137-S140 PolarHBondContact O-N 2.84Å; L137-I141 HydrophobicContact CD1-CD1 4.27Å; L137-I141 HydrophobicContact CD1-CG2 4.19Å; L137-I141 HydrophobicContact CG-CD1 4.27Å; L137-I141 WeakPolarHBondContact O-CG1 3.25Å; L137-I141 PolarHBondContact O-N 3.04Å; L137-V217 HydrophobicContact CD2-CG1 4.15Å; L137-V217 HydrophobicContact CD2-CG2 4.05Å; L137-V306 HydrophobicContact CD2-CG1 3.6Å; L137-L308 HydrophobicContact CD1-CD1 4.48Å; L137-L308 HydrophobicContact CD1-CD2 4.38Å
138	F	94.5	Very high	92.6	Very high	10 Å²	10	26.4 Å²	26.4	4%	0.044	14%	0.137	C	C	.	.	H	α-helix	trans	-68.6	-35.7	-176.9	-77.8	-70.2	0	0	0	112.9	L134 D135 S140 G142 V217 V269 S271 T272 A275	L134-F138 HydrophobicContact CD2-CE2 4.44Å; L134-F138 VanDerWaalsContact O-CD2 3.25Å; L134-F138 WeakPolarHBondContact O-CD2 3.48Å; L134-F138 PolarHBondContact O-N 3.15Å; D135-F138 PolarHBondContact O-N 3.28Å; F138-S140 PolarHBondContact O-N 2.8Å; F138-G142 WeakPolarHBondContact O-CA 3.41Å; F138-G142 PolarHBondContact O-N 3.22Å; F138-V217 HydrophobicContact CE1-CB 4.16Å; F138-V217 HydrophobicContact CE1-CG2 3.95Å; F138-V217 HydrophobicContact CZ-CB 3.96Å; F138-V217 HydrophobicContact CZ-CG1 4.03Å; F138-V217 HydrophobicContact CZ-CG2 4.1Å; F138-V269 HydrophobicContact CZ-CB 4.29Å; F138-V269 HydrophobicContact CZ-CG2 3.84Å; F138-S271 VanDerWaalsContact CE2-C 3.46Å; F138-S271 WeakPolarHBondContact CE2-O 3.34Å; F138-T272 VanDerWaalsContact CD2-N 3.28Å; F138-A275 HydrophobicContact CE2-CB 3.95Å; F138-A275 HydrophobicContact CZ-CB 4.49Å
139	N	92.6	Very high	92.3	Very high	58 Å²	58	27.4 Å²	27.4	31%	0.31	14%	0.141	S	C	.	.	H	α-helix	trans	-63.6	-31.3	173.3	-69.9	-26.7	0	0	0	112.1	D135 K205	D135-N139 VanDerWaalsContact CG-ND2 3.25Å; D135-N139 VanDerWaalsContact O-CB 3.3Å; D135-N139 WeakPolarHBondContact O-CB 3.2Å; D135-N139 PolarHBondContact O-N 3.11Å; D135-N139 PolarHBondContact O-ND2 3.05Å; D135-N139 VanDerWaalsContact O-ND2 3.09Å; D135-N139 PolarHBondContact OD1-ND2 2.94Å; D135-N139 VanDerWaalsContact OD1-ND2 3.08Å; D135-N139 PolarHBondContact OD2-ND2 2.66Å; D135-N139 VanDerWaalsContact OD2-ND2 3.15Å; N139-K205 HydrophobicContact CB-CB 4.45Å; N139-K205 WeakPolarHBondContact O-CD 3.46Å; N139-K205 VanDerWaalsContact O-CE 3.31Å; N139-K205 WeakPolarHBondContact O-CE 3.4Å; N139-K205 WeakPolarHBondContact O-CG 3.25Å
140	S	93.3	Very high	92	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-77	-52.1	177.9	-53.8	0	0	0	0	112.1	M136 L137 F138 F206	M136-S140 WeakPolarHBondContact O-CB 3.34Å; M136-S140 PolarHBondContact O-N 3.4Å; M136-S140 PolarHBondContact O-OG 3.41Å; L137-S140 WeakPolarHBondContact O-CB 3.39Å; L137-S140 PolarHBondContact O-N 2.84Å; F138-S140 PolarHBondContact O-N 2.8Å; S140-F206 WeakPolarHBondContact OG-CB 3.25Å; S140-F206 PolarHBondContact OG-N 2.85Å
141	I	93.4	Very high	91.9	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-87.3	-6.1	-172.9	71.4	-179.9	0	0	0	114.4	I99 L137 F144 Q145 Y215 V217 L308	I99-I141 HydrophobicContact CG1-CG2 4.39Å; L137-I141 HydrophobicContact CD1-CD1 4.27Å; L137-I141 HydrophobicContact CD1-CG2 4.19Å; L137-I141 HydrophobicContact CG-CD1 4.27Å; L137-I141 WeakPolarHBondContact O-CG1 3.25Å; L137-I141 PolarHBondContact O-N 3.04Å; I141-F144 CarbonylContact O-C 3.59Å; I141-F144 WeakPolarHBondContact O-CA 3.32Å; I141-F144 PolarHBondContact O-N 2.92Å; I141-Q145 HydrophobicContact CD1-CG 4.33Å; I141-Q145 HydrophobicContact CG1-CG 4.04Å; I141-Q145 PolarHBondContact O-N 3.46Å; I141-Y215 HydrophobicContact CB-CD2 4.46Å; I141-Y215 HydrophobicContact CB-CG 4.34Å; I141-Y215 HydrophobicContact CG2-CD1 4.4Å; I141-Y215 HydrophobicContact CG2-CG 4.27Å; I141-V217 HydrophobicContact CD1-CG2 3.41Å; I141-V217 VanDerWaalsContact CD1-CG2 3.41Å; I141-L308 HydrophobicContact CD1-CD1 3.99Å
142	G	89.9	Confident	91.7	Very high	34 Å²	34	31.9 Å²	31.9	35%	0.351	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-40.9	-55.2	-171.7	0	0	0	0	0	115.7	F138 F144	F138-G142 WeakPolarHBondContact O-CA 3.41Å; F138-G142 PolarHBondContact O-N 3.22Å; G142-F144 PolarHBondContact O-N 3.11Å
143	P	88.4	Confident	91.5	Very high	83 Å²	83	32.4 Å²	32.4	54%	0.539	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-66.7	-16	-179.4	-21.5	34	0	0	0	115.3
144	F	90.9	Very high	91.1	Very high	26 Å²	26	34 Å²	34	11%	0.114	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-111.9	8.4	-170.3	-51.3	-70.7	0	0	0	112.6	I141 G142 V209 E211 C214 Y215 R453	I141-F144 CarbonylContact O-C 3.59Å; I141-F144 WeakPolarHBondContact O-CA 3.32Å; I141-F144 PolarHBondContact O-N 2.92Å; G142-F144 PolarHBondContact O-N 3.11Å; F144-V209 HydrophobicContact CD2-CB 4.44Å; F144-V209 HydrophobicContact CD2-CG1 3.79Å; F144-V209 HydrophobicContact CE2-CB 4.4Å; F144-V209 HydrophobicContact CE2-CG1 4.21Å; F144-E211 HydrophobicContact CD1-CB 4.3Å; F144-E211 VanDerWaalsContact CE1-CA 3.47Å; F144-E211 HydrophobicContact CE1-CB 3.54Å; F144-E211 HydrophobicContact CE1-CG 3.82Å; F144-E211 HydrophobicContact CE2-CG 4.41Å; F144-E211 HydrophobicContact CZ-CB 3.86Å; F144-E211 HydrophobicContact CZ-CG 3.57Å; F144-C214 WeakPolarHBondContact O-CA 2.95Å; F144-Y215 HydrophobicContact CB-CD2 3.56Å; F144-Y215 HydrophobicContact CB-CE2 3.77Å; F144-Y215 HydrophobicContact CG-CE2 4.45Å; F144-Y215 PolarHBondContact O-N 3.48Å; F144-R453 VanDerWaalsContact CD1-NH1 3.25Å
145	Q	93.1	Very high	90.5	Very high	50 Å²	50	42.7 Å²	42.7	23%	0.234	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	-70.8	133.1	179.1	-67.7	-166.1	52.1	0	0	112.1	I141 Y215 K270	I141-Q145 HydrophobicContact CD1-CG 4.33Å; I141-Q145 HydrophobicContact CG1-CG 4.04Å; I141-Q145 PolarHBondContact O-N 3.46Å; Q145-Y215 WeakPolarHBondContact CA-O 3.46Å; Q145-K270 PolarHBondContact NE2-O 2.95Å; Q145-K270 PolarHBondContact OE1-O 3.35Å
146	A	90.4	Very high	90.1	Very high	8 Å²	8	49.2 Å²	49.2	7%	0.066	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-71	154.7	169.3	0	0	0	0	0	111.4	V150 F151 C214 Y215 K270 I320	A146-V150 HydrophobicContact CB-CB 4.2Å; A146-V150 HydrophobicContact CB-CG1 4.33Å; A146-F151 HydrophobicContact CB-CD2 3.86Å; A146-F151 HydrophobicContact CB-CE2 3.57Å; A146-C214 HydrophobicContact CB-CB 4.32Å; A146-Y215 PolarHBondContact N-O 3.24Å; A146-K270 WeakPolarHBondContact O-CE 3.34Å; A146-K270 PolarHBondContact O-NZ 3.01Å; A146-I320 HydrophobicContact CB-CD1 4.13Å
147	K	89	Confident	89.6	Confident	152 Å²	152	50 Å²	50	66%	0.661	25%	0.249	S	C	*	.	P	Polyproline II helix	trans	-63.2	152.2	170.3	-60.6	178.8	-178	173.6	0	110.2	V150 R171	K147-V150 HydrophobicContact CB-CG2 4.27Å; K147-V150 WeakPolarHBondContact O-CB 3.41Å; K147-V150 WeakPolarHBondContact O-CG2 3.39Å; K147-V150 PolarHBondContact O-N 3.29Å; K147-R171 VanDerWaalsContact CB-CZ 3.48Å
148	R	88.3	Confident	89.2	Confident	72 Å²	72	50.8 Å²	50.8	27%	0.272	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	148.9	-177.2	-66.3	-171.4	87.3	124	1.3	112.9	V150 R171 E268 K270 E274	R148-V150 PolarHBondContact O-N 3.46Å; R148-R171 PolarHBondContact O-NE 2.56Å; R148-R171 PolarHBondContact O-NH2 3.47Å; R148-E268 WeakPolarHBondContact CA-OE1 3.44Å; R148-E268 WeakPolarHBondContact CA-OE2 3.5Å; R148-E268 WeakPolarHBondContact CB-OE2 3.37Å; R148-E268 PolarHBondContact NH2-O 2.96Å; R148-K270 HydrophobicContact CG-CD 4.35Å; R148-K270 VanDerWaalsContact CG-CE 3.47Å; R148-K270 HydrophobicContact CG-CG 3.98Å; R148-E274 IonicContact CZ-OE1 2.74Å; R148-E274 VanDerWaalsContact CZ-OE1 3.23Å; R148-E274 IonicContact NH1-OE1 2.76Å; R148-E274 PolarHBondContact NH1-OE1 2.82Å; R148-E274 IonicContact NH1-OE2 2.99Å; R148-E274 PolarHBondContact NH1-OE2 3.15Å; R148-E274 IonicContact NH2-OE1 3.08Å; R148-E274 PolarHBondContact NH2-OE1 3.25Å
149	F	87.1	Confident	88.9	Confident	22 Å²	22	50.5 Å²	50.5	10%	0.096	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	0.7	178.5	-49.6	-85.7	0	0	0	116.2	F151 Q162 A167 E170 R171 R174 E268	F149-F151 VanDerWaalsContact C-N 3.27Å; F149-Q162 PolarHBondContact O-NE2 2.94Å; F149-A167 HydrophobicContact CB-CB 4.36Å; F149-E170 HydrophobicContact CB-CB 4.3Å; F149-E170 HydrophobicContact CD1-CB 4.19Å; F149-E170 HydrophobicContact CG-CB 4.18Å; F149-R171 HydrophobicContact CD2-CB 4.38Å; F149-R171 HydrophobicContact CD2-CG 3.35Å; F149-R171 HydrophobicContact CE2-CB 4.49Å; F149-R171 HydrophobicContact CE2-CG 3.75Å; F149-R171 HydrophobicContact CG-CG 4.41Å; F149-R174 HydrophobicContact CE1-CG 4.21Å; F149-R174 VanDerWaalsContact CE1-CZ 3.43Å; F149-R174 HydrophobicContact CZ-CB 4.37Å; F149-R174 HydrophobicContact CZ-CG 3.74Å; F149-R174 VanDerWaalsContact CZ-CZ 3.49Å; F149-E268 PolarHBondContact N-OE1 3.18Å; F149-E268 PolarHBondContact N-OE2 3.06Å
150	V	89.3	Confident	88.8	Confident	13 Å²	13	52 Å²	52	8%	0.079	26%	0.262	C	S	.	.	S	Bend	trans	-64.1	-41.4	169.7	171.3	0	0	0	0	109.7	A146 K147 R148 V161 Q162 A167 I320	A146-V150 HydrophobicContact CB-CB 4.2Å; A146-V150 HydrophobicContact CB-CG1 4.33Å; K147-V150 HydrophobicContact CB-CG2 4.27Å; K147-V150 WeakPolarHBondContact O-CB 3.41Å; K147-V150 WeakPolarHBondContact O-CG2 3.39Å; K147-V150 PolarHBondContact O-N 3.29Å; R148-V150 PolarHBondContact O-N 3.46Å; V150-V161 HydrophobicContact CG1-CG1 4.23Å; V150-V161 CarbonylContact O-C 3.59Å; V150-V161 WeakPolarHBondContact O-CA 3.39Å; V150-Q162 PolarHBondContact O-N 3.01Å; V150-A167 HydrophobicContact CG2-CB 4.16Å; V150-I320 HydrophobicContact CG1-CD1 3.64Å
151	F	91.6	Very high	88.6	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.009	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	137.4	169.3	-67.1	-89.1	0	0	0	109.3	A146 F149 I159 E160 V161 C214 S216 F218 A309 A311 V327	A146-F151 HydrophobicContact CB-CD2 3.86Å; A146-F151 HydrophobicContact CB-CE2 3.57Å; F149-F151 VanDerWaalsContact C-N 3.27Å; F151-I159 HydrophobicContact CB-CG2 3.82Å; F151-I159 HydrophobicContact CD1-CG2 3.61Å; F151-I159 HydrophobicContact CG-CG2 4.2Å; F151-E160 CarbonylContact C-O 3.57Å; F151-E160 WeakPolarHBondContact CA-O 3.41Å; F151-V161 HydrophobicContact CD1-CG2 3.89Å; F151-V161 HydrophobicContact CE1-CG2 3.72Å; F151-C214 HydrophobicContact CE2-CB 4.46Å; F151-S216 VanDerWaalsContact CD2-CB 3.4Å; F151-F218 HydrophobicContact CB-CE2 3.86Å; F151-F218 HydrophobicContact CB-CZ 3.76Å; F151-A309 HydrophobicContact CD1-CB 3.82Å; F151-A309 HydrophobicContact CE1-CB 4.13Å; F151-A309 HydrophobicContact CG-CB 4.22Å; F151-A311 HydrophobicContact CE1-CB 3.62Å; F151-A311 HydrophobicContact CZ-CB 3.65Å; F151-V327 HydrophobicContact CE1-CG1 4.45Å
152	K	89.7	Confident	88.3	Confident	82 Å²	82	54.4 Å²	54.4	36%	0.357	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	127.1	177.6	-173.8	170.6	-179	165.6	0	110.4	D154 I159 E160 Q162 E170	K152-D154 PolarHBondContact O-N 3.49Å; K152-I159 CarbonylContact O-C 3.41Å; K152-I159 WeakPolarHBondContact O-CA 3.31Å; K152-E160 PolarHBondContact N-O 2.96Å; K152-E160 PolarHBondContact O-N 2.9Å; K152-Q162 HydrophobicContact CB-CG 4.15Å; K152-Q162 HydrophobicContact CD-CG 4.44Å; K152-E170 IonicContact NZ-OE1 2.68Å; K152-E170 PolarHBondContact NZ-OE1 3.18Å
153	P	88.9	Confident	88	Confident	43 Å²	43	55.4 Å²	55.4	28%	0.279	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	135.5	170.1	-22	33.7	0	0	0	111.2	I159 F218 E266	P153-I159 HydrophobicContact CB-CD1 4.16Å; P153-I159 HydrophobicContact CG-CD1 4.11Å; P153-F218 HydrophobicContact CG-CD1 3.75Å; P153-F218 HydrophobicContact CG-CE1 3.65Å; P153-F218 HydrophobicContact CG-CG 4.46Å; P153-F218 HydrophobicContact CG-CZ 4.3Å; P153-E266 WeakPolarHBondContact CB-OE2 3.41Å; P153-E266 HydrophobicContact CG-CB 4.08Å; P153-E266 WeakPolarHBondContact CG-OE2 3.16Å
154	D	85.4	Confident	87.6	Confident	35 Å²	35	57.8 Å²	57.8	19%	0.187	28%	0.276	C	S	.	.			trans	-88.9	168	169.9	76.5	25.1	0	0	0	111.2	K152 K156 N157 G158 E160 K324	K152-D154 PolarHBondContact O-N 3.49Å; D154-K156 PolarHBondContact O-N 3.29Å; D154-K156 VanDerWaalsContact O-N 3.13Å; D154-K156 WeakPolarHBondContact OD1-CA 3.34Å; D154-K156 PolarHBondContact OD1-N 3.03Å; D154-N157 PolarHBondContact OD1-N 3.32Å; D154-N157 VanDerWaalsContact OD1-N 3.08Å; D154-G158 VanDerWaalsContact CG-C 3.5Å; D154-G158 VanDerWaalsContact CG-CA 3.45Å; D154-G158 VanDerWaalsContact CG-N 3.35Å; D154-G158 PolarHBondContact N-O 3.39Å; D154-G158 WeakPolarHBondContact OD1-CA 3.34Å; D154-G158 PolarHBondContact OD1-N 3.07Å; D154-G158 VanDerWaalsContact OD2-CA 3.29Å; D154-G158 WeakPolarHBondContact OD2-CA 3.19Å; D154-E160 HydrophobicContact CB-CG 4.31Å; D154-K324 IonicContact OD2-NZ 2.65Å; D154-K324 PolarHBondContact OD2-NZ 3.4Å
155	E	81.7	Confident	87.2	Confident	184 Å²	184	62 Å²	62	86%	0.86	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	0.5	179.8	-60.9	-171.2	165.3	0	0	113.8	Y260	E155-Y260 PolarHBondContact O-OH 2.99Å
156	K	84.4	Confident	86.8	Confident	156 Å²	156	62.9 Å²	62.9	68%	0.678	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.8	30.7	-170.4	-61.2	-179.4	-175.9	172.9	0	112.7	D154 G158	D154-K156 PolarHBondContact O-N 3.29Å; D154-K156 VanDerWaalsContact O-N 3.13Å; D154-K156 WeakPolarHBondContact OD1-CA 3.34Å; D154-K156 PolarHBondContact OD1-N 3.03Å; K156-G158 PolarHBondContact O-N 3.44Å
157	N	85.2	Confident	86.6	Confident	17 Å²	17	62.5 Å²	62.5	9%	0.091	30%	0.302	C	S	.	.	S	Bend	trans	69.9	0.3	177.8	-165.4	39.5	0	0	0	116	D154 D254 Y260 K307	D154-N157 PolarHBondContact OD1-N 3.32Å; D154-N157 VanDerWaalsContact OD1-N 3.08Å; N157-D254 HydrophobicContact CB-CB 4.05Å; N157-D254 PolarHBondContact ND2-OD2 3.12Å; N157-Y260 HydrophobicContact CB-CD1 3.77Å; N157-Y260 HydrophobicContact CB-CD2 3.74Å; N157-Y260 HydrophobicContact CB-CE1 4.12Å; N157-Y260 HydrophobicContact CB-CE2 4.07Å; N157-Y260 HydrophobicContact CB-CG 3.57Å; N157-K307 PolarHBondContact OD1-NZ 2.88Å
158	G	85.9	Confident	86.4	Confident	19 Å²	19	59.5 Å²	59.5	20%	0.196	29%	0.293	C	S	.	.			trans	-87	174.6	173.9	0	0	0	0	0	113	D154 K156	D154-G158 VanDerWaalsContact CG-C 3.5Å; D154-G158 VanDerWaalsContact CG-CA 3.45Å; D154-G158 VanDerWaalsContact CG-N 3.35Å; D154-G158 PolarHBondContact N-O 3.39Å; D154-G158 WeakPolarHBondContact OD1-CA 3.34Å; D154-G158 PolarHBondContact OD1-N 3.07Å; D154-G158 VanDerWaalsContact OD2-CA 3.29Å; D154-G158 WeakPolarHBondContact OD2-CA 3.19Å; K156-G158 PolarHBondContact O-N 3.44Å
159	I	89.1	Confident	86.3	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.021	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	137	173.8	-59.1	-66.4	0	0	0	108.1	F151 K152 P153 F218 K307 A309 V327 V329	F151-I159 HydrophobicContact CB-CG2 3.82Å; F151-I159 HydrophobicContact CD1-CG2 3.61Å; F151-I159 HydrophobicContact CG-CG2 4.2Å; K152-I159 CarbonylContact O-C 3.41Å; K152-I159 WeakPolarHBondContact O-CA 3.31Å; P153-I159 HydrophobicContact CB-CD1 4.16Å; P153-I159 HydrophobicContact CG-CD1 4.11Å; I159-F218 HydrophobicContact CD1-CD2 4.17Å; I159-F218 HydrophobicContact CD1-CE2 4.07Å; I159-K307 HydrophobicContact CD1-CD 4.04Å; I159-K307 HydrophobicContact CG1-CD 4.44Å; I159-A309 HydrophobicContact CB-CB 4.41Å; I159-A309 HydrophobicContact CG1-CB 4.07Å; I159-A309 HydrophobicContact CG2-CB 3.98Å; I159-V327 HydrophobicContact CB-CG1 4.28Å; I159-V327 HydrophobicContact CG2-CG1 4.46Å; I159-V329 HydrophobicContact CB-CG2 4.06Å; I159-V329 HydrophobicContact CG1-CG1 4.49Å; I159-V329 HydrophobicContact CG1-CG2 3.66Å
160	E	89.3	Confident	86.1	Confident	89 Å²	89	61.8 Å²	61.8	42%	0.416	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	141.3	174.7	-66.5	-176.7	172.4	0	0	110.3	F151 K152 D154 K324	F151-E160 CarbonylContact C-O 3.57Å; F151-E160 WeakPolarHBondContact CA-O 3.41Å; K152-E160 PolarHBondContact N-O 2.96Å; K152-E160 PolarHBondContact O-N 2.9Å; D154-E160 HydrophobicContact CB-CG 4.31Å; E160-K324 HydrophobicContact CG-CD 4.08Å; E160-K324 IonicContact OE1-NZ 3.15Å; E160-K324 PolarHBondContact OE1-NZ 3.34Å
161	V	89	Confident	85.8	Confident	18 Å²	18	63.8 Å²	63.8	11%	0.109	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	113.8	174.1	179	0	0	0	0	108	V150 F151 A311 I320 Q322 V327	V150-V161 HydrophobicContact CG1-CG1 4.23Å; V150-V161 CarbonylContact O-C 3.59Å; V150-V161 WeakPolarHBondContact O-CA 3.39Å; F151-V161 HydrophobicContact CD1-CG2 3.89Å; F151-V161 HydrophobicContact CE1-CG2 3.72Å; V161-A311 HydrophobicContact CG2-CB 4.06Å; V161-I320 HydrophobicContact CG1-CG2 3.87Å; V161-I320 HydrophobicContact CG2-CG2 4.43Å; V161-Q322 HydrophobicContact CG1-CG 4.33Å; V161-V327 HydrophobicContact CG2-CG2 3.65Å
162	Q	86.7	Confident	85.4	Confident	33 Å²	33	69.1 Å²	69.1	15%	0.154	34%	0.34	C	S	.	.			trans	-79.5	150.5	175.1	-61.4	-169.4	86.3	0	0	110.5	F149 V150 K152 E170	F149-Q162 PolarHBondContact O-NE2 2.94Å; V150-Q162 PolarHBondContact O-N 3.01Å; K152-Q162 HydrophobicContact CB-CG 4.15Å; K152-Q162 HydrophobicContact CD-CG 4.44Å; Q162-E170 PolarHBondContact NE2-OE2 3.35Å
163	N	84.3	Confident	85.1	Confident	55 Å²	55	71.5 Å²	71.5	29%	0.294	35%	0.351	S	S	.	.			trans	-64.8	160.3	170.1	71.9	43.7	0	0	0	110.4	L165 D166 A167	N163-L165 PolarHBondContact O-N 3.1Å; N163-L165 PolarHBondContact OD1-N 2.82Å; N163-L165 VanDerWaalsContact OD1-N 3.11Å; N163-D166 VanDerWaalsContact CG-OD2 3.26Å; N163-D166 PolarHBondContact ND2-OD2 3.28Å; N163-D166 PolarHBondContact O-N 3.09Å; N163-D166 VanDerWaalsContact OD1-CB 3.3Å; N163-D166 WeakPolarHBondContact OD1-CB 3.4Å; N163-D166 PolarHBondContact OD1-N 2.72Å; N163-D166 PolarHBondContact OD1-OD2 3.25Å; N163-A167 WeakPolarHBondContact O-CB 3.39Å; N163-A167 PolarHBondContact O-N 3.07Å; N163-A167 VanDerWaalsContact O-N 3.11Å
164	Q	80.3	Confident	84.5	Confident	133 Å²	133	75.7 Å²	75.7	62%	0.621	36%	0.361	S	S	*	.	H	α-helix	trans	-63.2	-30.4	-175.5	-69.8	-171.6	1.8	0	0	113.4	L168	Q164-L168 WeakPolarHBondContact O-CB 3.42Å; Q164-L168 PolarHBondContact O-N 3.5Å; Q164-L168 VanDerWaalsContact O-N 3.08Å
165	L	81.6	Confident	83.9	Confident	115 Å²	115	79.3 Å²	79.3	60%	0.602	38%	0.38	S	S	*	.	H	α-helix	trans	-72.4	-47	-177.9	-176.6	62.1	0	0	0	111.3	N163 L168 L169	N163-L165 PolarHBondContact O-N 3.1Å; N163-L165 PolarHBondContact OD1-N 2.82Å; N163-L165 VanDerWaalsContact OD1-N 3.11Å; L165-L168 WeakPolarHBondContact O-CB 3.36Å; L165-L168 PolarHBondContact O-N 2.67Å; L165-L168 VanDerWaalsContact O-N 3.13Å; L165-L169 HydrophobicContact CG-CD1 4.38Å; L165-L169 WeakPolarHBondContact O-CG 3.47Å; L165-L169 PolarHBondContact O-N 3.24Å
166	D	86.3	Confident	83.1	Confident	69 Å²	69	74.4 Å²	74.4	37%	0.369	37%	0.367	S	S	.	.	H	α-helix	trans	-64.2	-43.1	178	-66.9	-20.3	0	0	0	110.7	N163 L168 L169 E170	N163-D166 VanDerWaalsContact CG-OD2 3.26Å; N163-D166 PolarHBondContact ND2-OD2 3.28Å; N163-D166 PolarHBondContact O-N 3.09Å; N163-D166 VanDerWaalsContact OD1-CB 3.3Å; N163-D166 WeakPolarHBondContact OD1-CB 3.4Å; N163-D166 PolarHBondContact OD1-N 2.72Å; N163-D166 PolarHBondContact OD1-OD2 3.25Å; D166-L168 VanDerWaalsContact C-N 3.26Å; D166-L168 PolarHBondContact O-N 3.48Å; D166-L169 PolarHBondContact O-N 2.72Å; D166-E170 PolarHBondContact O-N 2.86Å
167	A	85.5	Confident	82	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-61.1	-35.9	173.8	0	0	0	0	0	112	F149 V150 N163 R171	F149-A167 HydrophobicContact CB-CB 4.36Å; V150-A167 HydrophobicContact CG2-CB 4.16Å; N163-A167 WeakPolarHBondContact O-CB 3.39Å; N163-A167 PolarHBondContact O-N 3.07Å; N163-A167 VanDerWaalsContact O-N 3.11Å; A167-R171 VanDerWaalsContact O-CG 3.29Å; A167-R171 WeakPolarHBondContact O-CG 3.05Å; A167-R171 PolarHBondContact O-N 3.26Å
168	L	85.1	Confident	80.6	Confident	89 Å²	89	79.6 Å²	79.6	47%	0.466	39%	0.393	S	S	.	.	H	α-helix	trans	-71.7	-40.7	176.4	-175.2	141.7	0	0	0	112	Q164 L165 D166 R171 Q172	Q164-L168 WeakPolarHBondContact O-CB 3.42Å; Q164-L168 PolarHBondContact O-N 3.5Å; Q164-L168 VanDerWaalsContact O-N 3.08Å; L165-L168 WeakPolarHBondContact O-CB 3.36Å; L165-L168 PolarHBondContact O-N 2.67Å; L165-L168 VanDerWaalsContact O-N 3.13Å; D166-L168 VanDerWaalsContact C-N 3.26Å; D166-L168 PolarHBondContact O-N 3.48Å; L168-R171 WeakPolarHBondContact O-CB 3.46Å; L168-R171 PolarHBondContact O-N 2.9Å; L168-Q172 PolarHBondContact O-N 2.65Å
169	L	85.1	Confident	78.3	Confident	89 Å²	89	83.4 Å²	83.4	47%	0.466	42%	0.416	S	S	.	.	H	α-helix	trans	-63.6	-41.7	175.3	-71.6	170.9	0	0	0	111.9	L165 D166 Q172 K173	L165-L169 HydrophobicContact CG-CD1 4.38Å; L165-L169 WeakPolarHBondContact O-CG 3.47Å; L165-L169 PolarHBondContact O-N 3.24Å; D166-L169 PolarHBondContact O-N 2.72Å; L169-Q172 PolarHBondContact O-N 2.93Å; L169-K173 WeakPolarHBondContact O-CB 3.36Å; L169-K173 PolarHBondContact O-N 3.44Å
170	E	83.9	Confident	75.9	Confident	53 Å²	53	88.9 Å²	88.9	25%	0.248	45%	0.45	C	S	.	.	H	α-helix	trans	-63.9	-39.7	175.4	-88.8	-170.3	161	0	0	112.4	F149 K152 Q162 D166 K173 R174	F149-E170 HydrophobicContact CB-CB 4.3Å; F149-E170 HydrophobicContact CD1-CB 4.19Å; F149-E170 HydrophobicContact CG-CB 4.18Å; K152-E170 IonicContact NZ-OE1 2.68Å; K152-E170 PolarHBondContact NZ-OE1 3.18Å; Q162-E170 PolarHBondContact NE2-OE2 3.35Å; D166-E170 PolarHBondContact O-N 2.86Å; E170-K173 PolarHBondContact O-N 2.78Å; E170-R174 PolarHBondContact O-N 2.75Å
171	R	83.3	Confident	73.5	Confident	54 Å²	54	90.1 Å²	90.1	20%	0.204	47%	0.466	C	S	.	.	H	α-helix	trans	-58.2	-52.6	172.5	-72.7	173.5	-156.2	147.8	18	110.9	K147 R148 F149 A167 L168 K173 R174 D175	K147-R171 VanDerWaalsContact CB-CZ 3.48Å; R148-R171 PolarHBondContact O-NE 2.56Å; R148-R171 PolarHBondContact O-NH2 3.47Å; F149-R171 HydrophobicContact CD2-CB 4.38Å; F149-R171 HydrophobicContact CD2-CG 3.35Å; F149-R171 HydrophobicContact CE2-CB 4.49Å; F149-R171 HydrophobicContact CE2-CG 3.75Å; F149-R171 HydrophobicContact CG-CG 4.41Å; A167-R171 VanDerWaalsContact O-CG 3.29Å; A167-R171 WeakPolarHBondContact O-CG 3.05Å; A167-R171 PolarHBondContact O-N 3.26Å; L168-R171 WeakPolarHBondContact O-CB 3.46Å; L168-R171 PolarHBondContact O-N 2.9Å; R171-K173 VanDerWaalsContact C-N 3.27Å; R171-K173 PolarHBondContact O-N 3.06Å; R171-R174 PolarHBondContact O-N 3.15Å; R171-R174 VanDerWaalsContact O-N 3.16Å; R171-D175 VanDerWaalsContact O-CG 3.28Å; R171-D175 PolarHBondContact O-N 3.21Å
172	Q	83.6	Confident	71.2	Confident	114 Å²	114	95.8 Å²	95.8	53%	0.533	49%	0.489	S	S	.	.	H	α-helix	trans	-61.8	-37.6	-178.8	-167.5	177.8	3.3	0	0	111.7	L168 L169 D175 S176	L168-Q172 PolarHBondContact O-N 2.65Å; L169-Q172 PolarHBondContact O-N 2.93Å; Q172-D175 PolarHBondContact O-N 3.36Å; Q172-S176 VanDerWaalsContact O-CB 3.3Å; Q172-S176 WeakPolarHBondContact O-CB 3.41Å; Q172-S176 PolarHBondContact O-N 3.32Å; Q172-S176 PolarHBondContact O-OG 3.13Å
173	K	83.4	Confident	68.8	Low	132 Å²	132	98.5 Å²	98.5	57%	0.574	51%	0.508	S	S	*	.	H	α-helix	trans	-65.3	-43.5	175.5	-173.2	179	178.9	-178.3	0	112.1	L169 E170 R171 S176 Q177	L169-K173 WeakPolarHBondContact O-CB 3.36Å; L169-K173 PolarHBondContact O-N 3.44Å; E170-K173 PolarHBondContact O-N 2.78Å; R171-K173 VanDerWaalsContact C-N 3.27Å; R171-K173 PolarHBondContact O-N 3.06Å; K173-S176 PolarHBondContact O-N 3.28Å; K173-Q177 WeakPolarHBondContact O-CB 3.3Å; K173-Q177 WeakPolarHBondContact O-CG 3.37Å; K173-Q177 PolarHBondContact O-N 2.87Å
174	R	75.8	Confident	66.8	Low	131 Å²	131	102.1 Å²	102.1	49%	0.494	53%	0.534	S	S	.	.	H	α-helix	trans	-62.7	-44	174.7	-85.8	-128.6	-169.7	143.2	-0.9	111.7	F149 E170 R171 S176 Q177 Q178	F149-R174 HydrophobicContact CE1-CG 4.21Å; F149-R174 VanDerWaalsContact CE1-CZ 3.43Å; F149-R174 HydrophobicContact CZ-CB 4.37Å; F149-R174 HydrophobicContact CZ-CG 3.74Å; F149-R174 VanDerWaalsContact CZ-CZ 3.49Å; E170-R174 PolarHBondContact O-N 2.75Å; R171-R174 PolarHBondContact O-N 3.15Å; R171-R174 VanDerWaalsContact O-N 3.16Å; R174-S176 VanDerWaalsContact C-N 3.28Å; R174-S176 PolarHBondContact O-N 2.87Å; R174-Q177 PolarHBondContact O-N 3.44Å; R174-Q178 PolarHBondContact O-N 3.28Å
175	D	72	Confident	64.7	Low	111 Å²	111	100.7 Å²	100.7	59%	0.594	54%	0.539	S	S	*	.	H	α-helix	trans	-63.9	-37.1	178.2	-65.5	-17	0	0	0	111.1	R171 Q172 Q178	R171-D175 VanDerWaalsContact O-CG 3.28Å; R171-D175 PolarHBondContact O-N 3.21Å; Q172-D175 PolarHBondContact O-N 3.36Å; D175-Q178 PolarHBondContact O-N 3.15Å
176	S	66.4	Low	62.7	Low	82 Å²	82	96.9 Å²	96.9	57%	0.573	52%	0.522	S	S	*	.	H	α-helix	trans	-72.5	-30.5	176.6	-55.4	0	0	0	0	113.5	Q172 K173 R174 Q178	Q172-S176 VanDerWaalsContact O-CB 3.3Å; Q172-S176 WeakPolarHBondContact O-CB 3.41Å; Q172-S176 PolarHBondContact O-N 3.32Å; Q172-S176 PolarHBondContact O-OG 3.13Å; K173-S176 PolarHBondContact O-N 3.28Å; R174-S176 VanDerWaalsContact C-N 3.28Å; R174-S176 PolarHBondContact O-N 2.87Å; S176-Q178 VanDerWaalsContact C-N 3.34Å
177	Q	60.6	Low	60.5	Low	133 Å²	133	103.1 Å²	103.1	62%	0.621	54%	0.54	S	S	*	.	H	α-helix	trans	-78.2	-16.3	176.4	-76.8	-179.6	-12.1	0	0	113	K173 R174 S179	K173-Q177 WeakPolarHBondContact O-CB 3.3Å; K173-Q177 WeakPolarHBondContact O-CG 3.37Å; K173-Q177 PolarHBondContact O-N 2.87Å; R174-Q177 PolarHBondContact O-N 3.44Å; Q177-S179 PolarHBondContact O-N 2.87Å
178	Q	55.3	Low	58.8	Low	149 Å²	149	109.9 Å²	109.9	70%	0.696	57%	0.572	S	S	*	*			trans	-76.8	56	164.6	-71	-175.6	0.6	0	0	110.8	R174 D175 S176 V180	R174-Q178 PolarHBondContact O-N 3.28Å; D175-Q178 PolarHBondContact O-N 3.15Å; S176-Q178 VanDerWaalsContact C-N 3.34Å; Q178-V180 VanDerWaalsContact C-N 3.34Å; Q178-V180 PolarHBondContact O-N 2.9Å
179	S	38.3	Very low	56.8	Low	98 Å²	98	112 Å²	112	69%	0.685	57%	0.574	S	S	*	*			trans	-87.9	6.7	-177.4	58.9	0	0	0	0	114.7	Q177	Q177-S179 PolarHBondContact O-N 2.87Å
180	V	39.2	Very low	55.1	Low	119 Å²	119	110.8 Å²	110.8	72%	0.721	57%	0.57	S	S	*	*	S	Bend	trans	-93.8	116.5	167.1	-162.6	0	0	0	0	107.6	Q178 K182	Q178-V180 VanDerWaalsContact C-N 3.34Å; Q178-V180 PolarHBondContact O-N 2.9Å; V180-K182 VanDerWaalsContact C-N 3.33Å; V180-K182 PolarHBondContact O-N 3.2Å
181	P	37.2	Very low	53.6	Low	116 Å²	116	111.5 Å²	111.5	75%	0.753	58%	0.575	S	S	*	*			trans	-61.3	103.2	171	-8.3	21.6	0	0	0	106.9	T183	P181-T183 PolarHBondContact O-N 2.62Å
182	K	41.1	Very low	52.2	Low	136 Å²	136	112.5 Å²	112.5	59%	0.591	59%	0.589	S	S	*	*			trans	-50.8	110.8	157.6	-92.6	-170	-173.8	-175.6	0	105.8	V180 S186	V180-K182 VanDerWaalsContact C-N 3.33Å; V180-K182 PolarHBondContact O-N 3.2Å; K182-S186 WeakPolarHBondContact CA-OG 3.42Å; K182-S186 WeakPolarHBondContact CB-OG 3.36Å; K182-S186 WeakPolarHBondContact CG-OG 3.19Å
183	T	37.4	Very low	50.7	Low	91 Å²	91	111.3 Å²	111.3	56%	0.558	58%	0.583	S	S	*	*			trans	-47.5	147.4	172.9	22.6	0	0	0	0	108.5	P181 S185 S186	P181-T183 PolarHBondContact O-N 2.62Å; T183-S185 PolarHBondContact O-N 2.87Å; T183-S186 PolarHBondContact O-N 2.83Å; T183-S186 PolarHBondContact O-OG 3.46Å
184	P	41.5	Very low	49.5	Very low	130 Å²	130	107.3 Å²	107.3	84%	0.844	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-57.4	-12.9	-172.2	-22.4	31.9	0	0	0	114.6	S186	P184-S186 VanDerWaalsContact C-N 3.3Å
185	S	37	Very low	48.5	Very low	103 Å²	103	104 Å²	104	72%	0.72	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-75.5	-5.4	171.1	61.4	0	0	0	0	115.2	T183	T183-S185 PolarHBondContact O-N 2.87Å
186	S	38.7	Very low	48.1	Very low	35 Å²	35	103.6 Å²	103.6	25%	0.245	56%	0.564	C	S	.	*	G	3₁₀ helix	trans	-118.5	18	-174.6	66.7	0	0	0	0	114.7	K182 T183 P184 Q188	K182-S186 WeakPolarHBondContact CA-OG 3.42Å; K182-S186 WeakPolarHBondContact CB-OG 3.36Å; K182-S186 WeakPolarHBondContact CG-OG 3.19Å; T183-S186 PolarHBondContact O-N 2.83Å; T183-S186 PolarHBondContact O-OG 3.46Å; P184-S186 VanDerWaalsContact C-N 3.3Å; S186-Q188 PolarHBondContact O-N 3.25Å
187	R	40.9	Very low	48.4	Very low	201 Å²	201	100.5 Å²	100.5	76%	0.758	54%	0.541	S	S	*	.	S	Bend	trans	-57.6	100.3	140.7	-97.5	-177	174.9	163.4	-0.5	104.3	R189	R187-R189 VanDerWaalsContact C-N 3.25Å; R187-R189 PolarHBondContact O-N 3.33Å
188	Q	48.6	Very low	48.7	Very low	141 Å²	141	96 Å²	96	66%	0.659	52%	0.521	S	S	*	.			trans	-48.3	97.6	175.8	-87.1	161.4	-78	0	0	106.7	S186 V190	S186-Q188 PolarHBondContact O-N 3.25Å; Q188-V190 PolarHBondContact O-N 3.29Å
189	R	44.6	Very low	49.3	Very low	134 Å²	134	92 Å²	92	51%	0.506	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-62.4	119.4	161.4	-70.8	-164.8	-178.5	-171.7	12.3	103	R187 D191 E576	R187-R189 VanDerWaalsContact C-N 3.25Å; R187-R189 PolarHBondContact O-N 3.33Å; R189-D191 PolarHBondContact O-N 3.46Å; R189-E576 IonicContact CZ-OE1 2.77Å; R189-E576 IonicContact CZ-OE2 3.29Å; R189-E576 IonicContact NE-OE2 2.87Å; R189-E576 IonicContact NH1-OE2 2.71Å; R189-E576 PolarHBondContact NH1-OE2 2.93Å; R189-E576 IonicContact NH2-OE1 2.72Å; R189-E576 IonicContact NH2-OE2 3.09Å; R189-E576 PolarHBondContact NH2-OE2 3.21Å; R189-E576 VanDerWaalsContact NH2-OE2 3.15Å
190	V	49	Very low	50.6	Low	64 Å²	64	92.3 Å²	92.3	39%	0.388	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-56	134.5	-178.5	-144.1	0	0	0	0	107.5	Q188 F194	Q188-V190 PolarHBondContact O-N 3.29Å; V190-F194 HydrophobicContact CB-CD1 3.27Å; V190-F194 HydrophobicContact CB-CE1 3.4Å; V190-F194 HydrophobicContact CB-CG 4.01Å; V190-F194 HydrophobicContact CB-CZ 4.2Å; V190-F194 HydrophobicContact CG1-CB 3.93Å; V190-F194 HydrophobicContact CG1-CD1 2.98Å; V190-F194 HydrophobicContact CG1-CD2 3.62Å; V190-F194 HydrophobicContact CG1-CE1 3.25Å; V190-F194 HydrophobicContact CG1-CE2 3.83Å; V190-F194 HydrophobicContact CG1-CG 3.19Å; V190-F194 HydrophobicContact CG1-CZ 3.67Å; V190-F194 HydrophobicContact CG2-CD1 4.14Å; V190-F194 HydrophobicContact CG2-CE1 3.72Å; V190-F194 HydrophobicContact CG2-CZ 4.27Å
191	D	52.4	Low	51.7	Low	67 Å²	67	93.8 Å²	93.8	36%	0.358	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-51.5	131	-176.8	-149.9	-33.7	0	0	0	107.7	R189 E193 F194	R189-D191 PolarHBondContact O-N 3.46Å; D191-E193 PolarHBondContact O-N 3.08Å; D191-F194 WeakPolarHBondContact O-CA 3.26Å; D191-F194 VanDerWaalsContact O-CB 3.23Å; D191-F194 WeakPolarHBondContact O-CB 3.41Å; D191-F194 PolarHBondContact O-N 3.49Å
192	P	52.3	Low	53.1	Low	76 Å²	76	92 Å²	92	49%	0.494	49%	0.489	S	S	.	.	H	α-helix	trans	-55.5	-26.1	-179.6	-26.4	34.5	0	0	0	112.9	F194 A195	P192-F194 PolarHBondContact O-N 3.2Å; P192-A195 PolarHBondContact O-N 3.38Å
193	E	53.9	Low	54.5	Low	88 Å²	88	88 Å²	88	41%	0.411	48%	0.482	S	S	.	.	H	α-helix	trans	-61.1	-21.7	172.4	-157	175.1	-171.3	0	0	113	P124 D191	P124-E193 HydrophobicContact CG-CG 3.53Å; D191-E193 PolarHBondContact O-N 3.08Å
194	F	56.5	Low	56.6	Low	48 Å²	48	85.2 Å²	85.2	21%	0.211	47%	0.465	C	S	.	.	H	α-helix	trans	-84.6	-39.2	-180	139.5	-75.8	0	0	0	114	V190 D191 P192 D196 M197 E273	V190-F194 HydrophobicContact CB-CD1 3.27Å; V190-F194 HydrophobicContact CB-CE1 3.4Å; V190-F194 HydrophobicContact CB-CG 4.01Å; V190-F194 HydrophobicContact CB-CZ 4.2Å; V190-F194 HydrophobicContact CG1-CB 3.93Å; V190-F194 HydrophobicContact CG1-CD1 2.98Å; V190-F194 HydrophobicContact CG1-CD2 3.62Å; V190-F194 HydrophobicContact CG1-CE1 3.25Å; V190-F194 HydrophobicContact CG1-CE2 3.83Å; V190-F194 HydrophobicContact CG1-CG 3.19Å; V190-F194 HydrophobicContact CG1-CZ 3.67Å; V190-F194 HydrophobicContact CG2-CD1 4.14Å; V190-F194 HydrophobicContact CG2-CE1 3.72Å; V190-F194 HydrophobicContact CG2-CZ 4.27Å; D191-F194 WeakPolarHBondContact O-CA 3.26Å; D191-F194 VanDerWaalsContact O-CB 3.23Å; D191-F194 WeakPolarHBondContact O-CB 3.41Å; D191-F194 PolarHBondContact O-N 3.49Å; P192-F194 PolarHBondContact O-N 3.2Å; F194-D196 PolarHBondContact O-N 3.12Å; F194-D196 VanDerWaalsContact O-N 3.16Å; F194-M197 PolarHBondContact O-N 3.13Å; F194-M197 VanDerWaalsContact O-N 3.17Å; F194-E273 HydrophobicContact CE2-CB 3.74Å; F194-E273 HydrophobicContact CE2-CG 3.65Å; F194-E273 HydrophobicContact CZ-CB 3.85Å; F194-E273 HydrophobicContact CZ-CG 3.41Å; F194-E273 VanDerWaalsContact CZ-CG 3.41Å
195	A	55.7	Low	58.8	Low	61 Å²	61	84.6 Å²	84.6	50%	0.504	45%	0.449	S	S	.	.	H	α-helix	trans	-66.2	-25.3	-170.9	0	0	0	0	0	111.2	P192	P192-A195 PolarHBondContact O-N 3.38Å
196	D	64	Low	61.3	Low	103 Å²	103	81.5 Å²	81.5	55%	0.551	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-11.8	-176.9	-65.5	-16.2	0	0	0	112.7	P124 G125 F194 I198	P124-D196 HydrophobicContact CB-CB 4.18Å; G125-D196 WeakPolarHBondContact CA-O 3.46Å; G125-D196 PolarHBondContact N-O 3.46Å; F194-D196 PolarHBondContact O-N 3.12Å; F194-D196 VanDerWaalsContact O-N 3.16Å; D196-I198 PolarHBondContact O-N 2.97Å
197	M	71.3	Confident	63.5	Low	18 Å²	18	88.4 Å²	88.4	9%	0.089	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-27.4	-176.8	-73.8	-163.1	76.4	0	0	113.8	T121 G127 P131 F194 F276	T121-M197 HydrophobicContact CG2-CE 4.06Å; T121-M197 WeakPolarHBondContact O-CE 3.31Å; G127-M197 VanDerWaalsContact CA-O 3.29Å; G127-M197 WeakPolarHBondContact CA-O 3.33Å; G127-M197 PolarHBondContact N-O 2.9Å; P131-M197 HydrophobicContact CG-CE 4.12Å; F194-M197 PolarHBondContact O-N 3.13Å; F194-M197 VanDerWaalsContact O-N 3.17Å; M197-F276 HydrophobicContact CE-CE1 3.99Å; M197-F276 HydrophobicContact CE-CZ 4.05Å; M197-F276 HydrophobicContact SD-CD1 4.39Å; M197-F276 HydrophobicContact SD-CE1 3.56Å; M197-F276 VanDerWaalsContact SD-CE1 3.56Å; M197-F276 HydrophobicContact SD-CZ 4.2Å
198	I	67.6	Low	65.5	Low	38 Å²	38	80.6 Å²	80.6	20%	0.195	43%	0.434	C	S	.	.	S	Bend	trans	-126.2	111.8	-177.1	-57.7	179.1	0	0	0	107.3	P131 D135 D196 T272	P131-I198 HydrophobicContact CB-CD1 4.02Å; P131-I198 HydrophobicContact CB-CG1 3.93Å; D135-I198 HydrophobicContact CB-CD1 4.34Å; D135-I198 HydrophobicContact CB-CG2 4.15Å; D196-I198 PolarHBondContact O-N 2.97Å; I198-T272 HydrophobicContact CD1-CG2 3.28Å
199	N	68.1	Low	67.4	Low	66 Å²	66	74.5 Å²	74.5	35%	0.353	41%	0.406	S	S	.	.			trans	-88.6	118.6	175	-171.9	-22.6	0	0	0	108.8	D201 Q202	N199-D201 PolarHBondContact O-N 2.99Å; N199-D201 VanDerWaalsContact O-N 3.16Å; N199-D201 WeakPolarHBondContact OD1-CB 3.46Å; N199-D201 PolarHBondContact OD1-N 3.45Å; N199-Q202 HydrophobicContact CB-CG 4.37Å; N199-Q202 PolarHBondContact O-N 3.4Å
200	P	66.2	Low	69.3	Low	103 Å²	103	70 Å²	70	67%	0.669	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-59.4	-25.1	179.6	22.9	-32.5	0	0	0	113.4	Q202 A203	P200-Q202 PolarHBondContact O-N 3.11Å; P200-A203 VanDerWaalsContact O-CB 3.26Å; P200-A203 WeakPolarHBondContact O-CB 3.3Å; P200-A203 PolarHBondContact O-N 2.86Å
201	D	61.5	Low	71.1	Confident	150 Å²	150	70.5 Å²	70.5	80%	0.802	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-69.4	-15	176.2	-61.8	-29	0	0	0	112.8	N199	N199-D201 PolarHBondContact O-N 2.99Å; N199-D201 VanDerWaalsContact O-N 3.16Å; N199-D201 WeakPolarHBondContact OD1-CB 3.46Å; N199-D201 PolarHBondContact OD1-N 3.45Å
202	Q	66.6	Low	72.7	Confident	80 Å²	80	67.3 Å²	67.3	37%	0.374	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-106.9	14.5	177.8	-62.6	-177.8	4.5	0	0	112.7	I84 N199 P200 C204	I84-Q202 HydrophobicContact CD1-CB 4.12Å; I84-Q202 HydrophobicContact CD1-CG 4.25Å; N199-Q202 HydrophobicContact CB-CG 4.37Å; N199-Q202 PolarHBondContact O-N 3.4Å; P200-Q202 PolarHBondContact O-N 3.11Å; Q202-C204 PolarHBondContact O-N 3.21Å
203	A	71.5	Confident	74.5	Confident	52 Å²	52	63.7 Å²	63.7	43%	0.43	35%	0.349	S	S	.	.			trans	-63	119.8	-178.1	0	0	0	0	0	111.3	P200	P200-A203 VanDerWaalsContact O-CB 3.26Å; P200-A203 WeakPolarHBondContact O-CB 3.3Å; P200-A203 PolarHBondContact O-N 2.86Å
204	C	80.7	Confident	76.3	Confident	31 Å²	31	60.2 Å²	60.2	21%	0.209	34%	0.335	C	S	.	.			trans	-95.9	141.6	175.1	-168.3	0	0	0	0	109.8	F87 M136 Q202	F87-C204 HydrophobicContact CE1-CB 4.31Å; M136-C204 WeakPolarHBondContact CA-O 3.17Å; M136-C204 HydrophobicContact CB-CB 4.37Å; M136-C204 HydrophobicContact CG-CB 4.25Å; Q202-C204 PolarHBondContact O-N 3.21Å
205	K	87.9	Confident	78.1	Confident	118 Å²	118	58 Å²	58	51%	0.513	33%	0.325	S	S	.	.			trans	-133.7	141.7	175.7	-176.6	179.1	177.4	-168.5	0	110.3	N139	N139-K205 HydrophobicContact CB-CB 4.45Å; N139-K205 WeakPolarHBondContact O-CD 3.46Å; N139-K205 VanDerWaalsContact O-CE 3.31Å; N139-K205 WeakPolarHBondContact O-CE 3.4Å; N139-K205 WeakPolarHBondContact O-CG 3.25Å
206	F	89.2	Confident	80	Confident	38 Å²	38	55.1 Å²	55.1	17%	0.167	30%	0.301	C	S	.	.			trans	-98.1	131.4	168.4	-175.2	-116	0	0	0	110.5	E96 I99 H100 M136 S140 G208 V209	E96-F206 HydrophobicContact CB-CD2 4.46Å; E96-F206 HydrophobicContact CB-CE2 4.38Å; E96-F206 HydrophobicContact CG-CD2 3.6Å; E96-F206 HydrophobicContact CG-CE2 3.85Å; E96-F206 HydrophobicContact CG-CG 4.01Å; E96-F206 HydrophobicContact CG-CZ 4.45Å; I99-F206 HydrophobicContact CD1-CB 4.26Å; I99-F206 HydrophobicContact CD1-CD1 3.95Å; I99-F206 HydrophobicContact CG2-CD1 4.47Å; H100-F206 AromaticContact CE1-CE1 3.37Å; H100-F206 WeakPolarHBondContact CE1-CE1 3.24Å; H100-F206 AromaticContact CE1-CZ 3.47Å; H100-F206 VanDerWaalsContact CE1-CZ 3.47Å; H100-F206 WeakPolarHBondContact CE1-CZ 3.07Å; M136-F206 HydrophobicContact CE-CB 3.81Å; S140-F206 WeakPolarHBondContact OG-CB 3.25Å; S140-F206 PolarHBondContact OG-N 2.85Å; F206-G208 WeakPolarHBondContact CE1-O 3.43Å; F206-V209 HydrophobicContact CD1-CG2 4.35Å
207	E	85.4	Confident	81.5	Confident	179 Å²	179	50.2 Å²	50.2	84%	0.836	28%	0.275	S	S	*	.	S	Bend	trans	-91.3	-20.4	-177.9	-64.8	-169.8	158.4	0	0	113.8	V209	E207-V209 PolarHBondContact O-N 2.85Å
208	G	83.4	Confident	82.8	Confident	38 Å²	38	49.6 Å²	49.6	39%	0.392	27%	0.272	S	S	.	.			trans	-78.2	35.4	-177.4	0	0	0	0	0	114.7	F206	F206-G208 WeakPolarHBondContact CE1-O 3.43Å
209	V	86.9	Confident	84.2	Confident	13 Å²	13	47.8 Å²	47.8	8%	0.079	26%	0.262	C	S	.	.			trans	-79.2	135.3	178.3	-176.1	0	0	0	0	109.1	I99 F144 F206 E207 E211 Y215	I99-V209 HydrophobicContact CD1-CG2 4.4Å; I99-V209 HydrophobicContact CG2-CB 4.46Å; I99-V209 HydrophobicContact CG2-CG1 4.38Å; I99-V209 HydrophobicContact CG2-CG2 4.16Å; F144-V209 HydrophobicContact CD2-CB 4.44Å; F144-V209 HydrophobicContact CD2-CG1 3.79Å; F144-V209 HydrophobicContact CE2-CB 4.4Å; F144-V209 HydrophobicContact CE2-CG1 4.21Å; F206-V209 HydrophobicContact CD1-CG2 4.35Å; E207-V209 PolarHBondContact O-N 2.85Å; V209-E211 PolarHBondContact O-N 3.39Å; V209-E211 VanDerWaalsContact O-N 3.11Å; V209-Y215 HydrophobicContact CG1-CE2 3.71Å
210	D	86.2	Confident	85.5	Confident	38 Å²	38	45.2 Å²	45.2	20%	0.203	25%	0.25	C	C	.	.			trans	-71.3	108.1	173.2	-177.3	-3.6	0	0	0	109.9	D212 C213 Y215 I445	D210-D212 PolarHBondContact O-N 2.91Å; D210-D212 WeakPolarHBondContact OD1-CB 3.48Å; D210-D212 PolarHBondContact OD1-N 2.82Å; D210-C213 HydrophobicContact CB-CB 4.37Å; D210-C213 PolarHBondContact O-N 3.39Å; D210-C213 PolarHBondContact OD2-SG 3.39Å; D210-Y215 WeakPolarHBondContact CB-OH 3.46Å; D210-Y215 PolarHBondContact N-OH 2.86Å; D210-Y215 WeakPolarHBondContact O-CE2 3.42Å; D210-Y215 PolarHBondContact O-OH 3.21Å; D210-I445 HydrophobicContact CB-CD1 4.33Å; D210-I445 WeakPolarHBondContact OD2-CG2 3.47Å
211	E	86.3	Confident	87	Confident	75 Å²	75	40.5 Å²	40.5	35%	0.35	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-22	-178.2	-53.1	-166.8	163.1	0	0	113.5	F144 V209 C213 R453	F144-E211 HydrophobicContact CD1-CB 4.3Å; F144-E211 VanDerWaalsContact CE1-CA 3.47Å; F144-E211 HydrophobicContact CE1-CB 3.54Å; F144-E211 HydrophobicContact CE1-CG 3.82Å; F144-E211 HydrophobicContact CE2-CG 4.41Å; F144-E211 HydrophobicContact CZ-CB 3.86Å; F144-E211 HydrophobicContact CZ-CG 3.57Å; V209-E211 PolarHBondContact O-N 3.39Å; V209-E211 VanDerWaalsContact O-N 3.11Å; E211-C213 PolarHBondContact O-N 3.12Å; E211-R453 WeakPolarHBondContact O-CD 3.27Å; E211-R453 PolarHBondContact O-NH1 3Å
212	D	86.5	Confident	88.6	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	12.2	-179.2	-63.3	-41.7	0	0	0	112.5	D210 L313 P450 G451 R452 R453	D210-D212 PolarHBondContact O-N 2.91Å; D210-D212 WeakPolarHBondContact OD1-CB 3.48Å; D210-D212 PolarHBondContact OD1-N 2.82Å; D212-L313 WeakPolarHBondContact O-CB 3.1Å; D212-L313 WeakPolarHBondContact O-CG 3.39Å; D212-L313 PolarHBondContact O-N 3.13Å; D212-P450 WeakPolarHBondContact OD2-CA 3.45Å; D212-G451 PolarHBondContact OD2-N 3.41Å; D212-R452 HydrophobicContact CB-CG 4.31Å; D212-R452 VanDerWaalsContact CB-CZ 3.43Å; D212-R452 PolarHBondContact O-NH2 2.67Å; D212-R452 VanDerWaalsContact OD1-CG 3.25Å; D212-R452 WeakPolarHBondContact OD1-CG 3.47Å; D212-R452 PolarHBondContact OD1-N 2.95Å; D212-R452 VanDerWaalsContact OD1-N 3.16Å; D212-R452 IonicContact OD2-CZ 2.83Å; D212-R452 PolarHBondContact OD2-N 3.26Å; D212-R452 IonicContact OD2-NH1 3.49Å; D212-R452 PolarHBondContact OD2-NH1 3.16Å; D212-R452 VanDerWaalsContact OD2-NH1 3.14Å; D212-R453 VanDerWaalsContact OD1-CB 3.24Å; D212-R453 WeakPolarHBondContact OD1-CB 3.49Å; D212-R453 PolarHBondContact OD1-N 3.19Å
213	C	88.8	Confident	89.9	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	151.6	175.2	-73.4	0	0	0	0	111.2	D210 E211 Y215 Q310 A311	D210-C213 HydrophobicContact CB-CB 4.37Å; D210-C213 PolarHBondContact O-N 3.39Å; D210-C213 PolarHBondContact OD2-SG 3.39Å; E211-C213 PolarHBondContact O-N 3.12Å; C213-Y215 HydrophobicContact CB-CE2 4Å; C213-Y215 WeakPolarHBondContact O-CE2 3.47Å; C213-Q310 HydrophobicContact CB-CG 3.62Å; C213-Q310 VanDerWaalsContact CB-NE2 3.31Å; C213-Q310 PolarHBondContact SG-NE2 2.8Å; C213-A311 WeakPolarHBondContact CA-O 3.29Å
214	C	91.2	Very high	90.8	Very high	16 Å²	16	28.1 Å²	28.1	11%	0.108	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	141.9	168.9	-81.1	0	0	0	0	111	F144 A146 F151 Q310 A311 I320	F144-C214 WeakPolarHBondContact O-CA 2.95Å; A146-C214 HydrophobicContact CB-CB 4.32Å; F151-C214 HydrophobicContact CE2-CB 4.46Å; C214-Q310 WeakPolarHBondContact O-CA 3.39Å; C214-A311 PolarHBondContact N-O 3.03Å; C214-A311 PolarHBondContact O-N 2.93Å; C214-I320 HydrophobicContact CB-CD1 3.66Å; C214-I320 HydrophobicContact CB-CG1 3.76Å
215	Y	94.4	Very high	91.2	Very high	1 Å²	1	29.2 Å²	29.2	0%	0.004	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	146.9	-174.8	-57.7	-92.7	0	0	0	112.1	I141 F144 Q145 A146 V209 D210 C213 L308 A309 Q310	I141-Y215 HydrophobicContact CB-CD2 4.46Å; I141-Y215 HydrophobicContact CB-CG 4.34Å; I141-Y215 HydrophobicContact CG2-CD1 4.4Å; I141-Y215 HydrophobicContact CG2-CG 4.27Å; F144-Y215 HydrophobicContact CB-CD2 3.56Å; F144-Y215 HydrophobicContact CB-CE2 3.77Å; F144-Y215 HydrophobicContact CG-CE2 4.45Å; F144-Y215 PolarHBondContact O-N 3.48Å; Q145-Y215 WeakPolarHBondContact CA-O 3.46Å; A146-Y215 PolarHBondContact N-O 3.24Å; V209-Y215 HydrophobicContact CG1-CE2 3.71Å; D210-Y215 WeakPolarHBondContact CB-OH 3.46Å; D210-Y215 PolarHBondContact N-OH 2.86Å; D210-Y215 WeakPolarHBondContact O-CE2 3.42Å; D210-Y215 PolarHBondContact O-OH 3.21Å; C213-Y215 HydrophobicContact CB-CE2 4Å; C213-Y215 WeakPolarHBondContact O-CE2 3.47Å; Y215-L308 HydrophobicContact CD1-CD1 4.01Å; Y215-L308 HydrophobicContact CD1-CD2 4.07Å; Y215-L308 HydrophobicContact CD1-CG 4.15Å; Y215-L308 HydrophobicContact CE1-CD2 4.46Å; Y215-A309 CarbonylContact C-O 3.56Å; Y215-A309 VanDerWaalsContact CA-O 3.28Å; Y215-A309 WeakPolarHBondContact CA-O 3.19Å; Y215-Q310 HydrophobicContact CD1-CB 4.09Å; Y215-Q310 HydrophobicContact CD1-CG 4.03Å; Y215-Q310 HydrophobicContact CE1-CB 4.08Å; Y215-Q310 HydrophobicContact CE1-CG 3.61Å; Y215-Q310 PolarHBondContact OH-NE2 3.32Å
216	S	95.6	Very high	91	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	142.5	162.9	-160.5	0	0	0	0	110.8	F151 E268 K270 A309	F151-S216 VanDerWaalsContact CD2-CB 3.4Å; S216-E268 PolarHBondContact OG-OE1 3.23Å; S216-K270 PolarHBondContact OG-NZ 3Å; S216-K270 VanDerWaalsContact OG-NZ 3.12Å; S216-A309 PolarHBondContact N-O 3.08Å; S216-A309 PolarHBondContact O-N 2.69Å
217	V	97.2	Very high	90.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	129.4	-176.6	-176.4	0	0	0	0	109.2	L137 F138 I141 V219 E268 V269 V306 L308	L137-V217 HydrophobicContact CD2-CG1 4.15Å; L137-V217 HydrophobicContact CD2-CG2 4.05Å; F138-V217 HydrophobicContact CE1-CB 4.16Å; F138-V217 HydrophobicContact CE1-CG2 3.95Å; F138-V217 HydrophobicContact CZ-CB 3.96Å; F138-V217 HydrophobicContact CZ-CG1 4.03Å; F138-V217 HydrophobicContact CZ-CG2 4.1Å; I141-V217 HydrophobicContact CD1-CG2 3.41Å; I141-V217 VanDerWaalsContact CD1-CG2 3.41Å; V217-V219 HydrophobicContact CG1-CG1 4.46Å; V217-E268 WeakPolarHBondContact O-CA 3.28Å; V217-V269 HydrophobicContact CB-CG2 4.03Å; V217-V269 HydrophobicContact CG1-CG2 3.75Å; V217-V269 PolarHBondContact O-N 3.39Å; V217-V306 HydrophobicContact CG1-CG1 3.78Å; V217-L308 HydrophobicContact CG2-CD1 3.85Å
218	F	97.1	Very high	91.1	Very high	5 Å²	5	24.5 Å²	24.5	2%	0.022	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	135.5	172.7	-62.1	-92.4	0	0	0	108.9	F151 P153 I159 V267 E268 K307 A309	F151-F218 HydrophobicContact CB-CE2 3.86Å; F151-F218 HydrophobicContact CB-CZ 3.76Å; P153-F218 HydrophobicContact CG-CD1 3.75Å; P153-F218 HydrophobicContact CG-CE1 3.65Å; P153-F218 HydrophobicContact CG-CG 4.46Å; P153-F218 HydrophobicContact CG-CZ 4.3Å; I159-F218 HydrophobicContact CD1-CD2 4.17Å; I159-F218 HydrophobicContact CD1-CE2 4.07Å; F218-V267 WeakPolarHBondContact CA-O 3.42Å; F218-E268 HydrophobicContact CD1-CB 3.87Å; F218-E268 HydrophobicContact CD1-CG 4.4Å; F218-E268 HydrophobicContact CE1-CB 3.6Å; F218-E268 HydrophobicContact CE1-CG 3.93Å; F218-E268 HydrophobicContact CZ-CB 4.35Å; F218-E268 HydrophobicContact CZ-CG 4.18Å; F218-K307 HydrophobicContact CB-CB 4.24Å; F218-K307 PolarHBondContact N-O 2.74Å; F218-K307 PolarHBondContact O-N 2.76Å; F218-A309 HydrophobicContact CD2-CB 4.49Å; F218-A309 HydrophobicContact CE2-CB 4.14Å
219	V	97.5	Very high	91.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	140.1	174.6	-63.9	0	0	0	0	110.3	V217 V267 V269 A275 V278 F304 T305 V306	V217-V219 HydrophobicContact CG1-CG1 4.46Å; V219-V267 HydrophobicContact CG2-CB 4.25Å; V219-V267 PolarHBondContact N-O 3.45Å; V219-V267 PolarHBondContact O-N 3.37Å; V219-V269 HydrophobicContact CG1-CG2 3.83Å; V219-V269 HydrophobicContact CG2-CG1 3.78Å; V219-V269 HydrophobicContact CG2-CG2 4.14Å; V219-A275 HydrophobicContact CG1-CB 4.46Å; V219-V278 HydrophobicContact CG2-CB 4.1Å; V219-V278 HydrophobicContact CG2-CG1 3.72Å; V219-V278 HydrophobicContact CG2-CG2 4.48Å; V219-F304 HydrophobicContact CB-CE1 4.48Å; V219-F304 HydrophobicContact CB-CE2 4.28Å; V219-F304 HydrophobicContact CB-CZ 3.84Å; V219-F304 HydrophobicContact CG1-CE1 4.12Å; V219-F304 HydrophobicContact CG1-CZ 3.78Å; V219-F304 HydrophobicContact CG2-CZ 4.45Å; V219-T305 WeakPolarHBondContact CA-O 3.47Å; V219-V306 HydrophobicContact CG1-CG2 4.39Å
220	S	96.5	Very high	91.8	Very high	13 Å²	13	24.6 Å²	24.6	9%	0.091	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	147.1	168.2	66.8	0	0	0	0	109.5	T265 T305	S220-T265 WeakPolarHBondContact CB-O 3.49Å; S220-T305 PolarHBondContact N-O 3.12Å; S220-T305 PolarHBondContact O-N 2.62Å; S220-T305 WeakPolarHBondContact OG-CB 3.49Å
221	Y	96.6	Very high	92.1	Very high	4 Å²	4	23.5 Å²	23.5	2%	0.016	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	116.9	-179.7	-165.2	-158.4	0	0	0	110.6	L232 F279 Q283 V303 F304	Y221-L232 HydrophobicContact CD1-CB 4.19Å; Y221-L232 HydrophobicContact CD1-CD1 3.71Å; Y221-L232 HydrophobicContact CD2-CD1 4.11Å; Y221-L232 HydrophobicContact CE1-CD1 3.62Å; Y221-L232 HydrophobicContact CE2-CD1 4.08Å; Y221-L232 HydrophobicContact CG-CB 4.37Å; Y221-L232 HydrophobicContact CG-CD1 3.92Å; Y221-L232 WeakPolarHBondContact O-CB 3.41Å; Y221-L232 PolarHBondContact O-N 2.86Å; Y221-F279 HydrophobicContact CD1-CD2 4.24Å; Y221-F279 AromaticContact CE1-CD2 3.85Å; Y221-F279 HydrophobicContact CE1-CD2 3.85Å; Y221-F279 AromaticContact CE1-CE2 3.96Å; Y221-F279 HydrophobicContact CE1-CE2 3.96Å; Y221-F279 HydrophobicContact CE2-CE2 4.4Å; Y221-F279 AromaticContact CZ-CE2 3.77Å; Y221-Q283 HydrophobicContact CE1-CG 4.11Å; Y221-Q283 PolarHBondContact OH-OE1 2.93Å; Y221-V303 WeakPolarHBondContact CD2-O 3.43Å; Y221-F304 HydrophobicContact CD1-CD2 4.31Å; Y221-F304 HydrophobicContact CD2-CB 3.85Å; Y221-F304 AromaticContact CD2-CD2 3.77Å; Y221-F304 HydrophobicContact CD2-CD2 3.77Å; Y221-F304 HydrophobicContact CD2-CG 4.32Å; Y221-F304 HydrophobicContact CE2-CB 4.04Å; Y221-F304 HydrophobicContact CE2-CD2 4.38Å; Y221-F304 AromaticContact CG-CD2 3.76Å; Y221-F304 HydrophobicContact CG-CD2 3.76Å
222	I	95.3	Very high	92.4	Very high	4 Å²	4	20.3 Å²	20.3	2%	0.021	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	154	-176.9	67.3	176.7	0	0	0	111.1	I229 Y230 V261 C264 V303 L395	I222-I229 HydrophobicContact CB-CG2 4.3Å; I222-I229 HydrophobicContact CD1-CG2 4.09Å; I222-Y230 CarbonylContact C-O 3.07Å; I222-Y230 VanDerWaalsContact CA-O 3.25Å; I222-Y230 WeakPolarHBondContact CA-O 3.41Å; I222-Y230 WeakPolarHBondContact CB-O 3.41Å; I222-V261 HydrophobicContact CD1-CG2 3.76Å; I222-C264 WeakPolarHBondContact CG2-SG 3.32Å; I222-V303 HydrophobicContact CD1-CB 4.04Å; I222-V303 HydrophobicContact CD1-CG1 4.34Å; I222-V303 HydrophobicContact CD1-CG2 4.46Å; I222-V303 HydrophobicContact CG1-CB 3.63Å; I222-V303 HydrophobicContact CG1-CG1 4.29Å; I222-V303 HydrophobicContact CG1-CG2 4.32Å; I222-V303 PolarHBondContact N-O 2.88Å; I222-V303 PolarHBondContact O-N 2.76Å; I222-L395 HydrophobicContact CD1-CD2 3.87Å
223	E	92.9	Very high	92.7	Very high	13 Å²	13	20.4 Å²	20.4	6%	0.061	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	127.1	171.6	177.6	170.7	-134.3	0	0	109.5	Y230 L232 R286 S300 H301	E223-Y230 PolarHBondContact N-O 3.36Å; E223-Y230 PolarHBondContact O-N 2.89Å; E223-L232 HydrophobicContact CB-CD1 4.02Å; E223-L232 HydrophobicContact CB-CD2 3.85Å; E223-L232 HydrophobicContact CB-CG 3.96Å; E223-R286 WeakPolarHBondContact OE1-CG 3.34Å; E223-R286 IonicContact OE1-NE 3.65Å; E223-R286 PolarHBondContact OE1-NE 2.85Å; E223-S300 WeakPolarHBondContact OE1-CB 3.31Å; E223-S300 PolarHBondContact OE1-OG 3.26Å; E223-H301 CarbonylContact C-O 3.55Å; E223-H301 WeakPolarHBondContact CA-O 3.46Å
224	I	92.2	Very high	92.6	Very high	5 Å²	5	23.8 Å²	23.8	3%	0.026	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	104.4	171	-52.9	177.1	0	0	0	107.4	Y228 I229 H301 V303 K391 V392 L395	I224-Y228 CarbonylContact C-O 3.58Å; I224-Y228 VanDerWaalsContact CA-O 3.3Å; I224-Y228 WeakPolarHBondContact CA-O 3.31Å; I224-I229 HydrophobicContact CG1-CG1 4.28Å; I224-H301 HydrophobicContact CB-CB 4.29Å; I224-H301 PolarHBondContact N-O 2.78Å; I224-H301 PolarHBondContact O-N 2.73Å; I224-V303 HydrophobicContact CD1-CG2 4.34Å; I224-K391 HydrophobicContact CG2-CB 4.11Å; I224-V392 HydrophobicContact CB-CG2 4.37Å; I224-V392 HydrophobicContact CD1-CG2 3.92Å; I224-V392 HydrophobicContact CG2-CG2 4.02Å; I224-L395 HydrophobicContact CD1-CD2 4.2Å
225	Y	87.6	Confident	91.9	Very high	53 Å²	53	28.4 Å²	28.4	21%	0.208	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	130.7	-178.5	174.7	-108.4	0	0	0	109.6	N227 Y228 Y230 N294 R299 E355	Y225-N227 PolarHBondContact O-N 3Å; Y225-N227 VanDerWaalsContact O-N 3.16Å; Y225-Y228 PolarHBondContact N-O 3.45Å; Y225-Y228 WeakPolarHBondContact O-CB 3.41Å; Y225-Y228 PolarHBondContact O-N 3.31Å; Y225-Y230 HydrophobicContact CD1-CE2 4.25Å; Y225-N294 PolarHBondContact OH-ND2 2.83Å; Y225-R299 WeakPolarHBondContact CD2-O 3.44Å; Y225-E355 HydrophobicContact CE2-CG 3.78Å; Y225-E355 VanDerWaalsContact CE2-OE1 3.28Å; Y225-E355 WeakPolarHBondContact CE2-OE1 3.45Å; Y225-E355 VanDerWaalsContact CZ-CD 3.49Å; Y225-E355 PolarHBondContact OH-OE1 3.19Å; Y225-E355 PolarHBondContact OH-OE2 3.17Å
226	N	83.6	Confident	90.5	Very high	50 Å²	50	32 Å²	32	27%	0.267	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	35.6	179.2	-163.9	39.4	0	0	0	113.7	Y228 N358	N226-Y228 HydrophobicContact CB-CD2 4.3Å; N226-Y228 WeakPolarHBondContact O-CD2 3.43Å; N226-Y228 PolarHBondContact O-N 2.68Å; N226-N358 PolarHBondContact OD1-ND2 2.73Å
227	N	86.8	Confident	88.8	Confident	64 Å²	64	38 Å²	38	34%	0.342	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	15.8	-175.3	-148	36.3	0	0	0	115.2	Y225 K391	Y225-N227 PolarHBondContact O-N 3Å; Y225-N227 VanDerWaalsContact O-N 3.16Å; N227-K391 WeakPolarHBondContact O-CG 3.39Å; N227-K391 WeakPolarHBondContact OD1-CG 3.35Å; N227-K391 PolarHBondContact OD1-N 3.48Å
228	Y	89.9	Confident	87	Confident	122 Å²	122	46 Å²	46	48%	0.478	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	152.5	168.4	-65.1	-76.9	0	0	0	109.9	I224 Y225 N226	I224-Y228 CarbonylContact C-O 3.58Å; I224-Y228 VanDerWaalsContact CA-O 3.3Å; I224-Y228 WeakPolarHBondContact CA-O 3.31Å; Y225-Y228 PolarHBondContact N-O 3.45Å; Y225-Y228 WeakPolarHBondContact O-CB 3.41Å; Y225-Y228 PolarHBondContact O-N 3.31Å; N226-Y228 HydrophobicContact CB-CD2 4.3Å; N226-Y228 WeakPolarHBondContact O-CD2 3.43Å; N226-Y228 PolarHBondContact O-N 2.68Å
229	I	93.3	Very high	85.3	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	120.4	-177.8	-54.4	-179.4	0	0	0	108.2	I222 I224 S248 K249 L251 V261 K391	I222-I229 HydrophobicContact CB-CG2 4.3Å; I222-I229 HydrophobicContact CD1-CG2 4.09Å; I224-I229 HydrophobicContact CG1-CG1 4.28Å; I229-S248 PolarHBondContact N-OG 2.67Å; I229-S248 VanDerWaalsContact N-OG 3.12Å; I229-S248 CarbonylContact O-C 3.53Å; I229-S248 VanDerWaalsContact O-CA 3.22Å; I229-S248 WeakPolarHBondContact O-CA 3.45Å; I229-S248 PolarHBondContact O-OG 3.2Å; I229-K249 HydrophobicContact CB-CB 4.37Å; I229-K249 HydrophobicContact CG2-CB 4.26Å; I229-K249 PolarHBondContact O-N 3.04Å; I229-L251 HydrophobicContact CD1-CD1 4.09Å; I229-L251 HydrophobicContact CD1-CD2 3.6Å; I229-L251 HydrophobicContact CD1-CG 3.56Å; I229-V261 HydrophobicContact CD1-CG2 4.38Å; I229-V261 HydrophobicContact CG2-CG1 3.97Å; I229-V261 HydrophobicContact CG2-CG2 4.18Å; I229-K391 HydrophobicContact CD1-CB 4.2Å; I229-K391 HydrophobicContact CD1-CD 4.45Å; I229-K391 HydrophobicContact CD1-CG 4.36Å; I229-K391 HydrophobicContact CG1-CB 4.21Å; I229-K391 HydrophobicContact CG1-CG 4.26Å
230	Y	92.1	Very high	83.5	Confident	53 Å²	53	54.5 Å²	54.5	21%	0.208	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	136	179	-58.7	-77.3	0	0	0	110	I222 E223 Y225 P246	I222-Y230 CarbonylContact C-O 3.07Å; I222-Y230 VanDerWaalsContact CA-O 3.25Å; I222-Y230 WeakPolarHBondContact CA-O 3.41Å; I222-Y230 WeakPolarHBondContact CB-O 3.41Å; E223-Y230 PolarHBondContact N-O 3.36Å; E223-Y230 PolarHBondContact O-N 2.89Å; Y225-Y230 HydrophobicContact CD1-CE2 4.25Å; Y230-P246 HydrophobicContact CD1-CB 4.02Å; Y230-P246 HydrophobicContact CD1-CG 4.46Å; Y230-P246 HydrophobicContact CE1-CB 4.27Å; Y230-P246 HydrophobicContact CE1-CG 4.34Å
231	D	93.3	Very high	82.1	Confident	15 Å²	15	60.9 Å²	60.9	8%	0.08	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	114.5	173.9	-179.9	-6.9	0	0	0	109	L233 E234 K249 T265	D231-L233 PolarHBondContact O-N 2.85Å; D231-L233 WeakPolarHBondContact OD1-CA 3.24Å; D231-L233 PolarHBondContact OD1-N 3.28Å; D231-E234 HydrophobicContact CB-CB 3.98Å; D231-E234 PolarHBondContact OD1-N 3.26Å; D231-K249 HydrophobicContact CB-CG 4.23Å; D231-T265 WeakPolarHBondContact OD2-CB 3.48Å; D231-T265 PolarHBondContact OD2-N 3.19Å; D231-T265 PolarHBondContact OD2-OG1 3.27Å
232	L	91.8	Very high	80.4	Confident	8 Å²	8	70 Å²	70	4%	0.042	36%	0.355	C	S	.	.	S	Bend	trans	-79.3	-9.4	-179.5	-61.8	176.6	0	0	0	112.2	Y221 E223 K285 R286	Y221-L232 HydrophobicContact CD1-CB 4.19Å; Y221-L232 HydrophobicContact CD1-CD1 3.71Å; Y221-L232 HydrophobicContact CD2-CD1 4.11Å; Y221-L232 HydrophobicContact CE1-CD1 3.62Å; Y221-L232 HydrophobicContact CE2-CD1 4.08Å; Y221-L232 HydrophobicContact CG-CB 4.37Å; Y221-L232 HydrophobicContact CG-CD1 3.92Å; Y221-L232 WeakPolarHBondContact O-CB 3.41Å; Y221-L232 PolarHBondContact O-N 2.86Å; E223-L232 HydrophobicContact CB-CD1 4.02Å; E223-L232 HydrophobicContact CB-CD2 3.85Å; E223-L232 HydrophobicContact CB-CG 3.96Å; L232-K285 WeakPolarHBondContact O-CD 3.17Å; L232-R286 HydrophobicContact CD1-CB 4.34Å; L232-R286 HydrophobicContact CD2-CB 4.14Å
233	L	92.5	Very high	78.8	Confident	2 Å²	2	74.5 Å²	74.5	1%	0.01	38%	0.384	C	S	.	.	S	Bend	trans	-103.6	-12.8	-178.9	-55.5	-174.8	0	0	0	112.9	D231 D235 T265 V267 V278 K285	D231-L233 PolarHBondContact O-N 2.85Å; D231-L233 WeakPolarHBondContact OD1-CA 3.24Å; D231-L233 PolarHBondContact OD1-N 3.28Å; L233-D235 PolarHBondContact O-N 2.88Å; L233-T265 HydrophobicContact CB-CG2 4.18Å; L233-V267 HydrophobicContact CD1-CG2 4Å; L233-V278 HydrophobicContact CD1-CG1 3.45Å; L233-V278 VanDerWaalsContact CD1-CG1 3.45Å; L233-V278 HydrophobicContact CD2-CG1 3.55Å; L233-V278 WeakPolarHBondContact CD2-O 3.3Å; L233-V278 HydrophobicContact CG-CG1 4.13Å; L233-K285 PolarHBondContact O-NZ 2.74Å
234	E	87.8	Confident	77.5	Confident	72 Å²	72	83.2 Å²	83.2	34%	0.336	42%	0.422	S	S	.	.			trans	-57	120.6	179.4	178.9	164.9	-148.3	0	0	112.4	D231 A236 K249 K285	D231-E234 HydrophobicContact CB-CB 3.98Å; D231-E234 PolarHBondContact OD1-N 3.26Å; E234-A236 PolarHBondContact O-N 3.44Å; E234-A236 VanDerWaalsContact O-N 3.15Å; E234-K249 IonicContact OE1-NZ 3.28Å; E234-K249 PolarHBondContact OE1-NZ 3.36Å; E234-K249 WeakPolarHBondContact OE2-CE 3.28Å; E234-K249 IonicContact OE2-NZ 3.23Å; E234-K249 PolarHBondContact OE2-NZ 3.2Å; E234-K285 PolarHBondContact O-NZ 3.23Å
235	D	76.5	Confident	76.3	Confident	113 Å²	113	88.2 Å²	88.2	60%	0.604	46%	0.455	S	S	*	.			trans	-86.6	80.5	175.5	-70.9	-31.2	0	0	0	109.8	L233 P237 K281 K285	L233-D235 PolarHBondContact O-N 2.88Å; D235-P237 WeakPolarHBondContact O-CD 3.34Å; D235-K281 WeakPolarHBondContact OD1-CE 3.47Å; D235-K281 IonicContact OD1-NZ 3.49Å; D235-K281 PolarHBondContact OD1-NZ 3.01Å; D235-K281 IonicContact OD2-NZ 3.87Å; D235-K281 PolarHBondContact OD2-NZ 3.19Å; D235-K285 IonicContact OD1-NZ 2.83Å; D235-K285 PolarHBondContact OD1-NZ 3.27Å
236	A	64.3	Low	75.6	Confident	76 Å²	76	90.6 Å²	90.6	63%	0.628	48%	0.477	S	S	*	.			trans	-68.3	121.3	172.8	0	0	0	0	0	109.3	E234 F238	E234-A236 PolarHBondContact O-N 3.44Å; E234-A236 VanDerWaalsContact O-N 3.15Å; A236-F238 PolarHBondContact O-N 2.91Å; A236-F238 VanDerWaalsContact O-N 3.07Å
237	P	60.8	Low	75.6	Confident	125 Å²	125	95.5 Å²	95.5	81%	0.812	50%	0.498	S	S	*	.			trans	-61.5	116.6	171.4	23.8	-30.7	0	0	0	108.2	D235 D239	D235-P237 WeakPolarHBondContact O-CD 3.34Å; P237-D239 PolarHBondContact O-N 3.21Å
238	F	57.9	Low	75.8	Confident	168 Å²	168	94.1 Å²	94.1	74%	0.737	49%	0.494	S	S	*	.			trans	-70.2	99.2	175.1	-174.2	-94	0	0	0	108.1	A236 P240	A236-F238 PolarHBondContact O-N 2.91Å; A236-F238 VanDerWaalsContact O-N 3.07Å; F238-P240 HydrophobicContact CD1-CG 4.35Å; F238-P240 HydrophobicContact CE1-CB 4.2Å; F238-P240 HydrophobicContact CE1-CG 4.41Å; F238-P240 WeakPolarHBondContact O-CD 3.38Å
239	D	61.1	Low	75.9	Confident	80 Å²	80	89.9 Å²	89.9	43%	0.428	48%	0.478	S	S	.	.			trans	-82.7	110.4	168	-174.1	-18.5	0	0	0	108	P237 I241 R242	P237-D239 PolarHBondContact O-N 3.21Å; D239-I241 PolarHBondContact O-N 3.4Å; D239-I241 VanDerWaalsContact O-N 3.11Å; D239-I241 WeakPolarHBondContact OD1-CB 3.43Å; D239-I241 PolarHBondContact OD1-N 3.47Å; D239-R242 CarbonylContact O-C 3.38Å; D239-R242 PolarHBondContact O-N 3.04Å
240	P	60.3	Low	76	Confident	105 Å²	105	95 Å²	95	68%	0.682	50%	0.504	S	S	*	.	S	Bend	trans	-62.9	-19.2	-178.2	-12.3	24.7	0	0	0	113	F238	F238-P240 HydrophobicContact CD1-CG 4.35Å; F238-P240 HydrophobicContact CE1-CB 4.2Å; F238-P240 HydrophobicContact CE1-CG 4.41Å; F238-P240 WeakPolarHBondContact O-CD 3.38Å
241	I	66.4	Low	76.1	Confident	146 Å²	146	93.3 Å²	93.3	75%	0.749	50%	0.499	S	S	*	.	S	Bend	trans	-90.6	-32.3	-174.2	-54.6	175	0	0	0	110.6	D239	D239-I241 PolarHBondContact O-N 3.4Å; D239-I241 VanDerWaalsContact O-N 3.11Å; D239-I241 WeakPolarHBondContact OD1-CB 3.43Å; D239-I241 PolarHBondContact OD1-N 3.47Å
242	R	62.7	Low	76.1	Confident	196 Å²	196	99.6 Å²	99.6	74%	0.74	52%	0.521	S	S	*	.	S	Bend	trans	-143.7	88.1	176.6	-69.8	-171.1	-172.7	-145.8	2.1	111	D239 K244	D239-R242 CarbonylContact O-C 3.38Å; D239-R242 PolarHBondContact O-N 3.04Å; R242-K244 PolarHBondContact O-N 2.68Å
243	P	61.8	Low	76.1	Confident	98 Å²	98	103.5 Å²	103.5	64%	0.636	54%	0.539	S	S	*	.			trans	-59.8	114.8	171.3	23.7	-31.5	0	0	0	108.9
244	K	65.1	Low	75.9	Confident	196 Å²	196	104.4 Å²	104.4	85%	0.852	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-76.6	128	171.3	-76	-177.3	-178.1	174.1	0	108.1	R242	R242-K244 PolarHBondContact O-N 2.68Å
245	P	67.6	Low	75.8	Confident	111 Å²	111	109 Å²	109	72%	0.721	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-64.1	149.1	175.4	27.4	-33.5	0	0	0	110.2	Q247	P245-Q247 PolarHBondContact O-N 3.01Å
246	P	72.9	Confident	76.1	Confident	103 Å²	103	107.5 Å²	107.5	67%	0.669	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-59.2	128.5	177.7	23.8	-32.4	0	0	0	110.2	Y230	Y230-P246 HydrophobicContact CD1-CB 4.02Å; Y230-P246 HydrophobicContact CD1-CG 4.46Å; Y230-P246 HydrophobicContact CE1-CB 4.27Å; Y230-P246 HydrophobicContact CE1-CG 4.34Å
247	Q	82.8	Confident	77.1	Confident	152 Å²	152	109.6 Å²	109.6	71%	0.71	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-90.6	130.2	-176.7	-172.2	174	2.5	0	0	110.4	P245 K249	P245-Q247 PolarHBondContact O-N 3.01Å; Q247-K249 PolarHBondContact O-N 3Å
248	S	90.8	Very high	78.3	Confident	36 Å²	36	104.8 Å²	104.8	25%	0.252	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-62.9	130.5	173.2	-177.9	0	0	0	0	110.6	I229	I229-S248 PolarHBondContact N-OG 2.67Å; I229-S248 VanDerWaalsContact N-OG 3.12Å; I229-S248 CarbonylContact O-C 3.53Å; I229-S248 VanDerWaalsContact O-CA 3.22Å; I229-S248 WeakPolarHBondContact O-CA 3.45Å; I229-S248 PolarHBondContact O-OG 3.2Å
249	K	93.1	Very high	80	Confident	32 Å²	32	97.5 Å²	97.5	14%	0.139	49%	0.49	C	S	.	.	B	Isolated β-bridge	trans	-75.3	161.4	169.1	-52.7	-63.2	177.1	174	0	110.6	I229 D231 E234 Q247 V261 G263	I229-K249 HydrophobicContact CB-CB 4.37Å; I229-K249 HydrophobicContact CG2-CB 4.26Å; I229-K249 PolarHBondContact O-N 3.04Å; D231-K249 HydrophobicContact CB-CG 4.23Å; E234-K249 IonicContact OE1-NZ 3.28Å; E234-K249 PolarHBondContact OE1-NZ 3.36Å; E234-K249 WeakPolarHBondContact OE2-CE 3.28Å; E234-K249 IonicContact OE2-NZ 3.23Å; E234-K249 PolarHBondContact OE2-NZ 3.2Å; Q247-K249 PolarHBondContact O-N 3Å; K249-V261 HydrophobicContact CB-CG1 3.41Å; K249-V261 VanDerWaalsContact CB-CG1 3.41Å; K249-V261 HydrophobicContact CG-CG1 4.11Å; K249-G263 PolarHBondContact NZ-O 2.59Å
250	I	94.1	Very high	81.5	Confident	108 Å²	108	94.8 Å²	94.8	55%	0.554	47%	0.474	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.8	138.6	-173.2	-57.3	172.9	0	0	0	109	A262	I250-A262 WeakPolarHBondContact O-CB 3.4Å; I250-A262 PolarHBondContact O-N 3.31Å
251	L	94.8	Very high	83.2	Confident	18 Å²	18	90.7 Å²	90.7	9%	0.094	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	135.4	171.7	-66.9	175.9	0	0	0	110.8	I229 M259 Y260 V261 K391 H394 L395	I229-L251 HydrophobicContact CD1-CD1 4.09Å; I229-L251 HydrophobicContact CD1-CD2 3.6Å; I229-L251 HydrophobicContact CD1-CG 3.56Å; L251-M259 HydrophobicContact CB-CE 3.77Å; L251-Y260 WeakPolarHBondContact CA-O 3.22Å; L251-V261 HydrophobicContact CD2-CG2 3.79Å; L251-K391 HydrophobicContact CD1-CB 4.44Å; L251-K391 HydrophobicContact CD1-CD 3.9Å; L251-H394 HydrophobicContact CD1-CB 3.86Å; L251-L395 HydrophobicContact CD1-CB 4.33Å; L251-L395 HydrophobicContact CD2-CB 4.18Å; L251-L395 HydrophobicContact CD2-CD1 3.72Å; L251-L395 HydrophobicContact CD2-CG 4.47Å
252	R	93.8	Very high	84.4	Confident	146 Å²	146	84.6 Å²	84.6	55%	0.551	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.1	164.8	173.2	-69.5	-168.3	179.7	-175.9	-1.1	110.2	M259 Y260 A262	R252-M259 WeakPolarHBondContact O-CA 3.44Å; R252-Y260 HydrophobicContact CB-CD1 4.21Å; R252-Y260 HydrophobicContact CB-CE1 3.59Å; R252-Y260 PolarHBondContact N-O 2.85Å; R252-Y260 VanDerWaalsContact O-CD1 3.31Å; R252-Y260 WeakPolarHBondContact O-CD1 3.3Å; R252-Y260 PolarHBondContact O-N 3.11Å; R252-A262 HydrophobicContact CB-CB 4.36Å; R252-A262 HydrophobicContact CG-CB 3.83Å
253	E	92.1	Very high	85.7	Confident	91 Å²	91	78.1 Å²	78.1	43%	0.425	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	131.3	176.3	-171.9	174	166.6	0	0	107.9	H257 N258 M259	E253-H257 HydrophobicContact CG-CB 4.4Å; E253-H257 WeakPolarHBondContact OE1-CA 3.38Å; E253-H257 VanDerWaalsContact OE1-CB 3.29Å; E253-H257 WeakPolarHBondContact OE1-CB 3.38Å; E253-H257 IonicContact OE1-CE1 3.51Å; E253-H257 IonicContact OE1-CG 2.9Å; E253-H257 IonicContact OE1-ND1 2.67Å; E253-H257 PolarHBondContact OE1-ND1 3.08Å; E253-N258 CarbonylContact C-O 3.59Å; E253-N258 WeakPolarHBondContact CA-O 3.28Å; E253-M259 HydrophobicContact CB-SD 4.04Å; E253-M259 HydrophobicContact CG-SD 4.37Å
254	D	88.3	Confident	87.1	Confident	21 Å²	21	74.6 Å²	74.6	11%	0.112	39%	0.39	C	S	.	.			trans	-86	-175.6	178.1	74.4	15.5	0	0	0	112.5	N157 N256 H257 N258 Y260	N157-D254 HydrophobicContact CB-CB 4.05Å; N157-D254 PolarHBondContact ND2-OD2 3.12Å; D254-N256 PolarHBondContact O-N 3.01Å; D254-N256 VanDerWaalsContact OD1-CA 3.32Å; D254-N256 WeakPolarHBondContact OD1-CA 3.42Å; D254-N256 WeakPolarHBondContact OD1-CB 3.37Å; D254-N256 PolarHBondContact OD1-N 2.77Å; D254-H257 PolarHBondContact O-N 3.44Å; D254-H257 VanDerWaalsContact O-N 3.11Å; D254-H257 PolarHBondContact OD1-N 3.22Å; D254-N258 PolarHBondContact N-O 3.18Å; D254-N258 WeakPolarHBondContact OD1-CB 3.37Å; D254-N258 PolarHBondContact OD1-N 3.02Å; D254-N258 WeakPolarHBondContact OD2-CB 3.28Å; D254-Y260 HydrophobicContact CB-CD1 4.03Å; D254-Y260 HydrophobicContact CB-CE1 3.99Å
255	Q	85.3	Confident	88.4	Confident	168 Å²	168	67.5 Å²	67.5	79%	0.785	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-22.4	-179.8	64.7	176.2	31.4	0	0	114.2	H257	Q255-H257 VanDerWaalsContact C-N 3.31Å
256	N	82.4	Confident	89.7	Confident	82 Å²	82	64.7 Å²	64.7	44%	0.439	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	12.5	178.7	-64	-22.4	0	0	0	111.3	D254 N258	D254-N256 PolarHBondContact O-N 3.01Å; D254-N256 VanDerWaalsContact OD1-CA 3.32Å; D254-N256 WeakPolarHBondContact OD1-CA 3.42Å; D254-N256 WeakPolarHBondContact OD1-CB 3.37Å; D254-N256 PolarHBondContact OD1-N 2.77Å; N256-N258 PolarHBondContact O-N 2.95Å
257	H	84.4	Confident	90.7	Very high	119 Å²	119	61.5 Å²	61.5	55%	0.551	32%	0.319	S	S	*	.	S	Bend	trans	65.3	18.2	-175	-58.9	-70.4	0	0	0	114.4	E253 D254 Q255 N398	E253-H257 HydrophobicContact CG-CB 4.4Å; E253-H257 WeakPolarHBondContact OE1-CA 3.38Å; E253-H257 VanDerWaalsContact OE1-CB 3.29Å; E253-H257 WeakPolarHBondContact OE1-CB 3.38Å; E253-H257 IonicContact OE1-CE1 3.51Å; E253-H257 IonicContact OE1-CG 2.9Å; E253-H257 IonicContact OE1-ND1 2.67Å; E253-H257 PolarHBondContact OE1-ND1 3.08Å; D254-H257 PolarHBondContact O-N 3.44Å; D254-H257 VanDerWaalsContact O-N 3.11Å; D254-H257 PolarHBondContact OD1-N 3.22Å; Q255-H257 VanDerWaalsContact C-N 3.31Å; H257-N398 PolarHBondContact O-ND2 3.36Å
258	N	87.9	Confident	91.3	Very high	25 Å²	25	55 Å²	55	13%	0.134	29%	0.289	C	S	.	.			trans	-85.3	134.1	177.7	-80.9	-56.9	0	0	0	112.5	E253 D254 N256 N398 E403	E253-N258 CarbonylContact C-O 3.59Å; E253-N258 WeakPolarHBondContact CA-O 3.28Å; D254-N258 PolarHBondContact N-O 3.18Å; D254-N258 WeakPolarHBondContact OD1-CB 3.37Å; D254-N258 PolarHBondContact OD1-N 3.02Å; D254-N258 WeakPolarHBondContact OD2-CB 3.28Å; N256-N258 PolarHBondContact O-N 2.95Å; N258-N398 WeakPolarHBondContact CA-ND2 3.34Å; N258-N398 WeakPolarHBondContact OD1-CB 3.31Å; N258-N398 PolarHBondContact OD1-ND2 3.35Å; N258-E403 VanDerWaalsContact CG-OE2 3.24Å; N258-E403 PolarHBondContact ND2-OE2 3.31Å; N258-E403 PolarHBondContact OD1-OE2 2.9Å
259	M	92.1	Very high	91.5	Very high	15 Å²	15	53.2 Å²	53.2	7%	0.074	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	128.3	177.8	-65.8	-60.7	-50.7	0	0	110.7	L251 R252 E253 H394 K397 N398	L251-M259 HydrophobicContact CB-CE 3.77Å; R252-M259 WeakPolarHBondContact O-CA 3.44Å; E253-M259 HydrophobicContact CB-SD 4.04Å; E253-M259 HydrophobicContact CG-SD 4.37Å; M259-H394 WeakPolarHBondContact CE-NE2 3.47Å; M259-H394 VanDerWaalsContact CG-O 3.3Å; M259-H394 WeakPolarHBondContact CG-O 3.32Å; M259-K397 HydrophobicContact CG-CB 4.39Å; M259-N398 WeakPolarHBondContact CG-OD1 3.33Å; M259-N398 PolarHBondContact N-OD1 3.22Å
260	Y	93.6	Very high	91.5	Very high	23 Å²	23	53.6 Å²	53.6	9%	0.09	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	161.5	179.2	77.7	-80.1	0	0	0	112.1	E155 N157 L251 R252 D254 A262	E155-Y260 PolarHBondContact O-OH 2.99Å; N157-Y260 HydrophobicContact CB-CD1 3.77Å; N157-Y260 HydrophobicContact CB-CD2 3.74Å; N157-Y260 HydrophobicContact CB-CE1 4.12Å; N157-Y260 HydrophobicContact CB-CE2 4.07Å; N157-Y260 HydrophobicContact CB-CG 3.57Å; L251-Y260 WeakPolarHBondContact CA-O 3.22Å; R252-Y260 HydrophobicContact CB-CD1 4.21Å; R252-Y260 HydrophobicContact CB-CE1 3.59Å; R252-Y260 PolarHBondContact N-O 2.85Å; R252-Y260 VanDerWaalsContact O-CD1 3.31Å; R252-Y260 WeakPolarHBondContact O-CD1 3.3Å; R252-Y260 PolarHBondContact O-N 3.11Å; D254-Y260 HydrophobicContact CB-CD1 4.03Å; D254-Y260 HydrophobicContact CB-CE1 3.99Å; Y260-A262 HydrophobicContact CE2-CB 4.2Å
261	V	94.6	Very high	91.4	Very high	19 Å²	19	50.3 Å²	50.3	12%	0.115	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	111.2	177	-175.9	0	0	0	0	109.5	I222 I229 K249 L251 C264 L395	I222-V261 HydrophobicContact CD1-CG2 3.76Å; I229-V261 HydrophobicContact CD1-CG2 4.38Å; I229-V261 HydrophobicContact CG2-CG1 3.97Å; I229-V261 HydrophobicContact CG2-CG2 4.18Å; K249-V261 HydrophobicContact CB-CG1 3.41Å; K249-V261 VanDerWaalsContact CB-CG1 3.41Å; K249-V261 HydrophobicContact CG-CG1 4.11Å; L251-V261 HydrophobicContact CD2-CG2 3.79Å; V261-C264 HydrophobicContact CB-CB 3.98Å; V261-C264 HydrophobicContact CG1-CB 3.92Å; V261-C264 WeakPolarHBondContact O-CB 3.38Å; V261-C264 PolarHBondContact O-N 2.84Å; V261-L395 HydrophobicContact CG2-CD1 4.14Å
262	A	93	Very high	91.2	Very high	17 Å²	17	49.7 Å²	49.7	14%	0.14	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	132.9	-179.4	0	0	0	0	0	111.7	I250 R252 Y260 C264	I250-A262 WeakPolarHBondContact O-CB 3.4Å; I250-A262 PolarHBondContact O-N 3.31Å; R252-A262 HydrophobicContact CB-CB 4.36Å; R252-A262 HydrophobicContact CG-CB 3.83Å; Y260-A262 HydrophobicContact CE2-CB 4.2Å; A262-C264 VanDerWaalsContact C-N 3.26Å; A262-C264 PolarHBondContact O-N 3.45Å
263	G	88.8	Confident	91	Very high	61 Å²	61	47 Å²	47	63%	0.629	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	24.1	-178.9	0	0	0	0	0	113.7	K249	K249-G263 PolarHBondContact NZ-O 2.59Å
264	C	91.9	Very high	90.9	Very high	23 Å²	23	44.8 Å²	44.8	16%	0.155	25%	0.245	C	C	.	.			trans	-76.1	139.1	168.9	-169.7	0	0	0	0	109.9	I222 V261 A262 E266	I222-C264 WeakPolarHBondContact CG2-SG 3.32Å; V261-C264 HydrophobicContact CB-CB 3.98Å; V261-C264 HydrophobicContact CG1-CB 3.92Å; V261-C264 WeakPolarHBondContact O-CB 3.38Å; V261-C264 PolarHBondContact O-N 2.84Å; A262-C264 VanDerWaalsContact C-N 3.26Å; A262-C264 PolarHBondContact O-N 3.45Å; C264-E266 PolarHBondContact O-N 2.96Å
265	T	92.7	Very high	91.1	Very high	47 Å²	47	43.8 Å²	43.8	29%	0.288	24%	0.24	S	C	.	.			trans	-72.1	120.4	175.9	-53.6	0	0	0	0	109.6	S220 D231 L233 V267	S220-T265 WeakPolarHBondContact CB-O 3.49Å; D231-T265 WeakPolarHBondContact OD2-CB 3.48Å; D231-T265 PolarHBondContact OD2-N 3.19Å; D231-T265 PolarHBondContact OD2-OG1 3.27Å; L233-T265 HydrophobicContact CB-CG2 4.18Å; T265-V267 HydrophobicContact CG2-CG2 4Å
266	E	93.6	Very high	91.3	Very high	52 Å²	52	36.3 Å²	36.3	24%	0.243	21%	0.205	C	C	.	.			trans	-108.4	116.2	172.4	-62.2	-168.7	166.8	0	0	109.1	P153 C264 K307	P153-E266 WeakPolarHBondContact CB-OE2 3.41Å; P153-E266 HydrophobicContact CG-CB 4.08Å; P153-E266 WeakPolarHBondContact CG-OE2 3.16Å; C264-E266 PolarHBondContact O-N 2.96Å; E266-K307 WeakPolarHBondContact OE1-CE 3.27Å; E266-K307 IonicContact OE1-NZ 2.59Å; E266-K307 PolarHBondContact OE1-NZ 3.33Å; E266-K307 IonicContact OE2-NZ 2.84Å; E266-K307 PolarHBondContact OE2-NZ 3.05Å
267	V	94.5	Very high	91.6	Very high	37 Å²	37	35.5 Å²	35.5	22%	0.224	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	118.5	-176.5	-174.9	0	0	0	0	109.1	F218 V219 L233 T265 V269 V278	F218-V267 WeakPolarHBondContact CA-O 3.42Å; V219-V267 HydrophobicContact CG2-CB 4.25Å; V219-V267 PolarHBondContact N-O 3.45Å; V219-V267 PolarHBondContact O-N 3.37Å; L233-V267 HydrophobicContact CD1-CG2 4Å; T265-V267 HydrophobicContact CG2-CG2 4Å; V267-V269 HydrophobicContact CG1-CG1 4.27Å; V267-V269 PolarHBondContact O-N 3.37Å; V267-V278 HydrophobicContact CB-CG1 4.32Å; V267-V278 HydrophobicContact CB-CG2 4.35Å; V267-V278 HydrophobicContact CG1-CG2 3.85Å; V267-V278 HydrophobicContact CG2-CG1 4.25Å
268	E	95.3	Very high	92	Very high	14 Å²	14	30.6 Å²	30.6	7%	0.065	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	126.6	171	-170.1	-173.7	-165.5	0	0	110.1	R148 F149 S216 V217 F218 K270	R148-E268 WeakPolarHBondContact CA-OE1 3.44Å; R148-E268 WeakPolarHBondContact CA-OE2 3.5Å; R148-E268 WeakPolarHBondContact CB-OE2 3.37Å; R148-E268 PolarHBondContact NH2-O 2.96Å; F149-E268 PolarHBondContact N-OE1 3.18Å; F149-E268 PolarHBondContact N-OE2 3.06Å; S216-E268 PolarHBondContact OG-OE1 3.23Å; V217-E268 WeakPolarHBondContact O-CA 3.28Å; F218-E268 HydrophobicContact CD1-CB 3.87Å; F218-E268 HydrophobicContact CD1-CG 4.4Å; F218-E268 HydrophobicContact CE1-CB 3.6Å; F218-E268 HydrophobicContact CE1-CG 3.93Å; F218-E268 HydrophobicContact CZ-CB 4.35Å; F218-E268 HydrophobicContact CZ-CG 4.18Å; E268-K270 VanDerWaalsContact OE1-CE 3.24Å; E268-K270 WeakPolarHBondContact OE1-CE 3.4Å; E268-K270 IonicContact OE1-NZ 3.54Å; E268-K270 PolarHBondContact OE1-NZ 3.32Å
269	V	95.3	Very high	92.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	143.3	-177	-70.7	0	0	0	0	110.6	F138 V217 V219 V267 E274 A275 V278	F138-V269 HydrophobicContact CZ-CB 4.29Å; F138-V269 HydrophobicContact CZ-CG2 3.84Å; V217-V269 HydrophobicContact CB-CG2 4.03Å; V217-V269 HydrophobicContact CG1-CG2 3.75Å; V217-V269 PolarHBondContact O-N 3.39Å; V219-V269 HydrophobicContact CG1-CG2 3.83Å; V219-V269 HydrophobicContact CG2-CG1 3.78Å; V219-V269 HydrophobicContact CG2-CG2 4.14Å; V267-V269 HydrophobicContact CG1-CG1 4.27Å; V267-V269 PolarHBondContact O-N 3.37Å; V269-E274 HydrophobicContact CB-CB 4.39Å; V269-E274 HydrophobicContact CB-CG 4.38Å; V269-E274 HydrophobicContact CG1-CB 4.4Å; V269-E274 HydrophobicContact CG1-CG 4.03Å; V269-A275 HydrophobicContact CB-CB 4.24Å; V269-A275 HydrophobicContact CG1-CB 4.37Å; V269-A275 HydrophobicContact CG2-CB 4.08Å; V269-V278 HydrophobicContact CG1-CG2 4.1Å
270	K	93.1	Very high	91.9	Very high	39 Å²	39	31.1 Å²	31.1	17%	0.17	18%	0.178	C	C	.	.			trans	-113.5	-11	-176	-65.4	-62.1	174.1	-164.1	0	115.2	Q145 A146 R148 S216 E268 E274	Q145-K270 PolarHBondContact NE2-O 2.95Å; Q145-K270 PolarHBondContact OE1-O 3.35Å; A146-K270 WeakPolarHBondContact O-CE 3.34Å; A146-K270 PolarHBondContact O-NZ 3.01Å; R148-K270 HydrophobicContact CG-CD 4.35Å; R148-K270 VanDerWaalsContact CG-CE 3.47Å; R148-K270 HydrophobicContact CG-CG 3.98Å; S216-K270 PolarHBondContact OG-NZ 3Å; S216-K270 VanDerWaalsContact OG-NZ 3.12Å; E268-K270 VanDerWaalsContact OE1-CE 3.24Å; E268-K270 WeakPolarHBondContact OE1-CE 3.4Å; E268-K270 IonicContact OE1-NZ 3.54Å; E268-K270 PolarHBondContact OE1-NZ 3.32Å; K270-E274 PolarHBondContact N-OE2 3.08Å
271	S	92.4	Very high	91.7	Very high	40 Å²	40	33.8 Å²	33.8	28%	0.28	19%	0.19	S	C	.	.	S	Bend	trans	-147.3	164.8	177.5	79.8	0	0	0	0	111.5	F138 E273 E274 A275	F138-S271 VanDerWaalsContact CE2-C 3.46Å; F138-S271 WeakPolarHBondContact CE2-O 3.34Å; S271-E273 WeakPolarHBondContact CB-OE2 3.25Å; S271-E273 PolarHBondContact O-N 3.26Å; S271-E273 PolarHBondContact OG-N 3.09Å; S271-E273 PolarHBondContact OG-OE2 2.97Å; S271-E274 PolarHBondContact O-N 3.06Å; S271-E274 PolarHBondContact OG-N 3.41Å; S271-A275 PolarHBondContact O-N 3.24Å; S271-A275 VanDerWaalsContact O-N 3.07Å
272	T	90.8	Very high	91.4	Very high	5 Å²	5	32.9 Å²	32.9	3%	0.031	19%	0.185	C	C	.	.	H	α-helix	trans	-56.1	-40.3	176.3	-51.9	0	0	0	0	111	L134 D135 F138 I198 A275 F276	L134-T272 HydrophobicContact CB-CG2 4.01Å; D135-T272 HydrophobicContact CB-CG2 4.09Å; F138-T272 VanDerWaalsContact CD2-N 3.28Å; I198-T272 HydrophobicContact CD1-CG2 3.28Å; T272-A275 PolarHBondContact O-N 3.25Å; T272-F276 WeakPolarHBondContact O-CB 3.41Å; T272-F276 PolarHBondContact O-N 3.16Å
273	E	88.3	Confident	91.1	Very high	89 Å²	89	32.9 Å²	32.9	42%	0.416	18%	0.182	S	C	.	.	H	α-helix	trans	-65.8	-44.8	-179.5	-53.3	75.2	-159.5	0	0	111.6	F194 S271 A275 F276 D277	F194-E273 HydrophobicContact CE2-CB 3.74Å; F194-E273 HydrophobicContact CE2-CG 3.65Å; F194-E273 HydrophobicContact CZ-CB 3.85Å; F194-E273 HydrophobicContact CZ-CG 3.41Å; F194-E273 VanDerWaalsContact CZ-CG 3.41Å; S271-E273 WeakPolarHBondContact CB-OE2 3.25Å; S271-E273 PolarHBondContact O-N 3.26Å; S271-E273 PolarHBondContact OG-N 3.09Å; S271-E273 PolarHBondContact OG-OE2 2.97Å; E273-A275 VanDerWaalsContact C-N 3.34Å; E273-A275 PolarHBondContact O-N 2.96Å; E273-F276 PolarHBondContact O-N 3.01Å; E273-D277 PolarHBondContact O-N 3.48Å
274	E	91.4	Very high	90.8	Very high	45 Å²	45	34.7 Å²	34.7	21%	0.21	17%	0.172	C	C	.	.	H	α-helix	trans	-64.2	-40.2	177.6	-164.8	-175.3	-179.6	0	0	111.4	R148 V269 K270 S271 F276 D277 V278	R148-E274 IonicContact CZ-OE1 2.74Å; R148-E274 VanDerWaalsContact CZ-OE1 3.23Å; R148-E274 IonicContact NH1-OE1 2.76Å; R148-E274 PolarHBondContact NH1-OE1 2.82Å; R148-E274 IonicContact NH1-OE2 2.99Å; R148-E274 PolarHBondContact NH1-OE2 3.15Å; R148-E274 IonicContact NH2-OE1 3.08Å; R148-E274 PolarHBondContact NH2-OE1 3.25Å; V269-E274 HydrophobicContact CB-CB 4.39Å; V269-E274 HydrophobicContact CB-CG 4.38Å; V269-E274 HydrophobicContact CG1-CB 4.4Å; V269-E274 HydrophobicContact CG1-CG 4.03Å; K270-E274 PolarHBondContact N-OE2 3.08Å; S271-E274 PolarHBondContact O-N 3.06Å; S271-E274 PolarHBondContact OG-N 3.41Å; E274-F276 VanDerWaalsContact C-N 3.35Å; E274-D277 PolarHBondContact O-N 3.47Å; E274-V278 WeakPolarHBondContact O-CG2 3.38Å; E274-V278 PolarHBondContact O-N 3.35Å; E274-V278 VanDerWaalsContact O-N 3.14Å
275	A	92.5	Very high	90.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.2	-39.6	175.9	0	0	0	0	0	112.2	L134 F138 V219 V269 S271 T272 E273 V278 F279	L134-A275 HydrophobicContact CD1-CB 3.82Å; L134-A275 HydrophobicContact CD2-CB 3.98Å; L134-A275 HydrophobicContact CG-CB 4.43Å; F138-A275 HydrophobicContact CE2-CB 3.95Å; F138-A275 HydrophobicContact CZ-CB 4.49Å; V219-A275 HydrophobicContact CG1-CB 4.46Å; V269-A275 HydrophobicContact CB-CB 4.24Å; V269-A275 HydrophobicContact CG1-CB 4.37Å; V269-A275 HydrophobicContact CG2-CB 4.08Å; S271-A275 PolarHBondContact O-N 3.24Å; S271-A275 VanDerWaalsContact O-N 3.07Å; T272-A275 PolarHBondContact O-N 3.25Å; E273-A275 VanDerWaalsContact C-N 3.34Å; E273-A275 PolarHBondContact O-N 2.96Å; A275-V278 PolarHBondContact O-N 2.92Å; A275-F279 PolarHBondContact O-N 2.98Å
276	F	88.5	Confident	89.7	Confident	10 Å²	10	34.7 Å²	34.7	4%	0.044	17%	0.166	C	C	.	.	H	α-helix	trans	-71.1	-35.9	176.8	-123.4	-96.3	0	0	0	113.1	L130 P131 L134 M197 T272 E273 E274 V278 F279 W280	L130-F276 HydrophobicContact CD2-CD2 4.17Å; L130-F276 HydrophobicContact CD2-CE2 3.35Å; L130-F276 HydrophobicContact CD2-CZ 3.91Å; P131-F276 HydrophobicContact CB-CD2 4.26Å; P131-F276 HydrophobicContact CB-CE2 3.36Å; P131-F276 HydrophobicContact CB-CZ 3.57Å; P131-F276 HydrophobicContact CG-CE2 4.06Å; P131-F276 HydrophobicContact CG-CZ 3.86Å; L134-F276 HydrophobicContact CD1-CD2 3.75Å; L134-F276 HydrophobicContact CD1-CE2 4.08Å; M197-F276 HydrophobicContact CE-CE1 3.99Å; M197-F276 HydrophobicContact CE-CZ 4.05Å; M197-F276 HydrophobicContact SD-CD1 4.39Å; M197-F276 HydrophobicContact SD-CE1 3.56Å; M197-F276 VanDerWaalsContact SD-CE1 3.56Å; M197-F276 HydrophobicContact SD-CZ 4.2Å; T272-F276 WeakPolarHBondContact O-CB 3.41Å; T272-F276 PolarHBondContact O-N 3.16Å; E273-F276 PolarHBondContact O-N 3.01Å; E274-F276 VanDerWaalsContact C-N 3.35Å; F276-V278 VanDerWaalsContact C-N 3.27Å; F276-V278 PolarHBondContact O-N 3.24Å; F276-F279 HydrophobicContact CD1-CD1 4.22Å; F276-F279 AromaticContact CE1-CD1 3.88Å; F276-F279 HydrophobicContact CE1-CD1 3.88Å; F276-F279 HydrophobicContact CE1-CE1 4.21Å; F276-F279 HydrophobicContact CZ-CD1 4.1Å; F276-F279 HydrophobicContact CZ-CE1 4.31Å; F276-F279 WeakPolarHBondContact O-CB 3.02Å; F276-F279 PolarHBondContact O-N 3.43Å; F276-W280 WeakPolarHBondContact O-CB 3.27Å; F276-W280 PolarHBondContact O-N 3.28Å
277	D	89	Confident	88.6	Confident	65 Å²	65	38.7 Å²	38.7	35%	0.348	18%	0.179	S	C	.	.	H	α-helix	trans	-59	-41.9	172.3	-83.4	-19.7	0	0	0	111.1	E273 E274 W280 K281	E273-D277 PolarHBondContact O-N 3.48Å; E274-D277 PolarHBondContact O-N 3.47Å; D277-W280 PolarHBondContact O-N 3.31Å; D277-K281 WeakPolarHBondContact O-CB 3.36Å; D277-K281 PolarHBondContact O-N 2.8Å
278	V	92.6	Very high	87	Confident	17 Å²	17	41.9 Å²	41.9	10%	0.103	19%	0.193	C	C	.	.	H	α-helix	trans	-66.4	-45	175.5	176.4	0	0	0	0	111.2	V219 L233 V267 V269 E274 A275 F276 W280 K281 G282	V219-V278 HydrophobicContact CG2-CB 4.1Å; V219-V278 HydrophobicContact CG2-CG1 3.72Å; V219-V278 HydrophobicContact CG2-CG2 4.48Å; L233-V278 HydrophobicContact CD1-CG1 3.45Å; L233-V278 VanDerWaalsContact CD1-CG1 3.45Å; L233-V278 HydrophobicContact CD2-CG1 3.55Å; L233-V278 WeakPolarHBondContact CD2-O 3.3Å; L233-V278 HydrophobicContact CG-CG1 4.13Å; V267-V278 HydrophobicContact CB-CG1 4.32Å; V267-V278 HydrophobicContact CB-CG2 4.35Å; V267-V278 HydrophobicContact CG1-CG2 3.85Å; V267-V278 HydrophobicContact CG2-CG1 4.25Å; V269-V278 HydrophobicContact CG1-CG2 4.1Å; E274-V278 WeakPolarHBondContact O-CG2 3.38Å; E274-V278 PolarHBondContact O-N 3.35Å; E274-V278 VanDerWaalsContact O-N 3.14Å; A275-V278 PolarHBondContact O-N 2.92Å; F276-V278 VanDerWaalsContact C-N 3.27Å; F276-V278 PolarHBondContact O-N 3.24Å; V278-W280 VanDerWaalsContact C-N 3.34Å; V278-W280 PolarHBondContact O-N 3.13Å; V278-K281 WeakPolarHBondContact O-CB 3.41Å; V278-K281 PolarHBondContact O-N 3.07Å; V278-G282 PolarHBondContact O-N 3.24Å; V278-G282 VanDerWaalsContact O-N 3.1Å
279	F	91.8	Very high	85.1	Confident	3 Å²	3	43.6 Å²	43.6	1%	0.013	21%	0.21	C	C	.	.	H	α-helix	trans	-56.8	-47.5	173.9	171.5	-103.7	0	0	0	111.6	T121 L130 Y221 A275 F276 G282 Q283 F304	T121-F279 HydrophobicContact CG2-CE1 3.75Å; T121-F279 HydrophobicContact CG2-CZ 3.92Å; L130-F279 HydrophobicContact CD1-CD2 3.75Å; L130-F279 HydrophobicContact CD1-CE2 3.51Å; L130-F279 HydrophobicContact CD1-CZ 4.09Å; L130-F279 HydrophobicContact CD2-CD2 4.33Å; L130-F279 HydrophobicContact CD2-CG 4.32Å; Y221-F279 HydrophobicContact CD1-CD2 4.24Å; Y221-F279 AromaticContact CE1-CD2 3.85Å; Y221-F279 HydrophobicContact CE1-CD2 3.85Å; Y221-F279 AromaticContact CE1-CE2 3.96Å; Y221-F279 HydrophobicContact CE1-CE2 3.96Å; Y221-F279 HydrophobicContact CE2-CE2 4.4Å; Y221-F279 AromaticContact CZ-CE2 3.77Å; A275-F279 PolarHBondContact O-N 2.98Å; F276-F279 HydrophobicContact CD1-CD1 4.22Å; F276-F279 AromaticContact CE1-CD1 3.88Å; F276-F279 HydrophobicContact CE1-CD1 3.88Å; F276-F279 HydrophobicContact CE1-CE1 4.21Å; F276-F279 HydrophobicContact CZ-CD1 4.1Å; F276-F279 HydrophobicContact CZ-CE1 4.31Å; F276-F279 WeakPolarHBondContact O-CB 3.02Å; F276-F279 PolarHBondContact O-N 3.43Å; F279-G282 PolarHBondContact O-N 3.33Å; F279-Q283 HydrophobicContact CD1-CG 4.14Å; F279-Q283 HydrophobicContact CD2-CG 4.42Å; F279-Q283 HydrophobicContact CE1-CG 3.67Å; F279-Q283 HydrophobicContact CE2-CG 3.98Å; F279-Q283 HydrophobicContact CG-CG 4.49Å; F279-Q283 HydrophobicContact CZ-CG 3.59Å; F279-Q283 WeakPolarHBondContact O-CG 3.43Å; F279-Q283 PolarHBondContact O-N 3.04Å; F279-F304 HydrophobicContact CB-CD2 4.39Å; F279-F304 HydrophobicContact CB-CE2 3.77Å; F279-F304 HydrophobicContact CB-CZ 4.24Å; F279-F304 AromaticContact CD2-CD2 3.75Å; F279-F304 HydrophobicContact CD2-CD2 3.75Å; F279-F304 HydrophobicContact CD2-CE2 4.01Å; F279-F304 HydrophobicContact CD2-CG 4.32Å; F279-F304 HydrophobicContact CG-CE2 4.38Å
280	W	87.1	Confident	83.2	Confident	48 Å²	48	44.8 Å²	44.8	18%	0.182	22%	0.216	C	C	.	.	H	α-helix	trans	-68.2	-37	-179	-164.9	-125.5	0	0	0	112.5	F276 D277 V278 G282 Q283 K284	F276-W280 WeakPolarHBondContact O-CB 3.27Å; F276-W280 PolarHBondContact O-N 3.28Å; D277-W280 PolarHBondContact O-N 3.31Å; V278-W280 VanDerWaalsContact C-N 3.34Å; V278-W280 PolarHBondContact O-N 3.13Å; W280-G282 VanDerWaalsContact C-N 3.28Å; W280-G282 PolarHBondContact O-N 2.94Å; W280-Q283 HydrophobicContact CE3-CB 4.12Å; W280-Q283 HydrophobicContact CE3-CG 4.41Å; W280-Q283 PolarHBondContact O-N 3.45Å; W280-K284 VanDerWaalsContact CD1-CE 3.49Å; W280-K284 WeakPolarHBondContact O-CG 3.37Å; W280-K284 PolarHBondContact O-N 3.08Å
281	K	88.6	Confident	80.9	Confident	78 Å²	78	48.5 Å²	48.5	34%	0.339	24%	0.242	S	C	.	.	H	α-helix	trans	-54.9	-46.4	170.2	-179.7	-176	177.5	-171.2	0	110.6	D235 D277 V278 K284 K285	D235-K281 WeakPolarHBondContact OD1-CE 3.47Å; D235-K281 IonicContact OD1-NZ 3.49Å; D235-K281 PolarHBondContact OD1-NZ 3.01Å; D235-K281 IonicContact OD2-NZ 3.87Å; D235-K281 PolarHBondContact OD2-NZ 3.19Å; D277-K281 WeakPolarHBondContact O-CB 3.36Å; D277-K281 PolarHBondContact O-N 2.8Å; V278-K281 WeakPolarHBondContact O-CB 3.41Å; V278-K281 PolarHBondContact O-N 3.07Å; K281-K284 PolarHBondContact O-N 2.75Å; K281-K285 PolarHBondContact O-N 2.81Å
282	G	89.3	Confident	78.7	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-69	-38.7	176	0	0	0	0	0	113.4	V278 F279 W280 K284 K285 R286	V278-G282 PolarHBondContact O-N 3.24Å; V278-G282 VanDerWaalsContact O-N 3.1Å; F279-G282 PolarHBondContact O-N 3.33Å; W280-G282 VanDerWaalsContact C-N 3.28Å; W280-G282 PolarHBondContact O-N 2.94Å; G282-K284 VanDerWaalsContact C-N 3.34Å; G282-K284 PolarHBondContact O-N 3.11Å; G282-K285 PolarHBondContact O-N 2.84Å; G282-R286 WeakPolarHBondContact O-CB 3.26Å; G282-R286 PolarHBondContact O-N 2.95Å
283	Q	85.3	Confident	76.3	Confident	17 Å²	17	59.9 Å²	59.9	8%	0.079	29%	0.294	C	S	.	.	H	α-helix	trans	-61.3	-40.1	174.2	-75.1	-69.6	82.1	0	0	112.5	Y221 F279 W280 R286 R287	Y221-Q283 HydrophobicContact CE1-CG 4.11Å; Y221-Q283 PolarHBondContact OH-OE1 2.93Å; F279-Q283 HydrophobicContact CD1-CG 4.14Å; F279-Q283 HydrophobicContact CD2-CG 4.42Å; F279-Q283 HydrophobicContact CE1-CG 3.67Å; F279-Q283 HydrophobicContact CE2-CG 3.98Å; F279-Q283 HydrophobicContact CG-CG 4.49Å; F279-Q283 HydrophobicContact CZ-CG 3.59Å; F279-Q283 WeakPolarHBondContact O-CG 3.43Å; F279-Q283 PolarHBondContact O-N 3.04Å; W280-Q283 HydrophobicContact CE3-CB 4.12Å; W280-Q283 HydrophobicContact CE3-CG 4.41Å; W280-Q283 PolarHBondContact O-N 3.45Å; Q283-R286 WeakPolarHBondContact O-CB 3.21Å; Q283-R286 PolarHBondContact O-N 3.13Å; Q283-R287 WeakPolarHBondContact O-CG 3.32Å; Q283-R287 PolarHBondContact O-N 2.94Å
284	K	82.9	Confident	74.2	Confident	99 Å²	99	56.1 Å²	56.1	43%	0.43	28%	0.277	S	S	.	.	H	α-helix	trans	-61.9	-46.7	174.3	-77.4	177.5	173.6	168.9	0	111.1	W280 K281 G282 R286 R287 I288	W280-K284 VanDerWaalsContact CD1-CE 3.49Å; W280-K284 WeakPolarHBondContact O-CG 3.37Å; W280-K284 PolarHBondContact O-N 3.08Å; K281-K284 PolarHBondContact O-N 2.75Å; G282-K284 VanDerWaalsContact C-N 3.34Å; G282-K284 PolarHBondContact O-N 3.11Å; K284-R286 VanDerWaalsContact C-N 3.34Å; K284-R286 PolarHBondContact O-N 3.23Å; K284-R287 PolarHBondContact O-N 3.16Å; K284-I288 VanDerWaalsContact O-CG1 3.31Å; K284-I288 WeakPolarHBondContact O-CG1 3.2Å; K284-I288 PolarHBondContact O-N 2.89Å
285	K	81.6	Confident	71.9	Confident	64 Å²	64	66 Å²	66	28%	0.278	31%	0.313	S	S	.	.	H	α-helix	trans	-59.9	-43.4	175.7	-79.9	171.8	172.3	-178.2	0	111.9	L232 L233 E234 D235 K281 G282 R287 I288 A289	L232-K285 WeakPolarHBondContact O-CD 3.17Å; L233-K285 PolarHBondContact O-NZ 2.74Å; E234-K285 PolarHBondContact O-NZ 3.23Å; D235-K285 IonicContact OD1-NZ 2.83Å; D235-K285 PolarHBondContact OD1-NZ 3.27Å; K281-K285 PolarHBondContact O-N 2.81Å; G282-K285 PolarHBondContact O-N 2.84Å; K285-R287 PolarHBondContact O-N 3.27Å; K285-I288 PolarHBondContact O-N 2.81Å; K285-A289 PolarHBondContact O-N 2.92Å; K285-A289 VanDerWaalsContact O-N 3.1Å
286	R	80.8	Confident	70.3	Confident	6 Å²	6	70.6 Å²	70.6	2%	0.023	33%	0.334	C	S	.	.	H	α-helix	trans	-59.3	-43.6	174	-170.7	178.1	177.7	-162.4	1.2	112.5	E223 L232 G282 Q283 K284 N290 S297 S300 S302	E223-R286 WeakPolarHBondContact OE1-CG 3.34Å; E223-R286 IonicContact OE1-NE 3.65Å; E223-R286 PolarHBondContact OE1-NE 2.85Å; L232-R286 HydrophobicContact CD1-CB 4.34Å; L232-R286 HydrophobicContact CD2-CB 4.14Å; G282-R286 WeakPolarHBondContact O-CB 3.26Å; G282-R286 PolarHBondContact O-N 2.95Å; Q283-R286 WeakPolarHBondContact O-CB 3.21Å; Q283-R286 PolarHBondContact O-N 3.13Å; K284-R286 VanDerWaalsContact C-N 3.34Å; K284-R286 PolarHBondContact O-N 3.23Å; R286-N290 PolarHBondContact O-N 2.81Å; R286-N290 VanDerWaalsContact O-N 3.08Å; R286-S297 PolarHBondContact NH2-O 2.85Å; R286-S300 PolarHBondContact NE-OG 3.11Å; R286-S300 PolarHBondContact NH2-O 3.47Å; R286-S300 VanDerWaalsContact NH2-O 3.1Å; R286-S300 PolarHBondContact NH2-OG 2.75Å; R286-S302 VanDerWaalsContact NH1-CB 3.26Å; R286-S302 PolarHBondContact NH1-OG 2.96Å
287	R	70.1	Confident	69.2	Low	137 Å²	137	72.5 Å²	72.5	52%	0.517	35%	0.349	S	S	.	.	H	α-helix	trans	-66.2	-38.1	177.3	-74.5	179.6	-177.5	-177.3	2.9	113.1	Q283 K284 K285 N290 T291	Q283-R287 WeakPolarHBondContact O-CG 3.32Å; Q283-R287 PolarHBondContact O-N 2.94Å; K284-R287 PolarHBondContact O-N 3.16Å; K285-R287 PolarHBondContact O-N 3.27Å; R287-N290 WeakPolarHBondContact O-CB 3.35Å; R287-N290 PolarHBondContact O-N 2.97Å; R287-T291 PolarHBondContact O-N 3.04Å; R287-T291 PolarHBondContact O-OG1 3.04Å
288	I	60.3	Low	68.3	Low	103 Å²	103	70 Å²	70	53%	0.528	34%	0.336	S	S	.	.	H	α-helix	trans	-66.4	-45	178.4	-67.1	163.1	0	0	0	110.4	K284 K285 N290 T291 E292	K284-I288 VanDerWaalsContact O-CG1 3.31Å; K284-I288 WeakPolarHBondContact O-CG1 3.2Å; K284-I288 PolarHBondContact O-N 2.89Å; K285-I288 PolarHBondContact O-N 2.81Å; I288-N290 PolarHBondContact O-N 3.02Å; I288-T291 WeakPolarHBondContact CA-OG1 3.42Å; I288-T291 PolarHBondContact O-N 2.85Å; I288-T291 VanDerWaalsContact O-N 3.13Å; I288-T291 PolarHBondContact O-OG1 2.86Å; I288-E292 PolarHBondContact O-N 2.78Å
289	A	56.4	Low	67.5	Low	51 Å²	51	71.3 Å²	71.3	42%	0.421	34%	0.339	S	S	.	.	H	α-helix	trans	-59.3	-36.1	173.7	0	0	0	0	0	112	K285	K285-A289 PolarHBondContact O-N 2.92Å; K285-A289 VanDerWaalsContact O-N 3.1Å
290	N	55.4	Low	67.2	Low	24 Å²	24	71.2 Å²	71.2	13%	0.128	34%	0.339	C	S	.	.	H	α-helix	trans	-63.8	-48.3	172.5	-78.6	-14.4	0	0	0	111.8	R286 R287 I288 E292 L293 N294	R286-N290 PolarHBondContact O-N 2.81Å; R286-N290 VanDerWaalsContact O-N 3.08Å; R287-N290 WeakPolarHBondContact O-CB 3.35Å; R287-N290 PolarHBondContact O-N 2.97Å; I288-N290 PolarHBondContact O-N 3.02Å; N290-E292 VanDerWaalsContact C-N 3.25Å; N290-E292 PolarHBondContact O-N 2.74Å; N290-E292 VanDerWaalsContact O-N 3.14Å; N290-L293 PolarHBondContact O-N 2.86Å; N290-L293 VanDerWaalsContact O-N 3.13Å; N290-N294 CarbonylContact C-O 3.59Å; N290-N294 WeakPolarHBondContact CA-O 3.29Å; N290-N294 WeakPolarHBondContact CB-O 2.98Å; N290-N294 CarbonylContact O-C 3.24Å; N290-N294 VanDerWaalsContact O-C 3.24Å; N290-N294 WeakPolarHBondContact O-CA 3.49Å; N290-N294 PolarHBondContact O-N 2.96Å
291	T	44.8	Very low	67.4	Low	117 Å²	117	69.2 Å²	69.2	72%	0.718	33%	0.331	S	S	*	.	H	α-helix	trans	-62.6	-24.9	-177.6	45.4	0	0	0	0	115.4	R287 I288	R287-T291 PolarHBondContact O-N 3.04Å; R287-T291 PolarHBondContact O-OG1 3.04Å; I288-T291 WeakPolarHBondContact CA-OG1 3.42Å; I288-T291 PolarHBondContact O-N 2.85Å; I288-T291 VanDerWaalsContact O-N 3.13Å; I288-T291 PolarHBondContact O-OG1 2.86Å
292	E	45.5	Very low	67.6	Low	157 Å²	157	65.7 Å²	65.7	73%	0.734	32%	0.317	S	S	*	.	H	α-helix	trans	-74.8	-21.9	177.9	-71.2	-173.1	159.4	0	0	113.2	I288 N290	I288-E292 PolarHBondContact O-N 2.78Å; N290-E292 VanDerWaalsContact C-N 3.25Å; N290-E292 PolarHBondContact O-N 2.74Å; N290-E292 VanDerWaalsContact O-N 3.14Å
293	L	40.5	Very low	68	Low	127 Å²	127	65.8 Å²	65.8	67%	0.665	32%	0.317	S	S	*	.	H	α-helix	trans	-143.2	-28.9	-175.3	-87	147.4	0	0	0	116.8	N290 R352	N290-L293 PolarHBondContact O-N 2.86Å; N290-L293 VanDerWaalsContact O-N 3.13Å; L293-R352 PolarHBondContact O-NH2 3.11Å
294	N	43.3	Very low	68.6	Low	11 Å²	11	65 Å²	65	6%	0.059	31%	0.314	C	S	.	.			trans	-157.6	137.4	-171	-69.3	-44.5	0	0	0	114.8	Y225 N290 E296 R299 R352 E355	Y225-N294 PolarHBondContact OH-ND2 2.83Å; N290-N294 CarbonylContact C-O 3.59Å; N290-N294 WeakPolarHBondContact CA-O 3.29Å; N290-N294 WeakPolarHBondContact CB-O 2.98Å; N290-N294 CarbonylContact O-C 3.24Å; N290-N294 VanDerWaalsContact O-C 3.24Å; N290-N294 WeakPolarHBondContact O-CA 3.49Å; N290-N294 PolarHBondContact O-N 2.96Å; N294-E296 PolarHBondContact O-N 2.84Å; N294-R299 VanDerWaalsContact ND2-CZ 3.31Å; N294-R299 PolarHBondContact ND2-NH2 2.86Å; N294-R299 PolarHBondContact OD1-NH1 2.92Å; N294-R299 PolarHBondContact OD1-NH2 3.11Å; N294-R352 PolarHBondContact OD1-NE 3.3Å; N294-R352 PolarHBondContact OD1-NH2 3.35Å; N294-E355 PolarHBondContact ND2-OE1 3.11Å; N294-E355 PolarHBondContact ND2-OE2 2.99Å
295	R	44.7	Very low	69.3	Low	253 Å²	253	61 Å²	61	96%	0.955	30%	0.297	S	S	*	.	S	Bend	trans	-82.9	6	-169.7	-160.9	172.2	170.7	178.7	-2.2	117.7
296	E	58.3	Low	70	Confident	95 Å²	95	58.1 Å²	58.1	44%	0.444	29%	0.285	S	S	.	.			trans	-143.9	137.4	-162.6	-152.2	174.7	-162.5	0	0	116.9	T112 N294 S298	T112-E296 WeakPolarHBondContact CG2-OE1 3.38Å; N294-E296 PolarHBondContact O-N 2.84Å; E296-S298 WeakPolarHBondContact CB-OG 3.48Å; E296-S298 WeakPolarHBondContact CG-OG 3.41Å; E296-S298 PolarHBondContact O-N 2.83Å; E296-S298 PolarHBondContact OE2-OG 2.9Å
297	S	64.4	Low	70.7	Confident	51 Å²	51	58 Å²	58	36%	0.357	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-69	-7.6	176.1	56.4	0	0	0	0	114.3	R286 R299	R286-S297 PolarHBondContact NH2-O 2.85Å; S297-R299 PolarHBondContact O-N 2.86Å
298	S	70.4	Confident	72	Confident	12 Å²	12	51.5 Å²	51.5	8%	0.084	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-69.6	-11.8	177	50.4	0	0	0	0	114.4	T112 E296 A338 G339	T112-S298 WeakPolarHBondContact OG1-CB 3.33Å; E296-S298 WeakPolarHBondContact CB-OG 3.48Å; E296-S298 WeakPolarHBondContact CG-OG 3.41Å; E296-S298 PolarHBondContact O-N 2.83Å; E296-S298 PolarHBondContact OE2-OG 2.9Å; S298-A338 CarbonylContact O-C 3.46Å; S298-A338 VanDerWaalsContact O-CA 3.29Å; S298-A338 WeakPolarHBondContact O-CA 3.24Å; S298-A338 WeakPolarHBondContact O-CB 3.38Å; S298-G339 PolarHBondContact O-N 2.8Å
299	R	75.9	Confident	73.6	Confident	45 Å²	45	46.6 Å²	46.6	17%	0.17	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-103.7	1.4	-166.3	-62.3	174.5	70.4	162.6	-2.9	114.3	Y225 N294 S297 E355 I359	Y225-R299 WeakPolarHBondContact CD2-O 3.44Å; N294-R299 VanDerWaalsContact ND2-CZ 3.31Å; N294-R299 PolarHBondContact ND2-NH2 2.86Å; N294-R299 PolarHBondContact OD1-NH1 2.92Å; N294-R299 PolarHBondContact OD1-NH2 3.11Å; S297-R299 PolarHBondContact O-N 2.86Å; R299-E355 IonicContact CZ-OE1 3.72Å; R299-E355 IonicContact CZ-OE2 3.36Å; R299-E355 IonicContact NE-OE1 3.3Å; R299-E355 PolarHBondContact NE-OE1 2.8Å; R299-E355 IonicContact NH2-OE1 2.7Å; R299-E355 PolarHBondContact NH2-OE1 3.26Å; R299-E355 IonicContact NH2-OE2 2.72Å; R299-E355 PolarHBondContact NH2-OE2 3.45Å; R299-I359 HydrophobicContact CB-CD1 3.85Å; R299-I359 HydrophobicContact CG-CD1 4.41Å; R299-I359 WeakPolarHBondContact O-CD1 3.23Å; R299-I359 WeakPolarHBondContact O-CG1 3.49Å
300	S	85.8	Confident	75.3	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.007	22%	0.216	C	C	.	.	S	Bend	trans	-143.5	150.2	178	62.1	0	0	0	0	110.5	E223 R286	E223-S300 WeakPolarHBondContact OE1-CB 3.31Å; E223-S300 PolarHBondContact OE1-OG 3.26Å; R286-S300 PolarHBondContact NE-OG 3.11Å; R286-S300 PolarHBondContact NH2-O 3.47Å; R286-S300 VanDerWaalsContact NH2-O 3.1Å; R286-S300 PolarHBondContact NH2-OG 2.75Å
301	H	91.6	Very high	77	Confident	5 Å²	5	43.2 Å²	43.2	2%	0.023	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	127.1	172.9	-49.5	-77.5	0	0	0	108.3	E223 I224 D336 L337 A338 S362 V392	E223-H301 CarbonylContact C-O 3.55Å; E223-H301 WeakPolarHBondContact CA-O 3.46Å; I224-H301 HydrophobicContact CB-CB 4.29Å; I224-H301 PolarHBondContact N-O 2.78Å; I224-H301 PolarHBondContact O-N 2.73Å; H301-D336 WeakPolarHBondContact CA-O 3.39Å; H301-L337 HydrophobicContact CB-CD2 4.38Å; H301-L337 WeakPolarHBondContact ND1-CA 3.37Å; H301-L337 WeakPolarHBondContact ND1-CD2 3.43Å; H301-A338 WeakPolarHBondContact CE1-CB 3.32Å; H301-A338 PolarHBondContact CE1-N 3.02Å; H301-A338 PolarHBondContact ND1-N 2.86Å; H301-S362 PolarHBondContact NE2-OG 2.83Å; H301-V392 HydrophobicContact CB-CG2 4.4Å
302	S	93.6	Very high	79.1	Confident	5 Å²	5	37.8 Å²	37.8	4%	0.035	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	131.2	174	52.5	0	0	0	0	110.4	R286 V335 D336	R286-S302 VanDerWaalsContact NH1-CB 3.26Å; R286-S302 PolarHBondContact NH1-OG 2.96Å; S302-V335 WeakPolarHBondContact O-CA 3.27Å; S302-D336 PolarHBondContact N-O 3.07Å; S302-D336 PolarHBondContact O-N 3.19Å; S302-D336 WeakPolarHBondContact OG-CB 3.46Å
303	V	96.6	Very high	81	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.006	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	107.8	-177.7	178.6	0	0	0	0	108.1	Y221 I222 I224 V335 F396	Y221-V303 WeakPolarHBondContact CD2-O 3.43Å; I222-V303 HydrophobicContact CD1-CB 4.04Å; I222-V303 HydrophobicContact CD1-CG1 4.34Å; I222-V303 HydrophobicContact CD1-CG2 4.46Å; I222-V303 HydrophobicContact CG1-CB 3.63Å; I222-V303 HydrophobicContact CG1-CG1 4.29Å; I222-V303 HydrophobicContact CG1-CG2 4.32Å; I222-V303 PolarHBondContact N-O 2.88Å; I222-V303 PolarHBondContact O-N 2.76Å; I224-V303 HydrophobicContact CD1-CG2 4.34Å; V303-V335 HydrophobicContact CG1-CG2 4.18Å; V303-V335 HydrophobicContact CG2-CG1 4.03Å; V303-V335 HydrophobicContact CG2-CG2 4.18Å; V303-F396 HydrophobicContact CB-CZ 4.47Å; V303-F396 HydrophobicContact CG1-CE1 4.3Å; V303-F396 HydrophobicContact CG1-CZ 3.8Å; V303-F396 HydrophobicContact CG2-CE2 4.26Å; V303-F396 HydrophobicContact CG2-CZ 3.8Å
304	F	97.4	Very high	83	Confident	2 Å²	2	26 Å²	26	1%	0.009	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	116.9	172.3	-171	-97.5	0	0	0	108.6	L130 L134 V219 Y221 F279 V306 L334	L130-F304 HydrophobicContact CD1-CB 3.96Å; L130-F304 HydrophobicContact CD1-CD1 3.88Å; L130-F304 HydrophobicContact CD1-CG 3.9Å; L130-F304 HydrophobicContact CD2-CD1 4.46Å; L130-F304 HydrophobicContact CD2-CE1 4.34Å; L130-F304 HydrophobicContact CG-CD1 4.14Å; L130-F304 HydrophobicContact CG-CE1 4.47Å; L134-F304 HydrophobicContact CD1-CE1 4.19Å; L134-F304 HydrophobicContact CD1-CZ 4.41Å; L134-F304 HydrophobicContact CD2-CE1 4.28Å; V219-F304 HydrophobicContact CB-CE1 4.48Å; V219-F304 HydrophobicContact CB-CE2 4.28Å; V219-F304 HydrophobicContact CB-CZ 3.84Å; V219-F304 HydrophobicContact CG1-CE1 4.12Å; V219-F304 HydrophobicContact CG1-CZ 3.78Å; V219-F304 HydrophobicContact CG2-CZ 4.45Å; Y221-F304 HydrophobicContact CD1-CD2 4.31Å; Y221-F304 HydrophobicContact CD2-CB 3.85Å; Y221-F304 AromaticContact CD2-CD2 3.77Å; Y221-F304 HydrophobicContact CD2-CD2 3.77Å; Y221-F304 HydrophobicContact CD2-CG 4.32Å; Y221-F304 HydrophobicContact CE2-CB 4.04Å; Y221-F304 HydrophobicContact CE2-CD2 4.38Å; Y221-F304 AromaticContact CG-CD2 3.76Å; Y221-F304 HydrophobicContact CG-CD2 3.76Å; F279-F304 HydrophobicContact CB-CD2 4.39Å; F279-F304 HydrophobicContact CB-CE2 3.77Å; F279-F304 HydrophobicContact CB-CZ 4.24Å; F279-F304 AromaticContact CD2-CD2 3.75Å; F279-F304 HydrophobicContact CD2-CD2 3.75Å; F279-F304 HydrophobicContact CD2-CE2 4.01Å; F279-F304 HydrophobicContact CD2-CG 4.32Å; F279-F304 HydrophobicContact CG-CE2 4.38Å; F304-V306 HydrophobicContact CD1-CG2 3.97Å; F304-V306 HydrophobicContact CE1-CG2 3.65Å; F304-L334 PolarHBondContact N-O 3.05Å; F304-L334 PolarHBondContact O-N 3.14Å
305	T	97.2	Very high	84.7	Confident	14 Å²	14	28.6 Å²	28.6	9%	0.086	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	125.4	-177.6	-56	0	0	0	0	109.6	V219 S220 Q331 L332	V219-T305 WeakPolarHBondContact CA-O 3.47Å; S220-T305 PolarHBondContact N-O 3.12Å; S220-T305 PolarHBondContact O-N 2.62Å; S220-T305 WeakPolarHBondContact OG-CB 3.49Å; T305-Q331 HydrophobicContact CG2-CB 4.43Å; T305-L332 WeakPolarHBondContact CA-O 3.49Å
306	V	97.6	Very high	86	Confident	3 Å²	3	21.1 Å²	21.1	2%	0.018	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	113.2	170.4	-174.7	0	0	0	0	107.5	L98 L134 L137 V217 V219 F304 Q331 L332	L98-V306 HydrophobicContact CD2-CG1 4.37Å; L134-V306 HydrophobicContact CD2-CG1 4.48Å; L134-V306 HydrophobicContact CD2-CG2 3.83Å; L137-V306 HydrophobicContact CD2-CG1 3.6Å; V217-V306 HydrophobicContact CG1-CG1 3.78Å; V219-V306 HydrophobicContact CG1-CG2 4.39Å; F304-V306 HydrophobicContact CD1-CG2 3.97Å; F304-V306 HydrophobicContact CE1-CG2 3.65Å; V306-Q331 CarbonylContact O-C 3.14Å; V306-Q331 WeakPolarHBondContact O-CA 3.47Å; V306-L332 HydrophobicContact CB-CB 4.41Å; V306-L332 PolarHBondContact N-O 3.41Å; V306-L332 PolarHBondContact O-N 2.98Å
307	K	96	Very high	86.8	Confident	5 Å²	5	16.9 Å²	16.9	2%	0.022	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	119.6	178.3	178.8	-177.3	-72.7	-174.9	0	108.6	N157 I159 F218 E266 V329 S330 Q331	N157-K307 PolarHBondContact OD1-NZ 2.88Å; I159-K307 HydrophobicContact CD1-CD 4.04Å; I159-K307 HydrophobicContact CG1-CD 4.44Å; F218-K307 HydrophobicContact CB-CB 4.24Å; F218-K307 PolarHBondContact N-O 2.74Å; F218-K307 PolarHBondContact O-N 2.76Å; E266-K307 WeakPolarHBondContact OE1-CE 3.27Å; E266-K307 IonicContact OE1-NZ 2.59Å; E266-K307 PolarHBondContact OE1-NZ 3.33Å; E266-K307 IonicContact OE2-NZ 2.84Å; E266-K307 PolarHBondContact OE2-NZ 3.05Å; K307-V329 HydrophobicContact CD-CG1 3.79Å; K307-V329 HydrophobicContact CG-CG1 3.51Å; K307-S330 WeakPolarHBondContact CA-O 3.34Å; K307-Q331 HydrophobicContact CB-CG 4.45Å; K307-Q331 HydrophobicContact CG-CG 4.3Å
308	L	95.7	Very high	87.3	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	116.1	176.5	-176.6	67.2	0	0	0	108.8	L98 I99 L137 I141 Y215 V217 V329 S330	L98-L308 HydrophobicContact CD1-CB 4.26Å; L98-L308 HydrophobicContact CD2-CB 4.42Å; L98-L308 HydrophobicContact CG-CB 4.11Å; L98-L308 HydrophobicContact CG-CD2 4.22Å; I99-L308 HydrophobicContact CG1-CD2 4.4Å; L137-L308 HydrophobicContact CD1-CD1 4.48Å; L137-L308 HydrophobicContact CD1-CD2 4.38Å; I141-L308 HydrophobicContact CD1-CD1 3.99Å; Y215-L308 HydrophobicContact CD1-CD1 4.01Å; Y215-L308 HydrophobicContact CD1-CD2 4.07Å; Y215-L308 HydrophobicContact CD1-CG 4.15Å; Y215-L308 HydrophobicContact CE1-CD2 4.46Å; V217-L308 HydrophobicContact CG2-CD1 3.85Å; L308-V329 WeakPolarHBondContact O-CA 3.14Å; L308-S330 PolarHBondContact N-O 2.95Å; L308-S330 PolarHBondContact O-N 3.2Å
309	A	94.2	Very high	87.8	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	129.2	171.3	0	0	0	0	0	109.1	F151 I159 Y215 S216 F218	F151-A309 HydrophobicContact CD1-CB 3.82Å; F151-A309 HydrophobicContact CE1-CB 4.13Å; F151-A309 HydrophobicContact CG-CB 4.22Å; I159-A309 HydrophobicContact CB-CB 4.41Å; I159-A309 HydrophobicContact CG1-CB 4.07Å; I159-A309 HydrophobicContact CG2-CB 3.98Å; Y215-A309 CarbonylContact C-O 3.56Å; Y215-A309 VanDerWaalsContact CA-O 3.28Å; Y215-A309 WeakPolarHBondContact CA-O 3.19Å; S216-A309 PolarHBondContact N-O 3.08Å; S216-A309 PolarHBondContact O-N 2.69Å; F218-A309 HydrophobicContact CD2-CB 4.49Å; F218-A309 HydrophobicContact CE2-CB 4.14Å
310	Q	92.3	Very high	88.1	Confident	3 Å²	3	22.3 Å²	22.3	1%	0.014	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	130	178.1	-175.9	179.3	1.2	0	0	109.4	C101 C213 C214 Y215 V327 N328	C101-Q310 PolarHBondContact SG-OE1 3.03Å; C213-Q310 HydrophobicContact CB-CG 3.62Å; C213-Q310 VanDerWaalsContact CB-NE2 3.31Å; C213-Q310 PolarHBondContact SG-NE2 2.8Å; C214-Q310 WeakPolarHBondContact O-CA 3.39Å; Y215-Q310 HydrophobicContact CD1-CB 4.09Å; Y215-Q310 HydrophobicContact CD1-CG 4.03Å; Y215-Q310 HydrophobicContact CE1-CB 4.08Å; Y215-Q310 HydrophobicContact CE1-CG 3.61Å; Y215-Q310 PolarHBondContact OH-NE2 3.32Å; Q310-V327 WeakPolarHBondContact O-CA 3.43Å; Q310-N328 HydrophobicContact CB-CB 4.48Å; Q310-N328 PolarHBondContact N-O 3.39Å; Q310-N328 PolarHBondContact O-N 3.38Å
311	A	90.9	Very high	88	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	136	171	0	0	0	0	0	110.8	F151 V161 C213 C214 I320 V327	F151-A311 HydrophobicContact CE1-CB 3.62Å; F151-A311 HydrophobicContact CZ-CB 3.65Å; V161-A311 HydrophobicContact CG2-CB 4.06Å; C213-A311 WeakPolarHBondContact CA-O 3.29Å; C214-A311 PolarHBondContact N-O 3.03Å; C214-A311 PolarHBondContact O-N 2.93Å; A311-I320 HydrophobicContact CB-CG2 3.53Å; A311-V327 HydrophobicContact CB-CG2 4.27Å
312	P	89.1	Confident	87.5	Confident	3 Å²	3	30.2 Å²	30.2	2%	0.019	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	151.6	178.9	27.9	-33.2	0	0	0	111.7	L321 Q326 C446	P312-L321 HydrophobicContact CG-CB 4.46Å; P312-L321 HydrophobicContact CG-CD2 4.49Å; P312-L321 WeakPolarHBondContact O-CD1 3.47Å; P312-L321 PolarHBondContact O-N 3.42Å; P312-Q326 VanDerWaalsContact CD-O 3.22Å; P312-Q326 WeakPolarHBondContact CD-O 3.35Å; P312-Q326 HydrophobicContact CG-CB 3.85Å; P312-C446 HydrophobicContact CB-CB 4.12Å; P312-C446 HydrophobicContact CG-CB 4.3Å
313	L	85.8	Confident	86.9	Confident	4 Å²	4	33.8 Å²	33.8	2%	0.021	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-82.8	159.5	170.4	-63.7	172.7	0	0	0	111.7	D212 H319 I320 L321 R452	D212-L313 WeakPolarHBondContact O-CB 3.1Å; D212-L313 WeakPolarHBondContact O-CG 3.39Å; D212-L313 PolarHBondContact O-N 3.13Å; L313-H319 CarbonylContact C-O 3.53Å; L313-H319 WeakPolarHBondContact CA-O 3.46Å; L313-I320 HydrophobicContact CD2-CG1 3.85Å; L313-L321 WeakPolarHBondContact O-CD1 3.5Å; L313-R452 PolarHBondContact O-NH2 2.91Å
314	D	82.4	Confident	86.1	Confident	32 Å²	32	38 Å²	38	17%	0.171	20%	0.201	C	C	.	.			trans	-61.7	178.1	176.3	63.6	6	0	0	0	112.8	D316 G317 D318 H319 L321 R452	D314-D316 PolarHBondContact O-N 3.37Å; D314-D316 PolarHBondContact OD1-N 3.09Å; D314-G317 PolarHBondContact O-N 3.21Å; D314-G317 VanDerWaalsContact O-N 3.15Å; D314-G317 WeakPolarHBondContact OD1-CA 3.45Å; D314-G317 PolarHBondContact OD1-N 3.33Å; D314-D318 PolarHBondContact OD1-N 3.28Å; D314-H319 PolarHBondContact N-O 3.09Å; D314-H319 PolarHBondContact OD1-N 2.94Å; D314-H319 WeakPolarHBondContact OD2-CB 3.29Å; D314-H319 IonicContact OD2-CG 3.54Å; D314-H319 PolarHBondContact OD2-N 3.45Å; D314-H319 IonicContact OD2-ND1 3.72Å; D314-H319 PolarHBondContact OD2-ND1 2.91Å; D314-H319 VanDerWaalsContact OD2-ND1 3.15Å; D314-L321 VanDerWaalsContact CA-CD1 3.42Å; D314-L321 HydrophobicContact CB-CD1 4.15Å; D314-R452 PolarHBondContact O-NE 3.46Å
315	A	77.9	Confident	85.2	Confident	66 Å²	66	42 Å²	42	55%	0.545	23%	0.23	S	C	.	.	S	Bend	trans	-60.5	-30.1	179.2	0	0	0	0	0	112	N456	A315-N456 PolarHBondContact O-ND2 3.03Å; A315-N456 VanDerWaalsContact O-ND2 3.08Å
316	D	73.8	Confident	84.5	Confident	96 Å²	96	44.4 Å²	44.4	51%	0.513	24%	0.24	S	C	.	.	S	Bend	trans	-82.4	-19.2	179.5	-61.3	-47	0	0	0	112.6	D314 N456	D314-D316 PolarHBondContact O-N 3.37Å; D314-D316 PolarHBondContact OD1-N 3.09Å; D316-N456 WeakPolarHBondContact CA-ND2 3.07Å; D316-N456 WeakPolarHBondContact O-CB 3.47Å; D316-N456 PolarHBondContact O-ND2 2.73Å
317	G	73.8	Confident	84.1	Confident	6 Å²	6	45.1 Å²	45.1	6%	0.062	24%	0.244	C	C	.	.	S	Bend	trans	78.9	19.4	-178.5	0	0	0	0	0	113.3	D314	D314-G317 PolarHBondContact O-N 3.21Å; D314-G317 VanDerWaalsContact O-N 3.15Å; D314-G317 WeakPolarHBondContact OD1-CA 3.45Å; D314-G317 PolarHBondContact OD1-N 3.33Å
318	D	74.4	Confident	83.7	Confident	85 Å²	85	46.1 Å²	46.1	46%	0.455	25%	0.25	S	S	.	.	S	Bend	trans	-106.9	-39.3	-173.3	-67.9	-28.2	0	0	0	112.7	D314 K460	D314-D318 PolarHBondContact OD1-N 3.28Å; D318-K460 IonicContact OD1-NZ 3.74Å; D318-K460 PolarHBondContact OD1-NZ 3.25Å; D318-K460 IonicContact OD2-NZ 2.62Å; D318-K460 PolarHBondContact OD2-NZ 2.87Å
319	H	80.8	Confident	83.5	Confident	102 Å²	102	48.3 Å²	48.3	47%	0.472	26%	0.264	S	S	.	.	S	Bend	trans	-120	145.5	-174.7	-52.1	101.2	0	0	0	112.3	L313 D314	L313-H319 CarbonylContact C-O 3.53Å; L313-H319 WeakPolarHBondContact CA-O 3.46Å; D314-H319 PolarHBondContact N-O 3.09Å; D314-H319 PolarHBondContact OD1-N 2.94Å; D314-H319 WeakPolarHBondContact OD2-CB 3.29Å; D314-H319 IonicContact OD2-CG 3.54Å; D314-H319 PolarHBondContact OD2-N 3.45Å; D314-H319 IonicContact OD2-ND1 3.72Å; D314-H319 PolarHBondContact OD2-ND1 2.91Å; D314-H319 VanDerWaalsContact OD2-ND1 3.15Å
320	I	83.4	Confident	83.4	Confident	35 Å²	35	48.4 Å²	48.4	18%	0.179	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-74.8	131.8	177.6	-58.6	164.3	0	0	0	109	A146 V150 V161 C214 A311 L313 Q322	A146-I320 HydrophobicContact CB-CD1 4.13Å; V150-I320 HydrophobicContact CG1-CD1 3.64Å; V161-I320 HydrophobicContact CG1-CG2 3.87Å; V161-I320 HydrophobicContact CG2-CG2 4.43Å; C214-I320 HydrophobicContact CB-CD1 3.66Å; C214-I320 HydrophobicContact CB-CG1 3.76Å; A311-I320 HydrophobicContact CB-CG2 3.53Å; L313-I320 HydrophobicContact CD2-CG1 3.85Å; I320-Q322 PolarHBondContact O-N 3.35Å
321	L	83.4	Confident	83.5	Confident	46 Å²	46	49.8 Å²	49.8	24%	0.241	27%	0.271	C	S	.	.			trans	-63	128.8	171.8	-88.1	76.7	0	0	0	110	P312 L313 D314 D323 Q326	P312-L321 HydrophobicContact CG-CB 4.46Å; P312-L321 HydrophobicContact CG-CD2 4.49Å; P312-L321 WeakPolarHBondContact O-CD1 3.47Å; P312-L321 PolarHBondContact O-N 3.42Å; L313-L321 WeakPolarHBondContact O-CD1 3.5Å; D314-L321 VanDerWaalsContact CA-CD1 3.42Å; D314-L321 HydrophobicContact CB-CD1 4.15Å; L321-D323 VanDerWaalsContact C-N 3.26Å; L321-D323 PolarHBondContact O-N 3.03Å; L321-Q326 HydrophobicContact CD2-CG 4.5Å
322	Q	81.8	Confident	83.8	Confident	126 Å²	126	49.9 Å²	49.9	59%	0.589	27%	0.271	S	S	*	.			trans	-84.3	-0.7	177.1	-64	178.8	19.6	0	0	113.1	V161 I320 K324	V161-Q322 HydrophobicContact CG1-CG 4.33Å; I320-Q322 PolarHBondContact O-N 3.35Å; Q322-K324 PolarHBondContact O-N 3.2Å; Q322-K324 VanDerWaalsContact O-N 3.12Å
323	D	80.9	Confident	84.2	Confident	80 Å²	80	50 Å²	50	43%	0.428	27%	0.272	S	S	.	.			trans	-68.8	110.5	178.6	-176.2	-1.9	0	0	0	110.5	L321 S325 Q326	L321-D323 VanDerWaalsContact C-N 3.26Å; L321-D323 PolarHBondContact O-N 3.03Å; D323-S325 PolarHBondContact O-N 3.09Å; D323-S325 VanDerWaalsContact O-N 3.13Å; D323-S325 WeakPolarHBondContact OD1-CB 3.45Å; D323-S325 PolarHBondContact OD1-N 3.1Å; D323-S325 PolarHBondContact OD1-OG 3.33Å; D323-S325 PolarHBondContact OD2-OG 3.4Å; D323-Q326 HydrophobicContact CB-CB 4.45Å; D323-Q326 HydrophobicContact CB-CG 4Å; D323-Q326 PolarHBondContact O-N 2.77Å
324	K	78.9	Confident	84.8	Confident	89 Å²	89	50 Å²	50	39%	0.387	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-56.6	-27.8	178.4	-168.5	173.3	-173.6	170.9	0	112.6	D154 E160 Q322 Q326 V327	D154-K324 IonicContact OD2-NZ 2.65Å; D154-K324 PolarHBondContact OD2-NZ 3.4Å; E160-K324 HydrophobicContact CG-CD 4.08Å; E160-K324 IonicContact OE1-NZ 3.15Å; E160-K324 PolarHBondContact OE1-NZ 3.34Å; Q322-K324 PolarHBondContact O-N 3.2Å; Q322-K324 VanDerWaalsContact O-N 3.12Å; K324-Q326 PolarHBondContact O-N 3.04Å; K324-V327 PolarHBondContact O-N 3.11Å
325	S	79.9	Confident	85.5	Confident	86 Å²	86	48.4 Å²	48.4	60%	0.601	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-71.1	-20.2	178.9	76.8	0	0	0	0	113.7	D323	D323-S325 PolarHBondContact O-N 3.09Å; D323-S325 VanDerWaalsContact O-N 3.13Å; D323-S325 WeakPolarHBondContact OD1-CB 3.45Å; D323-S325 PolarHBondContact OD1-N 3.1Å; D323-S325 PolarHBondContact OD1-OG 3.33Å; D323-S325 PolarHBondContact OD2-OG 3.4Å
326	Q	82.6	Confident	86.3	Confident	65 Å²	65	45.6 Å²	45.6	30%	0.304	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-95.9	-4.6	179.8	-58.3	-63.4	-36.6	0	0	112.6	P312 L321 D323 K324 N328	P312-Q326 VanDerWaalsContact CD-O 3.22Å; P312-Q326 WeakPolarHBondContact CD-O 3.35Å; P312-Q326 HydrophobicContact CG-CB 3.85Å; L321-Q326 HydrophobicContact CD2-CG 4.5Å; D323-Q326 HydrophobicContact CB-CB 4.45Å; D323-Q326 HydrophobicContact CB-CG 4Å; D323-Q326 PolarHBondContact O-N 2.77Å; K324-Q326 PolarHBondContact O-N 3.04Å; Q326-N328 PolarHBondContact O-N 2.94Å
327	V	87.4	Confident	87.2	Confident	18 Å²	18	41.1 Å²	41.1	11%	0.109	22%	0.215	C	C	.	.			trans	-80.2	117.4	176.9	-177	0	0	0	0	108.8	F151 I159 V161 Q310 A311 K324 V329	F151-V327 HydrophobicContact CE1-CG1 4.45Å; I159-V327 HydrophobicContact CB-CG1 4.28Å; I159-V327 HydrophobicContact CG2-CG1 4.46Å; V161-V327 HydrophobicContact CG2-CG2 3.65Å; Q310-V327 WeakPolarHBondContact O-CA 3.43Å; A311-V327 HydrophobicContact CB-CG2 4.27Å; K324-V327 PolarHBondContact O-N 3.11Å; V327-V329 HydrophobicContact CG1-CG2 4.39Å
328	N	88.8	Confident	87.9	Confident	27 Å²	27	40.8 Å²	40.8	14%	0.144	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	142.9	172.2	-69.9	-39.8	0	0	0	110.2	C101 Q310 Q326	C101-N328 HydrophobicContact CB-CB 4.34Å; C101-N328 WeakPolarHBondContact SG-CB 3.4Å; Q310-N328 HydrophobicContact CB-CB 4.48Å; Q310-N328 PolarHBondContact N-O 3.39Å; Q310-N328 PolarHBondContact O-N 3.38Å; Q326-N328 PolarHBondContact O-N 2.94Å
329	V	91	Very high	88.5	Confident	46 Å²	46	36.8 Å²	36.8	28%	0.279	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	123.6	176.7	-177.5	0	0	0	0	107.7	I159 K307 L308 V327	I159-V329 HydrophobicContact CB-CG2 4.06Å; I159-V329 HydrophobicContact CG1-CG1 4.49Å; I159-V329 HydrophobicContact CG1-CG2 3.66Å; K307-V329 HydrophobicContact CD-CG1 3.79Å; K307-V329 HydrophobicContact CG-CG1 3.51Å; L308-V329 WeakPolarHBondContact O-CA 3.14Å; V327-V329 HydrophobicContact CG1-CG2 4.39Å
330	S	92.9	Very high	88.7	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.014	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	153.1	172.1	55.4	0	0	0	0	110.5	L98 N103 K307 L308	L98-S330 WeakPolarHBondContact CD1-OG 3.45Å; L98-S330 WeakPolarHBondContact O-CB 3.34Å; L98-S330 PolarHBondContact O-OG 2.92Å; N103-S330 WeakPolarHBondContact OD1-CA 3.29Å; K307-S330 WeakPolarHBondContact CA-O 3.34Å; L308-S330 PolarHBondContact N-O 2.95Å; L308-S330 PolarHBondContact O-N 3.2Å
331	Q	94.6	Very high	88.5	Confident	32 Å²	32	32 Å²	32	15%	0.15	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	134.5	-175.5	-59.8	-175.1	12.4	0	0	111.2	N103 G104 T305 V306 K307	N103-Q331 CarbonylContact C-O 3.32Å; N103-Q331 VanDerWaalsContact CA-O 3.28Å; N103-Q331 WeakPolarHBondContact CA-O 3.33Å; N103-Q331 PolarHBondContact OD1-N 3.41Å; G104-Q331 PolarHBondContact N-O 3.44Å; T305-Q331 HydrophobicContact CG2-CB 4.43Å; V306-Q331 CarbonylContact O-C 3.14Å; V306-Q331 WeakPolarHBondContact O-CA 3.47Å; K307-Q331 HydrophobicContact CB-CG 4.45Å; K307-Q331 HydrophobicContact CG-CG 4.3Å
332	L	96.8	Very high	87.8	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	113.2	166.2	177.3	66.3	0	0	0	108.8	L94 I95 L98 G104 T305 V306 L334	L94-L332 HydrophobicContact CB-CD1 3.99Å; L94-L332 HydrophobicContact CD1-CD1 4.07Å; I95-L332 HydrophobicContact CD1-CD2 3.38Å; L98-L332 HydrophobicContact CD1-CB 4.04Å; L98-L332 HydrophobicContact CD2-CB 4.03Å; G104-L332 WeakPolarHBondContact O-CA 3.3Å; T305-L332 WeakPolarHBondContact CA-O 3.49Å; V306-L332 HydrophobicContact CB-CB 4.41Å; V306-L332 PolarHBondContact N-O 3.41Å; V306-L332 PolarHBondContact O-N 2.98Å; L332-L334 HydrophobicContact CD1-CD2 4.34Å; L332-L334 HydrophobicContact CD2-CD2 4.19Å; L332-L334 HydrophobicContact CD2-CG 4.35Å; L332-L334 HydrophobicContact CG-CD2 4.14Å; L332-L334 HydrophobicContact CG-CG 4.23Å
333	C	97.5	Very high	86.9	Confident	5 Å²	5	31.6 Å²	31.6	3%	0.034	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	114.7	174.6	-67.6	0	0	0	0	110	G104 L105 L106 V335 F396 Y399	G104-C333 PolarHBondContact O-N 2.92Å; L105-C333 HydrophobicContact CD1-CB 3.6Å; L106-C333 PolarHBondContact N-O 3.11Å; C333-V335 HydrophobicContact CB-CG2 4.39Å; C333-F396 HydrophobicContact CB-CE1 3.96Å; C333-Y399 PolarHBondContact SG-OH 3.05Å
334	L	97.7	Very high	86	Confident	3 Å²	3	34.8 Å²	34.8	2%	0.016	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	112.6	173.7	-62.7	177.4	0	0	0	108.7	L106 M120 L130 F304 L332	L106-L334 HydrophobicContact CB-CD2 3.93Å; L106-L334 HydrophobicContact CD1-CD2 4.49Å; L106-L334 HydrophobicContact CD2-CD2 4.34Å; L106-L334 HydrophobicContact CG-CD2 4.48Å; M120-L334 HydrophobicContact CE-CB 4.25Å; M120-L334 HydrophobicContact SD-CB 3.82Å; L130-L334 HydrophobicContact CB-CD1 3.89Å; L130-L334 HydrophobicContact CD1-CD1 4.34Å; L130-L334 HydrophobicContact CG-CD1 3.76Å; F304-L334 PolarHBondContact N-O 3.05Å; F304-L334 PolarHBondContact O-N 3.14Å; L332-L334 HydrophobicContact CD1-CD2 4.34Å; L332-L334 HydrophobicContact CD2-CD2 4.19Å; L332-L334 HydrophobicContact CD2-CG 4.35Å; L332-L334 HydrophobicContact CG-CD2 4.14Å; L332-L334 HydrophobicContact CG-CG 4.23Å
335	V	96.8	Very high	85.2	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	117.1	-168.6	-174.4	0	0	0	0	110.7	L105 L106 F107 T108 M120 S302 V303 C333 L337 F396	L105-V335 HydrophobicContact CD1-CG2 3.77Å; L106-V335 PolarHBondContact O-N 2.94Å; F107-V335 WeakPolarHBondContact CA-O 3.4Å; F107-V335 HydrophobicContact CD1-CB 3.57Å; F107-V335 HydrophobicContact CD1-CG1 3.73Å; F107-V335 HydrophobicContact CD1-CG2 4.01Å; F107-V335 HydrophobicContact CE1-CB 4Å; F107-V335 HydrophobicContact CE1-CG1 4.01Å; F107-V335 HydrophobicContact CE1-CG2 3.96Å; T108-V335 PolarHBondContact N-O 3.3Å; T108-V335 PolarHBondContact OG1-O 2.67Å; M120-V335 WeakPolarHBondContact CE-O 3.36Å; S302-V335 WeakPolarHBondContact O-CA 3.27Å; V303-V335 HydrophobicContact CG1-CG2 4.18Å; V303-V335 HydrophobicContact CG2-CG1 4.03Å; V303-V335 HydrophobicContact CG2-CG2 4.18Å; C333-V335 HydrophobicContact CB-CG2 4.39Å; V335-L337 HydrophobicContact CG1-CD2 3.62Å; V335-L337 HydrophobicContact CG1-CG 4.06Å; V335-F396 HydrophobicContact CG1-CE2 4.38Å; V335-F396 HydrophobicContact CG2-CE1 4.1Å; V335-F396 HydrophobicContact CG2-CE2 3.95Å; V335-F396 HydrophobicContact CG2-CZ 3.43Å; V335-F396 VanDerWaalsContact CG2-CZ 3.43Å
336	D	94.8	Very high	84.4	Confident	6 Å²	6	34.4 Å²	34.4	3%	0.032	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	102.5	168.5	-168.5	19.9	0	0	0	108.9	T108 K116 T117 M120 H301 S302	T108-D336 WeakPolarHBondContact OG1-CA 3.36Å; T108-D336 PolarHBondContact OG1-OD1 3.46Å; K116-D336 VanDerWaalsContact CB-OD1 3.31Å; K116-D336 WeakPolarHBondContact CB-OD1 3.36Å; T117-D336 PolarHBondContact OG1-OD2 2.82Å; M120-D336 HydrophobicContact CB-CB 4.42Å; M120-D336 HydrophobicContact CG-CB 4.32Å; H301-D336 WeakPolarHBondContact CA-O 3.39Å; S302-D336 PolarHBondContact N-O 3.07Å; S302-D336 PolarHBondContact O-N 3.19Å; S302-D336 WeakPolarHBondContact OG-CB 3.46Å
337	L	92.7	Very high	83.5	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.01	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-75.8	152.2	-178.5	-63	173.4	0	0	0	110.9	F107 T108 Y109 K116 H301 V335 L363 L366 V392	F107-L337 HydrophobicContact CB-CD1 4.24Å; F107-L337 HydrophobicContact CD1-CD1 4Å; F107-L337 HydrophobicContact CD1-CD2 4.22Å; F107-L337 HydrophobicContact CD1-CG 4.15Å; F107-L337 HydrophobicContact CG-CD1 4.42Å; T108-L337 WeakPolarHBondContact O-CB 3.37Å; T108-L337 PolarHBondContact O-N 3.11Å; Y109-L337 HydrophobicContact CD2-CD1 3.94Å; K116-L337 WeakPolarHBondContact CE-O 3.35Å; H301-L337 HydrophobicContact CB-CD2 4.38Å; H301-L337 WeakPolarHBondContact ND1-CA 3.37Å; H301-L337 WeakPolarHBondContact ND1-CD2 3.43Å; V335-L337 HydrophobicContact CG1-CD2 3.62Å; V335-L337 HydrophobicContact CG1-CG 4.06Å; L337-L363 HydrophobicContact CB-CD2 4.35Å; L337-L363 HydrophobicContact CD1-CD2 4.2Å; L337-L366 HydrophobicContact CD1-CD2 4.16Å; L337-V392 HydrophobicContact CD2-CG1 4.26Å
338	A	89.3	Confident	82.3	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-57.7	163.5	170.6	0	0	0	0	0	112.3	S298 H301 I359	S298-A338 CarbonylContact O-C 3.46Å; S298-A338 VanDerWaalsContact O-CA 3.29Å; S298-A338 WeakPolarHBondContact O-CA 3.24Å; S298-A338 WeakPolarHBondContact O-CB 3.38Å; H301-A338 WeakPolarHBondContact CE1-CB 3.32Å; H301-A338 PolarHBondContact CE1-N 3.02Å; H301-A338 PolarHBondContact ND1-N 2.86Å; A338-I359 HydrophobicContact CB-CG2 3.45Å; A338-I359 VanDerWaalsContact CB-CG2 3.45Å
339	G	87.1	Confident	81.3	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.01	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-55.3	139.4	171.2	0	0	0	0	0	112.1	S298 E341 L363	S298-G339 PolarHBondContact O-N 2.8Å; G339-E341 VanDerWaalsContact C-OE2 3.25Å; G339-E341 WeakPolarHBondContact CA-OE2 3.47Å; G339-L363 VanDerWaalsContact O-CD1 3.29Å; G339-L363 WeakPolarHBondContact O-CD1 3.44Å
340	S	85.4	Confident	80.7	Confident	17 Å²	17	49.8 Å²	49.8	12%	0.119	25%	0.246	C	C	.	.			trans	-90	-3.8	178.9	48	0	0	0	0	113.9	Y109 G110 V111 V425	Y109-S340 WeakPolarHBondContact OH-CB 3.47Å; G110-S340 PolarHBondContact O-N 2.94Å; G110-S340 PolarHBondContact O-OG 3.32Å; V111-S340 PolarHBondContact N-OG 2.8Å; S340-V425 WeakPolarHBondContact OG-CG2 3.47Å
341	E	78.1	Confident	79.5	Confident	20 Å²	20	54.2 Å²	54.2	9%	0.093	28%	0.276	C	S	.	.			trans	-65	149.1	-176.2	64.1	-80.3	-177.3	0	0	113.8	T112 G339 T346 N360	T112-E341 WeakPolarHBondContact CB-OE1 3.35Å; T112-E341 PolarHBondContact N-OE2 3.43Å; T112-E341 PolarHBondContact OG1-OE1 3.26Å; T112-E341 PolarHBondContact OG1-OE2 3.37Å; G339-E341 VanDerWaalsContact C-OE2 3.25Å; G339-E341 WeakPolarHBondContact CA-OE2 3.47Å; E341-T346 HydrophobicContact CG-CG2 4.33Å; E341-N360 PolarHBondContact O-ND2 3.5Å; E341-N360 VanDerWaalsContact O-ND2 3.14Å; E341-N360 PolarHBondContact O-OD1 2.93Å
342	R	70	Confident	78.4	Confident	132 Å²	132	58.2 Å²	58.2	50%	0.498	29%	0.29	S	S	.	.			trans	-70.3	147.9	-178.6	-65.2	176.3	-179.1	176.7	-0.3	112.2	N344 R345 E421	R342-N344 PolarHBondContact O-N 2.68Å; R342-R345 WeakPolarHBondContact O-CB 3.29Å; R342-R345 PolarHBondContact O-N 2.91Å; R342-E421 PolarHBondContact N-OE1 2.87Å
343	T	62.6	Low	77.3	Confident	31 Å²	31	62.1 Å²	62.1	19%	0.19	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-30.1	179.3	-12.1	0	0	0	0	113.7	R345 T346 L353 A356 N360	T343-R345 PolarHBondContact O-N 3.46Å; T343-T346 PolarHBondContact O-N 3.46Å; T343-T346 PolarHBondContact O-OG1 2.87Å; T343-L353 HydrophobicContact CG2-CD1 3.66Å; T343-A356 HydrophobicContact CG2-CB 3.28Å; T343-N360 PolarHBondContact N-ND2 3.39Å; T343-N360 PolarHBondContact OG1-ND2 2.93Å
344	N	61	Low	76.2	Confident	146 Å²	146	71.5 Å²	71.5	78%	0.781	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-25.8	-179.5	-64	-5.9	0	0	0	112.6	R342	R342-N344 PolarHBondContact O-N 2.68Å
345	R	62.9	Low	75	Confident	104 Å²	104	72 Å²	72	39%	0.392	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-28.8	179	-175.4	177.4	152.5	147.6	-0.2	112.1	R342 T343 R347 D418	R342-R345 WeakPolarHBondContact O-CB 3.29Å; R342-R345 PolarHBondContact O-N 2.91Å; T343-R345 PolarHBondContact O-N 3.46Å; R345-R347 PolarHBondContact O-N 3.36Å; R345-D418 IonicContact CZ-OD1 2.71Å; R345-D418 IonicContact NH1-OD1 2.94Å; R345-D418 PolarHBondContact NH1-OD1 3.46Å; R345-D418 IonicContact NH2-OD1 3.35Å; R345-D418 PolarHBondContact NH2-OD1 2.93Å; R345-D418 IonicContact NH2-OD2 2.64Å
346	T	62.3	Low	73.8	Confident	64 Å²	64	72.5 Å²	72.5	39%	0.393	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-1.9	-176.5	61.2	0	0	0	0	113.8	E341 T343 A348	E341-T346 HydrophobicContact CG-CG2 4.33Å; T343-T346 PolarHBondContact O-N 3.46Å; T343-T346 PolarHBondContact O-OG1 2.87Å; T346-A348 PolarHBondContact O-N 3.35Å
347	R	64.1	Low	72.8	Confident	234 Å²	234	73.6 Å²	73.6	88%	0.883	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.1	33.2	-176.5	-63	-175.9	-178.5	172.9	1.7	112.6	R345	R345-R347 PolarHBondContact O-N 3.36Å
348	A	61.4	Low	72.1	Confident	21 Å²	21	76.9 Å²	76.9	17%	0.174	38%	0.382	C	S	.	.			trans	-86.7	130.1	-172.7	0	0	0	0	0	110.8	T346 R352	T346-A348 PolarHBondContact O-N 3.35Å; A348-R352 HydrophobicContact CB-CB 3.91Å
349	E	68.3	Low	71.5	Confident	168 Å²	168	77.5 Å²	77.5	79%	0.785	39%	0.385	S	S	*	.			trans	-113	156.8	178.5	-65.2	-176.2	174.7	0	0	112.1	S351 R352	E349-S351 PolarHBondContact O-N 2.95Å; E349-R352 PolarHBondContact O-N 3.12Å
350	G	77.6	Confident	71.2	Confident	56 Å²	56	78.6 Å²	78.6	58%	0.577	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	-127.3	172.3	0	0	0	0	0	114.8	R352 L353	G350-R352 VanDerWaalsContact C-N 3.25Å; G350-R352 PolarHBondContact O-N 2.94Å; G350-L353 WeakPolarHBondContact O-CB 3.39Å; G350-L353 PolarHBondContact O-N 3.01Å
351	S	68.8	Low	71.3	Confident	94 Å²	94	82 Å²	82	66%	0.657	41%	0.405	S	S	*	.	H	α-helix	trans	-61.9	-32	-179.4	52.9	0	0	0	0	112.9	E349 L353 R354 E355	E349-S351 PolarHBondContact O-N 2.95Å; S351-L353 VanDerWaalsContact C-N 3.32Å; S351-L353 PolarHBondContact O-N 2.77Å; S351-R354 PolarHBondContact O-N 2.98Å; S351-E355 PolarHBondContact O-N 3.33Å; S351-E355 VanDerWaalsContact O-N 3.12Å
352	R	70.7	Confident	71.9	Confident	117 Å²	117	81.4 Å²	81.4	44%	0.442	40%	0.403	S	S	.	.	H	α-helix	trans	-68.6	-30.7	177.3	-66.3	-175.4	163.2	164.4	1	112.6	L293 N294 A348 E349 G350 E355 A356	L293-R352 PolarHBondContact O-NH2 3.11Å; N294-R352 PolarHBondContact OD1-NE 3.3Å; N294-R352 PolarHBondContact OD1-NH2 3.35Å; A348-R352 HydrophobicContact CB-CB 3.91Å; E349-R352 PolarHBondContact O-N 3.12Å; G350-R352 VanDerWaalsContact C-N 3.25Å; G350-R352 PolarHBondContact O-N 2.94Å; R352-E355 PolarHBondContact O-N 2.85Å; R352-A356 WeakPolarHBondContact O-CB 3.4Å; R352-A356 PolarHBondContact O-N 3.46Å
353	L	74	Confident	72.8	Confident	84 Å²	84	75.6 Å²	75.6	44%	0.44	38%	0.382	S	S	.	.	H	α-helix	trans	-66.2	-41.7	174.2	-174.7	70	0	0	0	111.3	T343 G350 S351 G357	T343-L353 HydrophobicContact CG2-CD1 3.66Å; G350-L353 WeakPolarHBondContact O-CB 3.39Å; G350-L353 PolarHBondContact O-N 3.01Å; S351-L353 VanDerWaalsContact C-N 3.32Å; S351-L353 PolarHBondContact O-N 2.77Å; L353-G357 PolarHBondContact O-N 3.33Å
354	R	74	Confident	74.1	Confident	201 Å²	201	79.5 Å²	79.5	76%	0.758	40%	0.399	S	S	*	.	H	α-helix	trans	-64.5	-41.9	176.3	-67.1	-177.2	-178.2	177.1	0.9	111.8	S351 G357 N358	S351-R354 PolarHBondContact O-N 2.98Å; R354-G357 PolarHBondContact O-N 3.09Å; R354-N358 PolarHBondContact O-N 2.86Å
355	E	72.4	Confident	75.6	Confident	14 Å²	14	72.7 Å²	72.7	7%	0.065	36%	0.363	C	S	.	.	H	α-helix	trans	-62	-51.4	176.7	-172.9	-159.1	130.5	0	0	111.7	Y225 N294 R299 S351 R352 G357 N358 I359	Y225-E355 HydrophobicContact CE2-CG 3.78Å; Y225-E355 VanDerWaalsContact CE2-OE1 3.28Å; Y225-E355 WeakPolarHBondContact CE2-OE1 3.45Å; Y225-E355 VanDerWaalsContact CZ-CD 3.49Å; Y225-E355 PolarHBondContact OH-OE1 3.19Å; Y225-E355 PolarHBondContact OH-OE2 3.17Å; N294-E355 PolarHBondContact ND2-OE1 3.11Å; N294-E355 PolarHBondContact ND2-OE2 2.99Å; R299-E355 IonicContact CZ-OE1 3.72Å; R299-E355 IonicContact CZ-OE2 3.36Å; R299-E355 IonicContact NE-OE1 3.3Å; R299-E355 PolarHBondContact NE-OE1 2.8Å; R299-E355 IonicContact NH2-OE1 2.7Å; R299-E355 PolarHBondContact NH2-OE1 3.26Å; R299-E355 IonicContact NH2-OE2 2.72Å; R299-E355 PolarHBondContact NH2-OE2 3.45Å; S351-E355 PolarHBondContact O-N 3.33Å; S351-E355 VanDerWaalsContact O-N 3.12Å; R352-E355 PolarHBondContact O-N 2.85Å; E355-G357 PolarHBondContact O-N 3.17Å; E355-N358 PolarHBondContact O-N 3.23Å; E355-I359 HydrophobicContact CG-CD1 4.23Å; E355-I359 WeakPolarHBondContact O-CG1 3.48Å; E355-I359 PolarHBondContact O-N 2.79Å
356	A	72.1	Confident	77.1	Confident	11 Å²	11	67.9 Å²	67.9	9%	0.091	35%	0.345	C	S	.	.	H	α-helix	trans	-62.2	-32.4	175.8	0	0	0	0	0	112	T343 R352 N360	T343-A356 HydrophobicContact CG2-CB 3.28Å; R352-A356 WeakPolarHBondContact O-CB 3.4Å; R352-A356 PolarHBondContact O-N 3.46Å; A356-N360 WeakPolarHBondContact O-CB 3.45Å; A356-N360 PolarHBondContact O-N 3.37Å; A356-N360 PolarHBondContact O-ND2 2.75Å
357	G	74.6	Confident	78.6	Confident	29 Å²	29	69.3 Å²	69.3	30%	0.299	34%	0.343	S	S	.	.	H	α-helix	trans	-60	-44.2	168.7	0	0	0	0	0	113.4	L353 R354 E355 N360 Q361	L353-G357 PolarHBondContact O-N 3.33Å; R354-G357 PolarHBondContact O-N 3.09Å; E355-G357 PolarHBondContact O-N 3.17Å; G357-N360 PolarHBondContact O-N 2.89Å; G357-Q361 WeakPolarHBondContact O-CB 3.34Å; G357-Q361 PolarHBondContact O-N 3.44Å
358	N	77	Confident	80.1	Confident	71 Å²	71	61 Å²	61	38%	0.38	32%	0.318	S	S	.	.	H	α-helix	trans	-71.9	-34.7	179.4	-75.5	-24.6	0	0	0	113.3	N226 R354 E355 Q361 S362	N226-N358 PolarHBondContact OD1-ND2 2.73Å; R354-N358 PolarHBondContact O-N 2.86Å; E355-N358 PolarHBondContact O-N 3.23Å; N358-Q361 PolarHBondContact O-N 2.67Å; N358-S362 PolarHBondContact O-N 2.8Å; N358-S362 VanDerWaalsContact O-N 3.11Å
359	I	77.6	Confident	81.7	Confident	13 Å²	13	60 Å²	60	7%	0.067	31%	0.31	C	S	.	.	H	α-helix	trans	-61.3	-51	172	-65.5	157.8	0	0	0	109.4	R299 A338 E355 Q361 S362 L363	R299-I359 HydrophobicContact CB-CD1 3.85Å; R299-I359 HydrophobicContact CG-CD1 4.41Å; R299-I359 WeakPolarHBondContact O-CD1 3.23Å; R299-I359 WeakPolarHBondContact O-CG1 3.49Å; A338-I359 HydrophobicContact CB-CG2 3.45Å; A338-I359 VanDerWaalsContact CB-CG2 3.45Å; E355-I359 HydrophobicContact CG-CD1 4.23Å; E355-I359 WeakPolarHBondContact O-CG1 3.48Å; E355-I359 PolarHBondContact O-N 2.79Å; I359-Q361 VanDerWaalsContact C-N 3.29Å; I359-Q361 PolarHBondContact O-N 2.99Å; I359-S362 PolarHBondContact O-N 2.77Å; I359-S362 VanDerWaalsContact O-N 3.16Å; I359-S362 PolarHBondContact O-OG 3.19Å; I359-L363 PolarHBondContact O-N 3.28Å
360	N	80.4	Confident	82.9	Confident	24 Å²	24	52.2 Å²	52.2	13%	0.128	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-34.7	177.3	-75.7	-20.1	0	0	0	112.4	E341 T343 A356 G357 S362 L363 M364	E341-N360 PolarHBondContact O-ND2 3.5Å; E341-N360 VanDerWaalsContact O-ND2 3.14Å; E341-N360 PolarHBondContact O-OD1 2.93Å; T343-N360 PolarHBondContact N-ND2 3.39Å; T343-N360 PolarHBondContact OG1-ND2 2.93Å; A356-N360 WeakPolarHBondContact O-CB 3.45Å; A356-N360 PolarHBondContact O-N 3.37Å; A356-N360 PolarHBondContact O-ND2 2.75Å; G357-N360 PolarHBondContact O-N 2.89Å; N360-S362 VanDerWaalsContact C-N 3.33Å; N360-S362 PolarHBondContact O-N 3.18Å; N360-L363 PolarHBondContact O-N 3.18Å; N360-M364 WeakPolarHBondContact O-CB 3.47Å; N360-M364 WeakPolarHBondContact O-CG 3.4Å; N360-M364 PolarHBondContact O-N 3.13Å
361	Q	87.6	Confident	83.7	Confident	88 Å²	88	52.2 Å²	52.2	41%	0.411	26%	0.259	S	S	.	.	H	α-helix	trans	-60.6	-41.7	174.7	-174.9	59.2	34.5	0	0	112	G357 N358 I359 M364 T365	G357-Q361 WeakPolarHBondContact O-CB 3.34Å; G357-Q361 PolarHBondContact O-N 3.44Å; N358-Q361 PolarHBondContact O-N 2.67Å; I359-Q361 VanDerWaalsContact C-N 3.29Å; I359-Q361 PolarHBondContact O-N 2.99Å; Q361-M364 PolarHBondContact O-N 3.25Å; Q361-T365 PolarHBondContact NE2-OG1 3.49Å; Q361-T365 WeakPolarHBondContact O-CB 3.26Å; Q361-T365 PolarHBondContact O-N 3.2Å; Q361-T365 PolarHBondContact O-OG1 2.86Å
362	S	89.7	Confident	84.9	Confident	7 Å²	7	48.5 Å²	48.5	5%	0.049	23%	0.232	C	C	.	.	H	α-helix	trans	-64.2	-41.5	178.9	64.6	0	0	0	0	112.9	H301 N358 I359 N360 T365 L366 S390	H301-S362 PolarHBondContact NE2-OG 2.83Å; N358-S362 PolarHBondContact O-N 2.8Å; N358-S362 VanDerWaalsContact O-N 3.11Å; I359-S362 PolarHBondContact O-N 2.77Å; I359-S362 VanDerWaalsContact O-N 3.16Å; I359-S362 PolarHBondContact O-OG 3.19Å; N360-S362 VanDerWaalsContact C-N 3.33Å; N360-S362 PolarHBondContact O-N 3.18Å; S362-T365 PolarHBondContact O-N 3.45Å; S362-L366 PolarHBondContact O-N 2.92Å; S362-S390 WeakPolarHBondContact CA-OG 3.35Å; S362-S390 WeakPolarHBondContact CB-OG 3.39Å
363	L	89.9	Confident	85.9	Confident	11 Å²	11	43.5 Å²	43.5	6%	0.058	21%	0.214	C	C	.	.	H	α-helix	trans	-72.8	-37.5	176.7	-65.8	179.1	0	0	0	112.3	Y109 L337 G339 I359 N360 T365 L366 R367	Y109-L363 HydrophobicContact CD2-CD2 4.36Å; Y109-L363 HydrophobicContact CE2-CD1 4.26Å; Y109-L363 HydrophobicContact CE2-CD2 4.04Å; L337-L363 HydrophobicContact CB-CD2 4.35Å; L337-L363 HydrophobicContact CD1-CD2 4.2Å; G339-L363 VanDerWaalsContact O-CD1 3.29Å; G339-L363 WeakPolarHBondContact O-CD1 3.44Å; I359-L363 PolarHBondContact O-N 3.28Å; N360-L363 PolarHBondContact O-N 3.18Å; L363-T365 VanDerWaalsContact C-N 3.32Å; L363-L366 WeakPolarHBondContact O-CB 3.41Å; L363-L366 PolarHBondContact O-N 2.77Å; L363-R367 PolarHBondContact O-N 2.9Å
364	M	89.3	Confident	86.7	Confident	112 Å²	112	42.6 Å²	42.6	55%	0.552	21%	0.205	S	C	*	.	H	α-helix	trans	-62.9	-40.7	171.8	-75.8	-147.8	-69.9	0	0	111.4	N360 Q361 L366 R367 T368	N360-M364 WeakPolarHBondContact O-CB 3.47Å; N360-M364 WeakPolarHBondContact O-CG 3.4Å; N360-M364 PolarHBondContact O-N 3.13Å; Q361-M364 PolarHBondContact O-N 3.25Å; M364-L366 VanDerWaalsContact C-N 3.34Å; M364-L366 PolarHBondContact O-N 2.92Å; M364-R367 WeakPolarHBondContact O-CB 3.33Å; M364-R367 PolarHBondContact O-N 2.84Å; M364-T368 PolarHBondContact O-N 2.78Å; M364-T368 PolarHBondContact O-OG1 2.85Å
365	T	93.8	Very high	87.5	Confident	3 Å²	3	36 Å²	36	2%	0.018	18%	0.183	C	C	.	.	H	α-helix	trans	-63.1	-42.2	175.8	-54.8	0	0	0	0	111	Q361 S362 L363 R367 T368 C369 D389 T393	Q361-T365 PolarHBondContact NE2-OG1 3.49Å; Q361-T365 WeakPolarHBondContact O-CB 3.26Å; Q361-T365 PolarHBondContact O-N 3.2Å; Q361-T365 PolarHBondContact O-OG1 2.86Å; S362-T365 PolarHBondContact O-N 3.45Å; L363-T365 VanDerWaalsContact C-N 3.32Å; T365-R367 VanDerWaalsContact C-N 3.3Å; T365-R367 PolarHBondContact O-N 2.85Å; T365-T368 PolarHBondContact O-N 3Å; T365-C369 WeakPolarHBondContact O-CB 3.31Å; T365-C369 PolarHBondContact O-N 2.78Å; T365-C369 PolarHBondContact O-SG 3.25Å; T365-D389 HydrophobicContact CG2-CB 3.68Å; T365-T393 HydrophobicContact CG2-CG2 4.01Å
366	L	94	Very high	88.4	Confident	4 Å²	4	36.5 Å²	36.5	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-58	-45.1	174.2	-179.8	65.6	0	0	0	111.1	L337 S362 L363 M364 C369 M370 T393 F400 F428	L337-L366 HydrophobicContact CD1-CD2 4.16Å; S362-L366 PolarHBondContact O-N 2.92Å; L363-L366 WeakPolarHBondContact O-CB 3.41Å; L363-L366 PolarHBondContact O-N 2.77Å; M364-L366 VanDerWaalsContact C-N 3.34Å; M364-L366 PolarHBondContact O-N 2.92Å; L366-C369 WeakPolarHBondContact O-CB 3.1Å; L366-C369 PolarHBondContact O-N 2.88Å; L366-M370 HydrophobicContact CD1-CE 3.79Å; L366-M370 WeakPolarHBondContact O-CG 3.29Å; L366-M370 PolarHBondContact O-N 3.35Å; L366-M370 VanDerWaalsContact O-N 3.08Å; L366-T393 VanDerWaalsContact CA-CG2 3.46Å; L366-T393 HydrophobicContact CB-CG2 3.89Å; L366-T393 HydrophobicContact CD1-CG2 4.03Å; L366-F400 HydrophobicContact CD1-CE2 3.9Å; L366-F400 HydrophobicContact CD1-CZ 3.62Å; L366-F428 HydrophobicContact CD2-CZ 4.47Å; L366-F428 HydrophobicContact CG-CZ 4.35Å
367	R	93.5	Very high	89.2	Confident	93 Å²	93	38.8 Å²	38.8	35%	0.351	20%	0.195	S	C	.	.	H	α-helix	trans	-59.5	-50.6	174.9	174.5	171.5	176.9	179.2	2	112.6	L363 M364 T365 C369 M370 E371 F428 M431	L363-R367 PolarHBondContact O-N 2.9Å; M364-R367 WeakPolarHBondContact O-CB 3.33Å; M364-R367 PolarHBondContact O-N 2.84Å; T365-R367 VanDerWaalsContact C-N 3.3Å; T365-R367 PolarHBondContact O-N 2.85Å; R367-C369 PolarHBondContact O-N 2.92Å; R367-M370 PolarHBondContact O-N 2.87Å; R367-M370 VanDerWaalsContact O-N 3.16Å; R367-E371 HydrophobicContact CG-CG 4.35Å; R367-E371 WeakPolarHBondContact CG-OE1 3.5Å; R367-E371 IonicContact CZ-OE1 2.94Å; R367-E371 IonicContact NE-OE1 2.87Å; R367-E371 PolarHBondContact NE-OE1 2.95Å; R367-E371 IonicContact NH2-OE1 3.83Å; R367-E371 PolarHBondContact NH2-OE1 2.85Å; R367-E371 WeakPolarHBondContact O-CG 3.07Å; R367-E371 PolarHBondContact O-N 2.86Å; R367-F428 HydrophobicContact CB-CD2 3.81Å; R367-F428 HydrophobicContact CB-CE2 3.78Å; R367-F428 HydrophobicContact CG-CD2 3.66Å; R367-F428 HydrophobicContact CG-CE2 4.04Å; R367-M431 HydrophobicContact CG-CE 4.38Å
368	T	95.1	Very high	89.7	Confident	59 Å²	59	44 Å²	44	36%	0.362	21%	0.213	S	C	.	.	H	α-helix	trans	-59.1	-37.9	177	-53.8	0	0	0	0	111.5	M364 T365 E371 V372 P386	M364-T368 PolarHBondContact O-N 2.78Å; M364-T368 PolarHBondContact O-OG1 2.85Å; T365-T368 PolarHBondContact O-N 3Å; T368-E371 PolarHBondContact O-N 2.78Å; T368-V372 HydrophobicContact CG2-CG2 4.25Å; T368-V372 WeakPolarHBondContact O-CB 3.46Å; T368-V372 VanDerWaalsContact O-CG2 3.26Å; T368-V372 WeakPolarHBondContact O-CG2 3.01Å; T368-V372 PolarHBondContact O-N 3.49Å; T368-P386 HydrophobicContact CG2-CG 3.89Å
369	C	95.1	Very high	90.3	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.4	-46.9	176.3	-69	0	0	0	0	111.5	T365 L366 R367 L373 V385 Y387	T365-C369 WeakPolarHBondContact O-CB 3.31Å; T365-C369 PolarHBondContact O-N 2.78Å; T365-C369 PolarHBondContact O-SG 3.25Å; L366-C369 WeakPolarHBondContact O-CB 3.1Å; L366-C369 PolarHBondContact O-N 2.88Å; R367-C369 PolarHBondContact O-N 2.92Å; C369-L373 WeakPolarHBondContact O-CB 3.43Å; C369-L373 WeakPolarHBondContact O-CD1 3.44Å; C369-L373 VanDerWaalsContact O-CG 3.23Å; C369-L373 WeakPolarHBondContact O-CG 3.48Å; C369-L373 PolarHBondContact O-N 2.79Å; C369-V385 HydrophobicContact CB-CG1 3.75Å; C369-Y387 HydrophobicContact CB-CD1 4.42Å; C369-Y387 HydrophobicContact CB-CE1 4.29Å
370	M	94.3	Very high	90.6	Very high	6 Å²	6	47.7 Å²	47.7	3%	0.03	26%	0.255	C	S	.	.	H	α-helix	trans	-63.9	-41.7	176.7	-64.4	-54.2	152.5	0	0	112.3	L366 R367 L373 R374 F400 F428 M431 T432 V435	L366-M370 HydrophobicContact CD1-CE 3.79Å; L366-M370 WeakPolarHBondContact O-CG 3.29Å; L366-M370 PolarHBondContact O-N 3.35Å; L366-M370 VanDerWaalsContact O-N 3.08Å; R367-M370 PolarHBondContact O-N 2.87Å; R367-M370 VanDerWaalsContact O-N 3.16Å; M370-L373 PolarHBondContact O-N 2.84Å; M370-L373 HydrophobicContact SD-CD1 4.26Å; M370-R374 WeakPolarHBondContact O-CB 3.26Å; M370-R374 PolarHBondContact O-N 2.76Å; M370-F400 HydrophobicContact CE-CD1 3.34Å; M370-F400 HydrophobicContact CE-CD2 4.15Å; M370-F400 HydrophobicContact CE-CE1 3.1Å; M370-F400 HydrophobicContact CE-CE2 3.94Å; M370-F400 HydrophobicContact CE-CG 3.86Å; M370-F400 HydrophobicContact CE-CZ 3.41Å; M370-F400 VanDerWaalsContact CE-CZ 3.41Å; M370-F428 HydrophobicContact CB-CE2 4.23Å; M370-F428 HydrophobicContact CG-CE2 4.1Å; M370-F428 HydrophobicContact CG-CZ 4.31Å; M370-M431 HydrophobicContact CB-CE 3.73Å; M370-M431 HydrophobicContact CB-SD 3.79Å; M370-T432 HydrophobicContact CG-CG2 4.26Å; M370-T432 HydrophobicContact SD-CG2 4.29Å; M370-V435 HydrophobicContact CB-CG2 4.3Å; M370-V435 WeakPolarHBondContact O-CG2 3.45Å; M370-V435 HydrophobicContact SD-CG2 4.31Å
371	E	93.3	Very high	90.9	Very high	55 Å²	55	49 Å²	49	26%	0.257	26%	0.264	S	S	.	.	H	α-helix	trans	-61.6	-48.7	178	-72.1	173.6	173.8	0	0	111.1	R367 T368 L373 R374 E375 M431	R367-E371 HydrophobicContact CG-CG 4.35Å; R367-E371 WeakPolarHBondContact CG-OE1 3.5Å; R367-E371 IonicContact CZ-OE1 2.94Å; R367-E371 IonicContact NE-OE1 2.87Å; R367-E371 PolarHBondContact NE-OE1 2.95Å; R367-E371 IonicContact NH2-OE1 3.83Å; R367-E371 PolarHBondContact NH2-OE1 2.85Å; R367-E371 WeakPolarHBondContact O-CG 3.07Å; R367-E371 PolarHBondContact O-N 2.86Å; T368-E371 PolarHBondContact O-N 2.78Å; E371-L373 VanDerWaalsContact C-N 3.34Å; E371-L373 PolarHBondContact O-N 2.75Å; E371-R374 PolarHBondContact O-N 2.9Å; E371-E375 WeakPolarHBondContact O-CB 3.42Å; E371-E375 WeakPolarHBondContact O-CG 3.4Å; E371-E375 PolarHBondContact O-N 3.21Å; E371-M431 HydrophobicContact CG-CE 3.58Å; E371-M431 HydrophobicContact CG-CG 4.44Å; E371-M431 HydrophobicContact CG-SD 3.9Å
372	V	93.9	Very high	90.8	Very high	16 Å²	16	52.6 Å²	52.6	10%	0.097	29%	0.286	C	S	.	.	H	α-helix	trans	-65.6	-38.1	178.5	177.5	0	0	0	0	111.3	T368 E375 N376 R383 V385	T368-V372 HydrophobicContact CG2-CG2 4.25Å; T368-V372 WeakPolarHBondContact O-CB 3.46Å; T368-V372 VanDerWaalsContact O-CG2 3.26Å; T368-V372 WeakPolarHBondContact O-CG2 3.01Å; T368-V372 PolarHBondContact O-N 3.49Å; V372-E375 PolarHBondContact O-N 3.43Å; V372-N376 WeakPolarHBondContact O-CB 3.49Å; V372-N376 PolarHBondContact O-N 3.02Å; V372-N376 PolarHBondContact O-ND2 3.1Å; V372-R383 HydrophobicContact CG1-CB 3.86Å; V372-V385 HydrophobicContact CG1-CG2 3.97Å
373	L	91.9	Very high	90.9	Very high	13 Å²	13	57.6 Å²	57.6	7%	0.068	30%	0.304	C	S	.	.	H	α-helix	trans	-61.2	-50.2	174.7	-81.2	167.9	0	0	0	111.7	C369 M370 E371 E375 N376 Q377 V385 Y387 F400 V435	C369-L373 WeakPolarHBondContact O-CB 3.43Å; C369-L373 WeakPolarHBondContact O-CD1 3.44Å; C369-L373 VanDerWaalsContact O-CG 3.23Å; C369-L373 WeakPolarHBondContact O-CG 3.48Å; C369-L373 PolarHBondContact O-N 2.79Å; M370-L373 PolarHBondContact O-N 2.84Å; M370-L373 HydrophobicContact SD-CD1 4.26Å; E371-L373 VanDerWaalsContact C-N 3.34Å; E371-L373 PolarHBondContact O-N 2.75Å; L373-E375 VanDerWaalsContact C-N 3.35Å; L373-E375 PolarHBondContact O-N 2.89Å; L373-N376 WeakPolarHBondContact O-CB 3.47Å; L373-N376 PolarHBondContact O-N 3.35Å; L373-Q377 VanDerWaalsContact O-CG 3.25Å; L373-Q377 WeakPolarHBondContact O-CG 3.5Å; L373-Q377 PolarHBondContact O-N 2.86Å; L373-V385 HydrophobicContact CD2-CG2 3.82Å; L373-V385 HydrophobicContact CG-CG1 4.2Å; L373-V385 HydrophobicContact CG-CG2 3.94Å; L373-Y387 WeakPolarHBondContact CD1-OH 3.31Å; L373-Y387 WeakPolarHBondContact CD2-OH 3.35Å; L373-F400 HydrophobicContact CD1-CB 3.93Å; L373-V435 HydrophobicContact CB-CG1 4.04Å; L373-V435 HydrophobicContact CB-CG2 4.47Å; L373-V435 HydrophobicContact CD1-CG1 4.38Å
374	R	91.8	Very high	90.9	Very high	65 Å²	65	65.3 Å²	65.3	25%	0.245	34%	0.342	C	S	.	.	H	α-helix	trans	-57.6	-48.9	176.3	-174.4	-172.4	62.3	171.9	1.5	111.1	M370 E371 N376 Q377 M378 M431 E434 V435	M370-R374 WeakPolarHBondContact O-CB 3.26Å; M370-R374 PolarHBondContact O-N 2.76Å; E371-R374 PolarHBondContact O-N 2.9Å; R374-N376 VanDerWaalsContact C-N 3.3Å; R374-N376 PolarHBondContact O-N 3.13Å; R374-Q377 PolarHBondContact O-N 2.9Å; R374-Q377 VanDerWaalsContact O-N 3.08Å; R374-M378 HydrophobicContact CG-CG 4.08Å; R374-M378 HydrophobicContact CG-SD 3.85Å; R374-M378 WeakPolarHBondContact O-CG 3.3Å; R374-M378 PolarHBondContact O-N 2.88Å; R374-M431 VanDerWaalsContact CZ-CG 3.43Å; R374-M431 VanDerWaalsContact NH1-CG 3.27Å; R374-E434 WeakPolarHBondContact CD-OE2 3.48Å; R374-E434 HydrophobicContact CG-CB 4.18Å; R374-E434 IonicContact CZ-OE2 2.65Å; R374-E434 IonicContact NE-OE2 3.62Å; R374-E434 IonicContact NH1-OE2 3.6Å; R374-E434 PolarHBondContact NH1-OE2 3.23Å; R374-V435 HydrophobicContact CB-CG2 3.94Å
375	E	90.9	Very high	91.2	Very high	62 Å²	62	61 Å²	61	29%	0.29	32%	0.321	S	S	.	.	H	α-helix	trans	-60.9	-40	-180	-72.9	177.7	124.7	0	0	112.1	E371 V372 L373 Q377 C379 T381 R383	E371-E375 WeakPolarHBondContact O-CB 3.42Å; E371-E375 WeakPolarHBondContact O-CG 3.4Å; E371-E375 PolarHBondContact O-N 3.21Å; V372-E375 PolarHBondContact O-N 3.43Å; L373-E375 VanDerWaalsContact C-N 3.35Å; L373-E375 PolarHBondContact O-N 2.89Å; E375-Q377 VanDerWaalsContact C-N 3.29Å; E375-Q377 PolarHBondContact O-N 3.01Å; E375-C379 VanDerWaalsContact O-CB 3.3Å; E375-C379 WeakPolarHBondContact O-CB 3.39Å; E375-C379 PolarHBondContact O-N 3.19Å; E375-T381 PolarHBondContact O-OG1 3.33Å; E375-R383 IonicContact OE1-CZ 3.71Å; E375-R383 IonicContact OE1-NH1 3.66Å; E375-R383 PolarHBondContact OE1-NH1 2.6Å; E375-R383 IonicContact OE1-NH2 2.86Å; E375-R383 PolarHBondContact OE1-NH2 3.25Å; E375-R383 IonicContact OE2-CZ 2.8Å; E375-R383 IonicContact OE2-NE 2.67Å; E375-R383 IonicContact OE2-NH1 3.81Å; E375-R383 PolarHBondContact OE2-NH1 3.23Å; E375-R383 IonicContact OE2-NH2 2.72Å; E375-R383 PolarHBondContact OE2-NH2 3.39Å
376	N	90.3	Very high	91.2	Very high	24 Å²	24	62 Å²	62	13%	0.128	33%	0.328	C	S	.	.	H	α-helix	trans	-62.3	-37.4	174.5	-75.4	-18.9	0	0	0	112.5	V372 L373 R374 G380 T381 R383	V372-N376 WeakPolarHBondContact O-CB 3.49Å; V372-N376 PolarHBondContact O-N 3.02Å; V372-N376 PolarHBondContact O-ND2 3.1Å; L373-N376 WeakPolarHBondContact O-CB 3.47Å; L373-N376 PolarHBondContact O-N 3.35Å; R374-N376 VanDerWaalsContact C-N 3.3Å; R374-N376 PolarHBondContact O-N 3.13Å; N376-G380 CarbonylContact O-C 3.58Å; N376-G380 VanDerWaalsContact O-CA 3.25Å; N376-G380 WeakPolarHBondContact O-CA 3.31Å; N376-G380 PolarHBondContact O-N 3.46Å; N376-T381 VanDerWaalsContact CA-O 3.26Å; N376-T381 WeakPolarHBondContact CA-O 3.39Å; N376-T381 WeakPolarHBondContact CA-OG1 3.45Å; N376-T381 WeakPolarHBondContact CB-O 3.46Å; N376-T381 VanDerWaalsContact CG-O 3.23Å; N376-T381 PolarHBondContact O-N 3.38Å; N376-T381 VanDerWaalsContact OD1-C 3.26Å; N376-T381 PolarHBondContact OD1-O 3.26Å; N376-T381 PolarHBondContact OD1-OG1 2.85Å; N376-R383 PolarHBondContact ND2-O 3Å; N376-R383 WeakPolarHBondContact OD1-CB 3.46Å; N376-R383 PolarHBondContact OD1-N 3.28Å
377	Q	89	Confident	91.3	Very high	60 Å²	60	62.6 Å²	62.6	28%	0.28	33%	0.33	S	S	.	.	H	α-helix	trans	-75.4	-44.9	179.5	-67.2	168.2	0.5	0	0	112.2	L373 R374 E375 E436	L373-Q377 VanDerWaalsContact O-CG 3.25Å; L373-Q377 WeakPolarHBondContact O-CG 3.5Å; L373-Q377 PolarHBondContact O-N 2.86Å; R374-Q377 PolarHBondContact O-N 2.9Å; R374-Q377 VanDerWaalsContact O-N 3.08Å; E375-Q377 VanDerWaalsContact C-N 3.29Å; E375-Q377 PolarHBondContact O-N 3.01Å; Q377-E436 PolarHBondContact NE2-O 3.43Å
378	M	86.1	Confident	91.3	Very high	137 Å²	137	67.6 Å²	67.6	68%	0.675	35%	0.349	S	S	*	.	H	α-helix	trans	-74.4	-44.4	-177.5	-66.4	-169.8	85.3	0	0	113.1	R374	R374-M378 HydrophobicContact CG-CG 4.08Å; R374-M378 HydrophobicContact CG-SD 3.85Å; R374-M378 WeakPolarHBondContact O-CG 3.3Å; R374-M378 PolarHBondContact O-N 2.88Å
379	C	88.5	Confident	91.2	Very high	95 Å²	95	69.5 Å²	69.5	64%	0.642	36%	0.357	S	S	*	.	S	Bend	trans	-95.9	-1.7	-174.6	-60.6	0	0	0	0	112.8	E375 T381	E375-C379 VanDerWaalsContact O-CB 3.3Å; E375-C379 WeakPolarHBondContact O-CB 3.39Å; E375-C379 PolarHBondContact O-N 3.19Å; C379-T381 HydrophobicContact CB-CG2 3.93Å; C379-T381 PolarHBondContact O-N 3.07Å
380	G	83.4	Confident	91.1	Very high	67 Å²	67	69.6 Å²	69.6	69%	0.691	36%	0.358	S	S	*	.			trans	62.4	22.7	-173.4	0	0	0	0	0	113.4	N376	N376-G380 CarbonylContact O-C 3.58Å; N376-G380 VanDerWaalsContact O-CA 3.25Å; N376-G380 WeakPolarHBondContact O-CA 3.31Å; N376-G380 PolarHBondContact O-N 3.46Å
381	T	86.9	Confident	91.1	Very high	51 Å²	51	72.6 Å²	72.6	31%	0.313	37%	0.371	S	S	.	.			trans	-77.8	158.5	176.3	61	0	0	0	0	110.8	E375 N376 C379	E375-T381 PolarHBondContact O-OG1 3.33Å; N376-T381 VanDerWaalsContact CA-O 3.26Å; N376-T381 WeakPolarHBondContact CA-O 3.39Å; N376-T381 WeakPolarHBondContact CA-OG1 3.45Å; N376-T381 WeakPolarHBondContact CB-O 3.46Å; N376-T381 VanDerWaalsContact CG-O 3.23Å; N376-T381 PolarHBondContact O-N 3.38Å; N376-T381 VanDerWaalsContact OD1-C 3.26Å; N376-T381 PolarHBondContact OD1-O 3.26Å; N376-T381 PolarHBondContact OD1-OG1 2.85Å; C379-T381 HydrophobicContact CB-CG2 3.93Å; C379-T381 PolarHBondContact O-N 3.07Å
382	N	86.3	Confident	91.2	Very high	164 Å²	164	70.1 Å²	70.1	88%	0.877	36%	0.359	S	S	*	.			trans	-122.1	51	175.4	-162.8	18.4	0	0	0	110.3
383	R	91.2	Very high	91.2	Very high	113 Å²	113	69.4 Å²	69.4	43%	0.426	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-69.7	138.1	175.5	-75	-171.7	-87.2	176.4	-14.9	109.2	V372 E375 N376 V385	V372-R383 HydrophobicContact CG1-CB 3.86Å; E375-R383 IonicContact OE1-CZ 3.71Å; E375-R383 IonicContact OE1-NH1 3.66Å; E375-R383 PolarHBondContact OE1-NH1 2.6Å; E375-R383 IonicContact OE1-NH2 2.86Å; E375-R383 PolarHBondContact OE1-NH2 3.25Å; E375-R383 IonicContact OE2-CZ 2.8Å; E375-R383 IonicContact OE2-NE 2.67Å; E375-R383 IonicContact OE2-NH1 3.81Å; E375-R383 PolarHBondContact OE2-NH1 3.23Å; E375-R383 IonicContact OE2-NH2 2.72Å; E375-R383 PolarHBondContact OE2-NH2 3.39Å; N376-R383 PolarHBondContact ND2-O 3Å; N376-R383 WeakPolarHBondContact OD1-CB 3.46Å; N376-R383 PolarHBondContact OD1-N 3.28Å; R383-V385 PolarHBondContact O-N 2.71Å
384	M	91.3	Very high	91.4	Very high	173 Å²	173	70.4 Å²	70.4	85%	0.852	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-66.2	125.1	177.3	-175.7	177.1	67.5	0	0	110
385	V	93.9	Very high	91.6	Very high	21 Å²	21	68 Å²	68	13%	0.127	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-79	129	176.5	-173	0	0	0	0	109.2	C369 V372 L373 R383 Y387	C369-V385 HydrophobicContact CB-CG1 3.75Å; V372-V385 HydrophobicContact CG1-CG2 3.97Å; L373-V385 HydrophobicContact CD2-CG2 3.82Å; L373-V385 HydrophobicContact CG-CG1 4.2Å; L373-V385 HydrophobicContact CG-CG2 3.94Å; R383-V385 PolarHBondContact O-N 2.71Å; V385-Y387 HydrophobicContact CB-CD2 3.89Å; V385-Y387 HydrophobicContact CB-CE1 4.42Å; V385-Y387 HydrophobicContact CB-CE2 3.45Å; V385-Y387 VanDerWaalsContact CB-CE2 3.45Å; V385-Y387 HydrophobicContact CG1-CD1 4.03Å; V385-Y387 HydrophobicContact CG1-CD2 3.98Å; V385-Y387 HydrophobicContact CG1-CE1 3.61Å; V385-Y387 HydrophobicContact CG1-CE2 3.59Å; V385-Y387 HydrophobicContact CG1-CG 4.2Å; V385-Y387 HydrophobicContact CG2-CE2 4.19Å; V385-Y387 PolarHBondContact O-N 2.86Å
386	P	95.3	Very high	91.8	Very high	25 Å²	25	65.1 Å²	65.1	16%	0.162	34%	0.338	C	S	.	.			trans	-80.8	49.5	-171.3	33.4	-36.9	0	0	0	113.8	T368 R388 D389	T368-P386 HydrophobicContact CG2-CG 3.89Å; P386-R388 PolarHBondContact O-N 2.93Å; P386-D389 WeakPolarHBondContact CB-OD2 3.13Å; P386-D389 PolarHBondContact O-N 3.29Å
387	Y	94.8	Very high	91.9	Very high	15 Å²	15	66.6 Å²	66.6	6%	0.059	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-57.5	-29.2	-177.7	-63.4	-65.9	0	0	0	113.8	C369 L373 V385 D389 S390 T393 H394 K397 F400 D401	C369-Y387 HydrophobicContact CB-CD1 4.42Å; C369-Y387 HydrophobicContact CB-CE1 4.29Å; L373-Y387 WeakPolarHBondContact CD1-OH 3.31Å; L373-Y387 WeakPolarHBondContact CD2-OH 3.35Å; V385-Y387 HydrophobicContact CB-CD2 3.89Å; V385-Y387 HydrophobicContact CB-CE1 4.42Å; V385-Y387 HydrophobicContact CB-CE2 3.45Å; V385-Y387 VanDerWaalsContact CB-CE2 3.45Å; V385-Y387 HydrophobicContact CG1-CD1 4.03Å; V385-Y387 HydrophobicContact CG1-CD2 3.98Å; V385-Y387 HydrophobicContact CG1-CE1 3.61Å; V385-Y387 HydrophobicContact CG1-CE2 3.59Å; V385-Y387 HydrophobicContact CG1-CG 4.2Å; V385-Y387 HydrophobicContact CG2-CE2 4.19Å; V385-Y387 PolarHBondContact O-N 2.86Å; Y387-D389 VanDerWaalsContact C-N 3.29Å; Y387-D389 PolarHBondContact O-N 2.74Å; Y387-S390 VanDerWaalsContact O-O 3.13Å; Y387-T393 CarbonylContact O-C 3.52Å; Y387-T393 PolarHBondContact O-OG1 2.91Å; Y387-H394 VanDerWaalsContact O-CA 3.27Å; Y387-H394 WeakPolarHBondContact O-CA 3.26Å; Y387-H394 VanDerWaalsContact O-CB 3.31Å; Y387-H394 WeakPolarHBondContact O-CB 3.2Å; Y387-H394 PolarHBondContact O-N 3.47Å; Y387-K397 HydrophobicContact CD1-CB 4.28Å; Y387-K397 HydrophobicContact CD1-CG 4.38Å; Y387-K397 HydrophobicContact CD2-CB 4.4Å; Y387-K397 HydrophobicContact CD2-CD 4.09Å; Y387-K397 HydrophobicContact CD2-CG 3.69Å; Y387-K397 HydrophobicContact CE2-CG 3.95Å; Y387-K397 HydrophobicContact CG-CB 4.09Å; Y387-K397 HydrophobicContact CG-CD 4.43Å; Y387-K397 HydrophobicContact CG-CG 3.9Å; Y387-F400 HydrophobicContact CD1-CD2 4.24Å; Y387-F400 HydrophobicContact CE1-CB 3.89Å; Y387-F400 AromaticContact CE1-CD2 3.71Å; Y387-F400 HydrophobicContact CE1-CD2 3.71Å; Y387-F400 HydrophobicContact CE1-CG 4.25Å; Y387-D401 PolarHBondContact OH-OD1 3.34Å; Y387-D401 VanDerWaalsContact OH-OD1 3.12Å
388	R	93.9	Very high	91.9	Very high	198 Å²	198	64.2 Å²	64.2	75%	0.747	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-75.3	-15.1	-174	-67.6	-175.7	173.2	-178.6	-0.7	114.1	P386 S390	P386-R388 PolarHBondContact O-N 2.93Å; R388-S390 VanDerWaalsContact C-N 3.25Å; R388-S390 PolarHBondContact O-N 2.6Å
389	D	93.1	Very high	92.2	Very high	100 Å²	100	58.3 Å²	58.3	54%	0.535	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-73.5	-20.1	-172.6	-67.1	2.6	0	0	0	112	T365 P386 Y387	T365-D389 HydrophobicContact CG2-CB 3.68Å; P386-D389 WeakPolarHBondContact CB-OD2 3.13Å; P386-D389 PolarHBondContact O-N 3.29Å; Y387-D389 VanDerWaalsContact C-N 3.29Å; Y387-D389 PolarHBondContact O-N 2.74Å
390	S	94.1	Very high	92.2	Very high	2 Å²	2	54 Å²	54	1%	0.014	27%	0.273	C	S	.	.	S	Bend	trans	-133.8	146.2	170.6	-178.7	0	0	0	0	112	S362 Y387 R388 V392 T393 H394	S362-S390 WeakPolarHBondContact CA-OG 3.35Å; S362-S390 WeakPolarHBondContact CB-OG 3.39Å; Y387-S390 VanDerWaalsContact O-O 3.13Å; R388-S390 VanDerWaalsContact C-N 3.25Å; R388-S390 PolarHBondContact O-N 2.6Å; S390-V392 VanDerWaalsContact C-N 3.26Å; S390-V392 PolarHBondContact O-N 2.9Å; S390-V392 PolarHBondContact OG-N 3.38Å; S390-T393 WeakPolarHBondContact CB-OG1 3.41Å; S390-T393 PolarHBondContact O-N 3.16Å; S390-T393 PolarHBondContact O-OG1 2.88Å; S390-H394 VanDerWaalsContact O-CB 3.25Å; S390-H394 WeakPolarHBondContact O-CB 3.4Å; S390-H394 PolarHBondContact O-N 3.46Å
391	K	94.2	Very high	92.3	Very high	69 Å²	69	55 Å²	55	30%	0.3	26%	0.262	S	S	.	.	H	α-helix	trans	-62.2	-31.8	173.3	-64.7	-54.3	-180	-174.9	0	113.1	I224 N227 I229 L251 L395	I224-K391 HydrophobicContact CG2-CB 4.11Å; N227-K391 WeakPolarHBondContact O-CG 3.39Å; N227-K391 WeakPolarHBondContact OD1-CG 3.35Å; N227-K391 PolarHBondContact OD1-N 3.48Å; I229-K391 HydrophobicContact CD1-CB 4.2Å; I229-K391 HydrophobicContact CD1-CD 4.45Å; I229-K391 HydrophobicContact CD1-CG 4.36Å; I229-K391 HydrophobicContact CG1-CB 4.21Å; I229-K391 HydrophobicContact CG1-CG 4.26Å; L251-K391 HydrophobicContact CD1-CB 4.44Å; L251-K391 HydrophobicContact CD1-CD 3.9Å; K391-L395 VanDerWaalsContact O-CB 3.26Å; K391-L395 WeakPolarHBondContact O-CB 3.45Å; K391-L395 PolarHBondContact O-N 3.34Å
392	V	94.2	Very high	91.9	Very high	3 Å²	3	53.2 Å²	53.2	2%	0.018	25%	0.254	C	S	.	.	H	α-helix	trans	-64.4	-54.3	177.8	177.9	0	0	0	0	109.9	I224 H301 L337 S390 H394 L395 F396	I224-V392 HydrophobicContact CB-CG2 4.37Å; I224-V392 HydrophobicContact CD1-CG2 3.92Å; I224-V392 HydrophobicContact CG2-CG2 4.02Å; H301-V392 HydrophobicContact CB-CG2 4.4Å; L337-V392 HydrophobicContact CD2-CG1 4.26Å; S390-V392 VanDerWaalsContact C-N 3.26Å; S390-V392 PolarHBondContact O-N 2.9Å; S390-V392 PolarHBondContact OG-N 3.38Å; V392-H394 VanDerWaalsContact C-N 3.28Å; V392-H394 PolarHBondContact O-N 3.36Å; V392-L395 PolarHBondContact O-N 3.17Å; V392-F396 HydrophobicContact CG1-CD2 4.02Å; V392-F396 HydrophobicContact CG1-CE2 4.06Å; V392-F396 WeakPolarHBondContact O-CD2 3.33Å; V392-F396 PolarHBondContact O-N 3.35Å
393	T	94.8	Very high	91.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-66.3	-32.1	179.8	51	0	0	0	0	112.5	T365 L366 Y387 S390 K397	T365-T393 HydrophobicContact CG2-CG2 4.01Å; L366-T393 VanDerWaalsContact CA-CG2 3.46Å; L366-T393 HydrophobicContact CB-CG2 3.89Å; L366-T393 HydrophobicContact CD1-CG2 4.03Å; Y387-T393 CarbonylContact O-C 3.52Å; Y387-T393 PolarHBondContact O-OG1 2.91Å; S390-T393 WeakPolarHBondContact CB-OG1 3.41Å; S390-T393 PolarHBondContact O-N 3.16Å; S390-T393 PolarHBondContact O-OG1 2.88Å; T393-K397 PolarHBondContact O-N 2.89Å; T393-K397 VanDerWaalsContact O-N 3.12Å
394	H	95.4	Very high	91.3	Very high	34 Å²	34	43.6 Å²	43.6	16%	0.157	21%	0.209	C	C	.	.	H	α-helix	trans	-72.3	-39.1	178	-163.2	-175.8	0	0	0	111.6	L251 M259 Y387 S390 V392 K397	L251-H394 HydrophobicContact CD1-CB 3.86Å; M259-H394 WeakPolarHBondContact CE-NE2 3.47Å; M259-H394 VanDerWaalsContact CG-O 3.3Å; M259-H394 WeakPolarHBondContact CG-O 3.32Å; Y387-H394 VanDerWaalsContact O-CA 3.27Å; Y387-H394 WeakPolarHBondContact O-CA 3.26Å; Y387-H394 VanDerWaalsContact O-CB 3.31Å; Y387-H394 WeakPolarHBondContact O-CB 3.2Å; Y387-H394 PolarHBondContact O-N 3.47Å; S390-H394 VanDerWaalsContact O-CB 3.25Å; S390-H394 WeakPolarHBondContact O-CB 3.4Å; S390-H394 PolarHBondContact O-N 3.46Å; V392-H394 VanDerWaalsContact C-N 3.28Å; V392-H394 PolarHBondContact O-N 3.36Å; H394-K397 WeakPolarHBondContact O-CB 3.49Å
395	L	95.4	Very high	91.3	Very high	15 Å²	15	38 Å²	38	8%	0.079	18%	0.18	C	C	.	.	H	α-helix	trans	-63.5	-41.5	176.2	177.2	61.6	0	0	0	111.4	I222 I224 L251 V261 K391 V392	I222-L395 HydrophobicContact CD1-CD2 3.87Å; I224-L395 HydrophobicContact CD1-CD2 4.2Å; L251-L395 HydrophobicContact CD1-CB 4.33Å; L251-L395 HydrophobicContact CD2-CB 4.18Å; L251-L395 HydrophobicContact CD2-CD1 3.72Å; L251-L395 HydrophobicContact CD2-CG 4.47Å; V261-L395 HydrophobicContact CG2-CD1 4.14Å; K391-L395 VanDerWaalsContact O-CB 3.26Å; K391-L395 WeakPolarHBondContact O-CB 3.45Å; K391-L395 PolarHBondContact O-N 3.34Å; V392-L395 PolarHBondContact O-N 3.17Å
396	F	94.9	Very high	91.3	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.009	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95	10.6	-176.1	-58.1	-57.3	0	0	0	114.8	L105 F107 V303 C333 V335 V392 N398 Y399 F400	L105-F396 HydrophobicContact CD1-CD1 3.62Å; L105-F396 HydrophobicContact CD1-CE1 3.61Å; L105-F396 HydrophobicContact CD1-CG 4.18Å; L105-F396 HydrophobicContact CD1-CZ 4.15Å; L105-F396 HydrophobicContact CD2-CB 3.88Å; L105-F396 HydrophobicContact CD2-CD1 3.87Å; L105-F396 HydrophobicContact CD2-CG 3.93Å; L105-F396 HydrophobicContact CG-CD1 4.42Å; F107-F396 AromaticContact CE1-CD2 3.84Å; F107-F396 HydrophobicContact CE1-CD2 3.84Å; F107-F396 AromaticContact CE1-CE2 3.91Å; F107-F396 HydrophobicContact CE1-CE2 3.91Å; F107-F396 HydrophobicContact CE1-CG 4.46Å; F107-F396 HydrophobicContact CZ-CB 4.49Å; F107-F396 AromaticContact CZ-CD2 3.94Å; F107-F396 HydrophobicContact CZ-CD2 3.94Å; F107-F396 HydrophobicContact CZ-CE2 4.43Å; F107-F396 HydrophobicContact CZ-CG 4.18Å; V303-F396 HydrophobicContact CB-CZ 4.47Å; V303-F396 HydrophobicContact CG1-CE1 4.3Å; V303-F396 HydrophobicContact CG1-CZ 3.8Å; V303-F396 HydrophobicContact CG2-CE2 4.26Å; V303-F396 HydrophobicContact CG2-CZ 3.8Å; C333-F396 HydrophobicContact CB-CE1 3.96Å; V335-F396 HydrophobicContact CG1-CE2 4.38Å; V335-F396 HydrophobicContact CG2-CE1 4.1Å; V335-F396 HydrophobicContact CG2-CE2 3.95Å; V335-F396 HydrophobicContact CG2-CZ 3.43Å; V335-F396 VanDerWaalsContact CG2-CZ 3.43Å; V392-F396 HydrophobicContact CG1-CD2 4.02Å; V392-F396 HydrophobicContact CG1-CE2 4.06Å; V392-F396 WeakPolarHBondContact O-CD2 3.33Å; V392-F396 PolarHBondContact O-N 3.35Å; F396-N398 VanDerWaalsContact C-N 3.25Å; F396-N398 PolarHBondContact O-N 3.13Å; F396-Y399 HydrophobicContact CB-CD2 4.35Å; F396-Y399 HydrophobicContact CD1-CD2 4.01Å; F396-Y399 HydrophobicContact CD1-CE2 4.12Å; F396-Y399 PolarHBondContact O-N 3.12Å; F396-Y399 VanDerWaalsContact O-N 3.09Å; F396-F400 HydrophobicContact CB-CD2 4.33Å; F396-F400 HydrophobicContact CB-CE2 3.71Å; F396-F400 HydrophobicContact CB-CZ 3.98Å; F396-F400 VanDerWaalsContact O-CD2 3.27Å; F396-F400 WeakPolarHBondContact O-CD2 3.4Å; F396-F400 PolarHBondContact O-N 3.47Å
397	K	92.7	Very high	91.4	Very high	55 Å²	55	37.2 Å²	37.2	24%	0.239	17%	0.172	C	C	.	.	H	α-helix	trans	-45.6	-50.2	179.7	173.5	-175.7	170.1	-122.9	0	112.1	M259 Y387 T393 H394 Y399 F400 D401	M259-K397 HydrophobicContact CG-CB 4.39Å; Y387-K397 HydrophobicContact CD1-CB 4.28Å; Y387-K397 HydrophobicContact CD1-CG 4.38Å; Y387-K397 HydrophobicContact CD2-CB 4.4Å; Y387-K397 HydrophobicContact CD2-CD 4.09Å; Y387-K397 HydrophobicContact CD2-CG 3.69Å; Y387-K397 HydrophobicContact CE2-CG 3.95Å; Y387-K397 HydrophobicContact CG-CB 4.09Å; Y387-K397 HydrophobicContact CG-CD 4.43Å; Y387-K397 HydrophobicContact CG-CG 3.9Å; T393-K397 PolarHBondContact O-N 2.89Å; T393-K397 VanDerWaalsContact O-N 3.12Å; H394-K397 WeakPolarHBondContact O-CB 3.49Å; K397-Y399 VanDerWaalsContact C-N 3.32Å; K397-Y399 PolarHBondContact O-N 3.46Å; K397-F400 PolarHBondContact O-N 3.47Å; K397-F400 VanDerWaalsContact O-N 3.11Å; K397-D401 VanDerWaalsContact CE-OD2 3.31Å; K397-D401 WeakPolarHBondContact CE-OD2 3.49Å; K397-D401 IonicContact NZ-OD2 2.8Å; K397-D401 PolarHBondContact O-N 2.89Å
398	N	90.1	Very high	91.4	Very high	9 Å²	9	36.8 Å²	36.8	5%	0.048	17%	0.171	C	C	.	.	H	α-helix	trans	-60.4	-39.1	-175.7	-66	82.9	0	0	0	113.2	H257 N258 M259 F396 F400 D401 G402 E403	H257-N398 PolarHBondContact O-ND2 3.36Å; N258-N398 WeakPolarHBondContact CA-ND2 3.34Å; N258-N398 WeakPolarHBondContact OD1-CB 3.31Å; N258-N398 PolarHBondContact OD1-ND2 3.35Å; M259-N398 WeakPolarHBondContact CG-OD1 3.33Å; M259-N398 PolarHBondContact N-OD1 3.22Å; F396-N398 VanDerWaalsContact C-N 3.25Å; F396-N398 PolarHBondContact O-N 3.13Å; N398-F400 VanDerWaalsContact C-N 3.31Å; N398-F400 PolarHBondContact O-N 3.28Å; N398-D401 PolarHBondContact O-N 3.24Å; N398-G402 PolarHBondContact O-N 2.83Å; N398-G402 VanDerWaalsContact O-N 3.11Å; N398-E403 HydrophobicContact CB-CB 4.21Å; N398-E403 WeakPolarHBondContact O-CB 3.09Å; N398-E403 PolarHBondContact O-N 3.49Å
399	Y	91.3	Very high	91.6	Very high	13 Å²	13	27.4 Å²	27.4	5%	0.051	14%	0.136	C	C	.	.	H	α-helix	trans	-66.3	-36	177.7	-66	-90.6	0	0	0	111.9	N103 L105 C333 F396 K397 V437	N103-Y399 HydrophobicContact CB-CD1 4.47Å; N103-Y399 HydrophobicContact CB-CE1 3.72Å; L105-Y399 HydrophobicContact CB-CD1 3.53Å; L105-Y399 HydrophobicContact CB-CE1 3.87Å; L105-Y399 HydrophobicContact CB-CG 3.93Å; L105-Y399 VanDerWaalsContact CD2-CB 3.45Å; L105-Y399 HydrophobicContact CD2-CD1 4.09Å; L105-Y399 HydrophobicContact CD2-CD2 3.96Å; L105-Y399 HydrophobicContact CD2-CG 3.59Å; L105-Y399 HydrophobicContact CG-CD1 4.45Å; L105-Y399 HydrophobicContact CG-CG 4.39Å; C333-Y399 PolarHBondContact SG-OH 3.05Å; F396-Y399 HydrophobicContact CB-CD2 4.35Å; F396-Y399 HydrophobicContact CD1-CD2 4.01Å; F396-Y399 HydrophobicContact CD1-CE2 4.12Å; F396-Y399 PolarHBondContact O-N 3.12Å; F396-Y399 VanDerWaalsContact O-N 3.09Å; K397-Y399 VanDerWaalsContact C-N 3.32Å; K397-Y399 PolarHBondContact O-N 3.46Å; Y399-V437 VanDerWaalsContact O-CG1 3.27Å; Y399-V437 WeakPolarHBondContact O-CG1 3.38Å
400	F	89.9	Confident	91.8	Very high	5 Å²	5	22.6 Å²	22.6	2%	0.022	11%	0.11	C	C	.	.	H	α-helix	trans	-76.4	-28.9	176.4	-55.3	-42.8	0	0	0	113	L105 F107 L366 M370 L373 Y387 F396 K397 N398 G402 V406	L105-F400 HydrophobicContact CD2-CE1 4.29Å; F107-F400 AromaticContact CE2-CE1 3.94Å; F107-F400 HydrophobicContact CE2-CE1 3.94Å; F107-F400 HydrophobicContact CE2-CZ 4.01Å; F107-F400 HydrophobicContact CZ-CE1 4.16Å; F107-F400 AromaticContact CZ-CZ 3.78Å; F107-F400 HydrophobicContact CZ-CZ 3.78Å; L366-F400 HydrophobicContact CD1-CE2 3.9Å; L366-F400 HydrophobicContact CD1-CZ 3.62Å; M370-F400 HydrophobicContact CE-CD1 3.34Å; M370-F400 HydrophobicContact CE-CD2 4.15Å; M370-F400 HydrophobicContact CE-CE1 3.1Å; M370-F400 HydrophobicContact CE-CE2 3.94Å; M370-F400 HydrophobicContact CE-CG 3.86Å; M370-F400 HydrophobicContact CE-CZ 3.41Å; M370-F400 VanDerWaalsContact CE-CZ 3.41Å; L373-F400 HydrophobicContact CD1-CB 3.93Å; Y387-F400 HydrophobicContact CD1-CD2 4.24Å; Y387-F400 HydrophobicContact CE1-CB 3.89Å; Y387-F400 AromaticContact CE1-CD2 3.71Å; Y387-F400 HydrophobicContact CE1-CD2 3.71Å; Y387-F400 HydrophobicContact CE1-CG 4.25Å; F396-F400 HydrophobicContact CB-CD2 4.33Å; F396-F400 HydrophobicContact CB-CE2 3.71Å; F396-F400 HydrophobicContact CB-CZ 3.98Å; F396-F400 VanDerWaalsContact O-CD2 3.27Å; F396-F400 WeakPolarHBondContact O-CD2 3.4Å; F396-F400 PolarHBondContact O-N 3.47Å; K397-F400 PolarHBondContact O-N 3.47Å; K397-F400 VanDerWaalsContact O-N 3.11Å; N398-F400 VanDerWaalsContact C-N 3.31Å; N398-F400 PolarHBondContact O-N 3.28Å; F400-G402 VanDerWaalsContact C-N 3.31Å; F400-V406 HydrophobicContact CD1-CG2 4.44Å; F400-V406 HydrophobicContact CE1-CG1 4.23Å
401	D	85.5	Confident	91.9	Very high	88 Å²	88	22.6 Å²	22.6	47%	0.471	11%	0.11	S	C	.	.	H	α-helix	trans	-80.1	-8.9	175.7	-78.9	-20.5	0	0	0	113.2	Y387 K397 N398	Y387-D401 PolarHBondContact OH-OD1 3.34Å; Y387-D401 VanDerWaalsContact OH-OD1 3.12Å; K397-D401 VanDerWaalsContact CE-OD2 3.31Å; K397-D401 WeakPolarHBondContact CE-OD2 3.49Å; K397-D401 IonicContact NZ-OD2 2.8Å; K397-D401 PolarHBondContact O-N 2.89Å; N398-D401 PolarHBondContact O-N 3.24Å
402	G	78	Confident	91.8	Very high	13 Å²	13	19.4 Å²	19.4	13%	0.134	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	123.2	3.7	173.7	0	0	0	0	0	117.4	N398 F400 G404	N398-G402 PolarHBondContact O-N 2.83Å; N398-G402 VanDerWaalsContact O-N 3.11Å; F400-G402 VanDerWaalsContact C-N 3.31Å; G402-G404 VanDerWaalsContact C-N 3.35Å; G402-G404 PolarHBondContact O-N 2.95Å
403	E	80.8	Confident	91.6	Very high	74 Å²	74	19.8 Å²	19.8	35%	0.346	10%	0.098	S	C	.	.	S	Bend	trans	-91.5	59.3	-179.6	-63.2	-157.2	-171.8	0	0	112.9	N103 N258 N398	N103-E403 WeakPolarHBondContact CB-O 3.45Å; N258-E403 VanDerWaalsContact CG-OE2 3.24Å; N258-E403 PolarHBondContact ND2-OE2 3.31Å; N258-E403 PolarHBondContact OD1-OE2 2.9Å; N398-E403 HydrophobicContact CB-CB 4.21Å; N398-E403 WeakPolarHBondContact O-CB 3.09Å; N398-E403 PolarHBondContact O-N 3.49Å
404	G	84.7	Confident	91.4	Very high	2 Å²	2	19.9 Å²	19.9	2%	0.021	10%	0.099	C	C	.	.	S	Bend	trans	142.6	175.3	174.6	0	0	0	0	0	113.9	N103 G402 V437	N103-G404 CarbonylContact O-C 3.51Å; N103-G404 WeakPolarHBondContact O-CA 3.29Å; G402-G404 VanDerWaalsContact C-N 3.35Å; G402-G404 PolarHBondContact O-N 2.95Å; G404-V437 WeakPolarHBondContact O-CG1 3.41Å
405	K	91	Very high	91	Very high	56 Å²	56	21 Å²	21	24%	0.243	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	134.6	171.1	-68	-168.2	-166.6	157	0	110.6	L94 D97 N103 G104 L105 P440	L94-K405 HydrophobicContact CD2-CB 3.95Å; D97-K405 IonicContact OD1-NZ 3.63Å; D97-K405 PolarHBondContact OD1-NZ 2.85Å; D97-K405 WeakPolarHBondContact OD2-CD 3.31Å; D97-K405 WeakPolarHBondContact OD2-CE 3.35Å; D97-K405 IonicContact OD2-NZ 2.82Å; D97-K405 PolarHBondContact OD2-NZ 3.32Å; N103-K405 PolarHBondContact O-N 3.4Å; G104-K405 WeakPolarHBondContact CA-O 3.44Å; L105-K405 PolarHBondContact N-O 2.92Å; K405-P440 HydrophobicContact CG-CG 4.21Å
406	V	94.2	Very high	90.5	Very high	9 Å²	9	21.1 Å²	21.1	6%	0.055	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	128.4	177.2	-173.5	0	0	0	0	109.9	V24 G25 L105 F107 F400 V437	V24-V406 HydrophobicContact CG1-CB 4.27Å; V24-V406 HydrophobicContact CG1-CG1 3.98Å; V24-V406 HydrophobicContact CG2-CB 4.42Å; G25-V406 PolarHBondContact N-O 3.23Å; L105-V406 HydrophobicContact CB-CG2 4.47Å; L105-V406 HydrophobicContact CD2-CG1 4.4Å; L105-V406 HydrophobicContact CD2-CG2 4.38Å; L105-V406 CarbonylContact O-C 3.58Å; L105-V406 WeakPolarHBondContact O-CA 3.46Å; F107-V406 HydrophobicContact CD2-CG1 4.23Å; F107-V406 HydrophobicContact CE2-CG1 3.9Å; F400-V406 HydrophobicContact CD1-CG2 4.44Å; F400-V406 HydrophobicContact CE1-CG1 4.23Å; V406-V437 HydrophobicContact CG2-CG2 4.34Å
407	R	95.9	Very high	90	Very high	20 Å²	20	27.7 Å²	27.7	8%	0.075	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	142.6	173.6	-64	-172.2	-178.9	-165.2	-4.8	110.8	G25 Y27 D89 V90 T93 L94 L105 L106 F107	G25-R407 CarbonylContact O-C 3.48Å; G25-R407 VanDerWaalsContact O-CA 3.24Å; G25-R407 WeakPolarHBondContact O-CA 3.39Å; Y27-R407 HydrophobicContact CE2-CB 4.39Å; Y27-R407 HydrophobicContact CE2-CG 4.22Å; Y27-R407 PolarHBondContact OH-NH1 2.89Å; D89-R407 PolarHBondContact O-NH1 2.88Å; V90-R407 VanDerWaalsContact C-NH1 3.3Å; V90-R407 WeakPolarHBondContact O-CD 3.39Å; V90-R407 PolarHBondContact O-NH1 3.32Å; T93-R407 PolarHBondContact OG1-NH1 2.79Å; T93-R407 PolarHBondContact OG1-NH2 3.16Å; L94-R407 HydrophobicContact CD1-CG 4.38Å; L94-R407 HydrophobicContact CD2-CG 4.34Å; L105-R407 PolarHBondContact O-N 3.26Å; L106-R407 WeakPolarHBondContact CA-O 3.33Å; F107-R407 PolarHBondContact N-O 3.14Å
408	M	96.2	Very high	89.7	Confident	6 Å²	6	25.2 Å²	25.2	3%	0.03	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	123.9	176.9	-177.8	169.7	66.1	0	0	109.4	G25 V26 Y27 F107 Y109 V410 F428 A429 T432	G25-M408 PolarHBondContact O-N 3.09Å; V26-M408 WeakPolarHBondContact CA-O 3.3Å; V26-M408 HydrophobicContact CG1-CE 3.83Å; V26-M408 HydrophobicContact CG2-CE 3.92Å; Y27-M408 PolarHBondContact N-O 3.49Å; F107-M408 HydrophobicContact CB-CG 4.35Å; Y109-M408 HydrophobicContact CG-SD 4.42Å; M408-V410 HydrophobicContact CE-CG2 3.94Å; M408-V410 HydrophobicContact CG-CG2 4.06Å; M408-V410 HydrophobicContact SD-CG2 4.4Å; M408-F428 HydrophobicContact CE-CE1 4.33Å; M408-F428 HydrophobicContact SD-CE1 4.03Å; M408-A429 HydrophobicContact CE-CB 4.14Å; M408-T432 HydrophobicContact CE-CG2 3.79Å
409	V	97.6	Very high	89.5	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	111.4	171.3	-173	0	0	0	0	108.5	Y27 R29 V90 F107 T108 Y109 T119 L129	Y27-V409 CarbonylContact O-C 3.56Å; Y27-V409 WeakPolarHBondContact O-CA 3.25Å; R29-V409 HydrophobicContact CB-CG1 4.3Å; V90-V409 HydrophobicContact CG1-CG2 3.63Å; V90-V409 HydrophobicContact CG2-CG2 4.46Å; F107-V409 PolarHBondContact O-N 3.08Å; T108-V409 CarbonylContact C-O 3.54Å; T108-V409 WeakPolarHBondContact CA-O 3.5Å; T108-V409 HydrophobicContact CG2-CB 4.31Å; Y109-V409 PolarHBondContact N-O 3.45Å; T119-V409 HydrophobicContact CG2-CG1 3.96Å; L129-V409 HydrophobicContact CD1-CG2 4.3Å
410	V	96.9	Very high	89.3	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	106.9	-179.2	-175.4	0	0	0	0	108.1	V26 Y27 C28 R29 Y109 M408 V412 V425 A429	V26-V410 HydrophobicContact CG1-CG2 3.86Å; Y27-V410 PolarHBondContact O-N 3.31Å; C28-V410 CarbonylContact C-O 3.57Å; C28-V410 WeakPolarHBondContact CA-O 3.46Å; R29-V410 PolarHBondContact N-O 2.88Å; Y109-V410 CarbonylContact O-C 3.6Å; Y109-V410 WeakPolarHBondContact O-CA 3.36Å; M408-V410 HydrophobicContact CE-CG2 3.94Å; M408-V410 HydrophobicContact CG-CG2 4.06Å; M408-V410 HydrophobicContact SD-CG2 4.4Å; V410-V412 HydrophobicContact CG1-CG1 4.03Å; V410-V425 HydrophobicContact CG1-CG1 3.3Å; V410-A429 HydrophobicContact CG1-CB 4.36Å; V410-A429 HydrophobicContact CG2-CB 3.67Å
411	C	95.4	Very high	89.2	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.007	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	124.9	178.3	-59.1	0	0	0	0	109.4	R29 Y109 G110 S114 K116 T119	R29-C411 WeakPolarHBondContact O-CA 3.49Å; Y109-C411 PolarHBondContact O-N 3.44Å; G110-C411 WeakPolarHBondContact CA-O 3.32Å; S114-C411 WeakPolarHBondContact CB-O 3.3Å; S114-C411 WeakPolarHBondContact O-CB 3.47Å; S114-C411 VanDerWaalsContact OG-CB 3.29Å; S114-C411 WeakPolarHBondContact OG-CB 3.44Å; S114-C411 PolarHBondContact OG-O 3.22Å; K116-C411 HydrophobicContact CG-CB 4.01Å; T119-C411 PolarHBondContact OG1-SG 2.98Å; T119-C411 VanDerWaalsContact OG1-SG 3.41Å
412	V	93.6	Very high	89.4	Confident	2 Å²	2	27 Å²	27	1%	0.012	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	140.6	-176.9	-59.8	0	0	0	0	112.1	R29 I30 R31 V42 I50 V410 T422 V425 M426	R29-V412 PolarHBondContact O-N 3.12Å; I30-V412 HydrophobicContact CB-CG2 4.37Å; I30-V412 HydrophobicContact CG1-CG2 4Å; R31-V412 WeakPolarHBondContact CB-O 3.2Å; R31-V412 PolarHBondContact N-O 3.17Å; V42-V412 HydrophobicContact CG1-CG2 4.45Å; I50-V412 HydrophobicContact CD1-CG2 4.37Å; V410-V412 HydrophobicContact CG1-CG1 4.03Å; V412-T422 HydrophobicContact CB-CG2 4.34Å; V412-T422 HydrophobicContact CG1-CG2 4.34Å; V412-V425 HydrophobicContact CG1-CG1 4.45Å; V412-M426 HydrophobicContact CB-CE 4.2Å; V412-M426 HydrophobicContact CG1-CE 3.53Å; V412-M426 HydrophobicContact CG1-SD 4.15Å; V412-M426 HydrophobicContact CG2-CE 4.08Å
413	N	90.2	Very high	90	Very high	11 Å²	11	27.7 Å²	27.7	6%	0.059	13%	0.132	C	C	.	.			trans	-96.7	120.1	173.7	-170.3	12.8	0	0	0	108.7	V111 K415 D418	V111-N413 HydrophobicContact CG2-CB 4.45Å; N413-K415 PolarHBondContact O-N 3.38Å; N413-D418 HydrophobicContact CB-CB 4.45Å; N413-D418 VanDerWaalsContact CB-OD2 3.27Å; N413-D418 WeakPolarHBondContact CB-OD2 3.29Å; N413-D418 PolarHBondContact ND2-OD2 3.09Å
414	P	89.3	Confident	90.4	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.013	13%	0.126	C	C	.	.			trans	-71.6	-2.2	-177.6	24.1	-32.8	0	0	0	115.6	I30 R31 L33 C40 C41 V42	I30-P414 HydrophobicContact CG2-CB 4.26Å; I30-P414 HydrophobicContact CG2-CG 4.05Å; R31-P414 VanDerWaalsContact O-CD 3.25Å; R31-P414 WeakPolarHBondContact O-CD 3.46Å; R31-P414 WeakPolarHBondContact O-CG 3.39Å; L33-P414 HydrophobicContact CD1-CB 4.4Å; L33-P414 HydrophobicContact CD1-CG 4.21Å; L33-P414 HydrophobicContact CD2-CB 4.28Å; L33-P414 HydrophobicContact CD2-CG 3.62Å; L33-P414 HydrophobicContact CG-CB 4.3Å; L33-P414 HydrophobicContact CG-CG 3.61Å; C40-P414 CarbonylContact C-O 3.49Å; C40-P414 WeakPolarHBondContact CA-O 3.29Å; C41-P414 PolarHBondContact N-O 3.18Å; C41-P414 PolarHBondContact SG-O 3.33Å; C41-P414 VanDerWaalsContact SG-O 3.37Å; V42-P414 HydrophobicContact CB-CB 4.03Å; V42-P414 HydrophobicContact CG2-CB 4.31Å
415	K	88.1	Confident	90.8	Very high	57 Å²	57	26.2 Å²	26.2	25%	0.248	13%	0.126	C	C	.	.	B	Isolated β-bridge	trans	-64.5	138	-179	-63.2	-171	-178.8	-144.9	0	112.5	L33 E38 C41 N413 E417 D418	L33-K415 HydrophobicContact CD2-CG 3.69Å; E38-K415 WeakPolarHBondContact OE1-CE 3.23Å; E38-K415 IonicContact OE1-NZ 3.7Å; E38-K415 PolarHBondContact OE1-NZ 3.37Å; E38-K415 WeakPolarHBondContact OE2-CE 3.45Å; E38-K415 IonicContact OE2-NZ 3.6Å; C41-K415 PolarHBondContact SG-O 2.91Å; N413-K415 PolarHBondContact O-N 3.38Å; K415-E417 HydrophobicContact CB-CG 3.9Å; K415-E417 HydrophobicContact CD-CG 4.43Å; K415-E417 VanDerWaalsContact CD-OE1 3.25Å; K415-E417 WeakPolarHBondContact CD-OE1 3.49Å; K415-E417 PolarHBondContact O-N 2.76Å; K415-D418 PolarHBondContact O-N 3.13Å
416	A	85.3	Confident	90.8	Very high	18 Å²	18	23.6 Å²	23.6	15%	0.149	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-53	-36.6	175.7	0	0	0	0	0	114.4	E39 P55 D418 Y419	E39-A416 HydrophobicContact CB-CB 3.99Å; E39-A416 HydrophobicContact CG-CB 4.07Å; E39-A416 PolarHBondContact O-N 3.08Å; P55-A416 HydrophobicContact CB-CB 3.9Å; P55-A416 HydrophobicContact CG-CB 4.34Å; A416-D418 PolarHBondContact O-N 3.29Å; A416-D418 VanDerWaalsContact O-N 3.16Å; A416-Y419 VanDerWaalsContact O-CB 3.22Å; A416-Y419 WeakPolarHBondContact O-CB 3.48Å; A416-Y419 PolarHBondContact O-N 3.34Å; A416-Y419 VanDerWaalsContact O-N 3.07Å
417	E	83.6	Confident	90.7	Very high	141 Å²	141	29.4 Å²	29.4	66%	0.659	14%	0.136	S	C	*	.	G	3₁₀ helix	trans	-60.8	-23.6	177.7	65.1	-175.5	176.5	0	0	113.9	K415	K415-E417 HydrophobicContact CB-CG 3.9Å; K415-E417 HydrophobicContact CD-CG 4.43Å; K415-E417 VanDerWaalsContact CD-OE1 3.25Å; K415-E417 WeakPolarHBondContact CD-OE1 3.49Å; K415-E417 PolarHBondContact O-N 2.76Å
418	D	85.7	Confident	90.6	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.011	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-95.4	-0.3	-179.5	-71.7	-14.1	0	0	0	112.8	R345 N413 K415 A416 E420 E421 T422	R345-D418 IonicContact CZ-OD1 2.71Å; R345-D418 IonicContact NH1-OD1 2.94Å; R345-D418 PolarHBondContact NH1-OD1 3.46Å; R345-D418 IonicContact NH2-OD1 3.35Å; R345-D418 PolarHBondContact NH2-OD1 2.93Å; R345-D418 IonicContact NH2-OD2 2.64Å; N413-D418 HydrophobicContact CB-CB 4.45Å; N413-D418 VanDerWaalsContact CB-OD2 3.27Å; N413-D418 WeakPolarHBondContact CB-OD2 3.29Å; N413-D418 PolarHBondContact ND2-OD2 3.09Å; K415-D418 PolarHBondContact O-N 3.13Å; A416-D418 PolarHBondContact O-N 3.29Å; A416-D418 VanDerWaalsContact O-N 3.16Å; D418-E420 PolarHBondContact O-N 3.12Å; D418-E421 PolarHBondContact O-N 2.74Å; D418-E421 VanDerWaalsContact O-N 3.11Å; D418-T422 WeakPolarHBondContact O-CB 3.46Å; D418-T422 PolarHBondContact O-N 3.25Å; D418-T422 PolarHBondContact O-OG1 2.94Å; D418-T422 VanDerWaalsContact O-OG1 3.14Å
419	Y	87.4	Confident	90.5	Very high	20 Å²	20	28.4 Å²	28.4	8%	0.078	13%	0.131	C	C	.	.	H	α-helix	trans	-52.3	-49	-172.9	172.6	-101.1	0	0	0	113.5	C41 L52 H53 A54 P55 L58 A416 E421 T422 L423	C41-Y419 HydrophobicContact CB-CD2 3.95Å; L52-Y419 HydrophobicContact CB-CE2 3.92Å; H53-Y419 WeakPolarHBondContact O-CD2 3.44Å; H53-Y419 WeakPolarHBondContact O-CE2 3.43Å; A54-Y419 HydrophobicContact CB-CE1 4.15Å; A54-Y419 HydrophobicContact CB-CE2 4.34Å; P55-Y419 HydrophobicContact CG-CD1 4.48Å; P55-Y419 HydrophobicContact CG-CG 4.35Å; L58-Y419 HydrophobicContact CD2-CD1 4.4Å; L58-Y419 HydrophobicContact CD2-CE1 4.38Å; A416-Y419 VanDerWaalsContact O-CB 3.22Å; A416-Y419 WeakPolarHBondContact O-CB 3.48Å; A416-Y419 PolarHBondContact O-N 3.34Å; A416-Y419 VanDerWaalsContact O-N 3.07Å; Y419-E421 VanDerWaalsContact C-N 3.33Å; Y419-E421 PolarHBondContact O-N 3.36Å; Y419-T422 PolarHBondContact O-N 3.46Å; Y419-L423 WeakPolarHBondContact O-CB 3.28Å; Y419-L423 PolarHBondContact O-N 3.38Å
420	E	86.5	Confident	90.2	Very high	113 Å²	113	31.6 Å²	31.6	53%	0.528	15%	0.147	S	C	.	.	H	α-helix	trans	-62.9	-39.2	-178.5	-67.7	-166	163.9	0	0	112.6	L58 D418 L424	L58-E420 HydrophobicContact CD2-CG 4.25Å; D418-E420 PolarHBondContact O-N 3.12Å; E420-L424 WeakPolarHBondContact O-CG 3.39Å; E420-L424 PolarHBondContact O-N 3.33Å
421	E	87.8	Confident	90	Very high	19 Å²	19	32.2 Å²	32.2	9%	0.089	15%	0.15	C	C	.	.	H	α-helix	trans	-75.8	-41.5	179.9	-62.7	-69.8	-177.7	0	0	110.6	V111 R342 D418 Y419 L423 L424 V425	V111-E421 HydrophobicContact CG1-CB 3.55Å; V111-E421 HydrophobicContact CG1-CG 4.45Å; R342-E421 PolarHBondContact N-OE1 2.87Å; D418-E421 PolarHBondContact O-N 2.74Å; D418-E421 VanDerWaalsContact O-N 3.11Å; Y419-E421 VanDerWaalsContact C-N 3.33Å; Y419-E421 PolarHBondContact O-N 3.36Å; E421-L423 VanDerWaalsContact C-N 3.28Å; E421-L423 PolarHBondContact O-N 3.1Å; E421-L424 WeakPolarHBondContact O-CB 3.5Å; E421-L424 PolarHBondContact O-N 3.37Å; E421-L424 VanDerWaalsContact O-N 3.1Å; E421-V425 WeakPolarHBondContact O-CG2 3.31Å; E421-V425 PolarHBondContact O-N 2.89Å
422	T	89.9	Confident	89.9	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.006	15%	0.15	C	C	.	.	H	α-helix	trans	-57.4	-41.8	172.6	-65.9	0	0	0	0	110.7	V42 L52 V412 D418 Y419 L424 V425 M426	V42-T422 HydrophobicContact CG2-CG2 4.12Å; L52-T422 HydrophobicContact CD1-CG2 4.29Å; L52-T422 HydrophobicContact CD2-CG2 3.82Å; V412-T422 HydrophobicContact CB-CG2 4.34Å; V412-T422 HydrophobicContact CG1-CG2 4.34Å; D418-T422 WeakPolarHBondContact O-CB 3.46Å; D418-T422 PolarHBondContact O-N 3.25Å; D418-T422 PolarHBondContact O-OG1 2.94Å; D418-T422 VanDerWaalsContact O-OG1 3.14Å; Y419-T422 PolarHBondContact O-N 3.46Å; T422-L424 VanDerWaalsContact C-N 3.33Å; T422-L424 PolarHBondContact O-N 2.87Å; T422-V425 PolarHBondContact O-N 2.92Å; T422-M426 HydrophobicContact CG2-CE 4.16Å; T422-M426 HydrophobicContact CG2-CG 4.29Å; T422-M426 VanDerWaalsContact O-CG 3.29Å; T422-M426 WeakPolarHBondContact O-CG 3.42Å; T422-M426 PolarHBondContact O-N 3.34Å
423	L	89.6	Confident	89.7	Confident	28 Å²	28	34.5 Å²	34.5	15%	0.147	16%	0.16	C	C	.	.	H	α-helix	trans	-59.2	-41.5	175.5	-175.4	71.6	0	0	0	112.3	L52 Y71 Y419 E421 R427	L52-L423 HydrophobicContact CD1-CB 4.3Å; L52-L423 HydrophobicContact CD1-CD1 3.86Å; Y71-L423 HydrophobicContact CE2-CD1 4.38Å; Y71-L423 WeakPolarHBondContact OH-CD1 3.4Å; Y419-L423 WeakPolarHBondContact O-CB 3.28Å; Y419-L423 PolarHBondContact O-N 3.38Å; E421-L423 VanDerWaalsContact C-N 3.28Å; E421-L423 PolarHBondContact O-N 3.1Å; L423-R427 VanDerWaalsContact O-CG 3.31Å; L423-R427 WeakPolarHBondContact O-CG 3.45Å; L423-R427 PolarHBondContact O-N 3.38Å; L423-R427 VanDerWaalsContact O-N 3.12Å
424	L	89.8	Confident	89.7	Confident	41 Å²	41	38.2 Å²	38.2	22%	0.215	18%	0.177	C	C	.	.	H	α-helix	trans	-68.6	-41.5	177.4	-65.1	167.9	0	0	0	111.7	E420 E421 T422 R427 F428	E420-L424 WeakPolarHBondContact O-CG 3.39Å; E420-L424 PolarHBondContact O-N 3.33Å; E421-L424 WeakPolarHBondContact O-CB 3.5Å; E421-L424 PolarHBondContact O-N 3.37Å; E421-L424 VanDerWaalsContact O-N 3.1Å; T422-L424 VanDerWaalsContact C-N 3.33Å; T422-L424 PolarHBondContact O-N 2.87Å; L424-R427 PolarHBondContact O-N 3.14Å; L424-F428 PolarHBondContact O-N 2.78Å; L424-F428 VanDerWaalsContact O-N 3.09Å
425	V	92.3	Very high	89.7	Confident	4 Å²	4	38.1 Å²	38.1	2%	0.024	18%	0.177	C	C	.	.	H	α-helix	trans	-60.5	-46.1	176.1	166.5	0	0	0	0	110.6	Y109 V111 S340 V410 V412 E421 T422 F428 A429	Y109-V425 HydrophobicContact CD1-CG1 3.98Å; Y109-V425 HydrophobicContact CE1-CB 4.16Å; Y109-V425 HydrophobicContact CE1-CG1 3.83Å; Y109-V425 HydrophobicContact CE1-CG2 3.87Å; V111-V425 HydrophobicContact CG1-CG2 4.31Å; S340-V425 WeakPolarHBondContact OG-CG2 3.47Å; V410-V425 HydrophobicContact CG1-CG1 3.3Å; V412-V425 HydrophobicContact CG1-CG1 4.45Å; E421-V425 WeakPolarHBondContact O-CG2 3.31Å; E421-V425 PolarHBondContact O-N 2.89Å; T422-V425 PolarHBondContact O-N 2.92Å; V425-F428 PolarHBondContact O-N 2.92Å; V425-A429 WeakPolarHBondContact O-CB 3.25Å; V425-A429 PolarHBondContact O-N 2.77Å
426	M	92.5	Very high	89.7	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-63.8	-44.5	178.7	-68	-47.9	-167.5	0	0	112.6	I50 L52 Y71 F73 V412 T422 F428 A429 E430	I50-M426 HydrophobicContact CD1-CE 3.7Å; I50-M426 HydrophobicContact CG2-CE 3.9Å; L52-M426 HydrophobicContact CD1-CB 4.49Å; L52-M426 HydrophobicContact CD1-CG 4Å; L52-M426 HydrophobicContact CD2-CE 4.4Å; Y71-M426 HydrophobicContact CD1-CB 3.86Å; Y71-M426 HydrophobicContact CD2-CB 3.69Å; Y71-M426 HydrophobicContact CD2-CG 3.94Å; Y71-M426 HydrophobicContact CE1-CB 3.79Å; Y71-M426 HydrophobicContact CE2-CB 3.63Å; Y71-M426 HydrophobicContact CE2-CG 4.12Å; Y71-M426 HydrophobicContact CG-CB 3.8Å; Y71-M426 HydrophobicContact CG-CG 4.31Å; F73-M426 HydrophobicContact CE2-CE 4.47Å; F73-M426 HydrophobicContact CE2-SD 3.73Å; F73-M426 HydrophobicContact CZ-SD 3.6Å; V412-M426 HydrophobicContact CB-CE 4.2Å; V412-M426 HydrophobicContact CG1-CE 3.53Å; V412-M426 HydrophobicContact CG1-SD 4.15Å; V412-M426 HydrophobicContact CG2-CE 4.08Å; T422-M426 HydrophobicContact CG2-CE 4.16Å; T422-M426 HydrophobicContact CG2-CG 4.29Å; T422-M426 VanDerWaalsContact O-CG 3.29Å; T422-M426 WeakPolarHBondContact O-CG 3.42Å; T422-M426 PolarHBondContact O-N 3.34Å; M426-F428 VanDerWaalsContact C-N 3.3Å; M426-F428 PolarHBondContact O-N 3.29Å; M426-A429 WeakPolarHBondContact O-CB 3.27Å; M426-A429 PolarHBondContact O-N 2.9Å; M426-E430 WeakPolarHBondContact O-CB 3.37Å; M426-E430 PolarHBondContact O-N 3.05Å
427	R	91.6	Very high	89.6	Confident	132 Å²	132	39.1 Å²	39.1	50%	0.498	18%	0.179	S	C	.	.	H	α-helix	trans	-59.8	-40.8	176.5	-73.8	176.8	-177.7	-171.4	3.1	112.5	Y71 L423 L424 M431	Y71-R427 HydrophobicContact CE1-CG 4.16Å; L423-R427 VanDerWaalsContact O-CG 3.31Å; L423-R427 WeakPolarHBondContact O-CG 3.45Å; L423-R427 PolarHBondContact O-N 3.38Å; L423-R427 VanDerWaalsContact O-N 3.12Å; L424-R427 PolarHBondContact O-N 3.14Å; R427-M431 WeakPolarHBondContact O-CB 3.48Å; R427-M431 PolarHBondContact O-N 2.92Å
428	F	92.9	Very high	89.4	Confident	4 Å²	4	33.6 Å²	33.6	2%	0.018	16%	0.158	C	C	.	.	H	α-helix	trans	-67.3	-42.4	176.2	170.8	-115.4	0	0	0	111.6	Y109 L366 R367 M370 M408 L424 V425 M426 M431 T432	Y109-F428 HydrophobicContact CD1-CD1 4.04Å; Y109-F428 HydrophobicContact CD1-CE1 4.28Å; Y109-F428 AromaticContact CE1-CD1 3.49Å; Y109-F428 HydrophobicContact CE1-CD1 3.49Å; Y109-F428 VanDerWaalsContact CE1-CD1 3.49Å; Y109-F428 HydrophobicContact CE1-CE1 4.04Å; Y109-F428 HydrophobicContact CE2-CD1 4.44Å; Y109-F428 HydrophobicContact CE2-CE1 4.35Å; Y109-F428 AromaticContact CZ-CD1 3.71Å; L366-F428 HydrophobicContact CD2-CZ 4.47Å; L366-F428 HydrophobicContact CG-CZ 4.35Å; R367-F428 HydrophobicContact CB-CD2 3.81Å; R367-F428 HydrophobicContact CB-CE2 3.78Å; R367-F428 HydrophobicContact CG-CD2 3.66Å; R367-F428 HydrophobicContact CG-CE2 4.04Å; M370-F428 HydrophobicContact CB-CE2 4.23Å; M370-F428 HydrophobicContact CG-CE2 4.1Å; M370-F428 HydrophobicContact CG-CZ 4.31Å; M408-F428 HydrophobicContact CE-CE1 4.33Å; M408-F428 HydrophobicContact SD-CE1 4.03Å; L424-F428 PolarHBondContact O-N 2.78Å; L424-F428 VanDerWaalsContact O-N 3.09Å; V425-F428 PolarHBondContact O-N 2.92Å; M426-F428 VanDerWaalsContact C-N 3.3Å; M426-F428 PolarHBondContact O-N 3.29Å; F428-M431 HydrophobicContact CD2-CE 3.47Å; F428-M431 VanDerWaalsContact CD2-CE 3.47Å; F428-M431 HydrophobicContact CE2-CE 3.67Å; F428-M431 PolarHBondContact O-N 2.91Å; F428-T432 VanDerWaalsContact CE2-OG1 3.29Å; F428-T432 WeakPolarHBondContact CE2-OG1 3.39Å; F428-T432 WeakPolarHBondContact CZ-OG1 3.49Å; F428-T432 WeakPolarHBondContact O-CB 3.35Å; F428-T432 PolarHBondContact O-N 2.94Å; F428-T432 PolarHBondContact O-OG1 3.41Å
429	A	94	Very high	88.9	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.5	-45.6	178.9	0	0	0	0	0	112.8	V26 F73 M408 V410 V425 M426 M431 T432 Q433	V26-A429 HydrophobicContact CG1-CB 4.03Å; F73-A429 HydrophobicContact CE1-CB 3.53Å; F73-A429 HydrophobicContact CZ-CB 3.99Å; M408-A429 HydrophobicContact CE-CB 4.14Å; V410-A429 HydrophobicContact CG1-CB 4.36Å; V410-A429 HydrophobicContact CG2-CB 3.67Å; V425-A429 WeakPolarHBondContact O-CB 3.25Å; V425-A429 PolarHBondContact O-N 2.77Å; M426-A429 WeakPolarHBondContact O-CB 3.27Å; M426-A429 PolarHBondContact O-N 2.9Å; A429-M431 PolarHBondContact O-N 2.92Å; A429-T432 PolarHBondContact O-N 3.37Å; A429-Q433 PolarHBondContact O-N 2.88Å
430	E	91.2	Very high	88	Confident	68 Å²	68	38.1 Å²	38.1	32%	0.318	18%	0.178	S	C	.	.	H	α-helix	trans	-64.4	-37.4	177.1	179.5	175.8	-117.1	0	0	112.4	Y71 M426 T432 Q433	Y71-E430 HydrophobicContact CD1-CB 4.13Å; M426-E430 WeakPolarHBondContact O-CB 3.37Å; M426-E430 PolarHBondContact O-N 3.05Å; E430-T432 VanDerWaalsContact C-N 3.33Å; E430-Q433 WeakPolarHBondContact O-CG 3.35Å
431	M	92.7	Very high	87	Confident	13 Å²	13	38.1 Å²	38.1	6%	0.064	19%	0.185	C	C	.	.	H	α-helix	trans	-67.9	-36.1	173.3	176	-84.1	-55.9	0	0	112	R367 M370 E371 R374 R427 F428 A429 Q433 E434	R367-M431 HydrophobicContact CG-CE 4.38Å; M370-M431 HydrophobicContact CB-CE 3.73Å; M370-M431 HydrophobicContact CB-SD 3.79Å; E371-M431 HydrophobicContact CG-CE 3.58Å; E371-M431 HydrophobicContact CG-CG 4.44Å; E371-M431 HydrophobicContact CG-SD 3.9Å; R374-M431 VanDerWaalsContact CZ-CG 3.43Å; R374-M431 VanDerWaalsContact NH1-CG 3.27Å; R427-M431 WeakPolarHBondContact O-CB 3.48Å; R427-M431 PolarHBondContact O-N 2.92Å; F428-M431 HydrophobicContact CD2-CE 3.47Å; F428-M431 VanDerWaalsContact CD2-CE 3.47Å; F428-M431 HydrophobicContact CE2-CE 3.67Å; F428-M431 PolarHBondContact O-N 2.91Å; A429-M431 PolarHBondContact O-N 2.92Å; M431-Q433 PolarHBondContact O-N 2.89Å; M431-E434 WeakPolarHBondContact O-CB 3.39Å; M431-E434 PolarHBondContact O-N 3.37Å
432	T	93.3	Very high	86	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.018	21%	0.209	C	C	.	.	H	α-helix	trans	-67.5	-34.8	-176	-59	0	0	0	0	112.5	V24 V26 M370 M408 F428 A429 E430 E434 V435	V24-T432 HydrophobicContact CB-CG2 4.28Å; V24-T432 HydrophobicContact CG1-CG2 3.94Å; V26-T432 HydrophobicContact CG2-CG2 4.24Å; M370-T432 HydrophobicContact CG-CG2 4.26Å; M370-T432 HydrophobicContact SD-CG2 4.29Å; M408-T432 HydrophobicContact CE-CG2 3.79Å; F428-T432 VanDerWaalsContact CE2-OG1 3.29Å; F428-T432 WeakPolarHBondContact CE2-OG1 3.39Å; F428-T432 WeakPolarHBondContact CZ-OG1 3.49Å; F428-T432 WeakPolarHBondContact O-CB 3.35Å; F428-T432 PolarHBondContact O-N 2.94Å; F428-T432 PolarHBondContact O-OG1 3.41Å; A429-T432 PolarHBondContact O-N 3.37Å; E430-T432 VanDerWaalsContact C-N 3.33Å; T432-E434 PolarHBondContact O-N 2.83Å; T432-V435 WeakPolarHBondContact O-CB 3.29Å; T432-V435 PolarHBondContact O-N 3.2Å; T432-V435 VanDerWaalsContact O-N 3.13Å
433	Q	90.9	Very high	84.7	Confident	47 Å²	47	50.3 Å²	50.3	22%	0.22	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-18.2	176.8	56.5	176.3	3.4	0	0	113.8	P23 V26 C72 A429 E430 M431 V435	P23-Q433 VanDerWaalsContact CB-O 3.27Å; P23-Q433 WeakPolarHBondContact CB-O 3.39Å; V26-Q433 HydrophobicContact CB-CB 4.15Å; V26-Q433 HydrophobicContact CG2-CB 3.79Å; C72-Q433 PolarHBondContact O-NE2 3.32Å; C72-Q433 PolarHBondContact O-OE1 3.35Å; A429-Q433 PolarHBondContact O-N 2.88Å; E430-Q433 WeakPolarHBondContact O-CG 3.35Å; M431-Q433 PolarHBondContact O-N 2.89Å; Q433-V435 VanDerWaalsContact C-N 3.27Å
434	E	89.9	Confident	83.1	Confident	89 Å²	89	54.9 Å²	54.9	42%	0.416	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-11.2	175.6	-59.9	175.3	163.2	0	0	112.3	R374 M431 T432	R374-E434 WeakPolarHBondContact CD-OE2 3.48Å; R374-E434 HydrophobicContact CG-CB 4.18Å; R374-E434 IonicContact CZ-OE2 2.65Å; R374-E434 IonicContact NE-OE2 3.62Å; R374-E434 IonicContact NH1-OE2 3.6Å; R374-E434 PolarHBondContact NH1-OE2 3.23Å; M431-E434 WeakPolarHBondContact O-CB 3.39Å; M431-E434 PolarHBondContact O-N 3.37Å; T432-E434 PolarHBondContact O-N 2.83Å
435	V	89.5	Confident	81.5	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.006	27%	0.273	C	S	.	.			trans	-78.7	124.3	175.1	-179	0	0	0	0	109.2	P23 V24 M370 L373 R374 T432 Q433	P23-V435 WeakPolarHBondContact CA-O 3.35Å; V24-V435 HydrophobicContact CG2-CB 4.16Å; V24-V435 HydrophobicContact CG2-CG1 4.4Å; V24-V435 PolarHBondContact N-O 2.87Å; M370-V435 HydrophobicContact CB-CG2 4.3Å; M370-V435 WeakPolarHBondContact O-CG2 3.45Å; M370-V435 HydrophobicContact SD-CG2 4.31Å; L373-V435 HydrophobicContact CB-CG1 4.04Å; L373-V435 HydrophobicContact CB-CG2 4.47Å; L373-V435 HydrophobicContact CD1-CG1 4.38Å; R374-V435 HydrophobicContact CB-CG2 3.94Å; T432-V435 WeakPolarHBondContact O-CB 3.29Å; T432-V435 PolarHBondContact O-N 3.2Å; T432-V435 VanDerWaalsContact O-N 3.13Å; Q433-V435 VanDerWaalsContact C-N 3.27Å
436	E	87.3	Confident	79.9	Confident	88 Å²	88	56.6 Å²	56.6	41%	0.411	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	129.9	175.7	-65.5	-175	156.2	0	0	111.1	K21 Q377	K21-E436 HydrophobicContact CB-CB 3.92Å; K21-E436 HydrophobicContact CD-CB 3.96Å; K21-E436 WeakPolarHBondContact CD-OE2 3.29Å; Q377-E436 PolarHBondContact NE2-O 3.43Å
437	V	83.9	Confident	78.4	Confident	7 Å²	7	61 Å²	61	4%	0.042	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	140.2	175.6	-176.2	0	0	0	0	108.4	K21 D22 V24 Y399 G404 V406 R439	K21-V437 CarbonylContact C-O 3.55Å; K21-V437 VanDerWaalsContact CA-O 3.31Å; K21-V437 WeakPolarHBondContact CA-O 3.48Å; D22-V437 PolarHBondContact N-O 3.37Å; D22-V437 PolarHBondContact O-N 3.12Å; V24-V437 HydrophobicContact CG2-CG2 3.77Å; Y399-V437 VanDerWaalsContact O-CG1 3.27Å; Y399-V437 WeakPolarHBondContact O-CG1 3.38Å; G404-V437 WeakPolarHBondContact O-CG1 3.41Å; V406-V437 HydrophobicContact CG2-CG2 4.34Å; V437-R439 PolarHBondContact O-N 3.21Å
438	A	78.8	Confident	77.2	Confident	26 Å²	26	58 Å²	58	22%	0.215	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	135.1	177.9	0	0	0	0	0	110.9	I19	I19-A438 HydrophobicContact CG2-CB 3.82Å
439	R	75.1	Confident	76.1	Confident	96 Å²	96	62.1 Å²	62.1	36%	0.362	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-65.9	129.9	176.1	-174.4	175	-71.1	174.3	-0	108.9	E20 D22 V437 V441	E20-R439 HydrophobicContact CB-CB 4.27Å; E20-R439 VanDerWaalsContact CD-NH1 3.29Å; E20-R439 WeakPolarHBondContact O-CB 3.23Å; E20-R439 PolarHBondContact O-N 3.27Å; E20-R439 IonicContact OE1-NH1 3.42Å; E20-R439 IonicContact OE2-CZ 2.71Å; E20-R439 IonicContact OE2-NE 2.95Å; E20-R439 IonicContact OE2-NH1 3.72Å; E20-R439 PolarHBondContact OE2-NH1 2.89Å; D22-R439 IonicContact OD1-CZ 3.48Å; D22-R439 IonicContact OD1-NE 2.56Å; D22-R439 IonicContact OD1-NH2 3.96Å; D22-R439 PolarHBondContact OD1-NH2 3.05Å; D22-R439 IonicContact OD2-CZ 2.61Å; D22-R439 IonicContact OD2-NE 3.14Å; D22-R439 PolarHBondContact OD2-NE 3.45Å; D22-R439 IonicContact OD2-NH2 3.91Å; V437-R439 PolarHBondContact O-N 3.21Å; R439-V441 PolarHBondContact O-N 3.38Å
440	P	67.8	Low	75.2	Confident	21 Å²	21	66.6 Å²	66.6	14%	0.136	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-59.1	126.1	173.9	-24.1	34.2	0	0	0	110.5	K102 K405	K102-P440 HydrophobicContact CB-CB 4.16Å; K102-P440 HydrophobicContact CD-CB 4.03Å; K102-P440 HydrophobicContact CG-CB 3.81Å; K405-P440 HydrophobicContact CG-CG 4.21Å
441	V	67.1	Low	74.5	Confident	113 Å²	113	64.5 Å²	64.5	69%	0.685	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-78	133.5	178.5	-175.1	0	0	0	0	109.4	R439 R443	R439-V441 PolarHBondContact O-N 3.38Å; V441-R443 PolarHBondContact O-N 3.43Å
442	D	65.2	Low	74	Confident	110 Å²	110	65 Å²	65	59%	0.588	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-62	121.2	172.3	-67.8	-39.1	0	0	0	109.8	K102	K102-D442 WeakPolarHBondContact CE-OD1 3.4Å; K102-D442 IonicContact NZ-OD1 2.65Å; K102-D442 PolarHBondContact NZ-OD1 2.79Å
443	R	63.9	Low	73.3	Confident	165 Å²	165	68.1 Å²	68.1	62%	0.623	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-88.3	123.5	170.9	-68.3	-175.8	-177.6	-177.3	2.8	107.7	V441 I445	V441-R443 PolarHBondContact O-N 3.43Å; R443-I445 PolarHBondContact O-N 2.98Å
444	P	56.6	Low	72.9	Confident	125 Å²	125	72 Å²	72	81%	0.812	40%	0.401	S	S	*	.	P	Polyproline II helix	trans	-61.4	116.7	173.2	23.6	-30.1	0	0	0	108.4	C446	P444-C446 PolarHBondContact O-N 3.24Å
445	I	55.1	Low	72.4	Confident	55 Å²	55	74.9 Å²	74.9	28%	0.282	41%	0.408	S	S	.	.			trans	-69.3	115	168.9	-58.2	165.6	0	0	0	104.9	D210 R443	D210-I445 HydrophobicContact CB-CD1 4.33Å; D210-I445 WeakPolarHBondContact OD2-CG2 3.47Å; R443-I445 PolarHBondContact O-N 2.98Å
446	C	58.1	Low	72.1	Confident	26 Å²	26	77.2 Å²	77.2	18%	0.176	42%	0.421	C	S	.	.			trans	28.1	123.1	170.6	-158.9	0	0	0	0	116.7	P312 P444 L448	P312-C446 HydrophobicContact CB-CB 4.12Å; P312-C446 HydrophobicContact CG-CB 4.3Å; P444-C446 PolarHBondContact O-N 3.24Å; C446-L448 PolarHBondContact O-N 3.39Å
447	G	60.6	Low	71.8	Confident	93 Å²	93	77.9 Å²	77.9	96%	0.959	42%	0.424	S	S	*	.	S	Bend	trans	-63.3	20.9	-177.3	0	0	0	0	0	117.9
448	L	68	Low	71.8	Confident	69 Å²	69	80.3 Å²	80.3	36%	0.361	45%	0.445	S	S	.	.	S	Bend	trans	-83.7	156.1	171.9	-60.2	177.2	0	0	0	111	C446 P450	C446-L448 PolarHBondContact O-N 3.39Å; L448-P450 WeakPolarHBondContact O-CD 3.45Å
449	T	69.2	Low	72	Confident	89 Å²	89	85.9 Å²	85.9	55%	0.546	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-69	128.9	-178.2	-45.8	0	0	0	0	110.8	R455	T449-R455 VanDerWaalsContact CG2-NH2 3.3Å
450	P	74.6	Confident	72.3	Confident	95 Å²	95	84.9 Å²	84.9	62%	0.617	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	151.1	173.6	-23.5	34.1	0	0	0	113.6	D212 L448 R452 R455	D212-P450 WeakPolarHBondContact OD2-CA 3.45Å; L448-P450 WeakPolarHBondContact O-CD 3.45Å; P450-R452 VanDerWaalsContact C-N 3.3Å; P450-R455 PolarHBondContact O-NH2 3.18Å
451	G	76.6	Confident	73.1	Confident	24 Å²	24	88.5 Å²	88.5	25%	0.247	48%	0.481	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.7	26.5	-178.7	0	0	0	0	0	113	D212 R455	D212-G451 PolarHBondContact OD2-N 3.41Å; G451-R455 PolarHBondContact O-N 3.14Å; G451-R455 PolarHBondContact O-NE 3.27Å
452	R	81.9	Confident	73.8	Confident	22 Å²	22	86.1 Å²	86.1	8%	0.083	46%	0.462	C	S	.	.	H	α-helix	trans	-70.9	-39.9	179.7	60	-176.2	177.2	-76.7	1.6	111.3	D212 L313 D314 P450 Q454 R455 N456	D212-R452 HydrophobicContact CB-CG 4.31Å; D212-R452 VanDerWaalsContact CB-CZ 3.43Å; D212-R452 PolarHBondContact O-NH2 2.67Å; D212-R452 VanDerWaalsContact OD1-CG 3.25Å; D212-R452 WeakPolarHBondContact OD1-CG 3.47Å; D212-R452 PolarHBondContact OD1-N 2.95Å; D212-R452 VanDerWaalsContact OD1-N 3.16Å; D212-R452 IonicContact OD2-CZ 2.83Å; D212-R452 PolarHBondContact OD2-N 3.26Å; D212-R452 IonicContact OD2-NH1 3.49Å; D212-R452 PolarHBondContact OD2-NH1 3.16Å; D212-R452 VanDerWaalsContact OD2-NH1 3.14Å; L313-R452 PolarHBondContact O-NH2 2.91Å; D314-R452 PolarHBondContact O-NE 3.46Å; P450-R452 VanDerWaalsContact C-N 3.3Å; R452-Q454 PolarHBondContact O-N 3.42Å; R452-R455 PolarHBondContact O-N 2.81Å; R452-N456 WeakPolarHBondContact O-CB 3.25Å; R452-N456 VanDerWaalsContact O-CG 3.23Å; R452-N456 PolarHBondContact O-N 2.93Å
453	R	80.2	Confident	74.5	Confident	70 Å²	70	84.9 Å²	84.9	26%	0.264	46%	0.455	S	S	.	.	H	α-helix	trans	-56.1	-51.3	179.1	-179.8	179.3	175.2	-175.7	-3.2	111.6	F144 E211 D212 R455 N456 Q457	F144-R453 VanDerWaalsContact CD1-NH1 3.25Å; E211-R453 WeakPolarHBondContact O-CD 3.27Å; E211-R453 PolarHBondContact O-NH1 3Å; D212-R453 VanDerWaalsContact OD1-CB 3.24Å; D212-R453 WeakPolarHBondContact OD1-CB 3.49Å; D212-R453 PolarHBondContact OD1-N 3.19Å; R453-R455 PolarHBondContact O-N 3.44Å; R453-N456 PolarHBondContact O-N 3.48Å; R453-Q457 WeakPolarHBondContact O-CB 3.42Å; R453-Q457 PolarHBondContact O-N 3.11Å
454	Q	80.5	Confident	75.2	Confident	128 Å²	128	79.8 Å²	79.8	60%	0.598	45%	0.445	S	S	*	.	H	α-helix	trans	-64.4	-42.2	-179.5	-167	180	48.6	0	0	112.1	R452 A458	R452-Q454 PolarHBondContact O-N 3.42Å; Q454-A458 WeakPolarHBondContact O-CB 3.2Å; Q454-A458 PolarHBondContact O-N 2.87Å
455	R	80.1	Confident	76.3	Confident	149 Å²	149	78.9 Å²	78.9	56%	0.562	43%	0.425	S	S	*	.	H	α-helix	trans	-64	-45.8	177.1	-84.2	-173.8	-88.8	179	-12.5	112.8	T449 P450 G451 R452 R453 A458 F459	T449-R455 VanDerWaalsContact CG2-NH2 3.3Å; P450-R455 PolarHBondContact O-NH2 3.18Å; G451-R455 PolarHBondContact O-N 3.14Å; G451-R455 PolarHBondContact O-NE 3.27Å; R452-R455 PolarHBondContact O-N 2.81Å; R453-R455 PolarHBondContact O-N 3.44Å; R455-A458 PolarHBondContact O-N 3.24Å; R455-F459 WeakPolarHBondContact O-CB 3.22Å; R455-F459 PolarHBondContact O-N 2.78Å
456	N	83	Confident	77.4	Confident	50 Å²	50	83.4 Å²	83.4	27%	0.267	44%	0.439	S	S	.	.	H	α-helix	trans	-68.2	-38	179.8	-69.1	-11.1	0	0	0	111.3	A315 D316 R452 R453 F459 K460	A315-N456 PolarHBondContact O-ND2 3.03Å; A315-N456 VanDerWaalsContact O-ND2 3.08Å; D316-N456 WeakPolarHBondContact CA-ND2 3.07Å; D316-N456 WeakPolarHBondContact O-CB 3.47Å; D316-N456 PolarHBondContact O-ND2 2.73Å; R452-N456 WeakPolarHBondContact O-CB 3.25Å; R452-N456 VanDerWaalsContact O-CG 3.23Å; R452-N456 PolarHBondContact O-N 2.93Å; R453-N456 PolarHBondContact O-N 3.48Å; N456-F459 PolarHBondContact O-N 3.39Å; N456-K460 WeakPolarHBondContact O-CG 3.36Å; N456-K460 PolarHBondContact O-N 2.92Å
457	Q	81.9	Confident	77.9	Confident	102 Å²	102	87.4 Å²	87.4	48%	0.477	46%	0.458	S	S	.	.	H	α-helix	trans	-65.4	-47.3	175.7	-168.9	164.7	-2.2	0	0	111.4	R453 F459 K460 D461	R453-Q457 WeakPolarHBondContact O-CB 3.42Å; R453-Q457 PolarHBondContact O-N 3.11Å; Q457-F459 VanDerWaalsContact C-N 3.25Å; Q457-F459 PolarHBondContact O-N 2.95Å; Q457-K460 PolarHBondContact O-N 3.48Å; Q457-K460 VanDerWaalsContact O-N 3.14Å; Q457-D461 VanDerWaalsContact O-CG 3.26Å; Q457-D461 PolarHBondContact O-N 2.95Å
458	A	82.6	Confident	78.2	Confident	58 Å²	58	90.5 Å²	90.5	48%	0.479	45%	0.447	S	S	.	.	H	α-helix	trans	-58.7	-37.3	174.4	0	0	0	0	0	112.5	Q454 R455 E462	Q454-A458 WeakPolarHBondContact O-CB 3.2Å; Q454-A458 PolarHBondContact O-N 2.87Å; R455-A458 PolarHBondContact O-N 3.24Å; A458-E462 WeakPolarHBondContact O-CB 3.27Å; A458-E462 PolarHBondContact O-N 3.32Å; A458-E462 VanDerWaalsContact O-N 3.07Å
459	F	83.5	Confident	78.2	Confident	143 Å²	143	93.3 Å²	93.3	63%	0.627	46%	0.458	S	S	*	.	H	α-helix	trans	-66.3	-43.8	175.2	-179.3	-98.7	0	0	0	112.6	R455 N456 Q457 L463	R455-F459 WeakPolarHBondContact O-CB 3.22Å; R455-F459 PolarHBondContact O-N 2.78Å; N456-F459 PolarHBondContact O-N 3.39Å; Q457-F459 VanDerWaalsContact C-N 3.25Å; Q457-F459 PolarHBondContact O-N 2.95Å; F459-L463 WeakPolarHBondContact O-CB 3.27Å; F459-L463 PolarHBondContact O-N 3.23Å
460	K	81.8	Confident	78	Confident	76 Å²	76	99.8 Å²	99.8	33%	0.33	47%	0.473	S	S	.	.	H	α-helix	trans	-65	-41.3	176.9	-73.5	172.9	-177.4	176.7	0	112	D318 N456 Q457 L463 S464	D318-K460 IonicContact OD1-NZ 3.74Å; D318-K460 PolarHBondContact OD1-NZ 3.25Å; D318-K460 IonicContact OD2-NZ 2.62Å; D318-K460 PolarHBondContact OD2-NZ 2.87Å; N456-K460 WeakPolarHBondContact O-CG 3.36Å; N456-K460 PolarHBondContact O-N 2.92Å; Q457-K460 PolarHBondContact O-N 3.48Å; Q457-K460 VanDerWaalsContact O-N 3.14Å; K460-L463 PolarHBondContact O-N 2.96Å; K460-S464 WeakPolarHBondContact O-CB 3.37Å; K460-S464 PolarHBondContact O-N 3.31Å; K460-S464 PolarHBondContact O-OG 3.37Å
461	D	83.8	Confident	76.7	Confident	97 Å²	97	98 Å²	98	52%	0.519	47%	0.472	S	S	.	.	H	α-helix	trans	-64.6	-44.7	178.8	-67.9	-16.7	0	0	0	110.6	Q457 S464 R465	Q457-D461 VanDerWaalsContact O-CG 3.26Å; Q457-D461 PolarHBondContact O-N 2.95Å; D461-S464 PolarHBondContact O-N 3.03Å; D461-R465 WeakPolarHBondContact O-CB 3.46Å; D461-R465 PolarHBondContact O-N 3.01Å
462	E	82.8	Confident	75.1	Confident	63 Å²	63	100.2 Å²	100.2	29%	0.294	50%	0.495	S	S	.	.	H	α-helix	trans	-65.6	-38.1	175	178.1	58.2	-161.5	0	0	112.5	A458 R465 R466	A458-E462 WeakPolarHBondContact O-CB 3.27Å; A458-E462 PolarHBondContact O-N 3.32Å; A458-E462 VanDerWaalsContact O-N 3.07Å; E462-R465 PolarHBondContact O-N 3.04Å; E462-R465 IonicContact OE1-CZ 2.81Å; E462-R465 IonicContact OE1-NE 3.95Å; E462-R465 IonicContact OE1-NH2 2.73Å; E462-R465 PolarHBondContact OE1-NH2 3.4Å; E462-R465 IonicContact OE2-CZ 3.76Å; E462-R465 IonicContact OE2-NE 3.63Å; E462-R465 PolarHBondContact OE2-NE 3.37Å; E462-R465 IonicContact OE2-NH2 2.86Å; E462-R465 PolarHBondContact OE2-NH2 2.88Å; E462-R466 WeakPolarHBondContact O-CG 3.43Å; E462-R466 PolarHBondContact O-N 3.23Å; E462-R466 IonicContact OE1-CZ 3.59Å; E462-R466 IonicContact OE1-NE 2.66Å; E462-R466 PolarHBondContact OE1-NE 3.07Å; E462-R466 IonicContact OE1-NH2 3.46Å; E462-R466 PolarHBondContact OE1-NH2 2.64Å
463	L	79.9	Confident	73.6	Confident	84 Å²	84	104.9 Å²	104.9	44%	0.44	53%	0.528	S	S	.	.	H	α-helix	trans	-64	-42.4	175	-176.8	64.6	0	0	0	111.4	F459 K460 R466 L467	F459-L463 WeakPolarHBondContact O-CB 3.27Å; F459-L463 PolarHBondContact O-N 3.23Å; K460-L463 PolarHBondContact O-N 2.96Å; L463-R466 PolarHBondContact O-N 2.73Å; L463-L467 HydrophobicContact CG-CD1 4.14Å; L463-L467 VanDerWaalsContact O-CG 3.31Å; L463-L467 WeakPolarHBondContact O-CG 3.33Å; L463-L467 PolarHBondContact O-N 3.49Å
464	S	78.1	Confident	71.8	Confident	57 Å²	57	108 Å²	108	40%	0.399	56%	0.555	S	S	.	*	H	α-helix	trans	-64.1	-46.1	178.2	-56	0	0	0	0	110.6	K460 D461 R466 L467 E468	K460-S464 WeakPolarHBondContact O-CB 3.37Å; K460-S464 PolarHBondContact O-N 3.31Å; K460-S464 PolarHBondContact O-OG 3.37Å; D461-S464 PolarHBondContact O-N 3.03Å; S464-R466 VanDerWaalsContact C-N 3.32Å; S464-R466 PolarHBondContact O-N 2.89Å; S464-L467 PolarHBondContact O-N 2.85Å; S464-L467 VanDerWaalsContact O-N 3.11Å; S464-E468 WeakPolarHBondContact O-CG 3.46Å; S464-E468 PolarHBondContact O-N 3.44Å
465	R	79.8	Confident	70.2	Confident	107 Å²	107	110 Å²	110	40%	0.404	57%	0.569	S	S	.	*	H	α-helix	trans	-55.3	-45.2	174.2	-165.4	-174.2	74.8	73.3	14.9	112	D461 E462 L467 E468 E469	D461-R465 WeakPolarHBondContact O-CB 3.46Å; D461-R465 PolarHBondContact O-N 3.01Å; E462-R465 PolarHBondContact O-N 3.04Å; E462-R465 IonicContact OE1-CZ 2.81Å; E462-R465 IonicContact OE1-NE 3.95Å; E462-R465 IonicContact OE1-NH2 2.73Å; E462-R465 PolarHBondContact OE1-NH2 3.4Å; E462-R465 IonicContact OE2-CZ 3.76Å; E462-R465 IonicContact OE2-NE 3.63Å; E462-R465 PolarHBondContact OE2-NE 3.37Å; E462-R465 IonicContact OE2-NH2 2.86Å; E462-R465 PolarHBondContact OE2-NH2 2.88Å; R465-L467 PolarHBondContact O-N 2.93Å; R465-E468 PolarHBondContact O-N 2.96Å; R465-E469 IonicContact CZ-OE1 2.9Å; R465-E469 IonicContact CZ-OE2 3.76Å; R465-E469 VanDerWaalsContact NH1-CD 3.32Å; R465-E469 IonicContact NH1-OE1 3.83Å; R465-E469 PolarHBondContact NH1-OE1 3.38Å; R465-E469 IonicContact NH1-OE2 3.57Å; R465-E469 PolarHBondContact NH1-OE2 2.83Å; R465-E469 IonicContact NH2-OE2 3.54Å; R465-E469 VanDerWaalsContact O-CG 3.32Å; R465-E469 WeakPolarHBondContact O-CG 3.33Å; R465-E469 PolarHBondContact O-N 3.47Å
466	R	77.8	Confident	68.2	Low	150 Å²	150	105.9 Å²	105.9	57%	0.566	57%	0.574	S	S	*	*	H	α-helix	trans	-68.2	-31.7	177.8	-74.1	-178.3	-176.3	-161.2	-0.9	113.9	E462 L463 S464 R470	E462-R466 WeakPolarHBondContact O-CG 3.43Å; E462-R466 PolarHBondContact O-N 3.23Å; E462-R466 IonicContact OE1-CZ 3.59Å; E462-R466 IonicContact OE1-NE 2.66Å; E462-R466 PolarHBondContact OE1-NE 3.07Å; E462-R466 IonicContact OE1-NH2 3.46Å; E462-R466 PolarHBondContact OE1-NH2 2.64Å; L463-R466 PolarHBondContact O-N 2.73Å; S464-R466 VanDerWaalsContact C-N 3.32Å; S464-R466 PolarHBondContact O-N 2.89Å; R466-R470 WeakPolarHBondContact O-CB 3.33Å; R466-R470 PolarHBondContact O-N 3.35Å
467	L	68.4	Low	66.2	Low	110 Å²	110	109.4 Å²	109.4	58%	0.576	59%	0.593	S	S	*	*	H	α-helix	trans	-73.4	-37.4	176.3	-74.2	167.3	0	0	0	111.4	L463 S464 R465 R470 G471	L463-L467 HydrophobicContact CG-CD1 4.14Å; L463-L467 VanDerWaalsContact O-CG 3.31Å; L463-L467 WeakPolarHBondContact O-CG 3.33Å; L463-L467 PolarHBondContact O-N 3.49Å; S464-L467 PolarHBondContact O-N 2.85Å; S464-L467 VanDerWaalsContact O-N 3.11Å; R465-L467 PolarHBondContact O-N 2.93Å; L467-R470 PolarHBondContact O-N 3.34Å; L467-G471 PolarHBondContact O-N 3.47Å
468	E	68.1	Low	64.5	Low	158 Å²	158	109.2 Å²	109.2	74%	0.738	60%	0.6	S	S	*	*	H	α-helix	trans	-65.7	-42.7	172.8	-71.3	174.9	-179.5	0	0	111.6	S464 R465 R470 G471	S464-E468 WeakPolarHBondContact O-CG 3.46Å; S464-E468 PolarHBondContact O-N 3.44Å; R465-E468 PolarHBondContact O-N 2.96Å; E468-R470 PolarHBondContact O-N 3.46Å; E468-G471 PolarHBondContact O-N 3.21Å
469	E	66.9	Low	62.9	Low	127 Å²	127	110.4 Å²	110.4	59%	0.593	60%	0.601	S	S	*	*	H	α-helix	trans	-63	-23.8	174.6	-75.6	178.7	159.1	0	0	113.4	R465	R465-E469 IonicContact CZ-OE1 2.9Å; R465-E469 IonicContact CZ-OE2 3.76Å; R465-E469 VanDerWaalsContact NH1-CD 3.32Å; R465-E469 IonicContact NH1-OE1 3.83Å; R465-E469 PolarHBondContact NH1-OE1 3.38Å; R465-E469 IonicContact NH1-OE2 3.57Å; R465-E469 PolarHBondContact NH1-OE2 2.83Å; R465-E469 IonicContact NH2-OE2 3.54Å; R465-E469 VanDerWaalsContact O-CG 3.32Å; R465-E469 WeakPolarHBondContact O-CG 3.33Å; R465-E469 PolarHBondContact O-N 3.47Å
470	R	65	Low	61.4	Low	225 Å²	225	110.8 Å²	110.8	85%	0.849	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	-2.7	-179.9	-104.7	-174	173.1	-162.1	-1.7	115.2	R466 L467 E468	R466-R470 WeakPolarHBondContact O-CB 3.33Å; R466-R470 PolarHBondContact O-N 3.35Å; L467-R470 PolarHBondContact O-N 3.34Å; E468-R470 PolarHBondContact O-N 3.46Å
471	G	48.5	Very low	59.8	Low	59 Å²	59	112.9 Å²	112.9	61%	0.608	62%	0.619	S	S	*	*			trans	54.3	80.4	176.6	0	0	0	0	0	113.7	L467 E468	L467-G471 PolarHBondContact O-N 3.47Å; E468-G471 PolarHBondContact O-N 3.21Å
472	G	43.3	Very low	58.2	Low	70 Å²	70	113 Å²	113	72%	0.722	62%	0.62	S	S	*	*			trans	-69.2	159.8	170.1	0	0	0	0	0	112.8
473	P	49.6	Very low	57	Low	119 Å²	119	116.3 Å²	116.3	77%	0.773	64%	0.635	S	S	*	*			cis	-121.4	150.8	9.1	37.8	-23	0	0	0	114.2
474	V	42.5	Very low	55.9	Low	136 Å²	136	117.2 Å²	117.2	82%	0.824	64%	0.64	S	S	*	*			trans	-118.5	89.3	165.6	-176.6	0	0	0	0	109
475	N	46.7	Very low	54.9	Low	169 Å²	169	119.6 Å²	119.6	90%	0.904	65%	0.647	S	S	*	*			trans	-102.4	79	156.1	-82.6	-17	0	0	0	107.2
476	G	38.9	Very low	53.8	Low	64 Å²	64	122.3 Å²	122.3	66%	0.66	66%	0.664	S	S	*	*			trans	-98.2	87.7	169.1	0	0	0	0	0	109.4
477	D	39.7	Very low	53.1	Low	124 Å²	124	117.8 Å²	117.8	66%	0.663	66%	0.656	S	S	*	*			trans	-72.5	127.3	173.2	-125.8	-19.2	0	0	0	109.3	V479	D477-V479 PolarHBondContact O-N 3.11Å
478	P	47.5	Very low	53.1	Low	98 Å²	98	114.1 Å²	114.1	64%	0.636	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	2.3	-178.3	20.3	-27.1	0	0	0	115
479	V	48.8	Very low	52.9	Low	83 Å²	83	108.4 Å²	108.4	50%	0.503	61%	0.613	S	S	.	*	H	α-helix	trans	-72.6	-30.3	-176.1	-176.5	0	0	0	0	112.5	D477 N482 Q483	D477-V479 PolarHBondContact O-N 3.11Å; V479-N482 PolarHBondContact O-N 3.39Å; V479-Q483 PolarHBondContact O-N 3.4Å
480	Q	52.1	Low	52.9	Low	151 Å²	151	107.7 Å²	107.7	71%	0.706	62%	0.62	S	S	*	*	H	α-helix	trans	-72.7	-30.4	-176.6	-71.6	-176.9	14	0	0	113.7	N482	Q480-N482 VanDerWaalsContact C-N 3.33Å
481	L	48	Very low	53.1	Low	120 Å²	120	101.3 Å²	101.3	63%	0.628	60%	0.602	S	S	*	*	H	α-helix	trans	-71.2	-32.4	178.3	-161.3	73	0	0	0	111.5	L484 I485	L481-L484 PolarHBondContact O-N 2.94Å; L481-I485 WeakPolarHBondContact O-CG1 3.33Å; L481-I485 PolarHBondContact O-N 2.9Å
482	N	50.8	Low	53.9	Low	99 Å²	99	100.2 Å²	100.2	53%	0.529	58%	0.584	S	S	.	*	H	α-helix	trans	-70.6	-38.6	178.8	-77.4	-19.1	0	0	0	112.6	V479 Q480 L484 I485 E486	V479-N482 PolarHBondContact O-N 3.39Å; Q480-N482 VanDerWaalsContact C-N 3.33Å; N482-L484 VanDerWaalsContact C-N 3.29Å; N482-L484 PolarHBondContact O-N 3.14Å; N482-I485 PolarHBondContact O-N 3.26Å; N482-E486 PolarHBondContact O-N 3.45Å
483	Q	55.8	Low	54.8	Low	132 Å²	132	103 Å²	103	62%	0.617	59%	0.59	S	S	*	*	H	α-helix	trans	-64.6	-31.4	176	-80.8	179.8	-18.5	0	0	113.3	V479	V479-Q483 PolarHBondContact O-N 3.4Å
484	L	57.5	Low	55.4	Low	103 Å²	103	99.8 Å²	99.8	54%	0.539	57%	0.569	S	S	.	*	H	α-helix	trans	-69	-36.7	175.2	-94.9	147.9	0	0	0	112.4	L481 N482 S487	L481-L484 PolarHBondContact O-N 2.94Å; N482-L484 VanDerWaalsContact C-N 3.29Å; N482-L484 PolarHBondContact O-N 3.14Å; L484-S487 PolarHBondContact O-OG 2.79Å
485	I	56.4	Low	56.3	Low	108 Å²	108	101.5 Å²	101.5	55%	0.554	57%	0.568	S	S	*	*	H	α-helix	trans	-74.2	-34.2	-178.6	-65.4	169.4	0	0	0	111.5	L481 N482 S487 L488	L481-I485 WeakPolarHBondContact O-CG1 3.33Å; L481-I485 PolarHBondContact O-N 2.9Å; N482-I485 PolarHBondContact O-N 3.26Å; I485-S487 VanDerWaalsContact C-N 3.26Å; I485-S487 PolarHBondContact O-N 2.93Å; I485-L488 PolarHBondContact O-N 2.95Å
486	E	58.4	Low	57	Low	163 Å²	163	98.7 Å²	98.7	76%	0.762	55%	0.553	S	S	*	*	H	α-helix	trans	-67.3	-21.7	179.1	-75	-179.3	172	0	0	114.1	N482 L488	N482-E486 PolarHBondContact O-N 3.45Å; E486-L488 VanDerWaalsContact C-N 3.3Å; E486-L488 PolarHBondContact O-N 2.8Å
487	S	62.6	Low	58.1	Low	56 Å²	56	101.1 Å²	101.1	39%	0.392	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.9	-9.3	-179.3	71.8	0	0	0	0	114.7	L484 I485	L484-S487 PolarHBondContact O-OG 2.79Å; I485-S487 VanDerWaalsContact C-N 3.26Å; I485-S487 PolarHBondContact O-N 2.93Å
488	L	67.2	Low	59.3	Low	32 Å²	32	99.3 Å²	99.3	17%	0.168	55%	0.55	C	S	.	.	S	Bend	trans	-101.3	125.4	-176.8	-68.1	168.4	0	0	0	111.2	I485 E486 R515 I518 R519	I485-L488 PolarHBondContact O-N 2.95Å; E486-L488 VanDerWaalsContact C-N 3.3Å; E486-L488 PolarHBondContact O-N 2.8Å; L488-R515 HydrophobicContact CD2-CB 4.46Å; L488-R515 HydrophobicContact CD2-CG 4.39Å; L488-I518 HydrophobicContact CD2-CB 4.48Å; L488-I518 HydrophobicContact CD2-CG2 4.17Å; L488-R519 HydrophobicContact CD2-CG 4.04Å
489	P	64.9	Low	60	Low	38 Å²	38	100.6 Å²	100.6	25%	0.247	56%	0.558	C	S	.	*	P	Polyproline II helix	trans	-59.7	131.8	-177.7	21.8	-31.3	0	0	0	110.7	R515 I518	P489-R515 HydrophobicContact CG-CG 4.06Å; P489-R515 PolarHBondContact O-NE 3.45Å; P489-R515 PolarHBondContact O-NH2 3.24Å; P489-I518 HydrophobicContact CG-CD1 4.3Å
490	P	67	Low	60.6	Low	112 Å²	112	100.4 Å²	100.4	73%	0.727	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-57.3	147.7	-171.8	22.8	-33.2	0	0	0	112.6
491	L	68.6	Low	61.3	Low	92 Å²	92	94.6 Å²	94.6	48%	0.482	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-69.1	133.8	174.5	-71.6	168.7	0	0	0	108.8	L508 V511 L512	L491-L508 HydrophobicContact CD2-CD1 4.14Å; L491-V511 HydrophobicContact CD2-CG1 4.33Å; L491-L512 HydrophobicContact CD2-CD2 3.89Å
492	P	65.3	Low	62.3	Low	36 Å²	36	95.6 Å²	95.6	23%	0.234	54%	0.54	C	S	.	.	P	Polyproline II helix	trans	-64.1	147.3	172.8	26.2	-31.6	0	0	0	109.8	C494 V511	P492-C494 PolarHBondContact O-N 3.18Å; P492-C494 PolarHBondContact O-SG 2.67Å; P492-V511 HydrophobicContact CG-CG2 4.33Å
493	P	62.7	Low	63.2	Low	129 Å²	129	98.7 Å²	98.7	84%	0.838	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-63.7	119.9	170.7	25.1	-30.3	0	0	0	108.8
494	C	61.2	Low	64	Low	51 Å²	51	94.2 Å²	94.2	35%	0.345	53%	0.533	S	S	.	.			trans	-111	91.3	-179.1	-67.4	0	0	0	0	109.2	P492 T504	P492-C494 PolarHBondContact O-N 3.18Å; P492-C494 PolarHBondContact O-SG 2.67Å; C494-T504 HydrophobicContact CB-CG2 4.09Å
495	E	61.9	Low	64.7	Low	171 Å²	171	93 Å²	93	80%	0.799	53%	0.527	S	S	*	.			trans	-94.3	100.8	165.8	-74.2	-176.3	178.1	0	0	108.2	S497	E495-S497 PolarHBondContact O-N 2.78Å
496	L	60.9	Low	65.8	Low	111 Å²	111	91.1 Å²	91.1	58%	0.581	52%	0.522	S	S	*	.			trans	-70.9	112.6	178	-69.1	165.5	0	0	0	108.6	D501 L505	L496-D501 HydrophobicContact CD2-CB 4.43Å; L496-L505 HydrophobicContact CD2-CD2 4.3Å; L496-L505 HydrophobicContact CD2-CG 4.33Å
497	S	63.1	Low	66.6	Low	115 Å²	115	91.7 Å²	91.7	80%	0.804	52%	0.517	S	S	*	.	S	Bend	trans	-85.2	-24.2	179.4	-58.2	0	0	0	0	112.4	E495	E495-S497 PolarHBondContact O-N 2.78Å
498	D	65.6	Low	67.4	Low	86 Å²	86	91.2 Å²	91.2	46%	0.46	51%	0.51	S	S	.	.	S	Bend	trans	-153.5	151.2	-179.5	-172.5	59.4	0	0	0	110.6	S500 D501	D498-S500 PolarHBondContact O-N 3.38Å; D498-S500 VanDerWaalsContact O-N 3.16Å; D498-S500 WeakPolarHBondContact OD2-CB 3.45Å; D498-S500 PolarHBondContact OD2-N 3.27Å; D498-S500 VanDerWaalsContact OD2-N 3.07Å; D498-S500 PolarHBondContact OD2-OG 3.41Å; D498-D501 WeakPolarHBondContact O-CB 3.37Å; D498-D501 PolarHBondContact O-N 3.17Å
499	P	61.8	Low	67.9	Low	125 Å²	125	95.3 Å²	95.3	81%	0.812	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-12.7	174.7	-22	34.7	0	0	0	114.7
500	S	61.4	Low	68.8	Low	79 Å²	79	100 Å²	100	55%	0.552	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	28.8	178.9	-13	0	0	0	0	112.2	D498 D502	D498-S500 PolarHBondContact O-N 3.38Å; D498-S500 VanDerWaalsContact O-N 3.16Å; D498-S500 WeakPolarHBondContact OD2-CB 3.45Å; D498-S500 PolarHBondContact OD2-N 3.27Å; D498-S500 VanDerWaalsContact OD2-N 3.07Å; D498-S500 PolarHBondContact OD2-OG 3.41Å; S500-D502 VanDerWaalsContact C-N 3.34Å; S500-D502 PolarHBondContact O-N 3.07Å
501	D	67.1	Low	69.5	Low	29 Å²	29	96.1 Å²	96.1	16%	0.155	52%	0.522	C	S	.	.			trans	-72.7	85.1	-178.3	-169.6	-12.4	0	0	0	112.1	L496 D498 Q503 T504 L505	L496-D501 HydrophobicContact CD2-CB 4.43Å; D498-D501 WeakPolarHBondContact O-CB 3.37Å; D498-D501 PolarHBondContact O-N 3.17Å; D501-Q503 PolarHBondContact O-N 3.07Å; D501-Q503 VanDerWaalsContact O-N 3.12Å; D501-Q503 PolarHBondContact OD1-N 2.81Å; D501-T504 VanDerWaalsContact CG-OG1 3.26Å; D501-T504 PolarHBondContact OD1-N 2.77Å; D501-T504 VanDerWaalsContact OD1-N 3.14Å; D501-T504 PolarHBondContact OD1-OG1 2.83Å; D501-T504 VanDerWaalsContact OD2-CB 3.23Å; D501-T504 WeakPolarHBondContact OD2-CB 3.41Å; D501-T504 PolarHBondContact OD2-OG1 3.46Å; D501-L505 PolarHBondContact O-N 2.82Å
502	D	68.4	Low	70.1	Confident	140 Å²	140	95.4 Å²	95.4	75%	0.749	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-1.9	-178.1	-71.8	-25.6	0	0	0	114.3	S500 P506	S500-D502 VanDerWaalsContact C-N 3.34Å; S500-D502 PolarHBondContact O-N 3.07Å; D502-P506 WeakPolarHBondContact O-CD 3.46Å; D502-P506 WeakPolarHBondContact O-CG 3.41Å
503	Q	69.8	Low	71	Confident	165 Å²	165	98.3 Å²	98.3	77%	0.771	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	-41.8	178.2	-65.5	-172	28.2	0	0	112.9	D501	D501-Q503 PolarHBondContact O-N 3.07Å; D501-Q503 VanDerWaalsContact O-N 3.12Å; D501-Q503 PolarHBondContact OD1-N 2.81Å
504	T	72.8	Confident	71.9	Confident	37 Å²	37	99.9 Å²	99.9	23%	0.227	52%	0.518	C	S	.	.	H	α-helix	trans	-75.2	-39.6	-175.7	-54.4	0	0	0	0	111.9	C494 D501 R507 L508	C494-T504 HydrophobicContact CB-CG2 4.09Å; D501-T504 VanDerWaalsContact CG-OG1 3.26Å; D501-T504 PolarHBondContact OD1-N 2.77Å; D501-T504 VanDerWaalsContact OD1-N 3.14Å; D501-T504 PolarHBondContact OD1-OG1 2.83Å; D501-T504 VanDerWaalsContact OD2-CB 3.23Å; D501-T504 WeakPolarHBondContact OD2-CB 3.41Å; D501-T504 PolarHBondContact OD2-OG1 3.46Å; T504-R507 PolarHBondContact O-N 2.81Å; T504-L508 PolarHBondContact O-N 2.94Å; T504-L508 VanDerWaalsContact O-N 3.09Å
505	L	72.8	Confident	72.9	Confident	79 Å²	79	99.4 Å²	99.4	41%	0.414	51%	0.509	S	S	.	.	H	α-helix	trans	-66.4	-48.3	-177.4	-74.5	172.7	0	0	0	113.5	L496 D501 R507 L508 M509	L496-L505 HydrophobicContact CD2-CD2 4.3Å; L496-L505 HydrophobicContact CD2-CG 4.33Å; D501-L505 PolarHBondContact O-N 2.82Å; L505-R507 VanDerWaalsContact C-N 3.28Å; L505-R507 PolarHBondContact O-N 2.92Å; L505-L508 PolarHBondContact O-N 3.01Å; L505-M509 WeakPolarHBondContact O-CG 3.45Å; L505-M509 PolarHBondContact O-N 2.63Å
506	P	78.4	Confident	73.9	Confident	68 Å²	68	97.7 Å²	97.7	44%	0.442	50%	0.496	S	S	.	.	H	α-helix	trans	-61.5	-36	177.4	-25.5	36.4	0	0	0	113.1	D502 M509 E510	D502-P506 WeakPolarHBondContact O-CD 3.46Å; D502-P506 WeakPolarHBondContact O-CG 3.41Å; P506-M509 PolarHBondContact O-N 2.7Å; P506-E510 PolarHBondContact O-N 2.66Å
507	R	75.4	Confident	75	Confident	175 Å²	175	99.7 Å²	99.7	66%	0.66	50%	0.496	S	S	*	.	H	α-helix	trans	-69.3	-37.9	179	-167.8	167.1	-177	-173.2	-0.8	112.4	T504 L505 V511	T504-R507 PolarHBondContact O-N 2.81Å; L505-R507 VanDerWaalsContact C-N 3.28Å; L505-R507 PolarHBondContact O-N 2.92Å; R507-V511 WeakPolarHBondContact O-CG2 3.31Å; R507-V511 PolarHBondContact O-N 3.16Å; R507-V511 VanDerWaalsContact O-N 3.17Å
508	L	78.5	Confident	75.9	Confident	45 Å²	45	96.6 Å²	96.6	24%	0.236	47%	0.47	C	S	.	.	H	α-helix	trans	-66.3	-42.7	172.7	-179.6	61.8	0	0	0	111.2	L491 T504 L505 E510 V511 L512	L491-L508 HydrophobicContact CD2-CD1 4.14Å; T504-L508 PolarHBondContact O-N 2.94Å; T504-L508 VanDerWaalsContact O-N 3.09Å; L505-L508 PolarHBondContact O-N 3.01Å; L508-E510 VanDerWaalsContact C-N 3.34Å; L508-E510 PolarHBondContact O-N 3.21Å; L508-V511 PolarHBondContact O-N 3.04Å; L508-L512 HydrophobicContact CD1-CD1 4.15Å; L508-L512 HydrophobicContact CD1-CG 4.15Å; L508-L512 HydrophobicContact CG-CD1 3.92Å; L508-L512 HydrophobicContact CG-CG 4.35Å; L508-L512 WeakPolarHBondContact O-CB 3.42Å; L508-L512 VanDerWaalsContact O-CG 3.3Å; L508-L512 WeakPolarHBondContact O-CG 3.36Å; L508-L512 PolarHBondContact O-N 3.22Å
509	M	79.4	Confident	76.6	Confident	118 Å²	118	97.7 Å²	97.7	58%	0.581	47%	0.468	S	S	*	.	H	α-helix	trans	-57.7	-45.9	175.1	-72.8	175.8	64	0	0	111.5	L505 P506 V511 L512 E513	L505-M509 WeakPolarHBondContact O-CG 3.45Å; L505-M509 PolarHBondContact O-N 2.63Å; P506-M509 PolarHBondContact O-N 2.7Å; M509-V511 PolarHBondContact O-N 2.66Å; M509-L512 PolarHBondContact O-N 2.85Å; M509-E513 WeakPolarHBondContact O-CB 3.24Å; M509-E513 WeakPolarHBondContact O-CG 3.48Å; M509-E513 PolarHBondContact O-N 3.38Å
510	E	81.9	Confident	77.6	Confident	137 Å²	137	95.8 Å²	95.8	64%	0.64	45%	0.448	S	S	*	.	H	α-helix	trans	-60.1	-44.4	177.6	-168.4	-169.6	166.4	0	0	112.3	P506 L508 E513 R514	P506-E510 PolarHBondContact O-N 2.66Å; L508-E510 VanDerWaalsContact C-N 3.34Å; L508-E510 PolarHBondContact O-N 3.21Å; E510-E513 PolarHBondContact O-N 3.17Å; E510-R514 WeakPolarHBondContact O-CB 3.16Å; E510-R514 PolarHBondContact O-N 3.1Å
511	V	82.4	Confident	78.6	Confident	31 Å²	31	98.9 Å²	98.9	19%	0.188	45%	0.452	C	S	.	.	H	α-helix	trans	-66.2	-40.7	177.8	173.3	0	0	0	0	111.5	L491 P492 R507 L508 M509 R514 R515	L491-V511 HydrophobicContact CD2-CG1 4.33Å; P492-V511 HydrophobicContact CG-CG2 4.33Å; R507-V511 WeakPolarHBondContact O-CG2 3.31Å; R507-V511 PolarHBondContact O-N 3.16Å; R507-V511 VanDerWaalsContact O-N 3.17Å; L508-V511 PolarHBondContact O-N 3.04Å; M509-V511 PolarHBondContact O-N 2.66Å; V511-R514 PolarHBondContact O-N 3.41Å; V511-R515 WeakPolarHBondContact O-CB 3.46Å; V511-R515 WeakPolarHBondContact O-CG 3.43Å; V511-R515 PolarHBondContact O-N 3.45Å
512	L	81.4	Confident	79.2	Confident	77 Å²	77	100.3 Å²	100.3	40%	0.403	46%	0.458	S	S	.	.	H	α-helix	trans	-67.4	-41	177.6	-72	174.9	0	0	0	111.9	L491 L508 M509 R514 R515 Y516	L491-L512 HydrophobicContact CD2-CD2 3.89Å; L508-L512 HydrophobicContact CD1-CD1 4.15Å; L508-L512 HydrophobicContact CD1-CG 4.15Å; L508-L512 HydrophobicContact CG-CD1 3.92Å; L508-L512 HydrophobicContact CG-CG 4.35Å; L508-L512 WeakPolarHBondContact O-CB 3.42Å; L508-L512 VanDerWaalsContact O-CG 3.3Å; L508-L512 WeakPolarHBondContact O-CG 3.36Å; L508-L512 PolarHBondContact O-N 3.22Å; M509-L512 PolarHBondContact O-N 2.85Å; L512-R514 VanDerWaalsContact C-N 3.35Å; L512-R515 PolarHBondContact O-N 3.46Å; L512-Y516 WeakPolarHBondContact O-CB 3.32Å; L512-Y516 PolarHBondContact O-N 2.94Å
513	E	84.1	Confident	79.7	Confident	96 Å²	96	97.3 Å²	97.3	45%	0.449	45%	0.445	S	S	.	.	H	α-helix	trans	-61.4	-43.2	172.5	-80	-169.2	-175.7	0	0	111.5	M509 E510 Y516 R517	M509-E513 WeakPolarHBondContact O-CB 3.24Å; M509-E513 WeakPolarHBondContact O-CG 3.48Å; M509-E513 PolarHBondContact O-N 3.38Å; E510-E513 PolarHBondContact O-N 3.17Å; E513-Y516 WeakPolarHBondContact O-CB 3.17Å; E513-Y516 PolarHBondContact O-N 3.42Å; E513-R517 WeakPolarHBondContact O-CG 3.36Å; E513-R517 PolarHBondContact O-N 2.7Å; E513-R517 IonicContact OE2-NH2 3.41Å; E513-R517 PolarHBondContact OE2-NH2 2.81Å
514	R	82.1	Confident	80.3	Confident	162 Å²	162	95.7 Å²	95.7	61%	0.611	44%	0.437	S	S	*	.	H	α-helix	trans	-63.2	-44.2	176.8	-171	174	-179.1	-176	-0.3	111.6	E510 V511 L512 Y516 R517 I518	E510-R514 WeakPolarHBondContact O-CB 3.16Å; E510-R514 PolarHBondContact O-N 3.1Å; V511-R514 PolarHBondContact O-N 3.41Å; L512-R514 VanDerWaalsContact C-N 3.35Å; R514-Y516 VanDerWaalsContact C-N 3.33Å; R514-Y516 PolarHBondContact O-N 3.36Å; R514-R517 PolarHBondContact O-N 3.36Å; R514-I518 HydrophobicContact CG-CD1 4.3Å; R514-I518 WeakPolarHBondContact O-CG1 3.41Å; R514-I518 PolarHBondContact O-N 2.89Å; R514-I518 VanDerWaalsContact O-N 3.08Å
515	R	82.6	Confident	80.7	Confident	41 Å²	41	99.9 Å²	99.9	16%	0.155	45%	0.454	C	S	.	.	H	α-helix	trans	-61.4	-40.2	173.6	-78.9	-179.6	163.3	-136.2	-9.5	112	L488 P489 V511 L512 I518 R519	L488-R515 HydrophobicContact CD2-CB 4.46Å; L488-R515 HydrophobicContact CD2-CG 4.39Å; P489-R515 HydrophobicContact CG-CG 4.06Å; P489-R515 PolarHBondContact O-NE 3.45Å; P489-R515 PolarHBondContact O-NH2 3.24Å; V511-R515 WeakPolarHBondContact O-CB 3.46Å; V511-R515 WeakPolarHBondContact O-CG 3.43Å; V511-R515 PolarHBondContact O-N 3.45Å; L512-R515 PolarHBondContact O-N 3.46Å; R515-I518 PolarHBondContact O-N 2.8Å; R515-R519 WeakPolarHBondContact O-CG 3.3Å; R515-R519 PolarHBondContact O-N 3.17Å
516	Y	81.7	Confident	81.1	Confident	135 Å²	135	103.2 Å²	103.2	53%	0.529	47%	0.466	S	S	.	.	H	α-helix	trans	-62.6	-46.4	176.5	-179.8	-102.4	0	0	0	111.7	L512 E513 R514 I518 R519 Q520	L512-Y516 WeakPolarHBondContact O-CB 3.32Å; L512-Y516 PolarHBondContact O-N 2.94Å; E513-Y516 WeakPolarHBondContact O-CB 3.17Å; E513-Y516 PolarHBondContact O-N 3.42Å; R514-Y516 VanDerWaalsContact C-N 3.33Å; R514-Y516 PolarHBondContact O-N 3.36Å; Y516-I518 PolarHBondContact O-N 2.71Å; Y516-R519 PolarHBondContact O-N 3.5Å; Y516-Q520 HydrophobicContact CD1-CG 4.41Å; Y516-Q520 HydrophobicContact CE1-CG 4.01Å; Y516-Q520 VanDerWaalsContact CE1-NE2 3.35Å; Y516-Q520 HydrophobicContact CE2-CG 4.42Å; Y516-Q520 VanDerWaalsContact CZ-NE2 3.31Å; Y516-Q520 PolarHBondContact O-N 2.88Å; Y516-Q520 PolarHBondContact OH-NE2 2.97Å
517	R	84.9	Confident	81.3	Confident	153 Å²	153	103.9 Å²	103.9	58%	0.577	47%	0.465	S	S	*	.	H	α-helix	trans	-60.4	-41	175.9	-72	-178.9	-174.6	128.1	11.5	112.8	E513 R514 Q520 K521	E513-R517 WeakPolarHBondContact O-CG 3.36Å; E513-R517 PolarHBondContact O-N 2.7Å; E513-R517 IonicContact OE2-NH2 3.41Å; E513-R517 PolarHBondContact OE2-NH2 2.81Å; R514-R517 PolarHBondContact O-N 3.36Å; R517-Q520 PolarHBondContact O-N 3Å; R517-K521 PolarHBondContact O-N 3.43Å; R517-K521 VanDerWaalsContact O-N 3.14Å
518	I	81.4	Confident	81.8	Confident	51 Å²	51	101.6 Å²	101.6	26%	0.262	46%	0.462	S	S	.	.	H	α-helix	trans	-65.2	-44.7	177.5	-67	166.5	0	0	0	110.7	L488 P489 R514 R515 Y516 Q520 K521 M522	L488-I518 HydrophobicContact CD2-CB 4.48Å; L488-I518 HydrophobicContact CD2-CG2 4.17Å; P489-I518 HydrophobicContact CG-CD1 4.3Å; R514-I518 HydrophobicContact CG-CD1 4.3Å; R514-I518 WeakPolarHBondContact O-CG1 3.41Å; R514-I518 PolarHBondContact O-N 2.89Å; R514-I518 VanDerWaalsContact O-N 3.08Å; R515-I518 PolarHBondContact O-N 2.8Å; Y516-I518 PolarHBondContact O-N 2.71Å; I518-Q520 PolarHBondContact O-N 3.41Å; I518-K521 PolarHBondContact O-N 3.47Å; I518-M522 HydrophobicContact CG2-CE 4.08Å; I518-M522 PolarHBondContact O-N 2.65Å
519	R	80.4	Confident	81.9	Confident	108 Å²	108	103.9 Å²	103.9	41%	0.408	48%	0.478	S	S	.	.	H	α-helix	trans	-60.9	-43.7	175.5	-76.7	-173.8	-71.7	-127.9	1.3	112.4	L488 R515 Y516 K521 M522 T523	L488-R519 HydrophobicContact CD2-CG 4.04Å; R515-R519 WeakPolarHBondContact O-CG 3.3Å; R515-R519 PolarHBondContact O-N 3.17Å; Y516-R519 PolarHBondContact O-N 3.5Å; R519-K521 PolarHBondContact O-N 3.15Å; R519-M522 HydrophobicContact CG-CE 4.48Å; R519-M522 PolarHBondContact O-N 3.47Å; R519-T523 PolarHBondContact O-N 2.95Å; R519-T523 PolarHBondContact O-OG1 2.97Å
520	Q	82.3	Confident	81.9	Confident	86 Å²	86	100.3 Å²	100.3	40%	0.402	47%	0.467	S	S	.	.	H	α-helix	trans	-58.6	-47.2	177	-78.9	-167.5	-37.4	0	0	112.1	Y516 R517 I518 M522 T523 E524	Y516-Q520 HydrophobicContact CD1-CG 4.41Å; Y516-Q520 HydrophobicContact CE1-CG 4.01Å; Y516-Q520 VanDerWaalsContact CE1-NE2 3.35Å; Y516-Q520 HydrophobicContact CE2-CG 4.42Å; Y516-Q520 VanDerWaalsContact CZ-NE2 3.31Å; Y516-Q520 PolarHBondContact O-N 2.88Å; Y516-Q520 PolarHBondContact OH-NE2 2.97Å; R517-Q520 PolarHBondContact O-N 3Å; I518-Q520 PolarHBondContact O-N 3.41Å; Q520-M522 PolarHBondContact O-N 2.86Å; Q520-T523 PolarHBondContact O-N 3.41Å; Q520-E524 PolarHBondContact O-N 3.24Å
521	K	83.4	Confident	82	Confident	144 Å²	144	98.7 Å²	98.7	63%	0.626	46%	0.463	S	S	*	.	H	α-helix	trans	-61.2	-41.5	177.1	-75.7	-172.2	177.4	-173.9	0	112.9	R517 I518 R519 E524 Q525	R517-K521 PolarHBondContact O-N 3.43Å; R517-K521 VanDerWaalsContact O-N 3.14Å; I518-K521 PolarHBondContact O-N 3.47Å; R519-K521 PolarHBondContact O-N 3.15Å; K521-E524 PolarHBondContact O-N 3.47Å; K521-Q525 WeakPolarHBondContact O-CG 3.22Å; K521-Q525 PolarHBondContact O-N 3.38Å
522	M	78.7	Confident	82.3	Confident	58 Å²	58	102.3 Å²	102.3	29%	0.286	48%	0.482	S	S	.	.	H	α-helix	trans	-65.2	-41.6	176.6	-73.8	-166.6	-63.5	0	0	112	I518 R519 Q520 Q525 F526	I518-M522 HydrophobicContact CG2-CE 4.08Å; I518-M522 PolarHBondContact O-N 2.65Å; R519-M522 HydrophobicContact CG-CE 4.48Å; R519-M522 PolarHBondContact O-N 3.47Å; Q520-M522 PolarHBondContact O-N 2.86Å; M522-Q525 PolarHBondContact O-N 3.2Å; M522-F526 WeakPolarHBondContact O-CB 3.21Å; M522-F526 PolarHBondContact O-N 3.34Å
523	T	79.4	Confident	82.5	Confident	78 Å²	78	104.8 Å²	104.8	48%	0.479	49%	0.493	S	S	.	.	H	α-helix	trans	-63.4	-41.3	175.9	-58.6	0	0	0	0	111.6	R519 Q520 F526 N527	R519-T523 PolarHBondContact O-N 2.95Å; R519-T523 PolarHBondContact O-OG1 2.97Å; Q520-T523 PolarHBondContact O-N 3.41Å; T523-F526 PolarHBondContact O-N 2.65Å; T523-N527 WeakPolarHBondContact O-CB 3.01Å; T523-N527 PolarHBondContact O-N 2.68Å; T523-N527 PolarHBondContact O-ND2 3.49Å
524	E	81.9	Confident	82.7	Confident	130 Å²	130	106.1 Å²	106.1	61%	0.607	50%	0.497	S	S	*	.	H	α-helix	trans	-62.3	-46.4	174.7	-79.1	173.4	174.4	0	0	112	Q520 K521 N527 Q528	Q520-E524 PolarHBondContact O-N 3.24Å; K521-E524 PolarHBondContact O-N 3.47Å; E524-N527 PolarHBondContact O-N 2.94Å; E524-Q528 WeakPolarHBondContact O-CB 3.16Å; E524-Q528 PolarHBondContact O-N 2.84Å
525	Q	81	Confident	83	Confident	125 Å²	125	104.4 Å²	104.4	58%	0.584	49%	0.494	S	S	*	.	H	α-helix	trans	-61.9	-45	176.2	-75.1	-179.9	-22.3	0	0	111.8	K521 M522 N527 Q528 T529	K521-Q525 WeakPolarHBondContact O-CG 3.22Å; K521-Q525 PolarHBondContact O-N 3.38Å; M522-Q525 PolarHBondContact O-N 3.2Å; Q525-N527 PolarHBondContact O-N 3.38Å; Q525-Q528 PolarHBondContact O-N 3.35Å; Q525-T529 PolarHBondContact O-N 3.42Å; Q525-T529 PolarHBondContact O-OG1 2.62Å; Q525-T529 VanDerWaalsContact O-OG1 3.1Å
526	F	82.4	Confident	83.4	Confident	149 Å²	149	104.4 Å²	104.4	65%	0.654	50%	0.503	S	S	*	.	H	α-helix	trans	-60.4	-47.2	177.1	-178.9	-94	0	0	0	111.5	M522 T523 Q528 T529 A530	M522-F526 WeakPolarHBondContact O-CB 3.21Å; M522-F526 PolarHBondContact O-N 3.34Å; T523-F526 PolarHBondContact O-N 2.65Å; F526-Q528 VanDerWaalsContact C-N 3.29Å; F526-Q528 PolarHBondContact O-N 3.36Å; F526-T529 PolarHBondContact O-N 3.41Å; F526-A530 WeakPolarHBondContact O-CB 3.36Å; F526-A530 PolarHBondContact O-N 3.45Å
527	N	82	Confident	83.7	Confident	82 Å²	82	103.2 Å²	103.2	44%	0.439	51%	0.505	S	S	.	.	H	α-helix	trans	-62.5	-37.5	177.4	-74.7	-24.8	0	0	0	111.8	T523 E524 Q525 N531	T523-N527 WeakPolarHBondContact O-CB 3.01Å; T523-N527 PolarHBondContact O-N 2.68Å; T523-N527 PolarHBondContact O-ND2 3.49Å; E524-N527 PolarHBondContact O-N 2.94Å; Q525-N527 PolarHBondContact O-N 3.38Å; N527-N531 WeakPolarHBondContact O-CB 3.32Å; N527-N531 VanDerWaalsContact O-CG 3.28Å; N527-N531 PolarHBondContact O-N 3.35Å; N527-N531 PolarHBondContact O-ND2 3.14Å
528	Q	85.5	Confident	83.8	Confident	127 Å²	127	101.2 Å²	101.2	59%	0.593	50%	0.503	S	S	*	.	H	α-helix	trans	-65.7	-45.4	175.8	-166.7	171.8	27.3	0	0	111.6	E524 Q525 F526 N531 N532	E524-Q528 WeakPolarHBondContact O-CB 3.16Å; E524-Q528 PolarHBondContact O-N 2.84Å; Q525-Q528 PolarHBondContact O-N 3.35Å; F526-Q528 VanDerWaalsContact C-N 3.29Å; F526-Q528 PolarHBondContact O-N 3.36Å; Q528-N531 PolarHBondContact O-N 3.11Å; Q528-N532 VanDerWaalsContact O-CG 3.23Å; Q528-N532 PolarHBondContact O-N 2.84Å; Q528-N532 PolarHBondContact O-OD1 3.37Å
529	T	80.2	Confident	84.3	Confident	93 Å²	93	103.5 Å²	103.5	57%	0.571	51%	0.512	S	S	*	.	H	α-helix	trans	-63.9	-42.7	175.9	-57	0	0	0	0	111.8	Q525 F526 N531 N532 M533	Q525-T529 PolarHBondContact O-N 3.42Å; Q525-T529 PolarHBondContact O-OG1 2.62Å; Q525-T529 VanDerWaalsContact O-OG1 3.1Å; F526-T529 PolarHBondContact O-N 3.41Å; T529-N531 PolarHBondContact O-N 3.12Å; T529-N532 PolarHBondContact O-N 3.46Å; T529-M533 WeakPolarHBondContact O-CB 3.14Å; T529-M533 PolarHBondContact O-N 3.03Å
530	A	80.9	Confident	84.8	Confident	43 Å²	43	105.1 Å²	105.1	36%	0.355	52%	0.522	S	S	.	.	H	α-helix	trans	-61.8	-42.5	177.1	0	0	0	0	0	111.8	F526 M533 K534	F526-A530 WeakPolarHBondContact O-CB 3.36Å; F526-A530 PolarHBondContact O-N 3.45Å; A530-M533 PolarHBondContact O-N 3.16Å; A530-K534 WeakPolarHBondContact O-CB 3.13Å; A530-K534 PolarHBondContact O-N 2.79Å
531	N	84.3	Confident	85	Confident	104 Å²	104	107.8 Å²	107.8	56%	0.556	54%	0.535	S	S	*	.	H	α-helix	trans	-65.9	-40.5	176	-76.8	-30.2	0	0	0	112.5	N527 Q528 T529 M533 K534 F535	N527-N531 WeakPolarHBondContact O-CB 3.32Å; N527-N531 VanDerWaalsContact O-CG 3.28Å; N527-N531 PolarHBondContact O-N 3.35Å; N527-N531 PolarHBondContact O-ND2 3.14Å; Q528-N531 PolarHBondContact O-N 3.11Å; T529-N531 PolarHBondContact O-N 3.12Å; N531-M533 VanDerWaalsContact C-N 3.34Å; N531-M533 PolarHBondContact O-N 2.75Å; N531-K534 PolarHBondContact O-N 2.99Å; N531-F535 PolarHBondContact O-N 2.98Å
532	N	87.7	Confident	85.3	Confident	106 Å²	106	105 Å²	105	57%	0.567	53%	0.533	S	S	*	.	H	α-helix	trans	-62.6	-42.2	175	-71	-10.8	0	0	0	111.5	Q528 T529 F535 A536	Q528-N532 VanDerWaalsContact O-CG 3.23Å; Q528-N532 PolarHBondContact O-N 2.84Å; Q528-N532 PolarHBondContact O-OD1 3.37Å; T529-N532 PolarHBondContact O-N 3.46Å; N532-F535 PolarHBondContact O-N 2.87Å; N532-A536 PolarHBondContact O-N 3.17Å
533	M	86.1	Confident	85.9	Confident	129 Å²	129	106.9 Å²	106.9	64%	0.635	54%	0.541	S	S	*	.	H	α-helix	trans	-65	-40.7	176.9	-167.6	176.2	-118.8	0	0	111.6	T529 A530 N531 F535 A536 L537	T529-M533 WeakPolarHBondContact O-CB 3.14Å; T529-M533 PolarHBondContact O-N 3.03Å; A530-M533 PolarHBondContact O-N 3.16Å; N531-M533 VanDerWaalsContact C-N 3.34Å; N531-M533 PolarHBondContact O-N 2.75Å; M533-F535 PolarHBondContact O-N 3.35Å; M533-A536 PolarHBondContact O-N 3.5Å; M533-L537 HydrophobicContact CG-CD1 4.47Å; M533-L537 WeakPolarHBondContact O-CG 3.17Å; M533-L537 PolarHBondContact O-N 3.3Å
534	K	88	Confident	86.3	Confident	125 Å²	125	109.9 Å²	109.9	54%	0.543	55%	0.548	S	S	.	.	H	α-helix	trans	-59.4	-44.2	174.5	-174	179.9	-179.7	-179.9	0	112.1	A530 N531 L537 Q538	A530-K534 WeakPolarHBondContact O-CB 3.13Å; A530-K534 PolarHBondContact O-N 2.79Å; N531-K534 PolarHBondContact O-N 2.99Å; K534-L537 PolarHBondContact O-N 3.22Å; K534-Q538 PolarHBondContact O-N 3.19Å; K534-Q538 VanDerWaalsContact O-N 3.07Å
535	F	89.3	Confident	86.6	Confident	125 Å²	125	106.4 Å²	106.4	55%	0.548	54%	0.538	S	S	.	.	H	α-helix	trans	-64.9	-42.5	176.9	-176.1	-98.9	0	0	0	112	N531 N532 M533 L537 Q538 Q539	N531-F535 PolarHBondContact O-N 2.98Å; N532-F535 PolarHBondContact O-N 2.87Å; M533-F535 PolarHBondContact O-N 3.35Å; F535-L537 VanDerWaalsContact C-N 3.33Å; F535-L537 PolarHBondContact O-N 3.01Å; F535-Q538 PolarHBondContact O-N 2.54Å; F535-Q539 HydrophobicContact CD1-CG 4.33Å; F535-Q539 HydrophobicContact CE1-CG 3.97Å; F535-Q539 HydrophobicContact CZ-CG 4.23Å; F535-Q539 VanDerWaalsContact CZ-NE2 3.27Å; F535-Q539 PolarHBondContact O-N 2.91Å
536	A	89.3	Confident	87	Confident	41 Å²	41	103.6 Å²	103.6	34%	0.339	53%	0.532	S	S	.	.	H	α-helix	trans	-60.3	-42.9	175.8	0	0	0	0	0	111.8	N532 M533 Q539 F540	N532-A536 PolarHBondContact O-N 3.17Å; M533-A536 PolarHBondContact O-N 3.5Å; A536-Q539 PolarHBondContact O-N 3.1Å; A536-F540 VanDerWaalsContact O-CD2 3.23Å; A536-F540 WeakPolarHBondContact O-CD2 3.14Å; A536-F540 PolarHBondContact O-N 3.18Å
537	L	87.8	Confident	87.4	Confident	111 Å²	111	103 Å²	103	58%	0.581	53%	0.529	S	S	*	.	H	α-helix	trans	-62.4	-44.5	176.8	-74.1	169.9	0	0	0	112.2	M533 K534 F535 Q539 F540 E541	M533-L537 HydrophobicContact CG-CD1 4.47Å; M533-L537 WeakPolarHBondContact O-CG 3.17Å; M533-L537 PolarHBondContact O-N 3.3Å; K534-L537 PolarHBondContact O-N 3.22Å; F535-L537 VanDerWaalsContact C-N 3.33Å; F535-L537 PolarHBondContact O-N 3.01Å; L537-Q539 VanDerWaalsContact C-N 3.3Å; L537-Q539 PolarHBondContact O-N 2.79Å; L537-F540 PolarHBondContact O-N 2.87Å; L537-E541 WeakPolarHBondContact O-CB 2.99Å; L537-E541 PolarHBondContact O-N 2.64Å
538	Q	88.2	Confident	87.8	Confident	111 Å²	111	104.3 Å²	104.3	52%	0.519	53%	0.533	S	S	.	.	H	α-helix	trans	-62.3	-37.3	176.2	-74.8	-179	-23	0	0	112.5	K534 F535 S542	K534-Q538 PolarHBondContact O-N 3.19Å; K534-Q538 VanDerWaalsContact O-N 3.07Å; F535-Q538 PolarHBondContact O-N 2.54Å; Q538-S542 PolarHBondContact O-N 2.89Å; Q538-S542 VanDerWaalsContact O-N 3.1Å
539	Q	91.4	Very high	88	Confident	99 Å²	99	103.3 Å²	103.3	46%	0.463	53%	0.532	S	S	.	.	H	α-helix	trans	-66.1	-42.3	173.6	-72.4	-152.3	-13.3	0	0	112.2	F535 A536 L537 E541 S542 Q543	F535-Q539 HydrophobicContact CD1-CG 4.33Å; F535-Q539 HydrophobicContact CE1-CG 3.97Å; F535-Q539 HydrophobicContact CZ-CG 4.23Å; F535-Q539 VanDerWaalsContact CZ-NE2 3.27Å; F535-Q539 PolarHBondContact O-N 2.91Å; A536-Q539 PolarHBondContact O-N 3.1Å; L537-Q539 VanDerWaalsContact C-N 3.3Å; L537-Q539 PolarHBondContact O-N 2.79Å; Q539-E541 VanDerWaalsContact C-N 3.35Å; Q539-S542 PolarHBondContact O-N 3.24Å; Q539-Q543 WeakPolarHBondContact O-CG 3.38Å; Q539-Q543 PolarHBondContact O-N 3.01Å
540	F	90.4	Very high	88.6	Confident	142 Å²	142	102.8 Å²	102.8	62%	0.623	53%	0.528	S	S	*	.	H	α-helix	trans	-62.6	-41.6	176.1	-88.2	-65.4	0	0	0	112.2	A536 L537 Q543 F544	A536-F540 VanDerWaalsContact O-CD2 3.23Å; A536-F540 WeakPolarHBondContact O-CD2 3.14Å; A536-F540 PolarHBondContact O-N 3.18Å; L537-F540 PolarHBondContact O-N 2.87Å; F540-Q543 PolarHBondContact O-N 3.31Å; F540-F544 WeakPolarHBondContact O-CB 3.41Å; F540-F544 PolarHBondContact O-N 3.34Å
541	E	88.2	Confident	89	Confident	141 Å²	141	106 Å²	106	66%	0.659	54%	0.539	S	S	*	.	H	α-helix	trans	-63.4	-43.5	178.6	-166.5	172.2	-162.2	0	0	111.7	L537 Q539 F544 S545	L537-E541 WeakPolarHBondContact O-CB 2.99Å; L537-E541 PolarHBondContact O-N 2.64Å; Q539-E541 VanDerWaalsContact C-N 3.35Å; E541-F544 PolarHBondContact O-N 2.52Å; E541-S545 PolarHBondContact O-N 3.45Å
542	S	88.9	Confident	89.3	Confident	85 Å²	85	107.9 Å²	107.9	59%	0.594	54%	0.544	S	S	*	.	H	α-helix	trans	-62.4	-43.4	173.6	-178.3	0	0	0	0	112.4	Q538 Q539 F544 S545 S546	Q538-S542 PolarHBondContact O-N 2.89Å; Q538-S542 VanDerWaalsContact O-N 3.1Å; Q539-S542 PolarHBondContact O-N 3.24Å; S542-F544 VanDerWaalsContact C-N 3.33Å; S542-F544 PolarHBondContact O-N 3.35Å; S542-S545 PolarHBondContact O-N 3.29Å; S542-S546 PolarHBondContact O-N 3.47Å; S542-S546 VanDerWaalsContact O-N 3.08Å
543	Q	90.1	Very high	89.4	Confident	98 Å²	98	106.5 Å²	106.5	46%	0.458	54%	0.536	S	S	.	.	H	α-helix	trans	-63.6	-38.8	174.8	-74.7	-171.1	26	0	0	112.3	Q539 F540 S546 K547	Q539-Q543 WeakPolarHBondContact O-CG 3.38Å; Q539-Q543 PolarHBondContact O-N 3.01Å; F540-Q543 PolarHBondContact O-N 3.31Å; Q543-S546 PolarHBondContact O-N 3.46Å; Q543-S546 PolarHBondContact O-OG 3.02Å; Q543-K547 PolarHBondContact O-N 2.87Å; Q543-K547 VanDerWaalsContact O-N 3.13Å
544	F	89.8	Confident	89.6	Confident	141 Å²	141	105.2 Å²	105.2	62%	0.618	53%	0.529	S	S	*	.	H	α-helix	trans	-63.8	-49.2	178.2	-170.7	-92.5	0	0	0	111	F540 E541 S542 S546 K547 E548	F540-F544 WeakPolarHBondContact O-CB 3.41Å; F540-F544 PolarHBondContact O-N 3.34Å; E541-F544 PolarHBondContact O-N 2.52Å; S542-F544 VanDerWaalsContact C-N 3.33Å; S542-F544 PolarHBondContact O-N 3.35Å; F544-S546 VanDerWaalsContact C-N 3.31Å; F544-S546 PolarHBondContact O-N 3.38Å; F544-K547 PolarHBondContact O-N 3.46Å; F544-K547 VanDerWaalsContact O-N 3.13Å; F544-E548 WeakPolarHBondContact O-CB 3.25Å; F544-E548 PolarHBondContact O-N 2.66Å
545	S	86.8	Confident	89.7	Confident	58 Å²	58	108.9 Å²	108.9	41%	0.406	54%	0.539	S	S	.	.	H	α-helix	trans	-58.9	-40.5	177.8	-173.3	0	0	0	0	112.3	E541 S542 K547 E548 N549	E541-S545 PolarHBondContact O-N 3.45Å; S542-S545 PolarHBondContact O-N 3.29Å; S545-K547 PolarHBondContact O-N 3.27Å; S545-E548 PolarHBondContact O-N 3.15Å; S545-N549 PolarHBondContact O-N 3.21Å; S545-N549 VanDerWaalsContact O-N 3.12Å; S545-N549 PolarHBondContact O-ND2 2.91Å
546	S	90.2	Very high	89.8	Confident	65 Å²	65	106.2 Å²	106.2	46%	0.455	54%	0.536	S	S	.	.	H	α-helix	trans	-64.2	-40.7	176	71.6	0	0	0	0	113.1	S542 Q543 F544 V550	S542-S546 PolarHBondContact O-N 3.47Å; S542-S546 VanDerWaalsContact O-N 3.08Å; Q543-S546 PolarHBondContact O-N 3.46Å; Q543-S546 PolarHBondContact O-OG 3.02Å; F544-S546 VanDerWaalsContact C-N 3.31Å; F544-S546 PolarHBondContact O-N 3.38Å; S546-V550 WeakPolarHBondContact O-CG2 2.97Å; S546-V550 PolarHBondContact O-N 2.99Å
547	K	90.3	Very high	89.9	Confident	137 Å²	137	109.5 Å²	109.5	60%	0.596	54%	0.543	S	S	*	.	H	α-helix	trans	-68.7	-37.3	176.5	-76.4	-179.7	178.1	173.1	0	112.3	Q543 F544 S545 N549 V550 L551	Q543-K547 PolarHBondContact O-N 2.87Å; Q543-K547 VanDerWaalsContact O-N 3.13Å; F544-K547 PolarHBondContact O-N 3.46Å; F544-K547 VanDerWaalsContact O-N 3.13Å; S545-K547 PolarHBondContact O-N 3.27Å; K547-N549 VanDerWaalsContact C-N 3.35Å; K547-V550 PolarHBondContact O-N 3.43Å; K547-L551 WeakPolarHBondContact O-CG 3.16Å; K547-L551 PolarHBondContact O-N 3.19Å
548	E	90.7	Very high	90	Very high	109 Å²	109	109.3 Å²	109.3	51%	0.509	54%	0.542	S	S	.	.	H	α-helix	trans	-62.1	-42.5	177	-170	173	-160.8	0	0	111.7	F544 S545 V550 L551 H552	F544-E548 WeakPolarHBondContact O-CB 3.25Å; F544-E548 PolarHBondContact O-N 2.66Å; S545-E548 PolarHBondContact O-N 3.15Å; E548-V550 VanDerWaalsContact C-N 3.34Å; E548-V550 PolarHBondContact O-N 2.85Å; E548-L551 PolarHBondContact O-N 2.71Å; E548-H552 PolarHBondContact O-N 2.96Å
549	N	89.9	Confident	90.1	Very high	107 Å²	107	105.4 Å²	105.4	57%	0.572	53%	0.531	S	S	*	.	H	α-helix	trans	-61.6	-40.5	174.9	-69.3	-30.7	0	0	0	112.5	S545 K547 H552 D553	S545-N549 PolarHBondContact O-N 3.21Å; S545-N549 VanDerWaalsContact O-N 3.12Å; S545-N549 PolarHBondContact O-ND2 2.91Å; K547-N549 VanDerWaalsContact C-N 3.35Å; N549-H552 PolarHBondContact O-N 2.84Å; N549-D553 PolarHBondContact O-N 2.8Å; N549-D553 VanDerWaalsContact O-N 3.07Å
550	V	92.2	Very high	90.1	Very high	81 Å²	81	106.6 Å²	106.6	49%	0.491	54%	0.537	S	S	.	.	H	α-helix	trans	-65.7	-41.7	176.2	174.8	0	0	0	0	111.3	S546 K547 E548 H552 D553 Q554	S546-V550 WeakPolarHBondContact O-CG2 2.97Å; S546-V550 PolarHBondContact O-N 2.99Å; K547-V550 PolarHBondContact O-N 3.43Å; E548-V550 VanDerWaalsContact C-N 3.34Å; E548-V550 PolarHBondContact O-N 2.85Å; V550-H552 VanDerWaalsContact C-N 3.31Å; V550-H552 PolarHBondContact O-N 2.82Å; V550-D553 PolarHBondContact O-N 3.5Å; V550-Q554 WeakPolarHBondContact O-CG 3.31Å; V550-Q554 PolarHBondContact O-N 3.24Å
551	L	89.2	Confident	90.2	Very high	112 Å²	112	106.8 Å²	106.8	59%	0.586	54%	0.537	S	S	*	.	H	α-helix	trans	-63.3	-38.9	175.8	-75.1	171.7	0	0	0	111.7	K547 E548 Q554 R555	K547-L551 WeakPolarHBondContact O-CG 3.16Å; K547-L551 PolarHBondContact O-N 3.19Å; E548-L551 PolarHBondContact O-N 2.71Å; L551-Q554 PolarHBondContact O-N 2.87Å; L551-R555 WeakPolarHBondContact O-CB 3.37Å; L551-R555 PolarHBondContact O-N 2.84Å
552	H	90.6	Very high	90.2	Very high	143 Å²	143	104.3 Å²	104.3	66%	0.662	53%	0.529	S	S	*	.	H	α-helix	trans	-63.1	-46.5	176.7	-167.1	80.9	0	0	0	112	E548 N549 V550 R555 S556	E548-H552 PolarHBondContact O-N 2.96Å; N549-H552 PolarHBondContact O-N 2.84Å; V550-H552 VanDerWaalsContact C-N 3.31Å; V550-H552 PolarHBondContact O-N 2.82Å; H552-R555 PolarHBondContact O-N 3.16Å; H552-S556 PolarHBondContact O-N 3Å
553	D	91	Very high	90.4	Very high	76 Å²	76	107.4 Å²	107.4	41%	0.406	53%	0.531	S	S	.	.	H	α-helix	trans	-62.1	-43.2	175.9	178.4	60.7	0	0	0	112.1	N549 V550 R555 S556 K557	N549-D553 PolarHBondContact O-N 2.8Å; N549-D553 VanDerWaalsContact O-N 3.07Å; V550-D553 PolarHBondContact O-N 3.5Å; D553-R555 VanDerWaalsContact C-N 3.3Å; D553-R555 PolarHBondContact O-N 3.3Å; D553-S556 PolarHBondContact O-N 3.2Å; D553-K557 WeakPolarHBondContact O-CG 3.5Å; D553-K557 PolarHBondContact O-N 2.96Å; D553-K557 IonicContact OD1-NZ 3.71Å; D553-K557 VanDerWaalsContact OD2-CE 3.32Å; D553-K557 WeakPolarHBondContact OD2-CE 3.42Å; D553-K557 IonicContact OD2-NZ 3.35Å; D553-K557 PolarHBondContact OD2-NZ 2.98Å
554	Q	90.4	Very high	90.6	Very high	103 Å²	103	106.5 Å²	106.5	48%	0.481	53%	0.532	S	S	.	.	H	α-helix	trans	-61.4	-38.6	174.7	-74.8	-177.8	-7.4	0	0	112.2	V550 L551 K557 L558	V550-Q554 WeakPolarHBondContact O-CG 3.31Å; V550-Q554 PolarHBondContact O-N 3.24Å; L551-Q554 PolarHBondContact O-N 2.87Å; Q554-K557 PolarHBondContact O-N 3.42Å; Q554-L558 PolarHBondContact O-N 3.48Å
555	R	89.3	Confident	90.6	Very high	202 Å²	202	103 Å²	103	76%	0.762	52%	0.52	S	S	*	.	H	α-helix	trans	-68.3	-37.8	178.7	-160.6	164.4	-157.5	-173.2	3.3	112.2	L551 H552 D553 L558 G559	L551-R555 WeakPolarHBondContact O-CB 3.37Å; L551-R555 PolarHBondContact O-N 2.84Å; H552-R555 PolarHBondContact O-N 3.16Å; D553-R555 VanDerWaalsContact C-N 3.3Å; D553-R555 PolarHBondContact O-N 3.3Å; R555-L558 PolarHBondContact O-N 3.31Å; R555-G559 PolarHBondContact O-N 3.4Å
556	S	90.5	Very high	90.9	Very high	68 Å²	68	102.6 Å²	102.6	48%	0.476	52%	0.519	S	S	.	.	H	α-helix	trans	-61.6	-48.1	173	-169.2	0	0	0	0	111.5	H552 D553 L558 G559 E560	H552-S556 PolarHBondContact O-N 3Å; D553-S556 PolarHBondContact O-N 3.2Å; S556-L558 VanDerWaalsContact C-N 3.31Å; S556-L558 PolarHBondContact O-N 3.19Å; S556-G559 PolarHBondContact O-N 3.17Å; S556-G559 VanDerWaalsContact O-N 3.11Å; S556-E560 PolarHBondContact O-N 2.99Å; S556-E560 VanDerWaalsContact O-N 3.11Å
557	K	92.4	Very high	90.9	Very high	111 Å²	111	104.9 Å²	104.9	48%	0.483	53%	0.527	S	S	.	.	H	α-helix	trans	-61.7	-35.6	176.3	-72.5	170.2	179.2	164.2	0	113.1	D553 Q554 K561	D553-K557 WeakPolarHBondContact O-CG 3.5Å; D553-K557 PolarHBondContact O-N 2.96Å; D553-K557 IonicContact OD1-NZ 3.71Å; D553-K557 VanDerWaalsContact OD2-CE 3.32Å; D553-K557 WeakPolarHBondContact OD2-CE 3.42Å; D553-K557 IonicContact OD2-NZ 3.35Å; D553-K557 PolarHBondContact OD2-NZ 2.98Å; Q554-K557 PolarHBondContact O-N 3.42Å; K557-K561 PolarHBondContact O-N 3.02Å
558	L	89.3	Confident	91	Very high	107 Å²	107	103.9 Å²	103.9	56%	0.56	52%	0.524	S	S	*	.	H	α-helix	trans	-64.7	-44.5	173.6	-115.2	119.8	0	0	0	111.2	Q554 R555 S556 E560 K561 D562	Q554-L558 PolarHBondContact O-N 3.48Å; R555-L558 PolarHBondContact O-N 3.31Å; S556-L558 VanDerWaalsContact C-N 3.31Å; S556-L558 PolarHBondContact O-N 3.19Å; L558-E560 VanDerWaalsContact C-N 3.31Å; L558-E560 PolarHBondContact O-N 2.89Å; L558-K561 PolarHBondContact O-N 3.07Å; L558-K561 VanDerWaalsContact O-N 3.13Å; L558-D562 PolarHBondContact O-N 3.31Å
559	G	90.9	Very high	91	Very high	29 Å²	29	105.4 Å²	105.4	30%	0.299	53%	0.525	S	S	.	.	H	α-helix	trans	-60.7	-36.6	177.5	0	0	0	0	0	113.6	R555 S556 D562 K563	R555-G559 PolarHBondContact O-N 3.4Å; S556-G559 PolarHBondContact O-N 3.17Å; S556-G559 VanDerWaalsContact O-N 3.11Å; G559-D562 PolarHBondContact O-N 3.32Å; G559-K563 WeakPolarHBondContact O-CG 3.35Å; G559-K563 PolarHBondContact O-N 3.35Å; G559-K563 VanDerWaalsContact O-N 3.14Å
560	E	91.8	Very high	91.1	Very high	123 Å²	123	104.3 Å²	104.3	58%	0.575	52%	0.522	S	S	*	.	H	α-helix	trans	-65.2	-43.9	172.9	-70.6	-176.9	168.3	0	0	112.3	S556 L558 D562 K563 V564	S556-E560 PolarHBondContact O-N 2.99Å; S556-E560 VanDerWaalsContact O-N 3.11Å; L558-E560 VanDerWaalsContact C-N 3.31Å; L558-E560 PolarHBondContact O-N 2.89Å; E560-D562 VanDerWaalsContact C-N 3.32Å; E560-D562 PolarHBondContact O-N 2.99Å; E560-K563 PolarHBondContact O-N 3.23Å; E560-V564 WeakPolarHBondContact O-CG2 3.16Å; E560-V564 PolarHBondContact O-N 3.36Å; E560-V564 VanDerWaalsContact O-N 3.12Å
561	K	91.6	Very high	91.1	Very high	146 Å²	146	104.5 Å²	104.5	64%	0.635	52%	0.518	S	S	*	.	H	α-helix	trans	-63.3	-38.7	175.9	-72.7	-178.6	178.8	172.3	0	111.9	K557 L558 K563 V564 I565	K557-K561 PolarHBondContact O-N 3.02Å; L558-K561 PolarHBondContact O-N 3.07Å; L558-K561 VanDerWaalsContact O-N 3.13Å; K561-K563 VanDerWaalsContact C-N 3.34Å; K561-K563 PolarHBondContact O-N 2.93Å; K561-V564 PolarHBondContact O-N 2.97Å; K561-I565 VanDerWaalsContact O-CG1 3.28Å; K561-I565 WeakPolarHBondContact O-CG1 3.33Å; K561-I565 PolarHBondContact O-N 2.88Å
562	D	89.4	Confident	91	Very high	89 Å²	89	103 Å²	103	48%	0.476	51%	0.51	S	S	.	.	H	α-helix	trans	-63.5	-38.7	176.6	-73.3	-29.6	0	0	0	112.1	L558 G559 E560 I565 A566	L558-D562 PolarHBondContact O-N 3.31Å; G559-D562 PolarHBondContact O-N 3.32Å; E560-D562 VanDerWaalsContact C-N 3.32Å; E560-D562 PolarHBondContact O-N 2.99Å; D562-I565 PolarHBondContact O-N 2.71Å; D562-A566 WeakPolarHBondContact O-CB 3.49Å; D562-A566 PolarHBondContact O-N 3.05Å
563	K	92.6	Very high	91	Very high	150 Å²	150	99.9 Å²	99.9	65%	0.652	50%	0.495	S	S	*	.	H	α-helix	trans	-62.7	-42.8	172.9	-71.2	174.5	-176.1	177.6	0	112	G559 E560 K561 A566 N567	G559-K563 WeakPolarHBondContact O-CG 3.35Å; G559-K563 PolarHBondContact O-N 3.35Å; G559-K563 VanDerWaalsContact O-N 3.14Å; E560-K563 PolarHBondContact O-N 3.23Å; K561-K563 VanDerWaalsContact C-N 3.34Å; K561-K563 PolarHBondContact O-N 2.93Å; K563-A566 PolarHBondContact O-N 3.34Å; K563-N567 PolarHBondContact O-N 3.16Å
564	V	93.7	Very high	91	Very high	79 Å²	79	100.9 Å²	100.9	48%	0.479	49%	0.494	S	S	.	.	H	α-helix	trans	-63.5	-43.7	176.2	175.1	0	0	0	0	110.9	E560 K561 A566 N567 Q568	E560-V564 WeakPolarHBondContact O-CG2 3.16Å; E560-V564 PolarHBondContact O-N 3.36Å; E560-V564 VanDerWaalsContact O-N 3.12Å; K561-V564 PolarHBondContact O-N 2.97Å; V564-A566 VanDerWaalsContact C-N 3.33Å; V564-A566 PolarHBondContact O-N 2.93Å; V564-N567 PolarHBondContact O-N 3.32Å; V564-Q568 HydrophobicContact CG1-CG 4.49Å; V564-Q568 WeakPolarHBondContact O-CG 3.02Å; V564-Q568 PolarHBondContact O-N 2.72Å
565	I	90.5	Very high	91	Very high	69 Å²	69	100.3 Å²	100.3	35%	0.354	49%	0.493	S	S	.	.	H	α-helix	trans	-62	-41.8	176.7	-69.8	166.1	0	0	0	110.8	K561 D562 Q568 R569	K561-I565 VanDerWaalsContact O-CG1 3.28Å; K561-I565 WeakPolarHBondContact O-CG1 3.33Å; K561-I565 PolarHBondContact O-N 2.88Å; D562-I565 PolarHBondContact O-N 2.71Å; I565-Q568 PolarHBondContact O-N 2.91Å; I565-R569 HydrophobicContact CG2-CG 4.44Å; I565-R569 WeakPolarHBondContact O-CB 3.45Å; I565-R569 VanDerWaalsContact O-CG 3.29Å; I565-R569 WeakPolarHBondContact O-CG 3.45Å; I565-R569 PolarHBondContact O-N 3.3Å
566	A	91.6	Very high	90.9	Very high	48 Å²	48	94 Å²	94	40%	0.397	47%	0.472	S	S	.	.	H	α-helix	trans	-60.9	-46.1	176.9	0	0	0	0	0	111.7	D562 K563 V564 Q568 R569 T570	D562-A566 WeakPolarHBondContact O-CB 3.49Å; D562-A566 PolarHBondContact O-N 3.05Å; K563-A566 PolarHBondContact O-N 3.34Å; V564-A566 VanDerWaalsContact C-N 3.33Å; V564-A566 PolarHBondContact O-N 2.93Å; A566-Q568 PolarHBondContact O-N 2.77Å; A566-R569 WeakPolarHBondContact O-CB 3.4Å; A566-R569 PolarHBondContact O-N 3.28Å; A566-T570 PolarHBondContact O-N 3.32Å; A566-T570 VanDerWaalsContact O-N 3.11Å
567	N	92.1	Very high	90.9	Very high	114 Å²	114	96.7 Å²	96.7	61%	0.61	48%	0.476	S	S	*	.	H	α-helix	trans	-64.9	-38.4	177.3	-70.7	-12.9	0	0	0	112.7	K563 V564 R569 T570 E571	K563-N567 PolarHBondContact O-N 3.16Å; V564-N567 PolarHBondContact O-N 3.32Å; N567-R569 VanDerWaalsContact C-N 3.34Å; N567-T570 PolarHBondContact O-OG1 3.27Å; N567-E571 PolarHBondContact O-N 3.08Å
568	Q	92.1	Very high	90.9	Very high	115 Å²	115	97.3 Å²	97.3	54%	0.537	48%	0.478	S	S	.	.	H	α-helix	trans	-67.5	-36.7	175.1	-73.1	177.3	-14.1	0	0	111.7	V564 I565 A566 E571 I572	V564-Q568 HydrophobicContact CG1-CG 4.49Å; V564-Q568 WeakPolarHBondContact O-CG 3.02Å; V564-Q568 PolarHBondContact O-N 2.72Å; I565-Q568 PolarHBondContact O-N 2.91Å; A566-Q568 PolarHBondContact O-N 2.77Å; Q568-E571 PolarHBondContact O-N 3.15Å; Q568-I572 WeakPolarHBondContact O-CB 3.18Å; Q568-I572 VanDerWaalsContact O-CG1 3.24Å; Q568-I572 WeakPolarHBondContact O-CG1 3.34Å; Q568-I572 PolarHBondContact O-N 3.1Å
569	R	90.7	Very high	90.8	Very high	142 Å²	142	94.9 Å²	94.9	54%	0.536	47%	0.47	S	S	.	.	H	α-helix	trans	-63.4	-42.8	176.5	-78.5	177.9	-179	-178.9	7.6	112.4	I565 A566 N567 E571 I572 E573	I565-R569 HydrophobicContact CG2-CG 4.44Å; I565-R569 WeakPolarHBondContact O-CB 3.45Å; I565-R569 VanDerWaalsContact O-CG 3.29Å; I565-R569 WeakPolarHBondContact O-CG 3.45Å; I565-R569 PolarHBondContact O-N 3.3Å; A566-R569 WeakPolarHBondContact O-CB 3.4Å; A566-R569 PolarHBondContact O-N 3.28Å; N567-R569 VanDerWaalsContact C-N 3.34Å; R569-E571 VanDerWaalsContact C-N 3.34Å; R569-I572 PolarHBondContact O-N 3.07Å; R569-E573 WeakPolarHBondContact O-CB 3.33Å; R569-E573 PolarHBondContact O-N 3.32Å
570	T	91.1	Very high	90.8	Very high	84 Å²	84	99.1 Å²	99.1	52%	0.515	48%	0.48	S	S	.	.	H	α-helix	trans	-65.5	-38.5	178.2	55.2	0	0	0	0	111.7	A566 N567 E573 R574	A566-T570 PolarHBondContact O-N 3.32Å; A566-T570 VanDerWaalsContact O-N 3.11Å; N567-T570 PolarHBondContact O-OG1 3.27Å; T570-E573 PolarHBondContact O-N 2.98Å; T570-R574 WeakPolarHBondContact O-CB 3.5Å; T570-R574 PolarHBondContact O-N 3.36Å
571	E	91.6	Very high	90.6	Very high	84 Å²	84	96.9 Å²	96.9	39%	0.393	48%	0.475	S	S	.	.	H	α-helix	trans	-68.6	-40.4	176	-176.6	59.4	-169.6	0	0	112.4	N567 Q568 R569 E573 R574 L575	N567-E571 PolarHBondContact O-N 3.08Å; Q568-E571 PolarHBondContact O-N 3.15Å; R569-E571 VanDerWaalsContact C-N 3.34Å; E571-E573 VanDerWaalsContact C-N 3.33Å; E571-E573 PolarHBondContact O-N 2.68Å; E571-R574 WeakPolarHBondContact O-CB 3.28Å; E571-R574 PolarHBondContact O-N 3.48Å; E571-R574 IonicContact OE1-CZ 2.67Å; E571-R574 IonicContact OE1-NE 2.77Å; E571-R574 PolarHBondContact OE1-NE 2.95Å; E571-R574 IonicContact OE1-NH2 3.25Å; E571-R574 PolarHBondContact OE1-NH2 3.45Å; E571-R574 IonicContact OE2-CZ 2.68Å; E571-R574 IonicContact OE2-NE 2.79Å; E571-R574 PolarHBondContact OE2-NE 3.19Å; E571-R574 IonicContact OE2-NH2 3.4Å; E571-L575 HydrophobicContact CG-CD1 4.4Å; E571-L575 WeakPolarHBondContact O-CG 3.42Å; E571-L575 PolarHBondContact O-N 3.02Å
572	I	88.4	Confident	90.5	Very high	82 Å²	82	94.9 Å²	94.9	42%	0.421	47%	0.471	S	S	.	.	H	α-helix	trans	-59.4	-45.8	172.8	-72.1	167	0	0	0	110.3	Q568 R569 R574 L575 E576	Q568-I572 WeakPolarHBondContact O-CB 3.18Å; Q568-I572 VanDerWaalsContact O-CG1 3.24Å; Q568-I572 WeakPolarHBondContact O-CG1 3.34Å; Q568-I572 PolarHBondContact O-N 3.1Å; R569-I572 PolarHBondContact O-N 3.07Å; I572-R574 VanDerWaalsContact C-N 3.32Å; I572-R574 PolarHBondContact O-N 3.47Å; I572-L575 PolarHBondContact O-N 3.33Å; I572-E576 HydrophobicContact CG2-CG 4.24Å; I572-E576 WeakPolarHBondContact CG2-OE1 3.22Å; I572-E576 WeakPolarHBondContact O-CB 3.17Å; I572-E576 VanDerWaalsContact O-CG 3.31Å; I572-E576 WeakPolarHBondContact O-CG 3.49Å; I572-E576 PolarHBondContact O-N 3.43Å
573	E	89.7	Confident	90.5	Very high	76 Å²	76	96 Å²	96	36%	0.355	47%	0.473	S	S	.	.	H	α-helix	trans	-61.3	-40.6	177.5	-172	-172.9	159.4	0	0	112.1	R569 T570 E571 L575 E576 K577	R569-E573 WeakPolarHBondContact O-CB 3.33Å; R569-E573 PolarHBondContact O-N 3.32Å; T570-E573 PolarHBondContact O-N 2.98Å; E571-E573 VanDerWaalsContact C-N 3.33Å; E571-E573 PolarHBondContact O-N 2.68Å; E573-L575 VanDerWaalsContact C-N 3.33Å; E573-L575 PolarHBondContact O-N 3.4Å; E573-E576 PolarHBondContact O-N 3.05Å; E573-K577 HydrophobicContact CG-CD 4.46Å; E573-K577 WeakPolarHBondContact O-CG 3.33Å; E573-K577 PolarHBondContact O-N 2.87Å; E573-K577 WeakPolarHBondContact OE1-CE 3.48Å; E573-K577 IonicContact OE1-NZ 3.35Å; E573-K577 PolarHBondContact OE1-NZ 3.31Å
574	R	92.1	Very high	90.3	Very high	98 Å²	98	96.1 Å²	96.1	37%	0.37	47%	0.471	S	S	.	.	H	α-helix	trans	-62.2	-40.3	175.8	-164.9	-164.7	63.9	65.8	-8.7	111.9	T570 E571 I572 K578	T570-R574 WeakPolarHBondContact O-CB 3.5Å; T570-R574 PolarHBondContact O-N 3.36Å; E571-R574 WeakPolarHBondContact O-CB 3.28Å; E571-R574 PolarHBondContact O-N 3.48Å; E571-R574 IonicContact OE1-CZ 2.67Å; E571-R574 IonicContact OE1-NE 2.77Å; E571-R574 PolarHBondContact OE1-NE 2.95Å; E571-R574 IonicContact OE1-NH2 3.25Å; E571-R574 PolarHBondContact OE1-NH2 3.45Å; E571-R574 IonicContact OE2-CZ 2.68Å; E571-R574 IonicContact OE2-NE 2.79Å; E571-R574 PolarHBondContact OE2-NE 3.19Å; E571-R574 IonicContact OE2-NH2 3.4Å; I572-R574 VanDerWaalsContact C-N 3.32Å; I572-R574 PolarHBondContact O-N 3.47Å; R574-K578 PolarHBondContact O-N 3.12Å
575	L	88.8	Confident	90.2	Very high	90 Å²	90	98.1 Å²	98.1	47%	0.471	47%	0.473	S	S	.	.	H	α-helix	trans	-72.4	-40.6	178.1	-71.9	172.3	0	0	0	112	E571 I572 E573 K577 K578 S579	E571-L575 HydrophobicContact CG-CD1 4.4Å; E571-L575 WeakPolarHBondContact O-CG 3.42Å; E571-L575 PolarHBondContact O-N 3.02Å; I572-L575 PolarHBondContact O-N 3.33Å; E573-L575 VanDerWaalsContact C-N 3.33Å; E573-L575 PolarHBondContact O-N 3.4Å; L575-K577 PolarHBondContact O-N 3.05Å; L575-K578 WeakPolarHBondContact O-CB 3.37Å; L575-K578 PolarHBondContact O-N 3.47Å; L575-K578 VanDerWaalsContact O-N 3.17Å; L575-S579 PolarHBondContact O-N 2.7Å
576	E	88.4	Confident	90.3	Very high	70 Å²	70	99.2 Å²	99.2	33%	0.327	48%	0.478	S	S	.	.	H	α-helix	trans	-61.5	-42	175.2	-75	171.3	171.7	0	0	111.9	R189 I572 E573 K578 S579 K580	R189-E576 IonicContact CZ-OE1 2.77Å; R189-E576 IonicContact CZ-OE2 3.29Å; R189-E576 IonicContact NE-OE2 2.87Å; R189-E576 IonicContact NH1-OE2 2.71Å; R189-E576 PolarHBondContact NH1-OE2 2.93Å; R189-E576 IonicContact NH2-OE1 2.72Å; R189-E576 IonicContact NH2-OE2 3.09Å; R189-E576 PolarHBondContact NH2-OE2 3.21Å; R189-E576 VanDerWaalsContact NH2-OE2 3.15Å; I572-E576 HydrophobicContact CG2-CG 4.24Å; I572-E576 WeakPolarHBondContact CG2-OE1 3.22Å; I572-E576 WeakPolarHBondContact O-CB 3.17Å; I572-E576 VanDerWaalsContact O-CG 3.31Å; I572-E576 WeakPolarHBondContact O-CG 3.49Å; I572-E576 PolarHBondContact O-N 3.43Å; E573-E576 PolarHBondContact O-N 3.05Å; E576-K578 VanDerWaalsContact C-N 3.3Å; E576-K578 PolarHBondContact O-N 3.21Å; E576-S579 PolarHBondContact O-N 2.98Å; E576-K580 WeakPolarHBondContact O-CG 3.46Å; E576-K580 PolarHBondContact O-N 2.96Å
577	K	90.9	Very high	90.2	Very high	125 Å²	125	99.8 Å²	99.8	54%	0.543	48%	0.475	S	S	.	.	H	α-helix	trans	-58.3	-42	173.8	-78.2	170.8	170.6	163.4	0	111.7	E573 L575 T581	E573-K577 HydrophobicContact CG-CD 4.46Å; E573-K577 WeakPolarHBondContact O-CG 3.33Å; E573-K577 PolarHBondContact O-N 2.87Å; E573-K577 WeakPolarHBondContact OE1-CE 3.48Å; E573-K577 IonicContact OE1-NZ 3.35Å; E573-K577 PolarHBondContact OE1-NZ 3.31Å; L575-K577 PolarHBondContact O-N 3.05Å; K577-T581 PolarHBondContact O-N 2.97Å; K577-T581 PolarHBondContact O-OG1 2.77Å
578	K	91.5	Very high	90.1	Very high	124 Å²	124	97.7 Å²	97.7	54%	0.539	46%	0.463	S	S	.	.	H	α-helix	trans	-66.3	-42	174.7	-75.2	-175.1	175.9	177.1	0	112.2	R574 L575 E576 T581 L582	R574-K578 PolarHBondContact O-N 3.12Å; L575-K578 WeakPolarHBondContact O-CB 3.37Å; L575-K578 PolarHBondContact O-N 3.47Å; L575-K578 VanDerWaalsContact O-N 3.17Å; E576-K578 VanDerWaalsContact C-N 3.3Å; E576-K578 PolarHBondContact O-N 3.21Å; K578-T581 PolarHBondContact O-N 3Å; K578-L582 WeakPolarHBondContact O-CG 3.41Å; K578-L582 PolarHBondContact O-N 3.48Å; K578-L582 VanDerWaalsContact O-N 3.07Å
579	S	88.3	Confident	90	Very high	55 Å²	55	97.7 Å²	97.7	39%	0.385	47%	0.466	S	S	.	.	H	α-helix	trans	-59	-50.1	177.2	-161.8	0	0	0	0	111.5	L575 E576 T581 L582 E583	L575-S579 PolarHBondContact O-N 2.7Å; E576-S579 PolarHBondContact O-N 2.98Å; S579-T581 VanDerWaalsContact C-N 3.29Å; S579-T581 PolarHBondContact O-N 3Å; S579-L582 PolarHBondContact O-N 3Å; S579-E583 WeakPolarHBondContact O-CG 3.43Å; S579-E583 PolarHBondContact O-N 2.73Å; S579-E583 PolarHBondContact OG-OE1 3.13Å
580	K	90.2	Very high	90	Very high	118 Å²	118	96.2 Å²	96.2	51%	0.513	47%	0.465	S	S	.	.	H	α-helix	trans	-58.4	-40.4	178.1	-71.2	-177.3	178.7	-171.6	0	112.8	E576 L582 E583 Y584	E576-K580 WeakPolarHBondContact O-CG 3.46Å; E576-K580 PolarHBondContact O-N 2.96Å; K580-L582 VanDerWaalsContact C-N 3.32Å; K580-L582 PolarHBondContact O-N 3.24Å; K580-E583 PolarHBondContact O-N 2.96Å; K580-Y584 WeakPolarHBondContact O-CB 3.49Å; K580-Y584 PolarHBondContact O-N 3.45Å
581	T	88.3	Confident	89.9	Confident	77 Å²	77	97.9 Å²	97.9	47%	0.472	47%	0.465	S	S	.	.	H	α-helix	trans	-64.8	-38.8	177.6	-53.4	0	0	0	0	111.5	K577 K578 S579 K585	K577-T581 PolarHBondContact O-N 2.97Å; K577-T581 PolarHBondContact O-OG1 2.77Å; K578-T581 PolarHBondContact O-N 3Å; S579-T581 VanDerWaalsContact C-N 3.29Å; S579-T581 PolarHBondContact O-N 3Å; T581-K585 WeakPolarHBondContact O-CG 3.46Å; T581-K585 PolarHBondContact O-N 3.08Å; T581-K585 VanDerWaalsContact O-N 3.16Å
582	L	89.3	Confident	89.9	Confident	103 Å²	103	96.1 Å²	96.1	54%	0.539	46%	0.46	S	S	.	.	H	α-helix	trans	-71.2	-40.6	177	-70.5	172	0	0	0	111.9	K578 S579 K580 Y584 K585 I586	K578-L582 WeakPolarHBondContact O-CG 3.41Å; K578-L582 PolarHBondContact O-N 3.48Å; K578-L582 VanDerWaalsContact O-N 3.07Å; S579-L582 PolarHBondContact O-N 3Å; K580-L582 VanDerWaalsContact C-N 3.32Å; K580-L582 PolarHBondContact O-N 3.24Å; L582-Y584 VanDerWaalsContact C-N 3.34Å; L582-Y584 PolarHBondContact O-N 2.8Å; L582-K585 PolarHBondContact O-N 3.38Å; L582-I586 WeakPolarHBondContact O-CG1 3.33Å; L582-I586 PolarHBondContact O-N 3.44Å
583	E	88.9	Confident	90.1	Very high	112 Å²	112	95.8 Å²	95.8	52%	0.523	46%	0.462	S	S	.	.	H	α-helix	trans	-59.3	-44.1	174.2	-75	163.3	-152.6	0	0	111.6	S579 K580 K585 I586 D587	S579-E583 WeakPolarHBondContact O-CG 3.43Å; S579-E583 PolarHBondContact O-N 2.73Å; S579-E583 PolarHBondContact OG-OE1 3.13Å; K580-E583 PolarHBondContact O-N 2.96Å; E583-K585 PolarHBondContact O-N 3.13Å; E583-I586 PolarHBondContact O-N 3.14Å; E583-D587 PolarHBondContact O-N 3.37Å
584	Y	88.4	Confident	90.2	Very high	154 Å²	154	97.7 Å²	97.7	60%	0.604	47%	0.471	S	S	*	.	H	α-helix	trans	-61.9	-41.5	175.2	-178.1	-109.6	0	0	0	112.6	K580 L582 I586 D587 I588	K580-Y584 WeakPolarHBondContact O-CB 3.49Å; K580-Y584 PolarHBondContact O-N 3.45Å; L582-Y584 VanDerWaalsContact C-N 3.34Å; L582-Y584 PolarHBondContact O-N 2.8Å; Y584-I586 VanDerWaalsContact C-N 3.32Å; Y584-I586 PolarHBondContact O-N 2.69Å; Y584-D587 PolarHBondContact O-N 2.91Å; Y584-I588 HydrophobicContact CD1-CD1 3.71Å; Y584-I588 HydrophobicContact CE1-CD1 3.2Å; Y584-I588 HydrophobicContact CE1-CG1 4.25Å; Y584-I588 HydrophobicContact CE2-CD1 4.18Å; Y584-I588 HydrophobicContact CE2-CG1 4.43Å; Y584-I588 HydrophobicContact CG-CD1 4.39Å; Y584-I588 VanDerWaalsContact CZ-CD1 3.46Å; Y584-I588 WeakPolarHBondContact O-CG1 3.35Å; Y584-I588 PolarHBondContact O-N 3.34Å
585	K	92.2	Very high	90.2	Very high	121 Å²	121	97.7 Å²	97.7	53%	0.526	48%	0.476	S	S	.	.	H	α-helix	trans	-62.9	-39.5	174.5	-74.9	179.2	179.3	-173.8	0	111.9	T581 L582 E583 L589	T581-K585 WeakPolarHBondContact O-CG 3.46Å; T581-K585 PolarHBondContact O-N 3.08Å; T581-K585 VanDerWaalsContact O-N 3.16Å; L582-K585 PolarHBondContact O-N 3.38Å; E583-K585 PolarHBondContact O-N 3.13Å; K585-L589 WeakPolarHBondContact O-CB 3.34Å; K585-L589 VanDerWaalsContact O-CG 3.24Å; K585-L589 WeakPolarHBondContact O-CG 3.46Å; K585-L589 PolarHBondContact O-N 3.24Å
586	I	90.8	Very high	90.3	Very high	92 Å²	92	100.6 Å²	100.6	47%	0.472	48%	0.482	S	S	.	.	H	α-helix	trans	-64.1	-45	176.8	-69.9	166.7	0	0	0	110.5	L582 E583 Y584 I588 L589 Q590	L582-I586 WeakPolarHBondContact O-CG1 3.33Å; L582-I586 PolarHBondContact O-N 3.44Å; E583-I586 PolarHBondContact O-N 3.14Å; Y584-I586 VanDerWaalsContact C-N 3.32Å; Y584-I586 PolarHBondContact O-N 2.69Å; I586-I588 PolarHBondContact O-N 2.86Å; I586-L589 PolarHBondContact O-N 2.99Å; I586-Q590 HydrophobicContact CG2-CG 4.32Å; I586-Q590 WeakPolarHBondContact O-CB 3.34Å; I586-Q590 WeakPolarHBondContact O-CG 3.43Å; I586-Q590 PolarHBondContact O-N 3.35Å
587	D	89.6	Confident	90.6	Very high	60 Å²	60	101.9 Å²	101.9	32%	0.321	49%	0.488	S	S	.	.	H	α-helix	trans	-62	-43.2	178.6	179.4	63.6	0	0	0	112.3	E583 Y584 L589 Q590 K591	E583-D587 PolarHBondContact O-N 3.37Å; Y584-D587 PolarHBondContact O-N 2.91Å; D587-L589 PolarHBondContact O-N 3.38Å; D587-Q590 PolarHBondContact O-N 3.37Å; D587-K591 WeakPolarHBondContact O-CG 3.24Å; D587-K591 PolarHBondContact O-N 3.44Å; D587-K591 WeakPolarHBondContact OD1-CE 3.43Å; D587-K591 IonicContact OD1-NZ 3.5Å; D587-K591 PolarHBondContact OD1-NZ 3.02Å; D587-K591 WeakPolarHBondContact OD2-CE 3.37Å; D587-K591 IonicContact OD2-NZ 3.99Å; D587-K591 PolarHBondContact OD2-NZ 3.34Å
588	I	90.5	Very high	90.6	Very high	70 Å²	70	101.9 Å²	101.9	36%	0.359	49%	0.49	S	S	.	.	H	α-helix	trans	-60.9	-47.2	174.2	-68.5	167	0	0	0	110.7	Y584 I586 Q590 K591 T592	Y584-I588 HydrophobicContact CD1-CD1 3.71Å; Y584-I588 HydrophobicContact CE1-CD1 3.2Å; Y584-I588 HydrophobicContact CE1-CG1 4.25Å; Y584-I588 HydrophobicContact CE2-CD1 4.18Å; Y584-I588 HydrophobicContact CE2-CG1 4.43Å; Y584-I588 HydrophobicContact CG-CD1 4.39Å; Y584-I588 VanDerWaalsContact CZ-CD1 3.46Å; Y584-I588 WeakPolarHBondContact O-CG1 3.35Å; Y584-I588 PolarHBondContact O-N 3.34Å; I586-I588 PolarHBondContact O-N 2.86Å; I588-Q590 VanDerWaalsContact C-N 3.31Å; I588-Q590 PolarHBondContact O-N 3.49Å; I588-K591 PolarHBondContact O-N 3.49Å; I588-T592 WeakPolarHBondContact O-CB 3.39Å; I588-T592 PolarHBondContact O-N 2.94Å; I588-T592 PolarHBondContact O-OG1 3.27Å
589	L	89.6	Confident	90.6	Very high	114 Å²	114	100 Å²	100	60%	0.597	49%	0.486	S	S	*	.	H	α-helix	trans	-63.9	-37.8	-179.1	-73.4	171.5	0	0	0	111.8	K585 I586 D587 T593	K585-L589 WeakPolarHBondContact O-CB 3.34Å; K585-L589 VanDerWaalsContact O-CG 3.24Å; K585-L589 WeakPolarHBondContact O-CG 3.46Å; K585-L589 PolarHBondContact O-N 3.24Å; I586-L589 PolarHBondContact O-N 2.99Å; D587-L589 PolarHBondContact O-N 3.38Å; L589-T593 WeakPolarHBondContact O-CB 3.45Å; L589-T593 PolarHBondContact O-N 3.06Å; L589-T593 PolarHBondContact O-OG1 3.04Å
590	Q	90.9	Very high	90.8	Very high	111 Å²	111	103.7 Å²	103.7	52%	0.519	50%	0.495	S	S	.	.	H	α-helix	trans	-63.4	-51.2	174.9	-77.1	175.1	-17.7	0	0	111.4	I586 D587 I588 T592 T593 E594	I586-Q590 HydrophobicContact CG2-CG 4.32Å; I586-Q590 WeakPolarHBondContact O-CB 3.34Å; I586-Q590 WeakPolarHBondContact O-CG 3.43Å; I586-Q590 PolarHBondContact O-N 3.35Å; D587-Q590 PolarHBondContact O-N 3.37Å; I588-Q590 VanDerWaalsContact C-N 3.31Å; I588-Q590 PolarHBondContact O-N 3.49Å; Q590-T592 VanDerWaalsContact C-N 3.3Å; Q590-T592 PolarHBondContact O-N 3.11Å; Q590-T593 WeakPolarHBondContact O-CB 3.38Å; Q590-T593 PolarHBondContact O-N 3.33Å; Q590-T593 VanDerWaalsContact O-N 3.12Å; Q590-E594 WeakPolarHBondContact O-CG 3.15Å; Q590-E594 PolarHBondContact O-N 3.45Å
591	K	89.9	Confident	90.9	Very high	119 Å²	119	104.9 Å²	104.9	52%	0.517	50%	0.496	S	S	.	.	H	α-helix	trans	-59.7	-40.7	177.3	-73.5	170.7	179.2	162.1	0	112.8	D587 I588 T593 E594 M595	D587-K591 WeakPolarHBondContact O-CG 3.24Å; D587-K591 PolarHBondContact O-N 3.44Å; D587-K591 WeakPolarHBondContact OD1-CE 3.43Å; D587-K591 IonicContact OD1-NZ 3.5Å; D587-K591 PolarHBondContact OD1-NZ 3.02Å; D587-K591 WeakPolarHBondContact OD2-CE 3.37Å; D587-K591 IonicContact OD2-NZ 3.99Å; D587-K591 PolarHBondContact OD2-NZ 3.34Å; I588-K591 PolarHBondContact O-N 3.49Å; K591-T593 VanDerWaalsContact C-N 3.33Å; K591-E594 PolarHBondContact O-N 3.02Å; K591-M595 PolarHBondContact O-N 3.41Å
592	T	90.5	Very high	91.1	Very high	48 Å²	48	104.6 Å²	104.6	29%	0.294	50%	0.497	S	S	.	.	H	α-helix	trans	-65.8	-39.5	177.8	-51.6	0	0	0	0	110.8	I588 Q590 M595 Y596	I588-T592 WeakPolarHBondContact O-CB 3.39Å; I588-T592 PolarHBondContact O-N 2.94Å; I588-T592 PolarHBondContact O-OG1 3.27Å; Q590-T592 VanDerWaalsContact C-N 3.3Å; Q590-T592 PolarHBondContact O-N 3.11Å; T592-M595 PolarHBondContact O-N 2.9Å; T592-Y596 HydrophobicContact CG2-CD2 3.88Å; T592-Y596 HydrophobicContact CG2-CE2 3.47Å; T592-Y596 VanDerWaalsContact CG2-CE2 3.47Å; T592-Y596 WeakPolarHBondContact O-CD2 3.48Å; T592-Y596 PolarHBondContact O-N 2.71Å
593	T	92.3	Very high	91.3	Very high	75 Å²	75	105 Å²	105	46%	0.46	50%	0.499	S	S	.	.	H	α-helix	trans	-65.5	-44.6	175.9	-56.4	0	0	0	0	111.4	L589 Q590 K591 M595 Y596 E597	L589-T593 WeakPolarHBondContact O-CB 3.45Å; L589-T593 PolarHBondContact O-N 3.06Å; L589-T593 PolarHBondContact O-OG1 3.04Å; Q590-T593 WeakPolarHBondContact O-CB 3.38Å; Q590-T593 PolarHBondContact O-N 3.33Å; Q590-T593 VanDerWaalsContact O-N 3.12Å; K591-T593 VanDerWaalsContact C-N 3.33Å; T593-M595 VanDerWaalsContact C-N 3.32Å; T593-M595 PolarHBondContact O-N 3.12Å; T593-Y596 PolarHBondContact O-N 2.92Å; T593-E597 WeakPolarHBondContact O-CG 3.49Å; T593-E597 PolarHBondContact O-N 3.14Å
594	E	92.3	Very high	91.4	Very high	116 Å²	116	104.3 Å²	104.3	54%	0.542	50%	0.496	S	S	.	.	H	α-helix	trans	-60.4	-40.8	176.5	-73.4	176.5	-177.4	0	0	112.3	Q590 K591 E597 Q598	Q590-E594 WeakPolarHBondContact O-CG 3.15Å; Q590-E594 PolarHBondContact O-N 3.45Å; K591-E594 PolarHBondContact O-N 3.02Å; E594-E597 PolarHBondContact O-N 3.42Å; E594-Q598 WeakPolarHBondContact O-CG 3.41Å; E594-Q598 PolarHBondContact O-N 2.89Å
595	M	92.3	Very high	91.6	Very high	97 Å²	97	103.4 Å²	103.4	48%	0.478	50%	0.498	S	S	.	.	H	α-helix	trans	-62.3	-48.9	175.1	-173.4	179.2	69.2	0	0	111.2	K591 T592 T593 E597 Q598 D599	K591-M595 PolarHBondContact O-N 3.41Å; T592-M595 PolarHBondContact O-N 2.9Å; T593-M595 VanDerWaalsContact C-N 3.32Å; T593-M595 PolarHBondContact O-N 3.12Å; M595-E597 VanDerWaalsContact C-N 3.28Å; M595-E597 PolarHBondContact O-N 2.95Å; M595-Q598 PolarHBondContact O-N 3.13Å; M595-Q598 VanDerWaalsContact O-N 3.13Å; M595-D599 PolarHBondContact O-N 2.96Å
596	Y	91.1	Very high	91.6	Very high	152 Å²	152	101.9 Å²	101.9	60%	0.596	49%	0.492	S	S	*	.	H	α-helix	trans	-62.2	-34	176.2	-75	-51.1	0	0	0	113	T592 T593 K600	T592-Y596 HydrophobicContact CG2-CD2 3.88Å; T592-Y596 HydrophobicContact CG2-CE2 3.47Å; T592-Y596 VanDerWaalsContact CG2-CE2 3.47Å; T592-Y596 WeakPolarHBondContact O-CD2 3.48Å; T592-Y596 PolarHBondContact O-N 2.71Å; T593-Y596 PolarHBondContact O-N 2.92Å; Y596-K600 VanDerWaalsContact O-CB 3.28Å; Y596-K600 WeakPolarHBondContact O-CB 3.37Å; Y596-K600 PolarHBondContact O-N 2.89Å
597	E	93.8	Very high	91.7	Very high	96 Å²	96	103 Å²	103	45%	0.449	50%	0.498	S	S	.	.	H	α-helix	trans	-68.7	-35.8	174	-78.2	-168.6	177.3	0	0	113.2	T593 E594 M595 R601	T593-E597 WeakPolarHBondContact O-CG 3.49Å; T593-E597 PolarHBondContact O-N 3.14Å; E594-E597 PolarHBondContact O-N 3.42Å; M595-E597 VanDerWaalsContact C-N 3.28Å; M595-E597 PolarHBondContact O-N 2.95Å; E597-R601 WeakPolarHBondContact O-CG 3.42Å; E597-R601 PolarHBondContact O-N 3.43Å; E597-R601 VanDerWaalsContact O-N 3.13Å; E597-R601 PolarHBondContact O-NE 2.86Å; E597-R601 IonicContact OE2-NH2 2.79Å; E597-R601 PolarHBondContact OE2-NH2 3.22Å
598	Q	92.1	Very high	91.9	Very high	126 Å²	126	105.6 Å²	105.6	59%	0.589	51%	0.509	S	S	*	.	H	α-helix	trans	-69	-45.2	174.8	-73.8	176.7	14.3	0	0	111	E594 M595 K600 R601 S602	E594-Q598 WeakPolarHBondContact O-CG 3.41Å; E594-Q598 PolarHBondContact O-N 2.89Å; M595-Q598 PolarHBondContact O-N 3.13Å; M595-Q598 VanDerWaalsContact O-N 3.13Å; Q598-K600 VanDerWaalsContact C-N 3.33Å; Q598-K600 PolarHBondContact O-N 2.98Å; Q598-R601 WeakPolarHBondContact O-CB 3.34Å; Q598-R601 PolarHBondContact O-N 3.34Å; Q598-R601 VanDerWaalsContact O-N 3.14Å; Q598-S602 PolarHBondContact O-N 3.41Å
599	D	91.6	Very high	92	Very high	83 Å²	83	104.4 Å²	104.4	44%	0.444	51%	0.507	S	S	.	.	H	α-helix	trans	-60	-44.3	176.3	-72.3	-14.8	0	0	0	111.2	M595 R601 S602 L603	M595-D599 PolarHBondContact O-N 2.96Å; D599-R601 VanDerWaalsContact C-N 3.33Å; D599-R601 PolarHBondContact O-N 3.13Å; D599-S602 PolarHBondContact O-N 3.41Å; D599-L603 WeakPolarHBondContact O-CB 3.28Å; D599-L603 WeakPolarHBondContact O-CG 3.46Å; D599-L603 PolarHBondContact O-N 3.39Å
600	K	92.1	Very high	92.1	Very high	134 Å²	134	106.6 Å²	106.6	58%	0.583	51%	0.507	S	S	*	.	H	α-helix	trans	-57.8	-45	174.8	-178.5	-179.6	175	-177.2	0	111.8	Y596 Q598 L603 Q604	Y596-K600 VanDerWaalsContact O-CB 3.28Å; Y596-K600 WeakPolarHBondContact O-CB 3.37Å; Y596-K600 PolarHBondContact O-N 2.89Å; Q598-K600 VanDerWaalsContact C-N 3.33Å; Q598-K600 PolarHBondContact O-N 2.98Å; K600-L603 PolarHBondContact O-N 3.21Å; K600-Q604 WeakPolarHBondContact O-CB 3.45Å; K600-Q604 WeakPolarHBondContact O-CG 3.36Å; K600-Q604 PolarHBondContact O-N 3.35Å; K600-Q604 PolarHBondContact O-OE1 3.3Å
601	R	93.4	Very high	92.2	Very high	143 Å²	143	106.5 Å²	106.5	54%	0.54	51%	0.507	S	S	.	.	H	α-helix	trans	-63.7	-43	177.2	-78	-178.7	-110.7	-162.3	-6.9	111.9	E597 Q598 D599 Q604 Q605	E597-R601 WeakPolarHBondContact O-CG 3.42Å; E597-R601 PolarHBondContact O-N 3.43Å; E597-R601 VanDerWaalsContact O-N 3.13Å; E597-R601 PolarHBondContact O-NE 2.86Å; E597-R601 IonicContact OE2-NH2 2.79Å; E597-R601 PolarHBondContact OE2-NH2 3.22Å; Q598-R601 WeakPolarHBondContact O-CB 3.34Å; Q598-R601 PolarHBondContact O-N 3.34Å; Q598-R601 VanDerWaalsContact O-N 3.14Å; D599-R601 VanDerWaalsContact C-N 3.33Å; D599-R601 PolarHBondContact O-N 3.13Å; R601-Q604 PolarHBondContact O-N 2.72Å; R601-Q605 WeakPolarHBondContact O-CG 3.34Å; R601-Q605 PolarHBondContact O-N 3.5Å
602	S	91.7	Very high	92.4	Very high	70 Å²	70	106.3 Å²	106.3	49%	0.49	51%	0.507	S	S	.	.	H	α-helix	trans	-63.1	-47	177.4	-173.5	0	0	0	0	111.6	Q598 D599 Q604 Q605 E606	Q598-S602 PolarHBondContact O-N 3.41Å; D599-S602 PolarHBondContact O-N 3.41Å; S602-Q604 VanDerWaalsContact C-N 3.31Å; S602-Q604 PolarHBondContact O-N 2.93Å; S602-Q605 PolarHBondContact O-N 3.24Å; S602-E606 PolarHBondContact O-N 3.06Å
603	L	92.3	Very high	92.5	Very high	111 Å²	111	112.3 Å²	112.3	58%	0.581	53%	0.525	S	S	*	.	H	α-helix	trans	-63.1	-36.8	177.7	-73	171.3	0	0	0	112.1	D599 K600 E606 L607	D599-L603 WeakPolarHBondContact O-CB 3.28Å; D599-L603 WeakPolarHBondContact O-CG 3.46Å; D599-L603 PolarHBondContact O-N 3.39Å; K600-L603 PolarHBondContact O-N 3.21Å; L603-E606 PolarHBondContact O-N 2.98Å; L603-L607 WeakPolarHBondContact O-CB 3.46Å; L603-L607 PolarHBondContact O-N 2.9Å
604	Q	91.7	Very high	92.5	Very high	98 Å²	98	113.4 Å²	113.4	46%	0.458	53%	0.527	S	S	.	.	H	α-helix	trans	-64.7	-43.6	174.2	-81.6	173.2	-57.5	0	0	112	K600 R601 S602 E606 L607 E608	K600-Q604 WeakPolarHBondContact O-CB 3.45Å; K600-Q604 WeakPolarHBondContact O-CG 3.36Å; K600-Q604 PolarHBondContact O-N 3.35Å; K600-Q604 PolarHBondContact O-OE1 3.3Å; R601-Q604 PolarHBondContact O-N 2.72Å; S602-Q604 VanDerWaalsContact C-N 3.31Å; S602-Q604 PolarHBondContact O-N 2.93Å; Q604-E606 VanDerWaalsContact C-N 3.35Å; Q604-E606 PolarHBondContact O-N 3.4Å; Q604-L607 PolarHBondContact O-N 3.33Å; Q604-E608 WeakPolarHBondContact O-CG 3.4Å; Q604-E608 PolarHBondContact O-N 2.96Å
605	Q	93.1	Very high	92.5	Very high	136 Å²	136	113.7 Å²	113.7	64%	0.636	53%	0.529	S	S	*	.	H	α-helix	trans	-64.1	-39.3	175.3	-71.8	178.5	-1.7	0	0	112.4	R601 S602 E608 S609	R601-Q605 WeakPolarHBondContact O-CG 3.34Å; R601-Q605 PolarHBondContact O-N 3.5Å; S602-Q605 PolarHBondContact O-N 3.24Å; Q605-E608 PolarHBondContact O-N 3.4Å; Q605-S609 WeakPolarHBondContact O-CB 3.42Å; Q605-S609 PolarHBondContact O-N 3.5Å
606	E	92.2	Very high	92.4	Very high	89 Å²	89	116 Å²	116	42%	0.416	54%	0.536	S	S	.	.	H	α-helix	trans	-67.2	-40.6	177.2	-163.5	-176.3	167.6	0	0	111.6	S602 L603 Q604 S609 R610	S602-E606 PolarHBondContact O-N 3.06Å; L603-E606 PolarHBondContact O-N 2.98Å; Q604-E606 VanDerWaalsContact C-N 3.35Å; Q604-E606 PolarHBondContact O-N 3.4Å; E606-S609 PolarHBondContact O-N 2.97Å; E606-R610 WeakPolarHBondContact O-CG 3.39Å; E606-R610 PolarHBondContact O-N 3.36Å; E606-R610 IonicContact OE1-CZ 3.21Å; E606-R610 IonicContact OE1-NE 3.32Å; E606-R610 PolarHBondContact OE1-NE 3.48Å; E606-R610 IonicContact OE1-NH2 2.83Å; E606-R610 PolarHBondContact OE1-NH2 3.23Å
607	L	92.4	Very high	92.5	Very high	114 Å²	114	114.8 Å²	114.8	60%	0.597	54%	0.536	S	S	*	.	H	α-helix	trans	-60.7	-48.9	174.9	-174.6	68.5	0	0	0	111.2	L603 Q604 S609 R610 E611	L603-L607 WeakPolarHBondContact O-CB 3.46Å; L603-L607 PolarHBondContact O-N 2.9Å; Q604-L607 PolarHBondContact O-N 3.33Å; L607-S609 VanDerWaalsContact C-N 3.31Å; L607-S609 PolarHBondContact O-N 2.92Å; L607-R610 PolarHBondContact O-N 3.43Å; L607-E611 WeakPolarHBondContact O-CB 3.42Å; L607-E611 PolarHBondContact O-N 2.95Å
608	E	93.6	Very high	92.4	Very high	115 Å²	115	114.3 Å²	114.3	54%	0.537	54%	0.536	S	S	.	.	H	α-helix	trans	-59.2	-42	176.4	-75.9	176.9	-171.9	0	0	111.5	Q604 Q605 E611 Q612	Q604-E608 WeakPolarHBondContact O-CG 3.4Å; Q604-E608 PolarHBondContact O-N 2.96Å; Q605-E608 PolarHBondContact O-N 3.4Å; E608-E611 PolarHBondContact O-N 3.2Å; E608-Q612 VanDerWaalsContact O-CG 3.3Å; E608-Q612 WeakPolarHBondContact O-CG 3.46Å; E608-Q612 PolarHBondContact O-N 3.31Å
609	S	93.3	Very high	92.4	Very high	46 Å²	46	110.1 Å²	110.1	32%	0.322	52%	0.523	S	S	.	.	H	α-helix	trans	-63.9	-43.4	176.8	-168.7	0	0	0	0	112.3	Q605 E606 L607 Q612 R613	Q605-S609 WeakPolarHBondContact O-CB 3.42Å; Q605-S609 PolarHBondContact O-N 3.5Å; E606-S609 PolarHBondContact O-N 2.97Å; L607-S609 VanDerWaalsContact C-N 3.31Å; L607-S609 PolarHBondContact O-N 2.92Å; S609-Q612 PolarHBondContact O-N 2.92Å; S609-R613 WeakPolarHBondContact O-CG 3.3Å; S609-R613 PolarHBondContact O-N 3.44Å
610	R	92.1	Very high	92.4	Very high	159 Å²	159	112 Å²	112	60%	0.6	53%	0.529	S	S	*	.	H	α-helix	trans	-65.3	-41	176.7	-75.2	-177.4	-173.2	-166.7	4.3	111.5	E606 L607 R613 L614	E606-R610 WeakPolarHBondContact O-CG 3.39Å; E606-R610 PolarHBondContact O-N 3.36Å; E606-R610 IonicContact OE1-CZ 3.21Å; E606-R610 IonicContact OE1-NE 3.32Å; E606-R610 PolarHBondContact OE1-NE 3.48Å; E606-R610 IonicContact OE1-NH2 2.83Å; E606-R610 PolarHBondContact OE1-NH2 3.23Å; L607-R610 PolarHBondContact O-N 3.43Å; R610-R613 PolarHBondContact O-N 3.27Å; R610-L614 WeakPolarHBondContact O-CB 3.41Å; R610-L614 PolarHBondContact O-N 2.87Å
611	E	93.2	Very high	92.3	Very high	110 Å²	110	114.2 Å²	114.2	51%	0.514	53%	0.534	S	S	.	.	H	α-helix	trans	-63	-43.6	177.6	-170.7	169.3	-166.3	0	0	111.4	L607 E608 R613 L614 Q615	L607-E611 WeakPolarHBondContact O-CB 3.42Å; L607-E611 PolarHBondContact O-N 2.95Å; E608-E611 PolarHBondContact O-N 3.2Å; E611-R613 PolarHBondContact O-N 3.07Å; E611-L614 PolarHBondContact O-N 3.4Å; E611-Q615 WeakPolarHBondContact O-CG 3.43Å; E611-Q615 PolarHBondContact O-N 3.44Å
612	Q	92.9	Very high	92.2	Very high	114 Å²	114	115.7 Å²	115.7	53%	0.533	54%	0.539	S	S	.	.	H	α-helix	trans	-61.7	-40.7	174.4	-72.9	176.1	14.3	0	0	112.7	E608 S609 K616	E608-Q612 VanDerWaalsContact O-CG 3.3Å; E608-Q612 WeakPolarHBondContact O-CG 3.46Å; E608-Q612 PolarHBondContact O-N 3.31Å; S609-Q612 PolarHBondContact O-N 2.92Å; Q612-K616 WeakPolarHBondContact O-CG 3.4Å; Q612-K616 PolarHBondContact O-N 3.36Å; Q612-K616 VanDerWaalsContact O-N 3.1Å
613	R	92.5	Very high	92.2	Very high	175 Å²	175	119.9 Å²	119.9	66%	0.66	54%	0.544	S	S	*	.	H	α-helix	trans	-64.3	-45.6	175.8	-71.9	179	-161.9	-172.9	4.7	111.4	S609 R610 E611 Q615 K616 E617	S609-R613 WeakPolarHBondContact O-CG 3.3Å; S609-R613 PolarHBondContact O-N 3.44Å; R610-R613 PolarHBondContact O-N 3.27Å; E611-R613 PolarHBondContact O-N 3.07Å; R613-Q615 VanDerWaalsContact C-N 3.33Å; R613-Q615 PolarHBondContact O-N 3.47Å; R613-K616 PolarHBondContact O-N 2.98Å; R613-E617 PolarHBondContact O-N 2.92Å
614	L	92.7	Very high	92	Very high	98 Å²	98	120 Å²	120	51%	0.513	54%	0.543	S	S	.	.	H	α-helix	trans	-61.5	-41.9	178.6	-174.5	67.4	0	0	0	111.5	R610 E611 K616 E617 L618	R610-L614 WeakPolarHBondContact O-CB 3.41Å; R610-L614 PolarHBondContact O-N 2.87Å; E611-L614 PolarHBondContact O-N 3.4Å; L614-K616 PolarHBondContact O-N 3.26Å; L614-E617 PolarHBondContact O-N 2.92Å; L614-L618 HydrophobicContact CG-CD1 4.16Å; L614-L618 WeakPolarHBondContact O-CB 3.46Å; L614-L618 VanDerWaalsContact O-CG 3.31Å; L614-L618 WeakPolarHBondContact O-CG 3.42Å; L614-L618 PolarHBondContact O-N 3Å
615	Q	91.8	Very high	91.9	Very high	122 Å²	122	121 Å²	121	57%	0.57	55%	0.548	S	S	*	.	H	α-helix	trans	-62.2	-41.4	175.5	-75.9	-170.9	2	0	0	112.4	E611 R613 A619	E611-Q615 WeakPolarHBondContact O-CG 3.43Å; E611-Q615 PolarHBondContact O-N 3.44Å; R613-Q615 VanDerWaalsContact C-N 3.33Å; R613-Q615 PolarHBondContact O-N 3.47Å; Q615-A619 WeakPolarHBondContact O-CB 3.27Å; Q615-A619 PolarHBondContact O-N 2.85Å
616	K	91.7	Very high	91.7	Very high	145 Å²	145	121.4 Å²	121.4	63%	0.63	55%	0.55	S	S	*	.	H	α-helix	trans	-62.2	-46.9	175.1	-74.2	178.2	-178.3	-178.3	0	111.6	Q612 R613 L614 L618 A619 E620	Q612-K616 WeakPolarHBondContact O-CG 3.4Å; Q612-K616 PolarHBondContact O-N 3.36Å; Q612-K616 VanDerWaalsContact O-N 3.1Å; R613-K616 PolarHBondContact O-N 2.98Å; L614-K616 PolarHBondContact O-N 3.26Å; K616-L618 PolarHBondContact O-N 3.48Å; K616-A619 PolarHBondContact O-N 3.46Å; K616-E620 WeakPolarHBondContact O-CG 3.42Å; K616-E620 PolarHBondContact O-N 3.48Å
617	E	91.6	Very high	91.6	Very high	127 Å²	127	125.3 Å²	125.3	59%	0.593	56%	0.561	S	S	*	*	H	α-helix	trans	-63.1	-42.6	179.6	-167.3	-178.6	171.3	0	0	111.9	R613 L614 A619 E620 R621	R613-E617 PolarHBondContact O-N 2.92Å; L614-E617 PolarHBondContact O-N 2.92Å; E617-A619 VanDerWaalsContact C-N 3.34Å; E617-A619 PolarHBondContact O-N 3.35Å; E617-E620 PolarHBondContact O-N 2.92Å; E617-R621 VanDerWaalsContact O-CB 3.27Å; E617-R621 WeakPolarHBondContact O-CB 3.4Å; E617-R621 PolarHBondContact O-N 3.21Å
618	L	91.8	Very high	91.3	Very high	85 Å²	85	125.7 Å²	125.7	45%	0.445	56%	0.561	S	S	.	*	H	α-helix	trans	-62.3	-40.3	174.5	-74.7	171.4	0	0	0	112.2	L614 K616 R622	L614-L618 HydrophobicContact CG-CD1 4.16Å; L614-L618 WeakPolarHBondContact O-CB 3.46Å; L614-L618 VanDerWaalsContact O-CG 3.31Å; L614-L618 WeakPolarHBondContact O-CG 3.42Å; L614-L618 PolarHBondContact O-N 3Å; K616-L618 PolarHBondContact O-N 3.48Å; L618-R622 WeakPolarHBondContact O-CG 3.31Å; L618-R622 PolarHBondContact O-N 3.1Å
619	A	91.9	Very high	91.1	Very high	39 Å²	39	126 Å²	126	32%	0.322	56%	0.562	S	S	.	*	H	α-helix	trans	-66.1	-43.3	176.8	0	0	0	0	0	111.8	Q615 K616 E617 R622 R623	Q615-A619 WeakPolarHBondContact O-CB 3.27Å; Q615-A619 PolarHBondContact O-N 2.85Å; K616-A619 PolarHBondContact O-N 3.46Å; E617-A619 VanDerWaalsContact C-N 3.34Å; E617-A619 PolarHBondContact O-N 3.35Å; A619-R622 PolarHBondContact O-N 3.43Å; A619-R623 WeakPolarHBondContact O-CG 3.42Å; A619-R623 PolarHBondContact O-N 2.86Å
620	E	91.4	Very high	90.8	Very high	123 Å²	123	125.1 Å²	125.1	58%	0.575	56%	0.561	S	S	*	*	H	α-helix	trans	-64.7	-43.3	175.9	-74.4	-177.2	177.6	0	0	112.3	K616 E617 R622 R623 M624	K616-E620 WeakPolarHBondContact O-CG 3.42Å; K616-E620 PolarHBondContact O-N 3.48Å; E617-E620 PolarHBondContact O-N 2.92Å; E620-R622 PolarHBondContact O-N 2.9Å; E620-R623 PolarHBondContact O-N 3.25Å; E620-M624 WeakPolarHBondContact O-CB 3.37Å; E620-M624 PolarHBondContact O-N 3.24Å
621	R	91.8	Very high	90.7	Very high	179 Å²	179	121.9 Å²	121.9	68%	0.675	56%	0.559	S	S	*	*	H	α-helix	trans	-59.5	-45.7	176.1	-173.9	175.3	174.1	176.9	-1	111.3	E617 R623 M624 E625	E617-R621 VanDerWaalsContact O-CB 3.27Å; E617-R621 WeakPolarHBondContact O-CB 3.4Å; E617-R621 PolarHBondContact O-N 3.21Å; R621-R623 PolarHBondContact O-N 3.5Å; R621-M624 PolarHBondContact O-N 2.85Å; R621-E625 WeakPolarHBondContact O-CB 3.46Å; R621-E625 PolarHBondContact O-N 3.47Å
622	R	91.2	Very high	90.6	Very high	175 Å²	175	120.3 Å²	120.3	66%	0.66	56%	0.556	S	S	*	*	H	α-helix	trans	-60	-43.5	174.6	-76.8	-179.9	-177.2	-170.4	2.5	112.3	L618 A619 E620 M624 E625 Q626	L618-R622 WeakPolarHBondContact O-CG 3.31Å; L618-R622 PolarHBondContact O-N 3.1Å; A619-R622 PolarHBondContact O-N 3.43Å; E620-R622 PolarHBondContact O-N 2.9Å; R622-M624 VanDerWaalsContact C-N 3.35Å; R622-E625 PolarHBondContact O-N 3.45Å; R622-Q626 WeakPolarHBondContact O-CG 3.36Å; R622-Q626 PolarHBondContact O-N 3.02Å
623	R	91.4	Very high	90.4	Very high	157 Å²	157	118.3 Å²	118.3	59%	0.592	55%	0.552	S	S	*	*	H	α-helix	trans	-63.8	-40	176.3	-72	175.1	-172.1	159.9	0.3	111.9	A619 E620 R621 R627	A619-R623 WeakPolarHBondContact O-CG 3.42Å; A619-R623 PolarHBondContact O-N 2.86Å; E620-R623 PolarHBondContact O-N 3.25Å; R621-R623 PolarHBondContact O-N 3.5Å; R623-R627 WeakPolarHBondContact O-CG 3.32Å; R623-R627 PolarHBondContact O-N 2.83Å
624	M	88.2	Confident	90.2	Very high	114 Å²	114	114.6 Å²	114.6	56%	0.562	55%	0.545	S	S	*	.	H	α-helix	trans	-65.8	-44.8	177.6	-170.7	-178.3	-68.1	0	0	111.3	E620 R621 R622 Q626 R627 M628	E620-M624 WeakPolarHBondContact O-CB 3.37Å; E620-M624 PolarHBondContact O-N 3.24Å; R621-M624 PolarHBondContact O-N 2.85Å; R622-M624 VanDerWaalsContact C-N 3.35Å; M624-Q626 PolarHBondContact O-N 3.47Å; M624-R627 PolarHBondContact O-N 3.21Å; M624-M628 WeakPolarHBondContact O-CB 3.44Å; M624-M628 PolarHBondContact O-N 3.05Å
625	E	88.3	Confident	90	Very high	120 Å²	120	113 Å²	113	56%	0.561	54%	0.54	S	S	*	.	H	α-helix	trans	-60.1	-45.2	176.5	-172.1	171.6	-158.3	0	0	111.6	R621 R622 R627 M628 Q629	R621-E625 WeakPolarHBondContact O-CB 3.46Å; R621-E625 PolarHBondContact O-N 3.47Å; R622-E625 PolarHBondContact O-N 3.45Å; E625-R627 PolarHBondContact O-N 2.88Å; E625-M628 PolarHBondContact O-N 3Å; E625-Q629 WeakPolarHBondContact O-CB 3.4Å; E625-Q629 PolarHBondContact O-N 3.07Å
626	Q	89.1	Confident	89.9	Confident	143 Å²	143	113.4 Å²	113.4	67%	0.668	54%	0.54	S	S	*	.	H	α-helix	trans	-60.1	-43.8	174.5	-74.8	177.2	-7.9	0	0	112.8	R622 M624 Q629 G630	R622-Q626 WeakPolarHBondContact O-CG 3.36Å; R622-Q626 PolarHBondContact O-N 3.02Å; M624-Q626 PolarHBondContact O-N 3.47Å; Q626-Q629 PolarHBondContact O-N 3.04Å; Q626-G630 PolarHBondContact O-N 3.48Å
627	R	89.8	Confident	89.8	Confident	172 Å²	172	110 Å²	110	65%	0.649	53%	0.528	S	S	*	.	H	α-helix	trans	-63.2	-44.4	175.8	-75.3	-173.7	-66.8	-165.8	0.9	111.6	R623 M624 E625 G630 V631	R623-R627 WeakPolarHBondContact O-CG 3.32Å; R623-R627 PolarHBondContact O-N 2.83Å; M624-R627 PolarHBondContact O-N 3.21Å; E625-R627 PolarHBondContact O-N 2.88Å; R627-G630 PolarHBondContact O-N 3.18Å; R627-V631 WeakPolarHBondContact O-CG2 3.37Å; R627-V631 PolarHBondContact O-N 3.4Å
628	M	88.1	Confident	89.7	Confident	122 Å²	122	110.9 Å²	110.9	60%	0.601	53%	0.53	S	S	*	.	H	α-helix	trans	-65.1	-41.8	180	-168.4	152.6	66.7	0	0	111.1	M624 E625 G630 V631 V632	M624-M628 WeakPolarHBondContact O-CB 3.44Å; M624-M628 PolarHBondContact O-N 3.05Å; E625-M628 PolarHBondContact O-N 3Å; M628-G630 VanDerWaalsContact C-N 3.3Å; M628-G630 PolarHBondContact O-N 3.24Å; M628-V631 PolarHBondContact O-N 3.27Å; M628-V632 WeakPolarHBondContact O-CG2 3.37Å; M628-V632 PolarHBondContact O-N 3.45Å
629	Q	87.4	Confident	89.5	Confident	120 Å²	120	115 Å²	115	56%	0.561	54%	0.54	S	S	*	.	H	α-helix	trans	-58.5	-43.4	173.7	-162	69.5	7.4	0	0	111.2	E625 Q626 V632 T633	E625-Q629 WeakPolarHBondContact O-CB 3.4Å; E625-Q629 PolarHBondContact O-N 3.07Å; Q626-Q629 PolarHBondContact O-N 3.04Å; Q629-V632 PolarHBondContact O-N 3Å; Q629-T633 WeakPolarHBondContact O-CG2 3.37Å; Q629-T633 PolarHBondContact O-N 3.01Å; Q629-T633 PolarHBondContact O-OG1 2.96Å; Q629-T633 VanDerWaalsContact O-OG1 3.12Å
630	G	88.9	Confident	89.4	Confident	29 Å²	29	117.8 Å²	117.8	30%	0.299	55%	0.546	S	S	.	.	H	α-helix	trans	-59	-45.2	174.2	0	0	0	0	0	113.2	Q626 R627 M628 T633 D634	Q626-G630 PolarHBondContact O-N 3.48Å; R627-G630 PolarHBondContact O-N 3.18Å; M628-G630 VanDerWaalsContact C-N 3.3Å; M628-G630 PolarHBondContact O-N 3.24Å; G630-T633 WeakPolarHBondContact CA-OG1 3.34Å; G630-T633 PolarHBondContact O-N 3.35Å; G630-T633 PolarHBondContact O-OG1 3.43Å; G630-D634 WeakPolarHBondContact O-CB 3.42Å; G630-D634 PolarHBondContact O-N 2.95Å
631	V	89.9	Confident	89.4	Confident	90 Å²	90	119.2 Å²	119.2	55%	0.545	55%	0.546	S	S	.	.	H	α-helix	trans	-64.7	-40.9	176.7	174.8	0	0	0	0	111.5	R627 M628 D634 T635	R627-V631 WeakPolarHBondContact O-CG2 3.37Å; R627-V631 PolarHBondContact O-N 3.4Å; M628-V631 PolarHBondContact O-N 3.27Å; V631-D634 PolarHBondContact O-N 2.8Å; V631-T635 HydrophobicContact CG1-CG2 4.37Å; V631-T635 WeakPolarHBondContact O-CB 3.3Å; V631-T635 WeakPolarHBondContact O-CG2 3.35Å; V631-T635 PolarHBondContact O-N 2.92Å; V631-T635 PolarHBondContact O-OG1 2.78Å
632	V	89.5	Confident	89.2	Confident	77 Å²	77	113 Å²	113	47%	0.467	53%	0.525	S	S	.	.	H	α-helix	trans	-63.4	-43.4	176.1	171.8	0	0	0	0	110.7	M628 Q629 T635 K636	M628-V632 WeakPolarHBondContact O-CG2 3.37Å; M628-V632 PolarHBondContact O-N 3.45Å; Q629-V632 PolarHBondContact O-N 3Å; V632-T635 WeakPolarHBondContact CA-OG1 3.42Å; V632-T635 PolarHBondContact O-OG1 3.12Å; V632-K636 VanDerWaalsContact O-CB 3.3Å; V632-K636 WeakPolarHBondContact O-CB 3.45Å; V632-K636 PolarHBondContact O-N 3.35Å
633	T	88.8	Confident	89.1	Confident	72 Å²	72	108.1 Å²	108.1	44%	0.442	52%	0.516	S	S	.	.	H	α-helix	trans	-64.8	-41.5	176.6	49.7	0	0	0	0	112.2	Q629 G630 K636 L637	Q629-T633 WeakPolarHBondContact O-CG2 3.37Å; Q629-T633 PolarHBondContact O-N 3.01Å; Q629-T633 PolarHBondContact O-OG1 2.96Å; Q629-T633 VanDerWaalsContact O-OG1 3.12Å; G630-T633 WeakPolarHBondContact CA-OG1 3.34Å; G630-T633 PolarHBondContact O-N 3.35Å; G630-T633 PolarHBondContact O-OG1 3.43Å; T633-K636 PolarHBondContact O-N 2.89Å; T633-L637 WeakPolarHBondContact O-CB 3.37Å; T633-L637 PolarHBondContact O-N 3.3Å
634	D	88.7	Confident	89	Confident	97 Å²	97	106.5 Å²	106.5	52%	0.519	52%	0.516	S	S	.	.	H	α-helix	trans	-66.6	-41.7	179	-80.7	-4.4	0	0	0	112.2	G630 V631 L637 K638	G630-D634 WeakPolarHBondContact O-CB 3.42Å; G630-D634 PolarHBondContact O-N 2.95Å; V631-D634 PolarHBondContact O-N 2.8Å; D634-L637 PolarHBondContact O-N 2.83Å; D634-K638 WeakPolarHBondContact O-CG 3.28Å; D634-K638 PolarHBondContact O-N 2.86Å
635	T	88.4	Confident	89.1	Confident	65 Å²	65	107.4 Å²	107.4	40%	0.399	51%	0.513	S	S	.	.	H	α-helix	trans	-67.4	-40.6	177	48.1	0	0	0	0	111.6	V631 V632 K638 W639	V631-T635 HydrophobicContact CG1-CG2 4.37Å; V631-T635 WeakPolarHBondContact O-CB 3.3Å; V631-T635 WeakPolarHBondContact O-CG2 3.35Å; V631-T635 PolarHBondContact O-N 2.92Å; V631-T635 PolarHBondContact O-OG1 2.78Å; V632-T635 WeakPolarHBondContact CA-OG1 3.42Å; V632-T635 PolarHBondContact O-OG1 3.12Å; T635-K638 PolarHBondContact O-N 3.4Å; T635-W639 PolarHBondContact O-N 2.94Å
636	K	89.6	Confident	89.1	Confident	130 Å²	130	108.7 Å²	108.7	57%	0.565	51%	0.512	S	S	*	.	H	α-helix	trans	-57.9	-49.5	172.4	-175.1	-178.7	177.1	-171.3	0	111.3	V632 T633 K638 W639 E640	V632-K636 VanDerWaalsContact O-CB 3.3Å; V632-K636 WeakPolarHBondContact O-CB 3.45Å; V632-K636 PolarHBondContact O-N 3.35Å; T633-K636 PolarHBondContact O-N 2.89Å; K636-K638 VanDerWaalsContact C-N 3.33Å; K636-K638 PolarHBondContact O-N 2.61Å; K636-W639 PolarHBondContact O-N 2.82Å; K636-W639 VanDerWaalsContact O-N 3.15Å; K636-E640 WeakPolarHBondContact CE-OE1 3.44Å; K636-E640 WeakPolarHBondContact O-CG 3.34Å; K636-E640 PolarHBondContact O-N 3.28Å
637	L	90.5	Very high	89.1	Confident	75 Å²	75	105.7 Å²	105.7	39%	0.393	50%	0.504	S	S	.	.	H	α-helix	trans	-62.5	-38.1	179.6	-173.2	68.1	0	0	0	112.4	T633 D634 R641	T633-L637 WeakPolarHBondContact O-CB 3.37Å; T633-L637 PolarHBondContact O-N 3.3Å; D634-L637 PolarHBondContact O-N 2.83Å; L637-R641 WeakPolarHBondContact O-CG 3.39Å; L637-R641 PolarHBondContact O-N 3.4Å
638	K	89.9	Confident	89	Confident	145 Å²	145	101.8 Å²	101.8	63%	0.63	50%	0.496	S	S	*	.	H	α-helix	trans	-62.9	-43.6	174	-76.4	176	-175.9	177.2	0	111.8	D634 T635 K636 R641 E642	D634-K638 WeakPolarHBondContact O-CG 3.28Å; D634-K638 PolarHBondContact O-N 2.86Å; T635-K638 PolarHBondContact O-N 3.4Å; K636-K638 VanDerWaalsContact C-N 3.33Å; K636-K638 PolarHBondContact O-N 2.61Å; K638-R641 PolarHBondContact O-N 2.79Å; K638-E642 WeakPolarHBondContact O-CB 3.46Å; K638-E642 PolarHBondContact O-N 3.3Å
639	W	86.8	Confident	89	Confident	172 Å²	172	98.9 Å²	98.9	65%	0.652	49%	0.491	S	S	*	.	H	α-helix	trans	-67.2	-39.5	177.5	-91.2	111.8	0	0	0	112.8	T635 K636 E642 C643	T635-W639 PolarHBondContact O-N 2.94Å; K636-W639 PolarHBondContact O-N 2.82Å; K636-W639 VanDerWaalsContact O-N 3.15Å; W639-E642 HydrophobicContact CE3-CB 4.48Å; W639-E642 HydrophobicContact CE3-CG 4.32Å; W639-E642 HydrophobicContact CZ3-CG 4.35Å; W639-E642 PolarHBondContact O-N 3.43Å; W639-C643 VanDerWaalsContact O-CB 3.28Å; W639-C643 WeakPolarHBondContact O-CB 3.37Å; W639-C643 PolarHBondContact O-N 3.05Å
640	E	89.8	Confident	88.9	Confident	96 Å²	96	98.8 Å²	98.8	45%	0.449	49%	0.489	S	S	.	.	H	α-helix	trans	-59.4	-48.8	173.8	-75.4	172.2	171.8	0	0	110.7	K636 E642 C643 E644	K636-E640 WeakPolarHBondContact CE-OE1 3.44Å; K636-E640 WeakPolarHBondContact O-CG 3.34Å; K636-E640 PolarHBondContact O-N 3.28Å; E640-E642 PolarHBondContact O-N 2.92Å; E640-C643 PolarHBondContact O-N 3.45Å; E640-E644 WeakPolarHBondContact O-CB 3.35Å; E640-E644 PolarHBondContact O-N 2.81Å
641	R	90.5	Very high	88.8	Confident	154 Å²	154	102.8 Å²	102.8	58%	0.581	50%	0.5	S	S	*	.	H	α-helix	trans	-61.9	-39.5	175.4	-71.9	177.6	-176.7	167.4	2.5	113.1	L637 K638 R645	L637-R641 WeakPolarHBondContact O-CG 3.39Å; L637-R641 PolarHBondContact O-N 3.4Å; K638-R641 PolarHBondContact O-N 2.79Å; R641-R645 WeakPolarHBondContact O-CB 3.31Å; R641-R645 PolarHBondContact O-N 3.09Å
642	E	88.9	Confident	88.6	Confident	49 Å²	49	103.2 Å²	103.2	23%	0.229	50%	0.498	C	S	.	.	H	α-helix	trans	-64.3	-45.3	175.7	176.3	68.6	-137.7	0	0	111.6	K638 W639 E640 R645 R646	K638-E642 WeakPolarHBondContact O-CB 3.46Å; K638-E642 PolarHBondContact O-N 3.3Å; W639-E642 HydrophobicContact CE3-CB 4.48Å; W639-E642 HydrophobicContact CE3-CG 4.32Å; W639-E642 HydrophobicContact CZ3-CG 4.35Å; W639-E642 PolarHBondContact O-N 3.43Å; E640-E642 PolarHBondContact O-N 2.92Å; E642-R645 PolarHBondContact O-N 3.4Å; E642-R645 IonicContact OE1-CZ 3.12Å; E642-R645 IonicContact OE1-NH1 3.56Å; E642-R645 PolarHBondContact OE1-NH1 2.88Å; E642-R645 IonicContact OE2-CZ 2.61Å; E642-R645 IonicContact OE2-NH1 2.67Å; E642-R645 PolarHBondContact OE2-NH1 3.38Å; E642-R645 IonicContact OE2-NH2 2.79Å; E642-R645 PolarHBondContact OE2-NH2 3Å; E642-R646 WeakPolarHBondContact O-CG 3.36Å; E642-R646 PolarHBondContact O-N 2.72Å; E642-R646 IonicContact OE1-CZ 3.4Å; E642-R646 IonicContact OE1-NE 3.83Å; E642-R646 PolarHBondContact OE1-NE 3.15Å; E642-R646 IonicContact OE1-NH2 2.86Å; E642-R646 PolarHBondContact OE1-NH2 3.46Å
643	C	88.5	Confident	88.4	Confident	71 Å²	71	102.9 Å²	102.9	48%	0.48	49%	0.492	S	S	.	.	H	α-helix	trans	-62.9	-48.6	178.4	-164.5	0	0	0	0	110.6	W639 E640 R645 R646 V647	W639-C643 VanDerWaalsContact O-CB 3.28Å; W639-C643 WeakPolarHBondContact O-CB 3.37Å; W639-C643 PolarHBondContact O-N 3.05Å; E640-C643 PolarHBondContact O-N 3.45Å; C643-R645 VanDerWaalsContact C-N 3.31Å; C643-R645 PolarHBondContact O-N 2.97Å; C643-R646 PolarHBondContact O-N 3.38Å; C643-R646 VanDerWaalsContact O-N 3.1Å; C643-V647 WeakPolarHBondContact O-CG2 3.14Å; C643-V647 PolarHBondContact O-N 3.45Å
644	E	89.4	Confident	88.2	Confident	124 Å²	124	104.5 Å²	104.5	58%	0.579	50%	0.497	S	S	*	.	H	α-helix	trans	-58.8	-42.5	176.9	-170.4	174.6	-154.9	0	0	111.5	E640 R646 V647 N648	E640-E644 WeakPolarHBondContact O-CB 3.35Å; E640-E644 PolarHBondContact O-N 2.81Å; E644-R646 PolarHBondContact O-N 2.87Å; E644-V647 PolarHBondContact O-N 3.1Å; E644-N648 WeakPolarHBondContact O-CB 3.21Å; E644-N648 VanDerWaalsContact O-CG 3.27Å; E644-N648 PolarHBondContact O-N 3.38Å; E644-N648 PolarHBondContact O-ND2 3.48Å
645	R	90	Very high	87.9	Confident	133 Å²	133	105.2 Å²	105.2	50%	0.502	50%	0.497	S	S	.	.	H	α-helix	trans	-62.4	-41.3	175	-158.8	-165.4	-27.6	101.6	3.3	112.5	R641 E642 C643 A649	R641-R645 WeakPolarHBondContact O-CB 3.31Å; R641-R645 PolarHBondContact O-N 3.09Å; E642-R645 PolarHBondContact O-N 3.4Å; E642-R645 IonicContact OE1-CZ 3.12Å; E642-R645 IonicContact OE1-NH1 3.56Å; E642-R645 PolarHBondContact OE1-NH1 2.88Å; E642-R645 IonicContact OE2-CZ 2.61Å; E642-R645 IonicContact OE2-NH1 2.67Å; E642-R645 PolarHBondContact OE2-NH1 3.38Å; E642-R645 IonicContact OE2-NH2 2.79Å; E642-R645 PolarHBondContact OE2-NH2 3Å; C643-R645 VanDerWaalsContact C-N 3.31Å; C643-R645 PolarHBondContact O-N 2.97Å; R645-A649 VanDerWaalsContact O-CB 3.31Å; R645-A649 WeakPolarHBondContact O-CB 3.34Å; R645-A649 PolarHBondContact O-N 2.67Å
646	R	88.8	Confident	87.7	Confident	146 Å²	146	106.7 Å²	106.7	55%	0.551	50%	0.503	S	S	*	.	H	α-helix	trans	-67.3	-41.6	177.8	-73.7	-179	-173.5	-165.5	1	111.9	E642 C643 E644 A649 K650	E642-R646 WeakPolarHBondContact O-CG 3.36Å; E642-R646 PolarHBondContact O-N 2.72Å; E642-R646 IonicContact OE1-CZ 3.4Å; E642-R646 IonicContact OE1-NE 3.83Å; E642-R646 PolarHBondContact OE1-NE 3.15Å; E642-R646 IonicContact OE1-NH2 2.86Å; E642-R646 PolarHBondContact OE1-NH2 3.46Å; C643-R646 PolarHBondContact O-N 3.38Å; C643-R646 VanDerWaalsContact O-N 3.1Å; E644-R646 PolarHBondContact O-N 2.87Å; R646-A649 PolarHBondContact O-N 3.39Å; R646-K650 WeakPolarHBondContact O-CB 3.5Å; R646-K650 PolarHBondContact O-N 2.94Å
647	V	89.7	Confident	87.4	Confident	81 Å²	81	105.8 Å²	105.8	49%	0.491	50%	0.499	S	S	.	.	H	α-helix	trans	-60.3	-50.6	174.3	171.5	0	0	0	0	109.8	C643 E644 A649 K650 Q651	C643-V647 WeakPolarHBondContact O-CG2 3.14Å; C643-V647 PolarHBondContact O-N 3.45Å; E644-V647 PolarHBondContact O-N 3.1Å; V647-A649 VanDerWaalsContact C-N 3.34Å; V647-A649 PolarHBondContact O-N 2.89Å; V647-K650 PolarHBondContact O-N 2.89Å; V647-K650 VanDerWaalsContact O-N 3.16Å; V647-Q651 WeakPolarHBondContact O-CB 3.37Å; V647-Q651 PolarHBondContact O-N 3.37Å
648	N	87.3	Confident	87	Confident	90 Å²	90	107.1 Å²	107.1	48%	0.481	51%	0.506	S	S	.	.	H	α-helix	trans	-59.4	-42.6	177.5	-74.3	-21.4	0	0	0	112.2	E644 K650 Q651 L652	E644-N648 WeakPolarHBondContact O-CB 3.21Å; E644-N648 VanDerWaalsContact O-CG 3.27Å; E644-N648 PolarHBondContact O-N 3.38Å; E644-N648 PolarHBondContact O-ND2 3.48Å; N648-K650 PolarHBondContact O-N 3.37Å; N648-Q651 PolarHBondContact O-N 2.97Å; N648-L652 WeakPolarHBondContact O-CB 3.37Å; N648-L652 PolarHBondContact O-N 3.36Å
649	A	87.4	Confident	86.6	Confident	60 Å²	60	107.9 Å²	107.9	50%	0.496	51%	0.505	S	S	.	.	H	α-helix	trans	-62.4	-42.5	176.2	0	0	0	0	0	112.1	R645 R646 V647 L652 E653	R645-A649 VanDerWaalsContact O-CB 3.31Å; R645-A649 WeakPolarHBondContact O-CB 3.34Å; R645-A649 PolarHBondContact O-N 2.67Å; R646-A649 PolarHBondContact O-N 3.39Å; V647-A649 VanDerWaalsContact C-N 3.34Å; V647-A649 PolarHBondContact O-N 2.89Å; A649-L652 PolarHBondContact O-N 2.98Å; A649-E653 PolarHBondContact O-N 3.47Å
650	K	86.4	Confident	86.5	Confident	119 Å²	119	102.9 Å²	102.9	52%	0.517	49%	0.493	S	S	.	.	H	α-helix	trans	-68.3	-38.6	176.4	-82.9	-62.3	-176	-169	0	112.9	R646 V647 N648 L652 E653 L654	R646-K650 WeakPolarHBondContact O-CB 3.5Å; R646-K650 PolarHBondContact O-N 2.94Å; V647-K650 PolarHBondContact O-N 2.89Å; V647-K650 VanDerWaalsContact O-N 3.16Å; N648-K650 PolarHBondContact O-N 3.37Å; K650-L652 VanDerWaalsContact C-N 3.33Å; K650-E653 WeakPolarHBondContact CD-OE2 3.42Å; K650-E653 IonicContact NZ-OE1 3.83Å; K650-E653 IonicContact NZ-OE2 2.72Å; K650-E653 PolarHBondContact NZ-OE2 3.14Å; K650-E653 WeakPolarHBondContact O-CB 3.36Å; K650-E653 PolarHBondContact O-N 3.14Å; K650-L654 WeakPolarHBondContact O-CB 3.46Å; K650-L654 PolarHBondContact O-N 3.4Å
651	Q	85	Confident	86.1	Confident	113 Å²	113	105 Å²	105	53%	0.528	50%	0.501	S	S	.	.	H	α-helix	trans	-64.5	-40.4	175.9	-170.6	162.7	-3.9	0	0	111.3	V647 N648 L654 Q655	V647-Q651 WeakPolarHBondContact O-CB 3.37Å; V647-Q651 PolarHBondContact O-N 3.37Å; N648-Q651 PolarHBondContact O-N 2.97Å; Q651-L654 PolarHBondContact O-N 2.92Å; Q651-Q655 WeakPolarHBondContact O-CB 3.42Å; Q651-Q655 PolarHBondContact O-N 3.29Å
652	L	86.7	Confident	85.7	Confident	99 Å²	99	101.9 Å²	101.9	52%	0.518	50%	0.496	S	S	.	.	H	α-helix	trans	-66.7	-39	173.8	-164.4	71.7	0	0	0	112.1	N648 A649 K650 Q655 N656	N648-L652 WeakPolarHBondContact O-CB 3.37Å; N648-L652 PolarHBondContact O-N 3.36Å; A649-L652 PolarHBondContact O-N 2.98Å; K650-L652 VanDerWaalsContact C-N 3.33Å; L652-Q655 PolarHBondContact O-N 2.88Å; L652-N656 WeakPolarHBondContact O-CB 3.38Å; L652-N656 PolarHBondContact O-N 2.95Å; L652-N656 PolarHBondContact O-ND2 3.38Å
653	E	86	Confident	85.2	Confident	69 Å²	69	102.6 Å²	102.6	32%	0.322	50%	0.499	S	S	.	.	H	α-helix	trans	-61.6	-44.3	173.8	-168.3	-165.6	151.4	0	0	111.3	A649 K650 N656 K657	A649-E653 PolarHBondContact O-N 3.47Å; K650-E653 WeakPolarHBondContact CD-OE2 3.42Å; K650-E653 IonicContact NZ-OE1 3.83Å; K650-E653 IonicContact NZ-OE2 2.72Å; K650-E653 PolarHBondContact NZ-OE2 3.14Å; K650-E653 WeakPolarHBondContact O-CB 3.36Å; K650-E653 PolarHBondContact O-N 3.14Å; E653-N656 PolarHBondContact O-N 2.97Å; E653-K657 WeakPolarHBondContact O-CG 3.33Å; E653-K657 PolarHBondContact O-N 3.07Å; E653-K657 WeakPolarHBondContact OE1-CE 3.49Å; E653-K657 IonicContact OE1-NZ 2.74Å; E653-K657 PolarHBondContact OE1-NZ 2.83Å
654	L	84.2	Confident	84.8	Confident	106 Å²	106	105.4 Å²	105.4	56%	0.555	50%	0.503	S	S	*	.	H	α-helix	trans	-63.9	-44.9	175.6	-83.1	155.6	0	0	0	111.8	K650 Q651 N656 K657 L658	K650-L654 WeakPolarHBondContact O-CB 3.46Å; K650-L654 PolarHBondContact O-N 3.4Å; Q651-L654 PolarHBondContact O-N 2.92Å; L654-N656 PolarHBondContact O-N 3.5Å; L654-K657 PolarHBondContact O-N 3.38Å; L654-L658 WeakPolarHBondContact O-CB 3.36Å; L654-L658 PolarHBondContact O-N 3.38Å
655	Q	82.1	Confident	84	Confident	113 Å²	113	104.4 Å²	104.4	53%	0.528	50%	0.501	S	S	.	.	H	α-helix	trans	-60.2	-43.6	173.9	-87.5	-173.5	-14.4	0	0	111.9	Q651 L652 K657 L658 W659	Q651-Q655 WeakPolarHBondContact O-CB 3.42Å; Q651-Q655 PolarHBondContact O-N 3.29Å; L652-Q655 PolarHBondContact O-N 2.88Å; Q655-K657 VanDerWaalsContact C-N 3.34Å; Q655-K657 PolarHBondContact O-N 2.91Å; Q655-L658 PolarHBondContact O-N 2.96Å; Q655-W659 WeakPolarHBondContact O-CB 3.29Å; Q655-W659 PolarHBondContact O-N 3.46Å
656	N	83.1	Confident	83.3	Confident	95 Å²	95	104.7 Å²	104.7	51%	0.508	51%	0.506	S	S	.	.	H	α-helix	trans	-62.6	-41.2	175.4	-78.8	-27.5	0	0	0	111.6	L652 E653 L654 W659 V660	L652-N656 WeakPolarHBondContact O-CB 3.38Å; L652-N656 PolarHBondContact O-N 2.95Å; L652-N656 PolarHBondContact O-ND2 3.38Å; E653-N656 PolarHBondContact O-N 2.97Å; L654-N656 PolarHBondContact O-N 3.5Å; N656-W659 PolarHBondContact O-N 3.16Å; N656-V660 VanDerWaalsContact O-CG2 3.29Å; N656-V660 WeakPolarHBondContact O-CG2 3.44Å; N656-V660 PolarHBondContact O-N 3.38Å
657	K	84.5	Confident	82.3	Confident	112 Å²	112	103 Å²	103	49%	0.487	51%	0.505	S	S	.	.	H	α-helix	trans	-65.4	-40.6	175.7	-75.6	177.2	-174.9	172.7	0	112.2	E653 L654 Q655 V660 K661	E653-K657 WeakPolarHBondContact O-CG 3.33Å; E653-K657 PolarHBondContact O-N 3.07Å; E653-K657 WeakPolarHBondContact OE1-CE 3.49Å; E653-K657 IonicContact OE1-NZ 2.74Å; E653-K657 PolarHBondContact OE1-NZ 2.83Å; L654-K657 PolarHBondContact O-N 3.38Å; Q655-K657 VanDerWaalsContact C-N 3.34Å; Q655-K657 PolarHBondContact O-N 2.91Å; K657-V660 PolarHBondContact O-N 3.23Å; K657-K661 WeakPolarHBondContact O-CB 3.49Å; K657-K661 WeakPolarHBondContact O-CG 3.49Å; K657-K661 PolarHBondContact O-N 2.89Å
658	L	82.3	Confident	81.1	Confident	102 Å²	102	104 Å²	104	53%	0.534	51%	0.507	S	S	.	.	H	α-helix	trans	-62.3	-47.4	173.3	-84.8	159.8	0	0	0	110.7	L654 Q655 V660 K661 D662	L654-L658 WeakPolarHBondContact O-CB 3.36Å; L654-L658 PolarHBondContact O-N 3.38Å; Q655-L658 PolarHBondContact O-N 2.96Å; L658-V660 PolarHBondContact O-N 3.47Å; L658-K661 CarbonylContact O-C 3.55Å; L658-K661 WeakPolarHBondContact O-CA 3.46Å; L658-K661 WeakPolarHBondContact O-CB 3.45Å; L658-K661 PolarHBondContact O-N 3.39Å; L658-K661 VanDerWaalsContact O-N 3.08Å; L658-D662 WeakPolarHBondContact O-CB 3.29Å; L658-D662 PolarHBondContact O-N 2.86Å
659	W	81.9	Confident	80	Confident	161 Å²	161	107.1 Å²	107.1	61%	0.61	52%	0.516	S	S	*	.	H	α-helix	trans	-58.6	-45.1	176.5	-174	89.3	0	0	0	112	Q655 N656 K661 D662 E663	Q655-W659 WeakPolarHBondContact O-CB 3.29Å; Q655-W659 PolarHBondContact O-N 3.46Å; N656-W659 PolarHBondContact O-N 3.16Å; W659-K661 VanDerWaalsContact C-N 3.33Å; W659-K661 PolarHBondContact O-N 2.99Å; W659-D662 PolarHBondContact O-N 3.36Å; W659-E663 HydrophobicContact CH2-CG 4.32Å; W659-E663 HydrophobicContact CZ3-CB 4.48Å; W659-E663 WeakPolarHBondContact O-CB 3.44Å; W659-E663 PolarHBondContact O-N 2.8Å
660	V	83.2	Confident	78.7	Confident	67 Å²	67	106.7 Å²	106.7	41%	0.406	51%	0.512	S	S	.	.	H	α-helix	trans	-63.2	-38.9	175	170.7	0	0	0	0	111.5	N656 K657 L658 K664	N656-V660 VanDerWaalsContact O-CG2 3.29Å; N656-V660 WeakPolarHBondContact O-CG2 3.44Å; N656-V660 PolarHBondContact O-N 3.38Å; K657-V660 PolarHBondContact O-N 3.23Å; L658-V660 PolarHBondContact O-N 3.47Å; V660-K664 HydrophobicContact CG1-CD 4.34Å; V660-K664 WeakPolarHBondContact O-CB 3.29Å; V660-K664 VanDerWaalsContact O-CG 3.29Å; V660-K664 WeakPolarHBondContact O-CG 3.35Å; V660-K664 PolarHBondContact O-N 3.08Å
661	K	82.9	Confident	77.4	Confident	140 Å²	140	106.2 Å²	106.2	61%	0.609	51%	0.514	S	S	*	.	H	α-helix	trans	-66.1	-43.8	175.1	-79	-177.7	176.5	-175	0	111.6	K657 L658 W659 E663 K664 L665	K657-K661 WeakPolarHBondContact O-CB 3.49Å; K657-K661 WeakPolarHBondContact O-CG 3.49Å; K657-K661 PolarHBondContact O-N 2.89Å; L658-K661 CarbonylContact O-C 3.55Å; L658-K661 WeakPolarHBondContact O-CA 3.46Å; L658-K661 WeakPolarHBondContact O-CB 3.45Å; L658-K661 PolarHBondContact O-N 3.39Å; L658-K661 VanDerWaalsContact O-N 3.08Å; W659-K661 VanDerWaalsContact C-N 3.33Å; W659-K661 PolarHBondContact O-N 2.99Å; K661-E663 VanDerWaalsContact C-N 3.33Å; K661-K664 PolarHBondContact O-N 2.94Å; K661-L665 VanDerWaalsContact O-CG 3.29Å; K661-L665 WeakPolarHBondContact O-CB 3.41Å; K661-L665 PolarHBondContact O-N 2.87Å; K661-L665 WeakPolarHBondContact O-CG 3.48Å
662	D	81.1	Confident	76.2	Confident	89 Å²	89	106.2 Å²	106.2	48%	0.476	52%	0.522	S	S	.	.	H	α-helix	trans	-64.5	-38.4	176.7	-80.5	-9.1	0	0	0	111.5	L658 W659 L665 K666	L658-D662 WeakPolarHBondContact O-CB 3.29Å; L658-D662 PolarHBondContact O-N 2.86Å; W659-D662 PolarHBondContact O-N 3.36Å; D662-L665 PolarHBondContact O-N 3.01Å; D662-K666 WeakPolarHBondContact O-CB 3.4Å; D662-K666 WeakPolarHBondContact O-CG 3.33Å; D662-K666 PolarHBondContact O-N 3.5Å
663	E	79.5	Confident	74.8	Confident	65 Å²	65	106.4 Å²	106.4	30%	0.304	53%	0.527	S	S	.	.	H	α-helix	trans	-67.6	-42	175.2	-164.1	61.1	-156.9	0	0	111.2	W659 K661 L665 K666 Q667	W659-E663 HydrophobicContact CH2-CG 4.32Å; W659-E663 HydrophobicContact CZ3-CB 4.48Å; W659-E663 WeakPolarHBondContact O-CB 3.44Å; W659-E663 PolarHBondContact O-N 2.8Å; K661-E663 VanDerWaalsContact C-N 3.33Å; E663-L665 VanDerWaalsContact C-N 3.34Å; E663-L665 PolarHBondContact O-N 3.3Å; E663-K666 WeakPolarHBondContact O-CB 3.39Å; E663-K666 PolarHBondContact O-N 3.42Å; E663-Q667 WeakPolarHBondContact O-CG 3.48Å; E663-Q667 PolarHBondContact O-N 2.95Å
664	K	78.3	Confident	73.2	Confident	129 Å²	129	110.9 Å²	110.9	56%	0.561	55%	0.548	S	S	*	.	H	α-helix	trans	-63.7	-38.1	171.4	-75.9	-179.1	177.6	-169.4	0	112.3	V660 K661 Q667 L668	V660-K664 HydrophobicContact CG1-CD 4.34Å; V660-K664 WeakPolarHBondContact O-CB 3.29Å; V660-K664 VanDerWaalsContact O-CG 3.29Å; V660-K664 WeakPolarHBondContact O-CG 3.35Å; V660-K664 PolarHBondContact O-N 3.08Å; K661-K664 PolarHBondContact O-N 2.94Å; K664-Q667 PolarHBondContact O-N 3.32Å; K664-L668 WeakPolarHBondContact O-CB 3.46Å; K664-L668 WeakPolarHBondContact O-CG 3.5Å; K664-L668 PolarHBondContact O-N 2.84Å
665	L	74.4	Confident	71.4	Confident	104 Å²	104	113.5 Å²	113.5	55%	0.545	56%	0.562	S	S	.	*	H	α-helix	trans	-66.6	-39.3	174.7	-79.5	165.6	0	0	0	111.1	K661 D662 E663 L668 K669	K661-L665 VanDerWaalsContact O-CG 3.29Å; K661-L665 WeakPolarHBondContact O-CB 3.41Å; K661-L665 PolarHBondContact O-N 2.87Å; K661-L665 WeakPolarHBondContact O-CG 3.48Å; D662-L665 PolarHBondContact O-N 3.01Å; E663-L665 VanDerWaalsContact C-N 3.34Å; E663-L665 PolarHBondContact O-N 3.3Å; L665-L668 PolarHBondContact O-N 3.3Å; L665-K669 WeakPolarHBondContact O-CB 3.27Å; L665-K669 PolarHBondContact O-N 3.44Å; L665-K669 VanDerWaalsContact O-CB 3.24Å
666	K	73.7	Confident	69.3	Low	138 Å²	138	111.1 Å²	111.1	60%	0.6	57%	0.569	S	S	*	*	H	α-helix	trans	-62.9	-43.3	171.7	-80.2	176.5	-179	172.3	0	111.8	D662 E663 K669 A670	D662-K666 WeakPolarHBondContact O-CB 3.4Å; D662-K666 WeakPolarHBondContact O-CG 3.33Å; D662-K666 PolarHBondContact O-N 3.5Å; E663-K666 WeakPolarHBondContact O-CB 3.39Å; E663-K666 PolarHBondContact O-N 3.42Å; K666-K669 PolarHBondContact O-N 2.85Å; K666-A670 WeakPolarHBondContact O-CB 3.5Å; K666-A670 PolarHBondContact O-N 3.32Å
667	Q	68.2	Low	67	Low	111 Å²	111	110.5 Å²	110.5	52%	0.519	58%	0.584	S	S	.	*	H	α-helix	trans	-63.3	-44.1	175	-71.6	173	9.9	0	0	111.7	E663 K664 K669 A670 I671	E663-Q667 WeakPolarHBondContact O-CG 3.48Å; E663-Q667 PolarHBondContact O-N 2.95Å; K664-Q667 PolarHBondContact O-N 3.32Å; Q667-K669 VanDerWaalsContact C-N 3.35Å; Q667-K669 PolarHBondContact O-N 2.83Å; Q667-A670 PolarHBondContact O-N 3.41Å; Q667-I671 WeakPolarHBondContact O-CD1 3.43Å; Q667-I671 VanDerWaalsContact O-CG1 3.26Å; Q667-I671 WeakPolarHBondContact O-CG1 3.24Å; Q667-I671 PolarHBondContact O-N 3.5Å
668	L	64.1	Low	64.7	Low	102 Å²	102	109.8 Å²	109.8	53%	0.534	60%	0.6	S	S	.	*	H	α-helix	trans	-62.4	-41.1	173.4	-83.2	159.6	0	0	0	111.9	K664 L665 A670 I671 V672	K664-L668 WeakPolarHBondContact O-CB 3.46Å; K664-L668 WeakPolarHBondContact O-CG 3.5Å; K664-L668 PolarHBondContact O-N 2.84Å; L665-L668 PolarHBondContact O-N 3.3Å; L668-A670 VanDerWaalsContact C-N 3.35Å; L668-I671 PolarHBondContact O-N 2.77Å; L668-V672 PolarHBondContact O-N 2.8Å; L668-V672 WeakPolarHBondContact O-CG2 3.32Å; L668-V672 WeakPolarHBondContact O-CB 3.26Å; L668-V672 VanDerWaalsContact O-CG2 3.27Å
669	K	65.6	Low	62.5	Low	156 Å²	156	110.9 Å²	110.9	68%	0.678	62%	0.616	S	S	*	*	H	α-helix	trans	-65.2	-39.6	177.7	-156.6	175.7	-172.5	-175.5	0	111.1	L665 K666 Q667 V672 T673	L665-K669 WeakPolarHBondContact O-CB 3.27Å; L665-K669 PolarHBondContact O-N 3.44Å; L665-K669 VanDerWaalsContact O-CB 3.24Å; K666-K669 PolarHBondContact O-N 2.85Å; Q667-K669 VanDerWaalsContact C-N 3.35Å; Q667-K669 PolarHBondContact O-N 2.83Å; K669-V672 PolarHBondContact O-N 2.77Å; K669-T673 PolarHBondContact O-N 3.24Å; K669-T673 PolarHBondContact O-OG1 3.5Å
670	A	60.5	Low	60.2	Low	51 Å²	51	107.1 Å²	107.1	42%	0.421	63%	0.627	S	S	.	*	H	α-helix	trans	-61.3	-42.9	173.6	0	0	0	0	0	112.1	K666 Q667 L668 T673 E674	K666-A670 WeakPolarHBondContact O-CB 3.5Å; K666-A670 PolarHBondContact O-N 3.32Å; Q667-A670 PolarHBondContact O-N 3.41Å; L668-A670 VanDerWaalsContact C-N 3.35Å; A670-T673 WeakPolarHBondContact CA-OG1 3.33Å; A670-T673 PolarHBondContact O-N 3.34Å; A670-T673 PolarHBondContact O-OG1 3.04Å; A670-E674 PolarHBondContact O-N 3.39Å
671	I	59.2	Low	57.9	Low	109 Å²	109	107.6 Å²	107.6	56%	0.559	65%	0.646	S	S	*	*	H	α-helix	trans	-66.7	-38.2	175.9	-64.5	162.4	0	0	0	111.6	Q667 L668 E674	Q667-I671 WeakPolarHBondContact O-CD1 3.43Å; Q667-I671 VanDerWaalsContact O-CG1 3.26Å; Q667-I671 WeakPolarHBondContact O-CG1 3.24Å; Q667-I671 PolarHBondContact O-N 3.5Å; L668-I671 PolarHBondContact O-N 2.77Å; I671-E674 PolarHBondContact O-N 2.9Å
672	V	58.7	Low	56.3	Low	112 Å²	112	107.1 Å²	107.1	68%	0.679	66%	0.657	S	S	*	*	H	α-helix	trans	-71.6	-32.3	178	171.7	0	0	0	0	111.8	L668 K669 E674	L668-V672 PolarHBondContact O-N 2.8Å; L668-V672 WeakPolarHBondContact O-CG2 3.32Å; L668-V672 WeakPolarHBondContact O-CB 3.26Å; L668-V672 VanDerWaalsContact O-CG2 3.27Å; K669-V672 PolarHBondContact O-N 2.77Å; V672-E674 VanDerWaalsContact C-N 3.31Å
673	T	57.6	Low	54.2	Low	103 Å²	103	107.5 Å²	107.5	63%	0.632	67%	0.672	S	S	*	*	H	α-helix	trans	-75.7	-12.5	173.7	41.5	0	0	0	0	114.3	K669 A670	K669-T673 PolarHBondContact O-N 3.24Å; K669-T673 PolarHBondContact O-OG1 3.5Å; A670-T673 WeakPolarHBondContact CA-OG1 3.33Å; A670-T673 PolarHBondContact O-N 3.34Å; A670-T673 PolarHBondContact O-OG1 3.04Å
674	E	53	Low	52.3	Low	163 Å²	163	113.6 Å²	113.6	76%	0.762	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-7.4	176.6	-81.2	-176.7	163.7	0	0	114.3	A670 I671 V672	A670-E674 PolarHBondContact O-N 3.39Å; I671-E674 PolarHBondContact O-N 2.9Å; V672-E674 VanDerWaalsContact C-N 3.31Å
675	N	45.8	Very low	50.9	Low	161 Å²	161	112.9 Å²	112.9	86%	0.861	71%	0.709	S	S	*	*	S	Bend	trans	-110.8	25.3	-178.9	-105.6	24	0	0	0	115.4
676	G	38	Very low	49.8	Very low	64 Å²	64	113.8 Å²	113.8	66%	0.66	72%	0.722	S	S	*	*	S	Bend	trans	-159	100.1	171.5	0	0	0	0	0	113.6
677	G	35.1	Very low	48.2	Very low	81 Å²	81	119 Å²	119	84%	0.835	74%	0.738	S	S	*	*			trans	100.7	112.4	153.9	0	0	0	0	0	116.6
678	A	35.1	Very low	47.1	Very low	98 Å²	98	123.5 Å²	123.5	81%	0.81	76%	0.755	S	S	*	*			trans	-62.6	143.9	170.9	0	0	0	0	0	113.8
679	S	36.1	Very low	46.2	Very low	124 Å²	124	124.7 Å²	124.7	87%	0.867	77%	0.769	S	S	*	*				152.6	121.7	118.8	54.8	0	0	0	0	113.9
680	G	34.6	Very low	45.1	Very low	83 Å²	83	126.5 Å²	126.5	86%	0.856	78%	0.78	S	S	*	*			trans	97.9	103.9	135.8	0	0	0	0	0	121.3
681	G	34.3	Very low	44.4	Very low	77 Å²	77	135.2 Å²	135.2	79%	0.794	80%	0.802	S	S	*	*			trans	105.4	148.9	135.6	0	0	0	0	0	118.5
682	P	48.9	Very low	43.8	Very low	130 Å²	130	136 Å²	136	84%	0.844	81%	0.814	S	S	*	*			trans	-114	158.6	-136.6	38.8	-28.4	0	0	0	117.9
683	A	38.3	Very low	43.1	Very low	97 Å²	97	135.1 Å²	135.1	80%	0.802	81%	0.813	S	S	*	*			trans	77.8	120.1	140.6	0	0	0	0	0	123.1
684	E	38.8	Very low	43	Very low	192 Å²	192	142.6 Å²	142.6	90%	0.897	83%	0.829	S	S	*	*				-166.8	155.8	113.3	-106.6	-165.5	165.3	0	0	112.3
685	P	49.1	Very low	42.7	Very low	114 Å²	114	143 Å²	143	74%	0.74	83%	0.831	S	S	*	*			trans	-88.6	174.9	-163.4	38.7	-37.4	0	0	0	114.8
686	P	51	Low	42.7	Very low	124 Å²	124	146.9 Å²	146.9	81%	0.805	83%	0.834	S	S	*	*			trans	-89.8	152.8	-150.5	36.2	-33.6	0	0	0	114.3
687	R	40.1	Very low	43.2	Very low	248 Å²	248	151.7 Å²	151.7	94%	0.936	85%	0.845	S	S	*	*			trans	-115	121.9	158.2	-75.5	-171.4	177.2	-168.9	0.6	110.9
688	K	44.8	Very low	43.8	Very low	205 Å²	205	158.9 Å²	158.9	89%	0.891	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-60.6	157.7	169.6	-92.1	-180	-179.5	176.6	0	111.2
689	P	45.9	Very low	44.3	Very low	126 Å²	126	162 Å²	162	82%	0.818	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-82.6	140.2	-158.6	32.3	-33.8	0	0	0	112.7
690	E	41.4	Very low	44.5	Very low	194 Å²	194	163 Å²	163	91%	0.907	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-95	119.1	161.7	-89.4	-174.8	158.6	0	0	110.3
691	R	47.6	Very low	44.6	Very low	235 Å²	235	163.1 Å²	163.1	89%	0.887	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-64.2	137.3	164.1	-133.3	178	-172.7	177.6	2.4	107.6	S693	R691-S693 PolarHBondContact O-N 3.29Å
692	P	45.1	Very low	45.1	Very low	124 Å²	124	169 Å²	169	81%	0.805	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-58.8	128.8	171.6	-18.4	29.9	0	0	0	109.8
693	S	45	Very low	44.5	Very low	95 Å²	95	172.2 Å²	172.2	66%	0.664	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-63.6	137.2	-177.7	48.3	0	0	0	0	111.8	R691 E695	R691-S693 PolarHBondContact O-N 3.29Å; S693-E695 PolarHBondContact O-N 3.49Å
694	R	55.3	Low	44.5	Very low	259 Å²	259	179 Å²	179	98%	0.977	86%	0.855	S	S	*	*			trans	-74.9	76.6	164.2	-107.7	-179.7	165.3	173.2	-5.1	108.3
695	E	47.4	Very low	44.4	Very low	171 Å²	171	175.5 Å²	175.5	80%	0.799	85%	0.852	S	S	*	*			trans	-119.5	84.7	169.3	-95.1	-172.3	155.4	0	0	110.3	S693	S693-E695 PolarHBondContact O-N 3.49Å
696	R	45.5	Very low	43.9	Very low	243 Å²	243	174.6 Å²	174.6	92%	0.917	86%	0.855	S	S	*	*			trans	-161.6	45.2	153.5	-120	-179.8	-162.6	-153.1	4.9	112.7
697	D	46.9	Very low	43.7	Very low	166 Å²	166	173.7 Å²	173.7	89%	0.888	85%	0.851	S	S	*	*			trans	-129	52.1	166.6	-88.2	-34	0	0	0	110.1
698	R	48.7	Very low	43.7	Very low	231 Å²	231	167.9 Å²	167.9	87%	0.872	85%	0.846	S	S	*	*			trans	-147.1	90.6	163.8	-90.8	-172.4	175.1	172.6	-2.3	108.6
699	N	46.3	Very low	43.6	Very low	164 Å²	164	164.5 Å²	164.5	88%	0.877	84%	0.842	S	S	*	*			trans	174.5	73.7	142.5	-88.1	-13.9	0	0	0	110.3
700	V	39.8	Very low	43.4	Very low	144 Å²	144	164.4 Å²	164.4	87%	0.873	84%	0.842	S	S	*	*			trans	-139.4	102.3	147.8	-174.4	0	0	0	0	107	Q702	V700-Q702 PolarHBondContact O-N 3.33Å
701	A	36.3	Very low	43.4	Very low	87 Å²	87	162.4 Å²	162.4	72%	0.719	84%	0.836	S	S	*	*			trans	-58.4	127.8	172.2	0	0	0	0	0	109.9	K703	A701-K703 PolarHBondContact O-N 2.91Å
702	Q	45.3	Very low	43.1	Very low	200 Å²	200	156.9 Å²	156.9	94%	0.935	83%	0.834	S	S	*	*			trans	-63.6	99	163.3	-80.2	177	-32	0	0	108.7	V700	V700-Q702 PolarHBondContact O-N 3.33Å
703	K	35.4	Very low	43.1	Very low	197 Å²	197	152.1 Å²	152.1	86%	0.857	81%	0.808	S	S	*	*			trans	-85.6	115.7	159.5	-80.7	-175.1	176.8	-179.5	0	107.9	A701	A701-K703 PolarHBondContact O-N 2.91Å
704	R	38.7	Very low	43.3	Very low	239 Å²	239	153.5 Å²	153.5	90%	0.902	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-48.4	140.1	164.7	-69.6	175.1	171.3	177.1	-4	109.1	A706	R704-A706 PolarHBondContact O-N 3.3Å; R704-A706 VanDerWaalsContact O-N 3.14Å
705	S	37.5	Very low	43	Very low	119 Å²	119	144.8 Å²	144.8	83%	0.832	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-46.5	116.3	172	45.7	0	0	0	0	110.6
706	A	38.9	Very low	43.3	Very low	95 Å²	95	143.6 Å²	143.6	79%	0.785	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-71.3	125.9	166.9	0	0	0	0	0	108.2	R704	R704-A706 PolarHBondContact O-N 3.3Å; R704-A706 VanDerWaalsContact O-N 3.14Å
707	S	44.9	Very low	43.6	Very low	105 Å²	105	140.9 Å²	140.9	73%	0.734	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-53.1	143.8	164.1	-46.8	0	0	0	0	109.6	T709	S707-T709 PolarHBondContact O-N 2.88Å
708	P	41.6	Very low	44.2	Very low	127 Å²	127	136.6 Å²	136.6	83%	0.825	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-62.1	134	179.9	23.7	-29.3	0	0	0	110.5
709	T	42.1	Very low	44.5	Very low	133 Å²	133	138.4 Å²	138.4	82%	0.816	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-59.5	141.8	175.7	26.5	0	0	0	0	111.7	S707	S707-T709 PolarHBondContact O-N 2.88Å
710	P	42.1	Very low	44.7	Very low	124 Å²	124	134.3 Å²	134.3	81%	0.805	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-69.4	143.7	179.9	28.6	-32.9	0	0	0	111.5	S712	P710-S712 PolarHBondContact O-N 3.3Å
711	L	41	Very low	45.5	Very low	152 Å²	152	131.3 Å²	131.3	80%	0.796	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-57.8	131.6	171.5	-72.6	157.2	0	0	0	110.1	G713	L711-G713 PolarHBondContact O-N 2.8Å; L711-G713 VanDerWaalsContact O-N 3.09Å
712	S	40.6	Very low	46.2	Very low	119 Å²	119	128.8 Å²	128.8	83%	0.832	73%	0.734	S	S	*	*			trans	-68.1	99.3	174.2	172	0	0	0	0	110.1	P710	P710-S712 PolarHBondContact O-N 3.3Å
713	G	46.5	Very low	46.3	Very low	25 Å²	25	126.1 Å²	126.1	26%	0.258	72%	0.722	S	S	.	*	P	Polyproline II helix	trans	-91.5	136.6	165.5	0	0	0	0	0	111	L711 V715	L711-G713 PolarHBondContact O-N 2.8Å; L711-G713 VanDerWaalsContact O-N 3.09Å; G713-V715 PolarHBondContact O-N 3.43Å
714	N	48.2	Very low	46.9	Very low	124 Å²	124	119.6 Å²	119.6	66%	0.663	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-66.4	127.1	175.4	-75.7	-25.8	0	0	0	110.4	F716	N714-F716 HydrophobicContact CB-CE2 4.02Å; N714-F716 HydrophobicContact CB-CZ 4.26Å
715	V	50.1	Low	47	Very low	75 Å²	75	111.8 Å²	111.8	46%	0.455	68%	0.683	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.4	125.7	-177.6	-178.8	0	0	0	0	110	G713 Q723 V725	G713-V715 PolarHBondContact O-N 3.43Å; V715-Q723 HydrophobicContact CG1-CB 3.91Å; V715-Q723 HydrophobicContact CG1-CG 3.73Å; V715-V725 HydrophobicContact CG2-CG2 4.37Å
716	F	52.9	Low	47.3	Very low	147 Å²	147	114 Å²	114	65%	0.645	68%	0.68	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-113.7	140.6	172.3	-59.4	-83.1	0	0	0	111.1	N714	N714-F716 HydrophobicContact CB-CE2 4.02Å; N714-F716 HydrophobicContact CB-CZ 4.26Å
717	K	51.7	Low	47.3	Very low	186 Å²	186	116.8 Å²	116.8	81%	0.809	68%	0.675	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-83.3	130.3	174	-78.2	-174.5	176.5	179.8	0	110.1
718	T	60.3	Low	47.4	Very low	75 Å²	75	117.4 Å²	117.4	46%	0.46	68%	0.675	S	S	.	*			trans	-91.9	154.2	172.7	64.1	0	0	0	0	111.1	G720 G721 G722	T718-G720 PolarHBondContact O-N 3.27Å; T718-G721 VanDerWaalsContact O-N 3.14Å; T718-G721 PolarHBondContact O-N 2.91Å; T718-G722 PolarHBondContact N-O 3.4Å; T718-G722 VanDerWaalsContact N-O 3.07Å; T718-G722 PolarHBondContact OG1-O 3.36Å
719	R	53.8	Low	47.5	Very low	270 Å²	270	118.4 Å²	118.4	100%	1.019	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	-4.5	-177.7	-88	-176.6	168	178.5	-3.4	115.2
720	G	52.2	Low	47.2	Very low	77 Å²	77	120 Å²	120	79%	0.794	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107	15.9	175.7	0	0	0	0	0	114.8	T718 G722	T718-G720 PolarHBondContact O-N 3.27Å; G720-G722 PolarHBondContact O-N 2.82Å
721	G	54.9	Low	47	Very low	81 Å²	81	123 Å²	123	84%	0.835	68%	0.678	S	S	*	*	S	Bend	trans	84	3.2	173	0	0	0	0	0	116.5	T718	T718-G721 VanDerWaalsContact O-N 3.14Å; T718-G721 PolarHBondContact O-N 2.91Å
722	G	51.9	Low	46.7	Very low	35 Å²	35	121.6 Å²	121.6	36%	0.361	68%	0.676	S	S	.	*			trans	-101.8	155	174	0	0	0	0	0	114.3	T718 G720	T718-G722 PolarHBondContact N-O 3.4Å; T718-G722 VanDerWaalsContact N-O 3.07Å; T718-G722 PolarHBondContact OG1-O 3.36Å; G720-G722 PolarHBondContact O-N 2.82Å
723	Q	47.9	Very low	46.5	Very low	144 Å²	144	124.5 Å²	124.5	67%	0.673	68%	0.681	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-100.4	140.9	172.7	-75.4	178.8	-23.7	0	0	111.2	V715	V715-Q723 HydrophobicContact CG1-CB 3.91Å; V715-Q723 HydrophobicContact CG1-CG 3.73Å
724	A	46.4	Very low	45.9	Very low	60 Å²	60	132.7 Å²	132.7	50%	0.496	71%	0.709	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.9	146.6	173.8	0	0	0	0	0	111.3
725	V	41.1	Very low	45	Very low	74 Å²	74	136 Å²	136	45%	0.448	72%	0.721	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.1	130.2	-178.5	-172.9	0	0	0	0	109	V715 F727	V715-V725 HydrophobicContact CG2-CG2 4.37Å; V725-F727 HydrophobicContact CB-CE2 4.31Å; V725-F727 HydrophobicContact CG1-CD2 4.41Å; V725-F727 HydrophobicContact CG1-CE2 3.89Å; V725-F727 HydrophobicContact CG1-CZ 4.03Å
726	E	43.8	Very low	44.2	Very low	166 Å²	166	141.3 Å²	141.3	78%	0.776	74%	0.741	S	S	*	*			trans	-99.9	128.1	176.7	-171.2	172.9	-155.8	0	0	110.3
727	F	38.9	Very low	43.2	Very low	153 Å²	153	141.3 Å²	141.3	67%	0.671	75%	0.748	S	S	*	*			trans	-111.5	117.3	173.8	-68.6	-84.4	0	0	0	108.9	V725	V725-F727 HydrophobicContact CB-CE2 4.31Å; V725-F727 HydrophobicContact CG1-CD2 4.41Å; V725-F727 HydrophobicContact CG1-CE2 3.89Å; V725-F727 HydrophobicContact CG1-CZ 4.03Å
728	T	48.2	Very low	43.3	Very low	119 Å²	119	137 Å²	137	73%	0.73	74%	0.738	S	S	*	*			trans	-89.8	104.5	170.3	48	0	0	0	0	109.3
729	D	42.4	Very low	41.9	Very low	148 Å²	148	139.7 Å²	139.7	79%	0.791	76%	0.755	S	S	*	*			trans	136.6	111.6	153	-72.8	-16.7	0	0	0	110.3
730	I	36.6	Very low	40.7	Very low	165 Å²	165	131.1 Å²	131.1	85%	0.846	74%	0.742	S	S	*	*			trans	-166.3	131	142.1	-91.5	145.8	0	0	0	109.1
731	E	37.9	Very low	39.8	Very low	187 Å²	187	133.9 Å²	133.9	87%	0.874	75%	0.746	S	S	*	*			trans	-51.1	141.4	168.7	-65.8	168.4	135.7	0	0	112.5
732	T	33.9	Very low	38.5	Very low	123 Å²	123	135.6 Å²	135.6	76%	0.755	75%	0.745	S	S	*	*			trans	-118.8	111.8	166.3	36.7	0	0	0	0	111
733	L	37.2	Very low	37.5	Very low	180 Å²	180	146.1 Å²	146.1	94%	0.942	77%	0.774	S	S	*	*			trans	-53.9	134.9	151.2	-94.6	142.6	0	0	0	109.5
734	K	32.8	Very low	36.6	Very low	197 Å²	197	149 Å²	149	86%	0.857	78%	0.784	S	S	*	*			trans	-134.7	136.6	164.3	-86.6	-171	176.5	180	0	112.2
735	Q	30.7	Very low	35.7	Very low	195 Å²	195	158.1 Å²	158.1	91%	0.911	81%	0.806	S	S	*	*			trans	-103.8	148.5	174.8	-168.2	177.2	-0.3	0	0	108.2
736	E	33.2	Very low	35.2	Very low	186 Å²	186	166.5 Å²	166.5	87%	0.869	83%	0.829	S	S	*	*			trans	-54.6	128.4	-178.3	-77.9	-179	161.9	0	0	114.8
737	D	31.3	Very low	34.6	Very low	147 Å²	147	164.5 Å²	164.5	79%	0.786	83%	0.833	S	S	*	*				102.4	160.9	88.7	-141.1	26.1	0	0	0	110
738	P	53.1	Low	34.1	Very low	94 Å²	94	160.8 Å²	160.8	61%	0.61	84%	0.839	S	S	*	*			cis	-137.8	-176.6	-0.7	34.1	-10.4	0	0	0	115.9
739	T	30.9	Very low	33.3	Very low	132 Å²	132	161.3 Å²	161.3	81%	0.81	85%	0.847	S	S	*	*			trans	119.3	117.1	151.7	65.1	0	0	0	0	120.5
740	A	29.6	Very low	32.7	Very low	90 Å²	90	158 Å²	158	74%	0.744	85%	0.848	S	S	*	*			trans	55.1	128.9	146	0	0	0	0	0	122.2
741	P	32.5	Very low	32.5	Very low	135 Å²	135	159.7 Å²	159.7	88%	0.877	85%	0.852	S	S	*	*			trans	-94.6	112.1	171.1	34.6	-26.6	0	0	0	112.3
742	S	27.8	Very low	32.1	Very low	117 Å²	117	154.2 Å²	154.2	82%	0.818	85%	0.846	S	S	*	*			trans	-92.9	103.8	161.4	-57.3	0	0	0	0	109.3	K744	S742-K744 PolarHBondContact O-N 2.95Å
743	R	31.3	Very low	32.5	Very low	256 Å²	256	154.5 Å²	154.5	97%	0.966	85%	0.85	S	S	*	*			trans	-65.2	113.8	172.2	-107.2	176.9	172.4	172.9	-2.2	110.2
744	K	29.1	Very low	32.1	Very low	205 Å²	205	150.4 Å²	150.4	89%	0.891	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-78	137.3	164.5	-99.9	-179.5	177.7	176.7	0	110.8	S742	S742-K744 PolarHBondContact O-N 2.95Å
745	R	28.4	Very low	32	Very low	251 Å²	251	149.5 Å²	149.5	95%	0.947	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-53	145	163.2	-81.9	172.3	154.7	-178.8	-7.2	112
746	R	29.4	Very low	31.9	Very low	251 Å²	251	146.5 Å²	146.5	95%	0.947	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-93.5	130	160.4	-132	178.7	-172.8	-172.8	1.4	107.9
747	S	30.9	Very low	31.8	Very low	123 Å²	123	145 Å²	145	86%	0.86	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-88.9	142.5	171.1	45.4	0	0	0	0	110.5
748	G	29	Very low	31.7	Very low	76 Å²	76	145.1 Å²	145.1	78%	0.784	84%	0.835	S	S	*	*			trans	-170	98.7	171.4	0	0	0	0	0	110.4
749	S	31.6	Very low	30.7	Very low	130 Å²	130	147.2 Å²	147.2	91%	0.909	84%	0.839	S	S	*	*			trans	-30.3	143.2	171.4	47.5	0	0	0	0	119.5
750	G	30	Very low	30.8	Very low	79 Å²	79	148.5 Å²	148.5	81%	0.814	84%	0.836	S	S	*	*			trans	-165.9	129.5	158	0	0	0	0	0	109.9
751	E	32.4	Very low	30.8	Very low	199 Å²	199	151.4 Å²	151.4	93%	0.93	84%	0.839	S	S	*	*			trans	-66.5	159.2	-166.8	-65.1	164.8	135.7	0	0	115.7
752	G	29.3	Very low	30.9	Very low	72 Å²	72	156.2 Å²	156.2	74%	0.742	84%	0.84	S	S	*	*			trans	-74.5	-174.5	-177.9	0	0	0	0	0	115.7
753	P	42.3	Very low	31.4	Very low	130 Å²	130	156.3 Å²	156.3	84%	0.844	84%	0.838	S	S	*	*				-144.7	160.7	67.9	35.3	-15.1	0	0	0	118.1
754	A	29.6	Very low	32.1	Very low	93 Å²	93	149.9 Å²	149.9	77%	0.769	83%	0.829	S	S	*	*			trans	10.5	133.8	153.6	0	0	0	0	0	123
755	Q	29.2	Very low	32.3	Very low	179 Å²	179	147.2 Å²	147.2	84%	0.836	83%	0.83	S	S	*	*				-175.1	119.2	106.7	-104.5	175.8	-1.4	0	0	113.4
756	T	29.6	Very low	32.4	Very low	132 Å²	132	139.7 Å²	139.7	81%	0.81	82%	0.821	S	S	*	*			trans	41.5	126.9	139.5	50.2	0	0	0	0	123.3
757	D	30.9	Very low	32.4	Very low	153 Å²	153	135.6 Å²	135.6	82%	0.818	82%	0.818	S	S	*	*			trans	-57	152.7	162.5	-64.2	-60.3	0	0	0	114.9
758	D	29	Very low	32.5	Very low	151 Å²	151	137.7 Å²	137.7	81%	0.807	82%	0.818	S	S	*	*			trans	-162.1	112	137.1	-97.6	-28.6	0	0	0	112.2
759	I	32.6	Very low	32.6	Very low	137 Å²	137	139.4 Å²	139.4	70%	0.703	82%	0.818	S	S	*	*				41.8	130.8	119.7	-62	175.7	0	0	0	121.1
760	E	32.3	Very low	32.6	Very low	160 Å²	160	138.2 Å²	138.2	75%	0.748	81%	0.81	S	S	*	*			trans	54.2	120.5	153.1	-73.1	173.1	167.3	0	0	122
761	N	30.3	Very low	32.7	Very low	151 Å²	151	139.2 Å²	139.2	81%	0.807	80%	0.804	S	S	*	*				175.4	136	97.7	-98.8	-51.3	0	0	0	113.7
762	R	35.1	Very low	32.6	Very low	235 Å²	235	139 Å²	139	89%	0.887	80%	0.803	S	S	*	*			trans	-83.7	153.4	155.5	-99.9	-178.5	173.6	-175.1	-1	109
763	P	36.8	Very low	32.7	Very low	119 Å²	119	138.6 Å²	138.6	77%	0.773	80%	0.799	S	S	*	*				-141.1	173.3	118	26.7	-6.4	0	0	0	114.3
764	P	46.1	Very low	32.2	Very low	121 Å²	121	143.1 Å²	143.1	79%	0.786	80%	0.8	S	S	*	*			trans	-108.5	169	-151.3	40.1	-31.7	0	0	0	114.3
765	V	32.8	Very low	32.3	Very low	149 Å²	149	147.2 Å²	147.2	90%	0.903	80%	0.804	S	S	*	*			trans	-118.3	132.6	166.6	-176.3	0	0	0	0	109.8
766	A	31.2	Very low	32.6	Very low	93 Å²	93	148.1 Å²	148.1	77%	0.769	81%	0.805	S	S	*	*			trans	-76.5	143.1	-165.5	0	0	0	0	0	114.5
767	N	30.1	Very low	32.8	Very low	165 Å²	165	153.9 Å²	153.9	88%	0.882	81%	0.812	S	S	*	*			trans	-90.6	137.5	161.9	-93.9	-24.5	0	0	0	109.4
768	I	32.7	Very low	33.7	Very low	168 Å²	168	158 Å²	158	86%	0.862	82%	0.815	S	S	*	*			trans	-120	129.5	157.3	-67.3	175.8	0	0	0	107.9
769	S	31.8	Very low	34	Very low	112 Å²	112	161.4 Å²	161.4	78%	0.783	82%	0.817	S	S	*	*			trans	-99.6	147.1	177.5	48.6	0	0	0	0	111.5
770	S	31.3	Very low	35.2	Very low	105 Å²	105	163.5 Å²	163.5	73%	0.734	84%	0.84	S	S	*	*			trans	-166.3	100.6	138.8	48.4	0	0	0	0	106.8
771	S	32	Very low	35.3	Very low	99 Å²	99	163.7 Å²	163.7	69%	0.692	84%	0.844	S	S	*	*				51.3	110.2	92.3	69.1	0	0	0	0	114.3
772	H	30.7	Very low	35.6	Very low	196 Å²	196	164.3 Å²	164.3	91%	0.907	85%	0.846	S	S	*	*				-168.2	131.2	121.4	-99.4	66.9	0	0	0	108.9
773	G	31.3	Very low	35.6	Very low	63 Å²	63	160.4 Å²	160.4	65%	0.649	84%	0.844	S	S	*	*			trans	-115.1	-177.9	-177.2	0	0	0	0	0	113.8
774	Y	31.4	Very low	35.6	Very low	225 Å²	225	162.8 Å²	162.8	88%	0.882	85%	0.848	S	S	*	*			trans	77.8	139.2	173.9	-66.9	-81.3	0	0	0	115.6
775	Q	30.3	Very low	34.9	Very low	179 Å²	179	165.4 Å²	165.4	84%	0.836	85%	0.852	S	S	*	*			cis	-162.6	153.6	27.4	-139.7	168.1	20	0	0	112.6
776	K	36.6	Very low	35	Very low	198 Å²	198	166.5 Å²	166.5	86%	0.861	85%	0.849	S	S	*	*			trans	-55	150.5	170.4	-71.6	165.3	168.4	169.1	0	113.9
777	R	34.3	Very low	35.3	Very low	253 Å²	253	171.8 Å²	171.8	96%	0.955	85%	0.854	S	S	*	*				-166.4	143.8	121.3	-107.8	174.2	-175.4	-157.2	1.4	114.2
778	R	48.6	Very low	35.7	Very low	238 Å²	238	172.3 Å²	172.3	90%	0.898	85%	0.852	S	S	*	*			trans	-80.3	147.5	-179.1	-84.2	176.5	163.8	-177.6	-5.2	112.1
779	R	35.1	Very low	36	Very low	223 Å²	223	172.7 Å²	172.7	84%	0.842	85%	0.851	S	S	*	*				37	152.7	126.4	-80.2	-167.9	-173.4	-162	4.1	120.4
780	P	58.5	Low	36.4	Very low	181 Å²	181	178.2 Å²	178.2	100%	1.175	86%	0.858	S	S	*	*				-93.3	0	64.3	-18.5	34.7	0	0	0	115.6

Retrieved 780 of 780 residues in 483.7 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).