A0A077Z469_TRITR Loading...

Condensin complex subunit 2

AlphaFold DB , UniProt , Accession A0A077Z469, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 669 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.5	Very low	38.7	Very low	238 Å²	238	163.6 Å²	163.6	100%	1.172	84%	0.838	S	S	*	*				0	78.5	0	-72.5	142.5	144.3	0	0	106.9
2	N	36.3	Very low	38.4	Very low	148 Å²	148	160.8 Å²	160.8	79%	0.791	84%	0.843	S	S	*	*				55.1	124.6	74.2	-70.5	-4.2	0	0	0	114.1
3	R	37.6	Very low	38.3	Very low	225 Å²	225	153.9 Å²	153.9	85%	0.849	84%	0.836	S	S	*	*			cis	-176	144.4	-7.2	-121.2	-178.5	-172.9	-161.7	2	110.3
4	S	40.6	Very low	38.2	Very low	99 Å²	99	152.1 Å²	152.1	69%	0.692	84%	0.84	S	S	*	*			trans	76.5	130.4	135.5	85.8	0	0	0	0	128.3
5	R	40	Very low	38.3	Very low	232 Å²	232	148.5 Å²	148.5	88%	0.875	84%	0.838	S	S	*	*			trans	74.2	132.1	133.9	-77.3	179.1	-172.7	163.7	0.8	121.5
6	V	40.8	Very low	38.2	Very low	133 Å²	133	146.9 Å²	146.9	81%	0.806	84%	0.839	S	S	*	*			cis	100.6	116.3	21.6	176.6	0	0	0	0	115.6
7	S	40.6	Very low	38.4	Very low	95 Å²	95	149.1 Å²	149.1	66%	0.664	84%	0.837	S	S	*	*				137.9	133.2	119	68.5	0	0	0	0	119
8	N	37.1	Very low	38.4	Very low	162 Å²	162	151.2 Å²	151.2	87%	0.866	84%	0.839	S	S	*	*			trans	85.6	117.8	145.4	-61	-7.4	0	0	0	122.1
9	G	36.4	Very low	38.9	Very low	67 Å²	67	150.7 Å²	150.7	69%	0.691	83%	0.833	S	S	*	*			trans	-159.9	121.9	157.7	0	0	0	0	0	109.1
10	D	38.5	Very low	39.3	Very low	166 Å²	166	147.6 Å²	147.6	89%	0.888	83%	0.829	S	S	*	*			trans	-123.8	146.4	177.3	-82.5	-35.9	0	0	0	111
11	Y	35.8	Very low	39.7	Very low	235 Å²	235	149.1 Å²	149.1	92%	0.922	83%	0.829	S	S	*	*			trans	-82.3	142.2	-162.8	-82	-109.3	0	0	0	115.2
12	S	35.4	Very low	40.6	Very low	129 Å²	129	142.6 Å²	142.6	90%	0.902	81%	0.805	S	S	*	*			trans	-169.5	132	152.1	177.4	0	0	0	0	109.8
13	G	37.8	Very low	42.4	Very low	72 Å²	72	140 Å²	140	74%	0.742	79%	0.79	S	S	*	*			trans	158.9	76.8	174.7	0	0	0	0	0	114.3
14	S	35.9	Very low	44.2	Very low	129 Å²	129	134.4 Å²	134.4	90%	0.902	78%	0.778	S	S	*	*			trans	-66.6	127.3	177.7	-34.2	0	0	0	0	112
15	A	40.9	Very low	45.9	Very low	98 Å²	98	133.7 Å²	133.7	81%	0.81	76%	0.763	S	S	*	*			trans	-112	118.4	165.9	0	0	0	0	0	109	F17	A15-F17 PolarHBondContact O-N 3.27Å
16	S	36.7	Very low	47.7	Very low	122 Å²	122	124.1 Å²	124.1	85%	0.853	73%	0.734	S	S	*	*			trans	-59	117.3	179.3	-66.4	0	0	0	0	112.1
17	F	41.4	Very low	49.5	Very low	184 Å²	184	122.8 Å²	122.8	81%	0.807	72%	0.722	S	S	*	*			trans	-94.3	111.7	160.7	-156.9	-97.8	0	0	0	107	A15 I19	A15-F17 PolarHBondContact O-N 3.27Å; F17-I19 HydrophobicContact CD1-CD1 4.47Å; F17-I19 HydrophobicContact CD1-CG1 3.87Å; F17-I19 HydrophobicContact CE1-CG1 4.5Å; F17-I19 PolarHBondContact O-N 3.47Å
18	Q	37.8	Very low	51.3	Low	187 Å²	187	123.8 Å²	123.8	87%	0.874	72%	0.715	S	S	*	*			trans	-71.1	92.4	177.9	-70.9	178	-8.8	0	0	108.9
19	I	47.2	Very low	53.4	Low	142 Å²	142	122.1 Å²	122.1	73%	0.728	70%	0.696	S	S	*	*			trans	-87.2	109.6	161.5	-57.5	177.7	0	0	0	104.4	F17 E21	F17-I19 HydrophobicContact CD1-CD1 4.47Å; F17-I19 HydrophobicContact CD1-CG1 3.87Å; F17-I19 HydrophobicContact CE1-CG1 4.5Å; F17-I19 PolarHBondContact O-N 3.47Å; I19-E21 PolarHBondContact O-N 3.14Å; I19-E21 VanDerWaalsContact O-N 3.14Å
20	A	47.3	Very low	55.5	Low	89 Å²	89	121.9 Å²	121.9	74%	0.736	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-53.5	120.9	178.3	0	0	0	0	0	108.8
21	E	47.3	Very low	57.1	Low	179 Å²	179	120.7 Å²	120.7	84%	0.836	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-52.7	131.4	170.1	-86.6	-174.9	148.3	0	0	108.1	I19 D23	I19-E21 PolarHBondContact O-N 3.14Å; I19-E21 VanDerWaalsContact O-N 3.14Å; E21-D23 PolarHBondContact O-N 3.45Å
22	P	60.4	Low	59	Low	102 Å²	102	116.3 Å²	116.3	66%	0.662	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-56.9	116.6	168.5	24.4	-29.8	0	0	0	107	D24	P22-D24 PolarHBondContact O-N 3.27Å
23	D	74.7	Confident	60.9	Low	92 Å²	92	117.2 Å²	117.2	49%	0.492	64%	0.641	S	S	.	*			trans	-68.3	86.3	179.2	-179.4	3.8	0	0	0	108.3	E21 E25 A26 D27	E21-D23 PolarHBondContact O-N 3.45Å; D23-E25 PolarHBondContact O-N 3.36Å; D23-E25 WeakPolarHBondContact OD1-CA 3.29Å; D23-E25 VanDerWaalsContact OD1-CB 3.23Å; D23-E25 WeakPolarHBondContact OD1-CB 3.2Å; D23-E25 PolarHBondContact OD1-N 3.41Å; D23-E25 VanDerWaalsContact OD1-N 3.09Å; D23-A26 HydrophobicContact CB-CB 3.81Å; D23-A26 VanDerWaalsContact CG-N 3.33Å; D23-A26 WeakPolarHBondContact O-CA 3.47Å; D23-A26 WeakPolarHBondContact O-CB 3.41Å; D23-A26 PolarHBondContact O-N 3.46Å; D23-A26 PolarHBondContact OD1-N 2.89Å; D23-A26 VanDerWaalsContact OD2-CB 3.27Å; D23-A26 WeakPolarHBondContact OD2-CB 3.49Å; D23-D27 PolarHBondContact O-N 3.19Å
24	D	75.2	Confident	62.6	Low	109 Å²	109	122.1 Å²	122.1	58%	0.583	64%	0.638	S	S	*	*	H	α-helix	trans	-52.4	-25.5	174.6	-76.5	-25	0	0	0	111.4	P22 K28	P22-D24 PolarHBondContact O-N 3.27Å; D24-K28 VanDerWaalsContact O-CB 3.31Å; D24-K28 WeakPolarHBondContact O-CB 3.3Å; D24-K28 WeakPolarHBondContact O-CG 3.16Å; D24-K28 PolarHBondContact O-N 2.86Å
25	E	75.8	Confident	63.8	Low	83 Å²	83	122.7 Å²	122.7	39%	0.388	62%	0.624	S	S	.	*	H	α-helix	trans	-78.8	-33.6	176.7	-157.8	62	-149	0	0	111.6	D23 R29 R32	D23-E25 PolarHBondContact O-N 3.36Å; D23-E25 WeakPolarHBondContact OD1-CA 3.29Å; D23-E25 VanDerWaalsContact OD1-CB 3.23Å; D23-E25 WeakPolarHBondContact OD1-CB 3.2Å; D23-E25 PolarHBondContact OD1-N 3.41Å; D23-E25 VanDerWaalsContact OD1-N 3.09Å; E25-R29 WeakPolarHBondContact O-CB 3.29Å; E25-R29 PolarHBondContact O-N 3.42Å; E25-R32 IonicContact OE1-NH2 2.73Å; E25-R32 PolarHBondContact OE1-NH2 3.42Å
26	A	79.3	Confident	64.9	Low	31 Å²	31	127.7 Å²	127.7	26%	0.256	62%	0.622	S	S	.	*	H	α-helix	trans	-66.2	-43.4	168.2	0	0	0	0	0	111.6	D23 R29 V30	D23-A26 HydrophobicContact CB-CB 3.81Å; D23-A26 VanDerWaalsContact CG-N 3.33Å; D23-A26 WeakPolarHBondContact O-CA 3.47Å; D23-A26 WeakPolarHBondContact O-CB 3.41Å; D23-A26 PolarHBondContact O-N 3.46Å; D23-A26 PolarHBondContact OD1-N 2.89Å; D23-A26 VanDerWaalsContact OD2-CB 3.27Å; D23-A26 WeakPolarHBondContact OD2-CB 3.49Å; A26-R29 CarbonylContact O-C 3.58Å; A26-R29 WeakPolarHBondContact O-CA 2.98Å; A26-R29 WeakPolarHBondContact O-CB 3.35Å; A26-R29 PolarHBondContact O-N 3.44Å; A26-V30 WeakPolarHBondContact O-CG2 3.39Å; A26-V30 PolarHBondContact O-N 3.27Å
27	D	78.8	Confident	66.1	Low	106 Å²	106	129.5 Å²	129.5	57%	0.567	62%	0.619	S	S	*	*	H	α-helix	trans	-67	-38.8	176.7	-91.5	-8.2	0	0	0	111.9	D23 R29 V30 M31	D23-D27 PolarHBondContact O-N 3.19Å; D27-R29 VanDerWaalsContact C-N 3.28Å; D27-R29 PolarHBondContact O-N 2.94Å; D27-V30 PolarHBondContact O-N 2.88Å; D27-M31 WeakPolarHBondContact O-CB 3.33Å; D27-M31 PolarHBondContact O-N 3.09Å
28	K	77.7	Confident	66.7	Low	115 Å²	115	128.6 Å²	128.6	50%	0.5	62%	0.617	S	S	.	*	H	α-helix	trans	-63.3	-31.5	168.3	-78.1	170.5	-173.3	165.6	0	112.9	D24 R32	D24-K28 VanDerWaalsContact O-CB 3.31Å; D24-K28 WeakPolarHBondContact O-CB 3.3Å; D24-K28 WeakPolarHBondContact O-CG 3.16Å; D24-K28 PolarHBondContact O-N 2.86Å; K28-R32 WeakPolarHBondContact O-CB 3.42Å; K28-R32 WeakPolarHBondContact O-CG 3.32Å; K28-R32 PolarHBondContact O-N 3.29Å; K28-R32 PolarHBondContact O-NE 3.19Å
29	R	81.3	Confident	67.5	Low	127 Å²	127	123.8 Å²	123.8	48%	0.479	60%	0.601	S	S	.	*	H	α-helix	trans	-76.4	-35.6	177.3	-161.5	-178.9	-65	113.2	-1.5	111.3	E25 A26 D27 R32 K33	E25-R29 WeakPolarHBondContact O-CB 3.29Å; E25-R29 PolarHBondContact O-N 3.42Å; A26-R29 CarbonylContact O-C 3.58Å; A26-R29 WeakPolarHBondContact O-CA 2.98Å; A26-R29 WeakPolarHBondContact O-CB 3.35Å; A26-R29 PolarHBondContact O-N 3.44Å; D27-R29 VanDerWaalsContact C-N 3.28Å; D27-R29 PolarHBondContact O-N 2.94Å; R29-R32 PolarHBondContact O-N 3.33Å; R29-K33 WeakPolarHBondContact O-CB 3.33Å; R29-K33 PolarHBondContact O-N 3.12Å
30	V	80.4	Confident	67.3	Low	63 Å²	63	119.1 Å²	119.1	38%	0.382	58%	0.583	S	S	.	*	H	α-helix	trans	-68.7	-42.7	171.3	173	0	0	0	0	110.4	A26 D27 K33 R34	A26-V30 WeakPolarHBondContact O-CG2 3.39Å; A26-V30 PolarHBondContact O-N 3.27Å; D27-V30 PolarHBondContact O-N 2.88Å; V30-K33 PolarHBondContact O-N 2.95Å; V30-R34 WeakPolarHBondContact O-CB 3.49Å; V30-R34 PolarHBondContact O-N 3.46Å
31	M	73	Confident	66.8	Low	141 Å²	141	120.3 Å²	120.3	70%	0.695	58%	0.583	S	S	*	*	H	α-helix	trans	-60.3	-46	170.2	-89.6	-156.8	-159.3	0	0	111.2	D27 K33 R34 F35	D27-M31 WeakPolarHBondContact O-CB 3.33Å; D27-M31 PolarHBondContact O-N 3.09Å; M31-K33 VanDerWaalsContact C-N 3.3Å; M31-K33 PolarHBondContact O-N 2.71Å; M31-R34 PolarHBondContact O-N 3.33Å; M31-F35 VanDerWaalsContact O-CB 3.25Å; M31-F35 WeakPolarHBondContact O-CB 3.36Å; M31-F35 PolarHBondContact O-N 3.18Å
32	R	75.4	Confident	66.4	Low	143 Å²	143	119.6 Å²	119.6	54%	0.54	59%	0.585	S	S	.	*	H	α-helix	trans	-60.2	-38.3	175	-83.3	-178.2	-83.8	-161.3	-3	112.2	E25 K28 R29 R36	E25-R32 IonicContact OE1-NH2 2.73Å; E25-R32 PolarHBondContact OE1-NH2 3.42Å; K28-R32 WeakPolarHBondContact O-CB 3.42Å; K28-R32 WeakPolarHBondContact O-CG 3.32Å; K28-R32 PolarHBondContact O-N 3.29Å; K28-R32 PolarHBondContact O-NE 3.19Å; R29-R32 PolarHBondContact O-N 3.33Å; R32-R36 WeakPolarHBondContact O-CB 3.4Å; R32-R36 PolarHBondContact O-N 2.95Å
33	K	75	Confident	65.1	Low	147 Å²	147	120.2 Å²	120.2	64%	0.639	59%	0.592	S	S	*	*	H	α-helix	trans	-69.7	-41.4	174.7	-85.2	-175.7	175.5	-178.7	0	112.7	R29 V30 M31 R36 M37	R29-K33 WeakPolarHBondContact O-CB 3.33Å; R29-K33 PolarHBondContact O-N 3.12Å; V30-K33 PolarHBondContact O-N 2.95Å; M31-K33 VanDerWaalsContact C-N 3.3Å; M31-K33 PolarHBondContact O-N 2.71Å; K33-R36 CarbonylContact O-C 3.52Å; K33-R36 PolarHBondContact O-N 3.14Å; K33-M37 WeakPolarHBondContact O-CB 3.49Å; K33-M37 PolarHBondContact O-N 2.83Å
34	R	72.4	Confident	63.2	Low	175 Å²	175	122.4 Å²	122.4	66%	0.66	60%	0.603	S	S	*	*	H	α-helix	trans	-66.1	-47.7	175.7	-80.3	-174.8	178.1	153.5	0.7	111.2	V30 M31 R36 M37 E38	V30-R34 WeakPolarHBondContact O-CB 3.49Å; V30-R34 PolarHBondContact O-N 3.46Å; M31-R34 PolarHBondContact O-N 3.33Å; R34-R36 VanDerWaalsContact C-N 3.27Å; R34-R36 PolarHBondContact O-N 3.26Å; R34-M37 CarbonylContact O-C 3.52Å; R34-M37 WeakPolarHBondContact O-CA 3.42Å; R34-M37 PolarHBondContact O-N 2.91Å; R34-E38 WeakPolarHBondContact O-CB 3.02Å; R34-E38 PolarHBondContact O-N 3.11Å
35	F	61.8	Low	61.1	Low	142 Å²	142	122.8 Å²	122.8	62%	0.623	61%	0.614	S	S	*	*	H	α-helix	trans	-60.4	-39.4	174.9	-142	-88.3	0	0	0	110.6	M31 M37 E38 T39	M31-F35 VanDerWaalsContact O-CB 3.25Å; M31-F35 WeakPolarHBondContact O-CB 3.36Å; M31-F35 PolarHBondContact O-N 3.18Å; F35-M37 VanDerWaalsContact C-N 3.34Å; F35-M37 PolarHBondContact O-N 3.23Å; F35-E38 PolarHBondContact O-N 3.41Å; F35-T39 HydrophobicContact CD1-CG2 3.65Å; F35-T39 HydrophobicContact CE1-CG2 3.69Å; F35-T39 WeakPolarHBondContact O-CA 3.41Å; F35-T39 VanDerWaalsContact O-CB 3.26Å; F35-T39 WeakPolarHBondContact O-CB 3.5Å; F35-T39 VanDerWaalsContact O-CG2 3.27Å; F35-T39 WeakPolarHBondContact O-CG2 3.33Å; F35-T39 PolarHBondContact O-N 3.04Å; F35-T39 PolarHBondContact O-OG1 3.12Å
36	R	63.2	Low	59.1	Low	202 Å²	202	124 Å²	124	76%	0.762	63%	0.632	S	S	*	*	H	α-helix	trans	-75.2	-18.7	175.7	-154.7	178.4	-162.7	179.4	4.3	113.8	R32 K33 R34 A40	R32-R36 WeakPolarHBondContact O-CB 3.4Å; R32-R36 PolarHBondContact O-N 2.95Å; K33-R36 CarbonylContact O-C 3.52Å; K33-R36 PolarHBondContact O-N 3.14Å; R34-R36 VanDerWaalsContact C-N 3.27Å; R34-R36 PolarHBondContact O-N 3.26Å; R36-A40 VanDerWaalsContact O-CA 3.23Å; R36-A40 WeakPolarHBondContact O-CA 3.34Å; R36-A40 WeakPolarHBondContact O-CB 3.47Å; R36-A40 PolarHBondContact O-N 3.2Å
37	M	62.9	Low	56.9	Low	161 Å²	161	128.1 Å²	128.1	79%	0.793	66%	0.656	S	S	*	*	H	α-helix	trans	-86.2	-32.8	170.7	-87.1	178.7	129.7	0	0	112	K33 R34 F35	K33-M37 WeakPolarHBondContact O-CB 3.49Å; K33-M37 PolarHBondContact O-N 2.83Å; R34-M37 CarbonylContact O-C 3.52Å; R34-M37 WeakPolarHBondContact O-CA 3.42Å; R34-M37 PolarHBondContact O-N 2.91Å; F35-M37 VanDerWaalsContact C-N 3.34Å; F35-M37 PolarHBondContact O-N 3.23Å
38	E	54.1	Low	54.8	Low	164 Å²	164	131.9 Å²	131.9	77%	0.766	68%	0.675	S	S	*	*	H	α-helix	trans	-77.8	-32.5	172.5	-91.5	178.5	139.4	0	0	112.2	R34 F35	R34-E38 WeakPolarHBondContact O-CB 3.02Å; R34-E38 PolarHBondContact O-N 3.11Å; F35-E38 PolarHBondContact O-N 3.41Å
39	T	53.5	Low	52.6	Low	87 Å²	87	130.4 Å²	130.4	53%	0.534	68%	0.679	S	S	.	*	S	Bend	trans	-100.1	10.5	171.6	77.7	0	0	0	0	112.2	F35	F35-T39 HydrophobicContact CD1-CG2 3.65Å; F35-T39 HydrophobicContact CE1-CG2 3.69Å; F35-T39 WeakPolarHBondContact O-CA 3.41Å; F35-T39 VanDerWaalsContact O-CB 3.26Å; F35-T39 WeakPolarHBondContact O-CB 3.5Å; F35-T39 VanDerWaalsContact O-CG2 3.27Å; F35-T39 WeakPolarHBondContact O-CG2 3.33Å; F35-T39 PolarHBondContact O-N 3.04Å; F35-T39 PolarHBondContact O-OG1 3.12Å
40	A	42.8	Very low	50.4	Low	43 Å²	43	136.8 Å²	136.8	36%	0.355	70%	0.704	S	S	.	*	S	Bend	trans	-63.4	126.6	167.8	0	0	0	0	0	106.4	R36 L42	R36-A40 VanDerWaalsContact O-CA 3.23Å; R36-A40 WeakPolarHBondContact O-CA 3.34Å; R36-A40 WeakPolarHBondContact O-CB 3.47Å; R36-A40 PolarHBondContact O-N 3.2Å; A40-L42 PolarHBondContact O-N 3.02Å
41	P	38.8	Very low	48.3	Very low	114 Å²	114	137.9 Å²	137.9	74%	0.74	71%	0.71	S	S	*	*			trans	-63	108.7	174	27.1	-29.9	0	0	0	106.2	S43	P41-S43 PolarHBondContact O-N 3.42Å
42	L	37.5	Very low	46.3	Very low	165 Å²	165	135.4 Å²	135.4	86%	0.864	71%	0.706	S	S	*	*			trans	-56.9	100.7	159.9	-70	172.6	0	0	0	105.3	A40 D44	A40-L42 PolarHBondContact O-N 3.02Å; L42-D44 PolarHBondContact O-N 3.2Å
43	S	33.6	Very low	44.3	Very low	115 Å²	115	135.3 Å²	135.3	80%	0.804	72%	0.724	S	S	*	*	S	Bend	trans	-65.1	86	163.3	-79.5	0	0	0	0	106.6	P41	P41-S43 PolarHBondContact O-N 3.42Å
44	D	34.3	Very low	42.7	Very low	138 Å²	138	131.7 Å²	131.7	74%	0.738	72%	0.722	S	S	*	*	S	Bend	trans	-160.5	105.6	139.5	-106.9	-21	0	0	0	106.3	L42	L42-D44 PolarHBondContact O-N 3.2Å
45	S	31.4	Very low	41.2	Very low	117 Å²	117	126.1 Å²	126.1	82%	0.818	71%	0.71	S	S	*	*			trans	36.6	88.8	162.5	56.1	0	0	0	0	116.2
46	S	34.2	Very low	40.2	Very low	108 Å²	108	127.5 Å²	127.5	76%	0.755	72%	0.718	S	S	*	*			trans	-142.5	142.7	170.8	-86.3	0	0	0	0	112.7
47	P	32.8	Very low	39.2	Very low	117 Å²	117	124 Å²	124	76%	0.76	71%	0.714	S	S	*	*				-111	103.1	-126.9	32.3	-20	0	0	0	111
48	L	34.6	Very low	38.3	Very low	186 Å²	186	126.4 Å²	126.4	97%	0.974	72%	0.715	S	S	*	*			trans	-124.7	57.7	164.9	-89.5	147.9	0	0	0	108.9
49	S	32.3	Very low	37.8	Very low	84 Å²	84	128 Å²	128	59%	0.587	71%	0.714	S	S	*	*			trans	-138.9	100	150.3	-168.6	0	0	0	0	103.4	V51	S49-V51 PolarHBondContact O-N 3.16Å; S49-V51 WeakPolarHBondContact OG-CG2 3.28Å
50	R	33.5	Very low	37.7	Very low	261 Å²	261	132.7 Å²	132.7	99%	0.985	73%	0.729	S	S	*	*			trans	-76.8	48	166.9	-133.2	-174.2	-145.5	-168.6	6.8	108.6
51	V	38.3	Very low	38.4	Very low	86 Å²	86	135.2 Å²	135.2	52%	0.521	74%	0.736	S	S	.	*	S	Bend	trans	-72.8	118.7	148.3	173.9	0	0	0	0	103.3	S49 S55	S49-V51 PolarHBondContact O-N 3.16Å; S49-V51 WeakPolarHBondContact OG-CG2 3.28Å; V51-S55 WeakPolarHBondContact CG1-OG 3.26Å
52	S	30.1	Very low	39.5	Very low	88 Å²	88	131.9 Å²	131.9	62%	0.615	72%	0.723	S	S	*	*			trans	-40.4	135.4	171.6	-61.8	0	0	0	0	109.6	A54 S55	S52-A54 PolarHBondContact O-N 3.04Å; S52-S55 PolarHBondContact O-OG 3.49Å
53	P	33.6	Very low	41.1	Very low	141 Å²	141	127 Å²	127	92%	0.916	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	70.3	170	31.6	-32.3	0	0	0	108.3
54	A	40.8	Very low	43.2	Very low	71 Å²	71	125.6 Å²	125.6	59%	0.587	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.4	-6.5	166.4	0	0	0	0	0	110.2	S52 H56	S52-A54 PolarHBondContact O-N 3.04Å; A54-H56 VanDerWaalsContact C-N 3.3Å; A54-H56 PolarHBondContact O-N 2.75Å
55	S	41.2	Very low	45.5	Very low	59 Å²	59	126.1 Å²	126.1	41%	0.413	70%	0.7	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.8	5.2	-175.6	44.8	0	0	0	0	115.3	V51 S52	V51-S55 WeakPolarHBondContact CG1-OG 3.26Å; S52-S55 PolarHBondContact O-OG 3.49Å
56	H	41.2	Very low	48	Very low	170 Å²	170	120.8 Å²	120.8	79%	0.787	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.9	12.2	180	-102.7	-60.9	0	0	0	117	A54	A54-H56 VanDerWaalsContact C-N 3.3Å; A54-H56 PolarHBondContact O-N 2.75Å
57	D	42.2	Very low	50.3	Low	128 Å²	128	117 Å²	117	68%	0.684	64%	0.637	S	S	*	*			trans	-107.4	31.7	161	-124.1	3.2	0	0	0	112.2	R59	D57-R59 PolarHBondContact O-N 3.09Å
58	R	42.8	Very low	52.9	Low	213 Å²	213	116.2 Å²	116.2	80%	0.804	62%	0.623	S	S	*	*			trans	-65.9	16.1	166.3	-79.3	-179.1	77.1	171.6	3.8	113.4	Q60	R58-Q60 VanDerWaalsContact C-N 3.35Å; R58-Q60 PolarHBondContact O-N 3Å
59	R	45.4	Very low	55.4	Low	197 Å²	197	108.6 Å²	108.6	74%	0.743	58%	0.583	S	S	*	*	S	Bend	trans	-81.5	84.6	173.5	-62.8	-175.1	-151.9	-177	6.7	108.8	D57 L61	D57-R59 PolarHBondContact O-N 3.09Å; R59-L61 PolarHBondContact O-N 3.19Å
60	Q	50.5	Low	58.1	Low	185 Å²	185	105.4 Å²	105.4	86%	0.864	56%	0.558	S	S	*	*			trans	44.7	63.3	153.4	-58.6	175.6	14	0	0	114	R58 G62	R58-Q60 VanDerWaalsContact C-N 3.35Å; R58-Q60 PolarHBondContact O-N 3Å; Q60-G62 VanDerWaalsContact C-N 3.31Å; Q60-G62 PolarHBondContact O-N 3.11Å
61	L	57.7	Low	60.8	Low	96 Å²	96	100.5 Å²	100.5	50%	0.503	54%	0.54	S	S	.	.			trans	-59.7	105.4	156.1	-74.6	164.5	0	0	0	105.7	R59 R65 V66 V95	R59-L61 PolarHBondContact O-N 3.19Å; L61-R65 HydrophobicContact CD2-CG 4.02Å; L61-V66 HydrophobicContact CB-CG2 4.19Å; L61-V66 WeakPolarHBondContact O-CG2 3.31Å; L61-V95 HydrophobicContact CD1-CG1 3.99Å
62	G	60.4	Low	63.3	Low	45 Å²	45	101.6 Å²	101.6	46%	0.464	54%	0.54	S	S	.	.			trans	-52	146.6	-175.3	0	0	0	0	0	111	Q60 A64 R65 V66	Q60-G62 VanDerWaalsContact C-N 3.31Å; Q60-G62 PolarHBondContact O-N 3.11Å; G62-A64 PolarHBondContact O-N 2.91Å; G62-R65 WeakPolarHBondContact O-CB 3.37Å; G62-R65 PolarHBondContact O-N 2.64Å; G62-V66 PolarHBondContact O-N 3.04Å
63	G	73.1	Confident	66.2	Low	61 Å²	61	97.5 Å²	97.5	63%	0.629	51%	0.511	S	S	*	.	H	α-helix	trans	-51	-29.1	-173.6	0	0	0	0	0	114.3	V66 A67	G63-V66 PolarHBondContact O-N 3.11Å; G63-A67 WeakPolarHBondContact O-CB 3.22Å; G63-A67 PolarHBondContact O-N 3.24Å
64	A	77.4	Confident	69	Low	87 Å²	87	92.6 Å²	92.6	72%	0.719	48%	0.476	S	S	*	.	H	α-helix	trans	-61.9	-42	172.6	0	0	0	0	0	113.5	G62 E68	G62-A64 PolarHBondContact O-N 2.91Å; A64-E68 PolarHBondContact O-N 3.1Å
65	R	82.8	Confident	71.4	Confident	149 Å²	149	91.2 Å²	91.2	56%	0.562	47%	0.465	S	S	*	.	H	α-helix	trans	-71	-36.7	178.3	-174.1	58.3	175.7	-170.4	2.6	111.4	L61 G62 E68 I69	L61-R65 HydrophobicContact CD2-CG 4.02Å; G62-R65 WeakPolarHBondContact O-CB 3.37Å; G62-R65 PolarHBondContact O-N 2.64Å; R65-E68 PolarHBondContact O-N 3.37Å; R65-I69 HydrophobicContact CG-CD1 4.2Å; R65-I69 VanDerWaalsContact O-CG1 3.3Å; R65-I69 WeakPolarHBondContact O-CG1 3.4Å; R65-I69 PolarHBondContact O-N 3.38Å
66	V	81.9	Confident	73.9	Confident	4 Å²	4	90.2 Å²	90.2	2%	0.024	46%	0.455	C	S	.	.	H	α-helix	trans	-64.2	-45	175	179.9	0	0	0	0	110.6	L61 G62 G63 E68 I69 Y70 V95 A98 L99	L61-V66 HydrophobicContact CB-CG2 4.19Å; L61-V66 WeakPolarHBondContact O-CG2 3.31Å; G62-V66 PolarHBondContact O-N 3.04Å; G63-V66 PolarHBondContact O-N 3.11Å; V66-E68 VanDerWaalsContact C-N 3.28Å; V66-E68 PolarHBondContact O-N 3.06Å; V66-I69 PolarHBondContact O-N 2.95Å; V66-Y70 PolarHBondContact O-N 3.15Å; V66-V95 HydrophobicContact CG1-CB 3.97Å; V66-V95 HydrophobicContact CG1-CG2 4.01Å; V66-V95 HydrophobicContact CG2-CB 4.32Å; V66-V95 HydrophobicContact CG2-CG1 4.46Å; V66-A98 HydrophobicContact CG2-CB 4.48Å; V66-L99 HydrophobicContact CG1-CB 4.18Å; V66-L99 HydrophobicContact CG1-CD1 3.95Å
67	A	82.8	Confident	76.3	Confident	29 Å²	29	84.7 Å²	84.7	24%	0.24	43%	0.43	C	S	.	.	H	α-helix	trans	-62.8	-34.9	176.2	0	0	0	0	0	112.5	G63 R71	G63-A67 WeakPolarHBondContact O-CB 3.22Å; G63-A67 PolarHBondContact O-N 3.24Å; A67-R71 WeakPolarHBondContact O-CG 3.24Å; A67-R71 PolarHBondContact O-N 2.82Å
68	E	87.6	Confident	78.6	Confident	101 Å²	101	85.7 Å²	85.7	47%	0.472	43%	0.432	S	S	.	.	H	α-helix	trans	-69	-45.3	175.3	-173.2	59.3	-162.8	0	0	112.2	A64 R65 V66 Y70 R71 Q72	A64-E68 PolarHBondContact O-N 3.1Å; R65-E68 PolarHBondContact O-N 3.37Å; V66-E68 VanDerWaalsContact C-N 3.28Å; V66-E68 PolarHBondContact O-N 3.06Å; E68-Y70 VanDerWaalsContact C-N 3.27Å; E68-Y70 PolarHBondContact O-N 3.35Å; E68-R71 PolarHBondContact O-N 3.04Å; E68-Q72 WeakPolarHBondContact O-CB 3.33Å; E68-Q72 PolarHBondContact O-N 3.46Å
69	I	87.3	Confident	80.9	Confident	26 Å²	26	81.1 Å²	81.1	13%	0.133	42%	0.42	C	S	.	.	H	α-helix	trans	-59	-42.4	174.5	-67.8	164.5	0	0	0	110.1	R65 V66 Q72 C73 V95	R65-I69 HydrophobicContact CG-CD1 4.2Å; R65-I69 VanDerWaalsContact O-CG1 3.3Å; R65-I69 WeakPolarHBondContact O-CG1 3.4Å; R65-I69 PolarHBondContact O-N 3.38Å; V66-I69 PolarHBondContact O-N 2.95Å; I69-Q72 PolarHBondContact O-N 3.31Å; I69-C73 WeakPolarHBondContact O-CB 3.46Å; I69-C73 PolarHBondContact O-N 2.98Å; I69-C73 PolarHBondContact O-SG 3.27Å; I69-V95 HydrophobicContact CD1-CG1 4.11Å; I69-V95 HydrophobicContact CG2-CG2 4.19Å
70	Y	89.5	Confident	83	Confident	16 Å²	16	77.5 Å²	77.5	6%	0.063	42%	0.415	C	S	.	.	H	α-helix	trans	-62.1	-47.2	175.1	172.8	-111.5	0	0	0	112.3	V66 E68 Q72 C73 L74 L92 Y111 V115	V66-Y70 PolarHBondContact O-N 3.15Å; E68-Y70 VanDerWaalsContact C-N 3.27Å; E68-Y70 PolarHBondContact O-N 3.35Å; Y70-Q72 PolarHBondContact O-N 3.19Å; Y70-C73 PolarHBondContact O-N 3.34Å; Y70-L74 HydrophobicContact CE1-CD2 4.15Å; Y70-L74 HydrophobicContact CE2-CB 4.48Å; Y70-L74 VanDerWaalsContact O-CB 3.24Å; Y70-L74 WeakPolarHBondContact O-CB 3.43Å; Y70-L74 PolarHBondContact O-N 2.86Å; Y70-L92 HydrophobicContact CD2-CD1 4.04Å; Y70-Y111 HydrophobicContact CD1-CE2 4.14Å; Y70-Y111 HydrophobicContact CE1-CD2 4.34Å; Y70-Y111 AromaticContact CE1-CE2 3.38Å; Y70-Y111 HydrophobicContact CE1-CE2 3.38Å; Y70-Y111 AromaticContact CE1-CZ 3.93Å; Y70-Y111 AromaticContact CZ-CE2 3.71Å; Y70-V115 HydrophobicContact CD2-CG2 4.02Å; Y70-V115 HydrophobicContact CE2-CB 4.15Å; Y70-V115 HydrophobicContact CE2-CG2 3.38Å
71	R	90.3	Very high	85	Confident	159 Å²	159	76.7 Å²	76.7	60%	0.6	40%	0.404	S	S	*	.	H	α-helix	trans	-60.6	-43.4	177.6	-80.1	-171.8	172	91	1.3	112.5	A67 E68 L74 A75	A67-R71 WeakPolarHBondContact O-CG 3.24Å; A67-R71 PolarHBondContact O-N 2.82Å; E68-R71 PolarHBondContact O-N 3.04Å; R71-L74 PolarHBondContact O-N 3.05Å; R71-A75 WeakPolarHBondContact O-CB 3.2Å; R71-A75 PolarHBondContact O-N 3.43Å
72	Q	90.5	Very high	86.5	Confident	109 Å²	109	72.6 Å²	72.6	51%	0.509	38%	0.383	S	S	.	.	H	α-helix	trans	-63	-46.9	177.1	-173.9	-178.4	2.9	0	0	111.5	E68 I69 Y70 L74 A75 L76	E68-Q72 WeakPolarHBondContact O-CB 3.33Å; E68-Q72 PolarHBondContact O-N 3.46Å; I69-Q72 PolarHBondContact O-N 3.31Å; Y70-Q72 PolarHBondContact O-N 3.19Å; Q72-L74 PolarHBondContact O-N 2.83Å; Q72-A75 PolarHBondContact O-N 2.91Å; Q72-L76 WeakPolarHBondContact O-CG 3.42Å; Q72-L76 PolarHBondContact O-N 3Å; Q72-L76 VanDerWaalsContact O-N 3.07Å
73	C	91.6	Very high	87.8	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.007	38%	0.377	C	S	.	.	H	α-helix	trans	-63.9	-40.4	177.2	-67.9	0	0	0	0	112	I69 Y70 L76 H77 L92 V118	I69-C73 WeakPolarHBondContact O-CB 3.46Å; I69-C73 PolarHBondContact O-N 2.98Å; I69-C73 PolarHBondContact O-SG 3.27Å; Y70-C73 PolarHBondContact O-N 3.34Å; C73-L76 PolarHBondContact O-N 2.6Å; C73-H77 WeakPolarHBondContact O-CB 3.48Å; C73-H77 PolarHBondContact O-N 3.18Å; C73-L92 HydrophobicContact CB-CB 4.36Å; C73-L92 HydrophobicContact CB-CD2 4.08Å; C73-V118 HydrophobicContact CB-CG1 3.89Å
74	L	90.9	Very high	88.5	Confident	38 Å²	38	70.9 Å²	70.9	20%	0.199	36%	0.355	C	S	.	.	H	α-helix	trans	-65	-42.3	177.5	-174.6	67.1	0	0	0	111.3	Y70 R71 Q72 L76 H77 M78 V118	Y70-L74 HydrophobicContact CE1-CD2 4.15Å; Y70-L74 HydrophobicContact CE2-CB 4.48Å; Y70-L74 VanDerWaalsContact O-CB 3.24Å; Y70-L74 WeakPolarHBondContact O-CB 3.43Å; Y70-L74 PolarHBondContact O-N 2.86Å; R71-L74 PolarHBondContact O-N 3.05Å; Q72-L74 PolarHBondContact O-N 2.83Å; L74-L76 PolarHBondContact O-N 3.14Å; L74-H77 WeakPolarHBondContact O-CB 3.38Å; L74-H77 PolarHBondContact O-N 3.31Å; L74-M78 HydrophobicContact CG-SD 4.4Å; L74-M78 WeakPolarHBondContact O-CG 3.31Å; L74-M78 PolarHBondContact O-N 2.8Å; L74-V118 HydrophobicContact CD1-CG2 3.74Å
75	A	92.3	Very high	89	Confident	43 Å²	43	74.9 Å²	74.9	36%	0.355	36%	0.359	S	S	.	.	H	α-helix	trans	-61.8	-43.3	175.8	0	0	0	0	0	112	R71 Q72 M78 Q79	R71-A75 WeakPolarHBondContact O-CB 3.2Å; R71-A75 PolarHBondContact O-N 3.43Å; Q72-A75 PolarHBondContact O-N 2.91Å; A75-M78 PolarHBondContact O-N 3.1Å; A75-Q79 WeakPolarHBondContact O-CB 3.41Å; A75-Q79 VanDerWaalsContact O-CG 3.25Å; A75-Q79 WeakPolarHBondContact O-CG 3.29Å; A75-Q79 PolarHBondContact O-N 3.14Å
76	L	92.6	Very high	89.3	Confident	38 Å²	38	69.3 Å²	69.3	20%	0.199	34%	0.34	C	S	.	.	H	α-helix	trans	-65.8	-36.7	175.6	-72	171.5	0	0	0	112.5	Q72 C73 L74 Q79 N80 R81 I82 L90	Q72-L76 WeakPolarHBondContact O-CG 3.42Å; Q72-L76 PolarHBondContact O-N 3Å; Q72-L76 VanDerWaalsContact O-N 3.07Å; C73-L76 PolarHBondContact O-N 2.6Å; L74-L76 PolarHBondContact O-N 3.14Å; L76-Q79 PolarHBondContact O-N 3.24Å; L76-N80 PolarHBondContact O-N 3.34Å; L76-R81 HydrophobicContact CD2-CB 4.02Å; L76-R81 PolarHBondContact O-N 3.15Å; L76-I82 HydrophobicContact CB-CG1 4.06Å; L76-L90 HydrophobicContact CD1-CD1 4.39Å; L76-L90 HydrophobicContact CD1-CD2 3.68Å
77	H	91.7	Very high	89.7	Confident	53 Å²	53	69.1 Å²	69.1	25%	0.245	34%	0.339	C	S	.	.	H	α-helix	trans	-64.7	-47	174.7	179.8	82.1	0	0	0	111.6	C73 L74 Q79 N80 I82 S117 V118	C73-H77 WeakPolarHBondContact O-CB 3.48Å; C73-H77 PolarHBondContact O-N 3.18Å; L74-H77 WeakPolarHBondContact O-CB 3.38Å; L74-H77 PolarHBondContact O-N 3.31Å; H77-Q79 VanDerWaalsContact C-N 3.27Å; H77-Q79 PolarHBondContact O-N 2.77Å; H77-N80 PolarHBondContact O-N 3.04Å; H77-I82 HydrophobicContact CB-CD1 3.74Å; H77-S117 PolarHBondContact CE1-OG 2.6Å; H77-S117 PolarHBondContact NE2-OG 3.08Å; H77-V118 HydrophobicContact CB-CB 4.48Å; H77-V118 HydrophobicContact CB-CG1 4.16Å; H77-V118 HydrophobicContact CB-CG2 3.79Å
78	M	91.5	Very high	90.1	Very high	150 Å²	150	72.9 Å²	72.9	74%	0.739	35%	0.35	S	S	*	.	H	α-helix	trans	-63.8	-32.5	177.6	-70.5	-177.8	70.9	0	0	112.5	L74 A75 N80	L74-M78 HydrophobicContact CG-SD 4.4Å; L74-M78 WeakPolarHBondContact O-CG 3.31Å; L74-M78 PolarHBondContact O-N 2.8Å; A75-M78 PolarHBondContact O-N 3.1Å; M78-N80 VanDerWaalsContact C-N 3.26Å; M78-N80 PolarHBondContact O-N 3.24Å
79	Q	92	Very high	90.1	Very high	116 Å²	116	75.9 Å²	75.9	54%	0.542	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-1	174.4	-66.5	172	12.7	0	0	113.5	A75 L76 H77 R81	A75-Q79 WeakPolarHBondContact O-CB 3.41Å; A75-Q79 VanDerWaalsContact O-CG 3.25Å; A75-Q79 WeakPolarHBondContact O-CG 3.29Å; A75-Q79 PolarHBondContact O-N 3.14Å; L76-Q79 PolarHBondContact O-N 3.24Å; H77-Q79 VanDerWaalsContact C-N 3.27Å; H77-Q79 PolarHBondContact O-N 2.77Å; Q79-R81 HydrophobicContact CB-CB 4.48Å; Q79-R81 HydrophobicContact CB-CG 3.98Å; Q79-R81 PolarHBondContact O-N 2.94Å
80	N	89.1	Confident	90.1	Very high	121 Å²	121	75.3 Å²	75.3	65%	0.647	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	37.6	-173.3	-162.5	26.9	0	0	0	113.6	L76 H77 M78	L76-N80 PolarHBondContact O-N 3.34Å; H77-N80 PolarHBondContact O-N 3.04Å; M78-N80 VanDerWaalsContact C-N 3.26Å; M78-N80 PolarHBondContact O-N 3.24Å
81	R	91.4	Very high	90	Very high	169 Å²	169	75.5 Å²	75.5	64%	0.638	37%	0.369	S	S	*	.			trans	-100.5	8.9	-178.8	-71	-170.9	176.5	-148.6	0.1	113.7	L76 Q79 S83 N86	L76-R81 HydrophobicContact CD2-CB 4.02Å; L76-R81 PolarHBondContact O-N 3.15Å; Q79-R81 HydrophobicContact CB-CB 4.48Å; Q79-R81 HydrophobicContact CB-CG 3.98Å; Q79-R81 PolarHBondContact O-N 2.94Å; R81-S83 PolarHBondContact O-N 3.31Å; R81-N86 PolarHBondContact O-ND2 3.42Å
82	I	88.9	Confident	89.9	Confident	10 Å²	10	68 Å²	68	5%	0.051	34%	0.34	C	S	.	.			trans	-79.8	110.5	173.7	-58.9	177.9	0	0	0	107.8	L76 H77 L90 V118 K121 I122 C125	L76-I82 HydrophobicContact CB-CG1 4.06Å; H77-I82 HydrophobicContact CB-CD1 3.74Å; I82-L90 HydrophobicContact CD1-CD1 4.39Å; I82-L90 HydrophobicContact CG1-CD1 4.09Å; I82-L90 HydrophobicContact CG2-CD1 4.23Å; I82-V118 HydrophobicContact CD1-CG1 4.34Å; I82-K121 HydrophobicContact CB-CG 4.29Å; I82-K121 HydrophobicContact CD1-CG 4.34Å; I82-K121 HydrophobicContact CG2-CG 4.27Å; I82-I122 HydrophobicContact CD1-CG1 4.13Å; I82-I122 HydrophobicContact CG2-CG1 4.16Å; I82-C125 HydrophobicContact CG2-CB 4.41Å
83	S	89.3	Confident	89.8	Confident	50 Å²	50	65.1 Å²	65.1	35%	0.35	33%	0.328	S	S	.	.			trans	-121.7	170.9	-178.2	79.1	0	0	0	0	110.9	R81 E85 N86 A87	R81-S83 PolarHBondContact O-N 3.31Å; S83-E85 PolarHBondContact O-N 2.83Å; S83-E85 VanDerWaalsContact O-N 3.12Å; S83-E85 PolarHBondContact OG-N 3.43Å; S83-N86 PolarHBondContact N-OD1 3.45Å; S83-N86 PolarHBondContact O-N 3.11Å; S83-N86 PolarHBondContact O-OD1 2.73Å; S83-A87 VanDerWaalsContact O-CB 3.3Å; S83-A87 WeakPolarHBondContact O-CB 3.27Å; S83-A87 PolarHBondContact O-N 3.01Å; S83-A87 VanDerWaalsContact O-N 3.14Å
84	A	87.3	Confident	89.5	Confident	20 Å²	20	70.1 Å²	70.1	17%	0.165	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-22.4	176.3	0	0	0	0	0	113.5	N129	A84-N129 HydrophobicContact CB-CB 3.92Å; A84-N129 PolarHBondContact O-ND2 3.42Å
85	E	87.4	Confident	89.2	Confident	171 Å²	171	68.7 Å²	68.7	80%	0.799	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-41.9	-176.5	-63.2	-179.8	171	0	0	112.2	S83	S83-E85 PolarHBondContact O-N 2.83Å; S83-E85 VanDerWaalsContact O-N 3.12Å; S83-E85 PolarHBondContact OG-N 3.43Å
86	N	90.6	Very high	88.7	Confident	32 Å²	32	69.1 Å²	69.1	17%	0.171	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-13.7	-178.2	65.6	9	0	0	0	114	R81 S83 F88 E89 L90	R81-N86 PolarHBondContact O-ND2 3.42Å; S83-N86 PolarHBondContact N-OD1 3.45Å; S83-N86 PolarHBondContact O-N 3.11Å; S83-N86 PolarHBondContact O-OD1 2.73Å; N86-F88 PolarHBondContact O-N 3.01Å; N86-F88 VanDerWaalsContact O-N 3.11Å; N86-E89 WeakPolarHBondContact O-CB 3.48Å; N86-E89 PolarHBondContact O-N 3.05Å; N86-L90 PolarHBondContact O-N 2.93Å
87	A	89.4	Confident	88.1	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-28.6	-173.3	0	0	0	0	0	114	S83 C125 R126	S83-A87 VanDerWaalsContact O-CB 3.3Å; S83-A87 WeakPolarHBondContact O-CB 3.27Å; S83-A87 PolarHBondContact O-N 3.01Å; S83-A87 VanDerWaalsContact O-N 3.14Å; A87-C125 HydrophobicContact CB-CB 3.72Å; A87-R126 HydrophobicContact CB-CG 3.84Å; A87-R126 PolarHBondContact O-NE 3.02Å; A87-R126 PolarHBondContact O-NH2 2.8Å; A87-R126 VanDerWaalsContact O-NH2 3.16Å
88	F	90.2	Very high	87.1	Confident	107 Å²	107	72.3 Å²	72.3	47%	0.469	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-25	176	-70.8	-81	0	0	0	113.4	N86 R126 N129 V130	N86-F88 PolarHBondContact O-N 3.01Å; N86-F88 VanDerWaalsContact O-N 3.11Å; F88-R126 HydrophobicContact CD1-CG 4.21Å; F88-R126 HydrophobicContact CE1-CB 4.28Å; F88-R126 HydrophobicContact CE1-CG 4.05Å; F88-R126 HydrophobicContact CE2-CG 4.39Å; F88-R126 HydrophobicContact CG-CG 4.45Å; F88-R126 HydrophobicContact CZ-CB 4.08Å; F88-R126 HydrophobicContact CZ-CG 4.14Å; F88-N129 HydrophobicContact CE2-CB 3.83Å; F88-V130 HydrophobicContact CZ-CG2 4.14Å
89	E	88.4	Confident	86	Confident	165 Å²	165	67.1 Å²	67.1	77%	0.771	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-22.3	177.3	-59.2	-179.4	171.7	0	0	112.1	N86 G91	N86-E89 WeakPolarHBondContact O-CB 3.48Å; N86-E89 PolarHBondContact O-N 3.05Å; E89-G91 PolarHBondContact O-N 2.93Å
90	L	88.4	Confident	84.6	Confident	13 Å²	13	62.6 Å²	62.6	7%	0.068	34%	0.337	C	S	.	.			trans	-80.7	98.6	178.1	-59.6	176.2	0	0	0	111	L76 I82 N86 L92 I122 R126	L76-L90 HydrophobicContact CD1-CD1 4.39Å; L76-L90 HydrophobicContact CD1-CD2 3.68Å; I82-L90 HydrophobicContact CD1-CD1 4.39Å; I82-L90 HydrophobicContact CG1-CD1 4.09Å; I82-L90 HydrophobicContact CG2-CD1 4.23Å; N86-L90 PolarHBondContact O-N 2.93Å; L90-L92 PolarHBondContact O-N 2.88Å; L90-L92 VanDerWaalsContact O-N 3.16Å; L90-I122 HydrophobicContact CB-CD1 3.92Å; L90-I122 HydrophobicContact CB-CG1 4.42Å; L90-I122 HydrophobicContact CD1-CD1 4.12Å; L90-I122 HydrophobicContact CD1-CG1 4.06Å; L90-R126 PolarHBondContact O-NH2 3.42Å
91	G	86.3	Confident	83.3	Confident	21 Å²	21	64.5 Å²	64.5	22%	0.216	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	20.9	179.9	0	0	0	0	0	116.2	E89 I93 D94 V95	E89-G91 PolarHBondContact O-N 2.93Å; G91-I93 VanDerWaalsContact C-N 3.29Å; G91-I93 PolarHBondContact O-N 3.33Å; G91-D94 PolarHBondContact O-N 3.09Å; G91-D94 VanDerWaalsContact O-N 3.17Å; G91-V95 PolarHBondContact O-N 3.37Å
92	L	88.6	Confident	82.2	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-59.7	-39.7	-177.4	-176.8	63.2	0	0	0	112.3	Y70 C73 L90 D94 V95 L96 V118 I122	Y70-L92 HydrophobicContact CD2-CD1 4.04Å; C73-L92 HydrophobicContact CB-CB 4.36Å; C73-L92 HydrophobicContact CB-CD2 4.08Å; L90-L92 PolarHBondContact O-N 2.88Å; L90-L92 VanDerWaalsContact O-N 3.16Å; L92-D94 VanDerWaalsContact C-N 3.27Å; L92-D94 PolarHBondContact O-N 2.62Å; L92-V95 HydrophobicContact CD1-CG2 4.17Å; L92-V95 WeakPolarHBondContact O-CG2 3.23Å; L92-V95 PolarHBondContact O-N 2.97Å; L92-L96 PolarHBondContact O-N 3.39Å; L92-V118 HydrophobicContact CD2-CB 3.85Å; L92-V118 HydrophobicContact CD2-CG1 3.45Å; L92-V118 VanDerWaalsContact CD2-CG1 3.45Å; L92-I122 HydrophobicContact CB-CD1 3.84Å; L92-I122 HydrophobicContact CD2-CD1 4.16Å
93	I	88	Confident	81	Confident	49 Å²	49	64.5 Å²	64.5	25%	0.251	35%	0.353	S	S	.	.	H	α-helix	trans	-65.6	-34.2	-179.6	-60.4	174.3	0	0	0	110.6	G91 L96 A119 I122	G91-I93 VanDerWaalsContact C-N 3.29Å; G91-I93 PolarHBondContact O-N 3.33Å; I93-L96 WeakPolarHBondContact O-CB 3.27Å; I93-L96 PolarHBondContact O-N 2.78Å; I93-A119 HydrophobicContact CG1-CB 4.41Å; I93-I122 HydrophobicContact CD1-CB 4.25Å; I93-I122 HydrophobicContact CD1-CG2 3.84Å; I93-I122 HydrophobicContact CG1-CG2 4.41Å
94	D	86.2	Confident	80	Confident	107 Å²	107	67.3 Å²	67.3	57%	0.572	37%	0.37	S	S	*	.	H	α-helix	trans	-75.3	-29.7	-178.8	-53.3	-46.4	0	0	0	111.9	G91 L92	G91-D94 PolarHBondContact O-N 3.09Å; G91-D94 VanDerWaalsContact O-N 3.17Å; L92-D94 VanDerWaalsContact C-N 3.27Å; L92-D94 PolarHBondContact O-N 2.62Å
95	V	84	Confident	79.1	Confident	8 Å²	8	74.2 Å²	74.2	5%	0.048	40%	0.403	C	S	.	.	H	α-helix	trans	-92.1	-6.8	176	-57.3	0	0	0	0	113.7	L61 V66 I69 G91 L92 P97 A98 L99	L61-V95 HydrophobicContact CD1-CG1 3.99Å; V66-V95 HydrophobicContact CG1-CB 3.97Å; V66-V95 HydrophobicContact CG1-CG2 4.01Å; V66-V95 HydrophobicContact CG2-CB 4.32Å; V66-V95 HydrophobicContact CG2-CG1 4.46Å; I69-V95 HydrophobicContact CD1-CG1 4.11Å; I69-V95 HydrophobicContact CG2-CG2 4.19Å; G91-V95 PolarHBondContact O-N 3.37Å; L92-V95 HydrophobicContact CD1-CG2 4.17Å; L92-V95 WeakPolarHBondContact O-CG2 3.23Å; L92-V95 PolarHBondContact O-N 2.97Å; V95-P97 VanDerWaalsContact C-CD 3.43Å; V95-P97 VanDerWaalsContact C-N 3.33Å; V95-A98 CarbonylContact O-C 3.57Å; V95-A98 WeakPolarHBondContact O-CA 3.43Å; V95-A98 WeakPolarHBondContact O-CB 3.21Å; V95-A98 PolarHBondContact O-N 3.29Å; V95-L99 PolarHBondContact O-N 3.17Å
96	L	82.1	Confident	78.1	Confident	51 Å²	51	76.3 Å²	76.3	27%	0.267	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-55	-40.5	179.8	-162.3	78.6	0	0	0	113.3	L92 I93 A98 L99 W102 V115	L92-L96 PolarHBondContact O-N 3.39Å; I93-L96 WeakPolarHBondContact O-CB 3.27Å; I93-L96 PolarHBondContact O-N 2.78Å; L96-A98 VanDerWaalsContact C-N 3.28Å; L96-A98 PolarHBondContact O-N 3.01Å; L96-L99 PolarHBondContact O-N 3.37Å; L96-W102 PolarHBondContact O-NE1 3.4Å; L96-V115 HydrophobicContact CD1-CG1 3.3Å
97	P	78.6	Confident	77.4	Confident	86 Å²	86	76.7 Å²	76.7	56%	0.558	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-68.8	-26.4	174.5	-18.2	33.1	0	0	0	113	V95	V95-P97 VanDerWaalsContact C-CD 3.43Å; V95-P97 VanDerWaalsContact C-N 3.33Å
98	A	71.6	Confident	77	Confident	72 Å²	72	81 Å²	81	60%	0.595	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-85.1	-14.2	-179.4	0	0	0	0	0	113.4	V66 V95 L96 G100	V66-A98 HydrophobicContact CG2-CB 4.48Å; V95-A98 CarbonylContact O-C 3.57Å; V95-A98 WeakPolarHBondContact O-CA 3.43Å; V95-A98 WeakPolarHBondContact O-CB 3.21Å; V95-A98 PolarHBondContact O-N 3.29Å; L96-A98 VanDerWaalsContact C-N 3.28Å; L96-A98 PolarHBondContact O-N 3.01Å; A98-G100 PolarHBondContact O-N 2.82Å
99	L	67.8	Low	76.8	Confident	41 Å²	41	83.5 Å²	83.5	22%	0.215	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-78.9	-1.4	173.1	-168.8	58.4	0	0	0	112.1	V66 V95 L96 W102 Y111 V115	V66-L99 HydrophobicContact CG1-CB 4.18Å; V66-L99 HydrophobicContact CG1-CD1 3.95Å; V95-L99 PolarHBondContact O-N 3.17Å; L96-L99 PolarHBondContact O-N 3.37Å; L99-W102 HydrophobicContact CB-CH2 4.47Å; L99-W102 HydrophobicContact CB-CZ2 4Å; L99-W102 HydrophobicContact CD2-CH2 4.03Å; L99-W102 HydrophobicContact CD2-CZ2 4.17Å; L99-W102 HydrophobicContact CG-CH2 4.02Å; L99-W102 HydrophobicContact CG-CZ2 4.06Å; L99-Y111 HydrophobicContact CD2-CE1 4.26Å; L99-Y111 WeakPolarHBondContact CD2-OH 3.36Å; L99-V115 HydrophobicContact CD2-CG1 4.12Å; L99-V115 HydrophobicContact CD2-CG2 4.12Å
100	G	62	Low	76.9	Confident	21 Å²	21	80 Å²	80	22%	0.216	43%	0.429	C	S	.	.			trans	-127.7	68.9	-150.2	0	0	0	0	0	116.1	A98 W102	A98-G100 PolarHBondContact O-N 2.82Å; G100-W102 VanDerWaalsContact CA-CE2 3.44Å; G100-W102 VanDerWaalsContact CA-CG 3.48Å; G100-W102 PolarHBondContact O-N 3.38Å
101	D	63.8	Low	76.8	Confident	161 Å²	161	82.9 Å²	82.9	86%	0.861	44%	0.44	S	S	*	.			trans	-71.5	67.7	138.6	-65.3	-29.4	0	0	0	106.3	D103	D101-D103 PolarHBondContact O-N 2.9Å
102	W	68.2	Low	76.9	Confident	91 Å²	91	82.9 Å²	82.9	35%	0.345	44%	0.435	S	S	.	.			trans	-76.6	65.4	-175.7	-64.4	121.1	0	0	0	108.8	L96 L99 G100 P104 L107 Y111 V112	L96-W102 PolarHBondContact O-NE1 3.4Å; L99-W102 HydrophobicContact CB-CH2 4.47Å; L99-W102 HydrophobicContact CB-CZ2 4Å; L99-W102 HydrophobicContact CD2-CH2 4.03Å; L99-W102 HydrophobicContact CD2-CZ2 4.17Å; L99-W102 HydrophobicContact CG-CH2 4.02Å; L99-W102 HydrophobicContact CG-CZ2 4.06Å; G100-W102 VanDerWaalsContact CA-CE2 3.44Å; G100-W102 VanDerWaalsContact CA-CG 3.48Å; G100-W102 PolarHBondContact O-N 3.38Å; W102-P104 VanDerWaalsContact O-CD 3.28Å; W102-P104 WeakPolarHBondContact O-CD 3.49Å; W102-L107 VanDerWaalsContact CA-CD1 3.47Å; W102-L107 HydrophobicContact CB-CD1 3.75Å; W102-L107 HydrophobicContact CE3-CD1 3.93Å; W102-L107 HydrophobicContact CE3-CD2 4.48Å; W102-L107 HydrophobicContact CE3-CG 4.19Å; W102-Y111 HydrophobicContact CH2-CE1 4.16Å; W102-Y111 HydrophobicContact CZ3-CD1 4.36Å; W102-Y111 HydrophobicContact CZ3-CE1 4.3Å; W102-V112 HydrophobicContact CE3-CG2 3.96Å; W102-V112 HydrophobicContact CH2-CG2 4.4Å; W102-V112 HydrophobicContact CZ3-CG2 3.51Å
103	D	62.3	Low	77	Confident	89 Å²	89	84.8 Å²	84.8	48%	0.476	46%	0.455	S	S	.	.			trans	-66.1	115.5	173.3	-78.4	-21.4	0	0	0	108.6	D101 I105 R106 L107	D101-D103 PolarHBondContact O-N 2.9Å; D103-I105 PolarHBondContact O-N 2.71Å; D103-R106 HydrophobicContact CB-CB 4.29Å; D103-R106 HydrophobicContact CB-CG 4.48Å; D103-R106 PolarHBondContact O-N 3.13Å; D103-L107 WeakPolarHBondContact O-CD1 3.43Å; D103-L107 PolarHBondContact O-N 2.89Å
104	P	68.6	Low	77.1	Confident	109 Å²	109	88.2 Å²	88.2	71%	0.708	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-19.4	-176.1	21.1	-31.2	0	0	0	113.1	W102	W102-P104 VanDerWaalsContact O-CD 3.28Å; W102-P104 WeakPolarHBondContact O-CD 3.49Å
105	I	68.8	Low	77.3	Confident	165 Å²	165	83.2 Å²	83.2	85%	0.846	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-28.5	179	-54	171.8	0	0	0	112	D103	D103-I105 PolarHBondContact O-N 2.71Å
106	R	67.2	Low	77.7	Confident	215 Å²	215	87.5 Å²	87.5	81%	0.811	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	6.5	-177.2	-56.5	-174.2	82.5	167.2	5.5	112.9	D103 D108	D103-R106 HydrophobicContact CB-CB 4.29Å; D103-R106 HydrophobicContact CB-CG 4.48Å; D103-R106 PolarHBondContact O-N 3.13Å; R106-D108 PolarHBondContact O-N 2.81Å
107	L	74.4	Confident	78.2	Confident	40 Å²	40	87.8 Å²	87.8	21%	0.209	47%	0.469	C	S	.	.			trans	-67.3	114.5	178.6	-117.7	83.7	0	0	0	110.5	W102 D103 F109 V112	W102-L107 VanDerWaalsContact CA-CD1 3.47Å; W102-L107 HydrophobicContact CB-CD1 3.75Å; W102-L107 HydrophobicContact CE3-CD1 3.93Å; W102-L107 HydrophobicContact CE3-CD2 4.48Å; W102-L107 HydrophobicContact CE3-CG 4.19Å; D103-L107 WeakPolarHBondContact O-CD1 3.43Å; D103-L107 PolarHBondContact O-N 2.89Å; L107-F109 PolarHBondContact O-N 2.6Å; L107-V112 HydrophobicContact CD2-CB 4.32Å; L107-V112 HydrophobicContact CD2-CG1 4.17Å; L107-V112 HydrophobicContact CD2-CG2 3.54Å; L107-V112 HydrophobicContact CG-CG2 3.68Å
108	D	81.7	Confident	78.9	Confident	90 Å²	90	83.7 Å²	83.7	48%	0.481	44%	0.443	S	S	.	.			trans	-75.3	101.1	162	-179.8	-0.3	0	0	0	108.6	R106 T110 Y111 V112	R106-D108 PolarHBondContact O-N 2.81Å; D108-T110 VanDerWaalsContact CG-OG1 3.25Å; D108-T110 PolarHBondContact O-N 3.34Å; D108-T110 VanDerWaalsContact O-N 3.13Å; D108-T110 WeakPolarHBondContact OD1-CB 3.46Å; D108-T110 PolarHBondContact OD1-N 3.27Å; D108-T110 PolarHBondContact OD1-OG1 3.02Å; D108-T110 PolarHBondContact OD2-OG1 3.49Å; D108-T110 VanDerWaalsContact OD2-OG1 3.14Å; D108-Y111 PolarHBondContact O-N 3.09Å; D108-Y111 VanDerWaalsContact O-N 3.08Å; D108-V112 VanDerWaalsContact O-CG2 3.29Å; D108-V112 WeakPolarHBondContact O-CG2 3.35Å; D108-V112 PolarHBondContact O-N 3.29Å
109	F	86.3	Confident	79.8	Confident	160 Å²	160	80.9 Å²	80.9	70%	0.702	42%	0.419	S	S	*	.	H	α-helix	trans	-57.2	-25.6	178.5	-68.3	-76.7	0	0	0	112.9	L107 G113	L107-F109 PolarHBondContact O-N 2.6Å; F109-G113 PolarHBondContact O-N 3.09Å
110	T	89.8	Confident	81.1	Confident	92 Å²	92	81.8 Å²	81.8	56%	0.564	43%	0.433	S	S	*	.	H	α-helix	trans	-72.4	-39.9	177.3	74.9	0	0	0	0	111.6	D108 K114	D108-T110 VanDerWaalsContact CG-OG1 3.25Å; D108-T110 PolarHBondContact O-N 3.34Å; D108-T110 VanDerWaalsContact O-N 3.13Å; D108-T110 WeakPolarHBondContact OD1-CB 3.46Å; D108-T110 PolarHBondContact OD1-N 3.27Å; D108-T110 PolarHBondContact OD1-OG1 3.02Å; D108-T110 PolarHBondContact OD2-OG1 3.49Å; D108-T110 VanDerWaalsContact OD2-OG1 3.14Å; T110-K114 WeakPolarHBondContact O-CG 3.25Å; T110-K114 PolarHBondContact O-N 2.92Å
111	Y	87.3	Confident	82.6	Confident	73 Å²	73	84.7 Å²	84.7	29%	0.286	44%	0.439	S	S	.	.	H	α-helix	trans	-67.8	-49.8	174.8	177.2	-102.4	0	0	0	110.9	Y70 L99 W102 D108 G113 K114 V115	Y70-Y111 HydrophobicContact CD1-CE2 4.14Å; Y70-Y111 HydrophobicContact CE1-CD2 4.34Å; Y70-Y111 AromaticContact CE1-CE2 3.38Å; Y70-Y111 HydrophobicContact CE1-CE2 3.38Å; Y70-Y111 AromaticContact CE1-CZ 3.93Å; Y70-Y111 AromaticContact CZ-CE2 3.71Å; L99-Y111 HydrophobicContact CD2-CE1 4.26Å; L99-Y111 WeakPolarHBondContact CD2-OH 3.36Å; W102-Y111 HydrophobicContact CH2-CE1 4.16Å; W102-Y111 HydrophobicContact CZ3-CD1 4.36Å; W102-Y111 HydrophobicContact CZ3-CE1 4.3Å; D108-Y111 PolarHBondContact O-N 3.09Å; D108-Y111 VanDerWaalsContact O-N 3.08Å; Y111-G113 VanDerWaalsContact C-N 3.33Å; Y111-G113 PolarHBondContact O-N 3Å; Y111-K114 WeakPolarHBondContact O-CB 3.35Å; Y111-K114 PolarHBondContact O-N 3.03Å; Y111-K114 VanDerWaalsContact O-N 3.13Å; Y111-V115 HydrophobicContact CD1-CG2 4.11Å; Y111-V115 HydrophobicContact CE1-CG2 3.7Å; Y111-V115 HydrophobicContact CE2-CG2 4.23Å; Y111-V115 WeakPolarHBondContact O-CG2 3.26Å; Y111-V115 PolarHBondContact O-N 2.78Å
112	V	87.5	Confident	84	Confident	20 Å²	20	77 Å²	77	12%	0.121	40%	0.398	C	S	.	.	H	α-helix	trans	-61.5	-42.5	-179.7	177.6	0	0	0	0	110.7	W102 L107 D108 K114 V115 I116	W102-V112 HydrophobicContact CE3-CG2 3.96Å; W102-V112 HydrophobicContact CH2-CG2 4.4Å; W102-V112 HydrophobicContact CZ3-CG2 3.51Å; L107-V112 HydrophobicContact CD2-CB 4.32Å; L107-V112 HydrophobicContact CD2-CG1 4.17Å; L107-V112 HydrophobicContact CD2-CG2 3.54Å; L107-V112 HydrophobicContact CG-CG2 3.68Å; D108-V112 VanDerWaalsContact O-CG2 3.29Å; D108-V112 WeakPolarHBondContact O-CG2 3.35Å; D108-V112 PolarHBondContact O-N 3.29Å; V112-K114 VanDerWaalsContact C-N 3.31Å; V112-K114 PolarHBondContact O-N 3.04Å; V112-V115 PolarHBondContact O-N 2.9Å; V112-I116 HydrophobicContact CG1-CD1 3.66Å; V112-I116 HydrophobicContact CG1-CG1 4.25Å; V112-I116 WeakPolarHBondContact O-CB 3.46Å; V112-I116 WeakPolarHBondContact O-CG1 3.27Å; V112-I116 PolarHBondContact O-N 3.06Å
113	G	89.7	Confident	85.3	Confident	41 Å²	41	80 Å²	80	42%	0.423	41%	0.41	S	S	.	.	H	α-helix	trans	-58.7	-40.2	175.4	0	0	0	0	0	112.9	F109 Y111 S117	F109-G113 PolarHBondContact O-N 3.09Å; Y111-G113 VanDerWaalsContact C-N 3.33Å; Y111-G113 PolarHBondContact O-N 3Å; G113-S117 WeakPolarHBondContact O-CB 3.45Å; G113-S117 PolarHBondContact O-N 2.88Å
114	K	90.3	Very high	86.9	Confident	121 Å²	121	77.6 Å²	77.6	53%	0.526	41%	0.407	S	S	.	.	H	α-helix	trans	-66.3	-46	174.2	-72	172.6	-176.1	173.2	0	111.8	T110 Y111 V112 I116 S117 V118	T110-K114 WeakPolarHBondContact O-CG 3.25Å; T110-K114 PolarHBondContact O-N 2.92Å; Y111-K114 WeakPolarHBondContact O-CB 3.35Å; Y111-K114 PolarHBondContact O-N 3.03Å; Y111-K114 VanDerWaalsContact O-N 3.13Å; V112-K114 VanDerWaalsContact C-N 3.31Å; V112-K114 PolarHBondContact O-N 3.04Å; K114-I116 PolarHBondContact O-N 3.39Å; K114-S117 PolarHBondContact O-N 2.84Å; K114-V118 VanDerWaalsContact O-CG2 3.31Å; K114-V118 WeakPolarHBondContact O-CG2 3.38Å; K114-V118 PolarHBondContact O-N 3.25Å
115	V	90.8	Very high	88	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.006	38%	0.379	C	S	.	.	H	α-helix	trans	-58.9	-48	178.3	177.1	0	0	0	0	110.8	Y70 L96 L99 Y111 V112 S117 V118 A119	Y70-V115 HydrophobicContact CD2-CG2 4.02Å; Y70-V115 HydrophobicContact CE2-CB 4.15Å; Y70-V115 HydrophobicContact CE2-CG2 3.38Å; L96-V115 HydrophobicContact CD1-CG1 3.3Å; L99-V115 HydrophobicContact CD2-CG1 4.12Å; L99-V115 HydrophobicContact CD2-CG2 4.12Å; Y111-V115 HydrophobicContact CD1-CG2 4.11Å; Y111-V115 HydrophobicContact CE1-CG2 3.7Å; Y111-V115 HydrophobicContact CE2-CG2 4.23Å; Y111-V115 WeakPolarHBondContact O-CG2 3.26Å; Y111-V115 PolarHBondContact O-N 2.78Å; V112-V115 PolarHBondContact O-N 2.9Å; V115-S117 PolarHBondContact O-N 3.46Å; V115-V118 PolarHBondContact O-N 2.78Å; V115-A119 WeakPolarHBondContact O-CB 3.48Å; V115-A119 PolarHBondContact O-N 3.23Å
116	I	92.3	Very high	89.2	Confident	99 Å²	99	67.5 Å²	67.5	51%	0.508	35%	0.347	S	S	.	.	H	α-helix	trans	-64.4	-40.6	179.2	-68.2	173.9	0	0	0	110.9	V112 K114 V118 A119 A120	V112-I116 HydrophobicContact CG1-CD1 3.66Å; V112-I116 HydrophobicContact CG1-CG1 4.25Å; V112-I116 WeakPolarHBondContact O-CB 3.46Å; V112-I116 WeakPolarHBondContact O-CG1 3.27Å; V112-I116 PolarHBondContact O-N 3.06Å; K114-I116 PolarHBondContact O-N 3.39Å; I116-V118 PolarHBondContact O-N 2.86Å; I116-A119 PolarHBondContact O-N 2.74Å; I116-A120 WeakPolarHBondContact O-CB 3.48Å; I116-A120 PolarHBondContact O-N 2.74Å
117	S	92.4	Very high	90.6	Very high	57 Å²	57	60.6 Å²	60.6	40%	0.399	33%	0.328	S	S	.	.	H	α-helix	trans	-59.2	-45.4	175.9	179.9	0	0	0	0	112.2	H77 G113 K114 V115 K121	H77-S117 PolarHBondContact CE1-OG 2.6Å; H77-S117 PolarHBondContact NE2-OG 3.08Å; G113-S117 WeakPolarHBondContact O-CB 3.45Å; G113-S117 PolarHBondContact O-N 2.88Å; K114-S117 PolarHBondContact O-N 2.84Å; V115-S117 PolarHBondContact O-N 3.46Å; S117-K121 PolarHBondContact O-N 3.34Å
118	V	93	Very high	91.5	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-65.1	-46	176.9	-179	0	0	0	0	110.5	C73 L74 H77 I82 L92 K114 V115 I116 A120 K121 I122	C73-V118 HydrophobicContact CB-CG1 3.89Å; L74-V118 HydrophobicContact CD1-CG2 3.74Å; H77-V118 HydrophobicContact CB-CB 4.48Å; H77-V118 HydrophobicContact CB-CG1 4.16Å; H77-V118 HydrophobicContact CB-CG2 3.79Å; I82-V118 HydrophobicContact CD1-CG1 4.34Å; L92-V118 HydrophobicContact CD2-CB 3.85Å; L92-V118 HydrophobicContact CD2-CG1 3.45Å; L92-V118 VanDerWaalsContact CD2-CG1 3.45Å; K114-V118 VanDerWaalsContact O-CG2 3.31Å; K114-V118 WeakPolarHBondContact O-CG2 3.38Å; K114-V118 PolarHBondContact O-N 3.25Å; V115-V118 PolarHBondContact O-N 2.78Å; I116-V118 PolarHBondContact O-N 2.86Å; V118-A120 PolarHBondContact O-N 3.4Å; V118-K121 PolarHBondContact O-N 3.36Å; V118-I122 HydrophobicContact CG1-CD1 4.08Å; V118-I122 WeakPolarHBondContact O-CG1 3.32Å; V118-I122 PolarHBondContact O-N 3.48Å
119	A	92.6	Very high	92.1	Very high	12 Å²	12	59.1 Å²	59.1	10%	0.099	32%	0.321	C	S	.	.	H	α-helix	trans	-62.5	-42.5	178.9	0	0	0	0	0	112.3	I93 V115 I116 K121 I122 Y123	I93-A119 HydrophobicContact CG1-CB 4.41Å; V115-A119 WeakPolarHBondContact O-CB 3.48Å; V115-A119 PolarHBondContact O-N 3.23Å; I116-A119 PolarHBondContact O-N 2.74Å; A119-K121 VanDerWaalsContact C-N 3.35Å; A119-K121 PolarHBondContact O-N 2.82Å; A119-I122 PolarHBondContact O-N 3.46Å; A119-Y123 WeakPolarHBondContact O-CB 3.35Å; A119-Y123 PolarHBondContact O-N 3.01Å
120	A	93.7	Very high	92.5	Very high	60 Å²	60	55 Å²	55	50%	0.496	31%	0.308	S	S	.	.	H	α-helix	trans	-62.8	-40.4	176.3	0	0	0	0	0	111.6	I116 V118 Y123 G124	I116-A120 WeakPolarHBondContact O-CB 3.48Å; I116-A120 PolarHBondContact O-N 2.74Å; V118-A120 PolarHBondContact O-N 3.4Å; A120-Y123 PolarHBondContact O-N 3.39Å; A120-G124 PolarHBondContact O-N 3.13Å
121	K	93.6	Very high	92.6	Very high	82 Å²	82	54.3 Å²	54.3	36%	0.357	31%	0.307	S	S	.	.	H	α-helix	trans	-63	-44.5	174.7	-171.6	66.4	175.5	-175	0	111.8	I82 S117 V118 A119 G124 C125	I82-K121 HydrophobicContact CB-CG 4.29Å; I82-K121 HydrophobicContact CD1-CG 4.34Å; I82-K121 HydrophobicContact CG2-CG 4.27Å; S117-K121 PolarHBondContact O-N 3.34Å; V118-K121 PolarHBondContact O-N 3.36Å; A119-K121 VanDerWaalsContact C-N 3.35Å; A119-K121 PolarHBondContact O-N 2.82Å; K121-G124 PolarHBondContact O-N 2.96Å; K121-C125 PolarHBondContact O-N 2.8Å; K121-C125 PolarHBondContact O-SG 3.09Å; K121-C125 VanDerWaalsContact O-SG 3.38Å
122	I	94.1	Very high	92.9	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-61.7	-47.3	176.6	-66.4	167	0	0	0	110.4	I82 L90 L92 I93 V118 A119 G124 C125 R126	I82-I122 HydrophobicContact CD1-CG1 4.13Å; I82-I122 HydrophobicContact CG2-CG1 4.16Å; L90-I122 HydrophobicContact CB-CD1 3.92Å; L90-I122 HydrophobicContact CB-CG1 4.42Å; L90-I122 HydrophobicContact CD1-CD1 4.12Å; L90-I122 HydrophobicContact CD1-CG1 4.06Å; L92-I122 HydrophobicContact CB-CD1 3.84Å; L92-I122 HydrophobicContact CD2-CD1 4.16Å; I93-I122 HydrophobicContact CD1-CB 4.25Å; I93-I122 HydrophobicContact CD1-CG2 3.84Å; I93-I122 HydrophobicContact CG1-CG2 4.41Å; V118-I122 HydrophobicContact CG1-CD1 4.08Å; V118-I122 WeakPolarHBondContact O-CG1 3.32Å; V118-I122 PolarHBondContact O-N 3.48Å; A119-I122 PolarHBondContact O-N 3.46Å; I122-G124 PolarHBondContact O-N 2.84Å; I122-C125 PolarHBondContact O-N 2.74Å; I122-R126 HydrophobicContact CG2-CG 4.5Å; I122-R126 WeakPolarHBondContact O-CG 3.37Å; I122-R126 PolarHBondContact O-N 2.94Å
123	Y	95.6	Very high	93.2	Very high	153 Å²	153	58.6 Å²	58.6	60%	0.6	33%	0.328	S	S	*	.	H	α-helix	trans	-59.6	-47.3	177.9	178.8	-101.6	0	0	0	111.7	A119 A120 C125 R126 V127	A119-Y123 WeakPolarHBondContact O-CB 3.35Å; A119-Y123 PolarHBondContact O-N 3.01Å; A120-Y123 PolarHBondContact O-N 3.39Å; Y123-C125 PolarHBondContact O-N 2.99Å; Y123-R126 PolarHBondContact O-N 2.99Å; Y123-R126 VanDerWaalsContact O-N 3.16Å; Y123-V127 HydrophobicContact CD1-CG2 4.22Å; Y123-V127 HydrophobicContact CD2-CG2 4.44Å; Y123-V127 HydrophobicContact CE1-CG2 3.78Å; Y123-V127 HydrophobicContact CE2-CG2 4.01Å; Y123-V127 WeakPolarHBondContact O-CG2 3.23Å; Y123-V127 PolarHBondContact O-N 3.18Å
124	G	94.3	Very high	93.4	Very high	39 Å²	39	60.6 Å²	60.6	40%	0.402	33%	0.332	S	S	.	.	H	α-helix	trans	-57.6	-44.5	176.4	0	0	0	0	0	112.9	A120 K121 I122 V127 D128	A120-G124 PolarHBondContact O-N 3.13Å; K121-G124 PolarHBondContact O-N 2.96Å; I122-G124 PolarHBondContact O-N 2.84Å; G124-V127 PolarHBondContact O-N 3.15Å; G124-D128 WeakPolarHBondContact O-CB 3.4Å; G124-D128 PolarHBondContact O-N 3.2Å
125	C	93.1	Very high	93.4	Very high	19 Å²	19	60.3 Å²	60.3	13%	0.128	33%	0.333	C	S	.	.	H	α-helix	trans	-66.7	-34.7	176.3	-70	0	0	0	0	113.3	I82 A87 K121 I122 Y123 N129	I82-C125 HydrophobicContact CG2-CB 4.41Å; A87-C125 HydrophobicContact CB-CB 3.72Å; K121-C125 PolarHBondContact O-N 2.8Å; K121-C125 PolarHBondContact O-SG 3.09Å; K121-C125 VanDerWaalsContact O-SG 3.38Å; I122-C125 PolarHBondContact O-N 2.74Å; Y123-C125 PolarHBondContact O-N 2.99Å; C125-N129 WeakPolarHBondContact O-CB 3.28Å; C125-N129 PolarHBondContact O-N 3.44Å
126	R	94.5	Very high	93.5	Very high	43 Å²	43	68 Å²	68	16%	0.162	36%	0.361	C	S	.	.	H	α-helix	trans	-65.7	-45.4	173.8	-72.5	178.9	179.9	-169.8	-3.8	111.4	A87 F88 L90 I122 Y123 N129 V130	A87-R126 HydrophobicContact CB-CG 3.84Å; A87-R126 PolarHBondContact O-NE 3.02Å; A87-R126 PolarHBondContact O-NH2 2.8Å; A87-R126 VanDerWaalsContact O-NH2 3.16Å; F88-R126 HydrophobicContact CD1-CG 4.21Å; F88-R126 HydrophobicContact CE1-CB 4.28Å; F88-R126 HydrophobicContact CE1-CG 4.05Å; F88-R126 HydrophobicContact CE2-CG 4.39Å; F88-R126 HydrophobicContact CG-CG 4.45Å; F88-R126 HydrophobicContact CZ-CB 4.08Å; F88-R126 HydrophobicContact CZ-CG 4.14Å; L90-R126 PolarHBondContact O-NH2 3.42Å; I122-R126 HydrophobicContact CG2-CG 4.5Å; I122-R126 WeakPolarHBondContact O-CG 3.37Å; I122-R126 PolarHBondContact O-N 2.94Å; Y123-R126 PolarHBondContact O-N 2.99Å; Y123-R126 VanDerWaalsContact O-N 3.16Å; R126-N129 WeakPolarHBondContact O-CB 3.39Å; R126-N129 PolarHBondContact O-N 2.81Å; R126-V130 WeakPolarHBondContact O-CG2 3.4Å; R126-V130 PolarHBondContact O-N 3.38Å
127	V	95.1	Very high	93.6	Very high	70 Å²	70	68.3 Å²	68.3	42%	0.424	36%	0.364	S	S	.	.	H	α-helix	trans	-63	-43.8	178	173.3	0	0	0	0	111	Y123 G124 N129 V130 C131	Y123-V127 HydrophobicContact CD1-CG2 4.22Å; Y123-V127 HydrophobicContact CD2-CG2 4.44Å; Y123-V127 HydrophobicContact CE1-CG2 3.78Å; Y123-V127 HydrophobicContact CE2-CG2 4.01Å; Y123-V127 WeakPolarHBondContact O-CG2 3.23Å; Y123-V127 PolarHBondContact O-N 3.18Å; G124-V127 PolarHBondContact O-N 3.15Å; V127-N129 PolarHBondContact O-N 3.48Å; V127-V130 PolarHBondContact O-N 2.9Å; V127-C131 WeakPolarHBondContact O-CB 3.29Å; V127-C131 PolarHBondContact O-N 3.29Å
128	D	94.5	Very high	93.6	Very high	76 Å²	76	72 Å²	72	41%	0.406	37%	0.37	S	S	.	.	H	α-helix	trans	-61.7	-42.1	176.2	-175.2	48.1	0	0	0	111.8	G124 V130 C131 Q132	G124-D128 WeakPolarHBondContact O-CB 3.4Å; G124-D128 PolarHBondContact O-N 3.2Å; D128-V130 PolarHBondContact O-N 2.89Å; D128-C131 WeakPolarHBondContact O-CB 3.47Å; D128-C131 PolarHBondContact O-N 2.94Å; D128-Q132 WeakPolarHBondContact O-CB 3.38Å; D128-Q132 VanDerWaalsContact O-CG 3.31Å; D128-Q132 WeakPolarHBondContact O-CG 3.26Å; D128-Q132 PolarHBondContact O-N 3.26Å; D128-Q132 PolarHBondContact OD1-NE2 2.92Å; D128-Q132 PolarHBondContact OD2-NE2 2.86Å
129	N	93.2	Very high	93.4	Very high	24 Å²	24	74.3 Å²	74.3	13%	0.128	38%	0.382	C	S	.	.	H	α-helix	trans	-58.6	-48.5	174.8	-171.5	-72.2	0	0	0	112	A84 F88 C125 R126 V127 C131 Q132 Q133	A84-N129 HydrophobicContact CB-CB 3.92Å; A84-N129 PolarHBondContact O-ND2 3.42Å; F88-N129 HydrophobicContact CE2-CB 3.83Å; C125-N129 WeakPolarHBondContact O-CB 3.28Å; C125-N129 PolarHBondContact O-N 3.44Å; R126-N129 WeakPolarHBondContact O-CB 3.39Å; R126-N129 PolarHBondContact O-N 2.81Å; V127-N129 PolarHBondContact O-N 3.48Å; N129-C131 VanDerWaalsContact C-N 3.32Å; N129-C131 PolarHBondContact O-N 3.38Å; N129-Q132 PolarHBondContact O-N 2.82Å; N129-Q133 WeakPolarHBondContact O-CB 3.45Å; N129-Q133 WeakPolarHBondContact O-CG 3.49Å; N129-Q133 PolarHBondContact O-N 3.3Å; N129-Q133 PolarHBondContact OD1-NE2 3.49Å
130	V	94.3	Very high	93.4	Very high	72 Å²	72	80 Å²	80	44%	0.436	41%	0.407	S	S	.	.	H	α-helix	trans	-63.2	-39.7	178.4	175.7	0	0	0	0	111.2	F88 R126 V127 D128 Q133 T134	F88-V130 HydrophobicContact CZ-CG2 4.14Å; R126-V130 WeakPolarHBondContact O-CG2 3.4Å; R126-V130 PolarHBondContact O-N 3.38Å; V127-V130 PolarHBondContact O-N 2.9Å; D128-V130 PolarHBondContact O-N 2.89Å; V130-Q133 PolarHBondContact O-N 2.93Å; V130-T134 WeakPolarHBondContact O-CB 3.39Å; V130-T134 PolarHBondContact O-N 3.48Å; V130-T134 PolarHBondContact O-OG1 2.95Å
131	C	93.4	Very high	93.3	Very high	79 Å²	79	80.1 Å²	80.1	53%	0.534	40%	0.401	S	S	.	.	H	α-helix	trans	-61.5	-49.1	175.1	-175	0	0	0	0	111.3	V127 D128 N129 Q133 T134 H135	V127-C131 WeakPolarHBondContact O-CB 3.29Å; V127-C131 PolarHBondContact O-N 3.29Å; D128-C131 WeakPolarHBondContact O-CB 3.47Å; D128-C131 PolarHBondContact O-N 2.94Å; N129-C131 VanDerWaalsContact C-N 3.32Å; N129-C131 PolarHBondContact O-N 3.38Å; C131-Q133 PolarHBondContact O-N 3.14Å; C131-T134 PolarHBondContact O-N 2.82Å; C131-H135 WeakPolarHBondContact O-CB 3.46Å; C131-H135 PolarHBondContact O-N 3.42Å
132	Q	93.2	Very high	93	Very high	71 Å²	71	79.9 Å²	79.9	33%	0.332	40%	0.403	S	S	.	.	H	α-helix	trans	-62.5	-43	177.7	-71.1	-176.8	34.1	0	0	112.3	D128 N129 H135 R136	D128-Q132 WeakPolarHBondContact O-CB 3.38Å; D128-Q132 VanDerWaalsContact O-CG 3.31Å; D128-Q132 WeakPolarHBondContact O-CG 3.26Å; D128-Q132 PolarHBondContact O-N 3.26Å; D128-Q132 PolarHBondContact OD1-NE2 2.92Å; D128-Q132 PolarHBondContact OD2-NE2 2.86Å; N129-Q132 PolarHBondContact O-N 2.82Å; Q132-H135 PolarHBondContact O-N 3.41Å; Q132-R136 VanDerWaalsContact O-CG 3.29Å; Q132-R136 WeakPolarHBondContact O-CG 3.31Å; Q132-R136 PolarHBondContact O-N 3.14Å
133	Q	92.6	Very high	92.6	Very high	111 Å²	111	88.4 Å²	88.4	52%	0.519	44%	0.435	S	S	.	.	H	α-helix	trans	-62.2	-43.3	175.7	-74.2	-176	-3	0	0	111.6	N129 V130 C131 H135 R136 L137	N129-Q133 WeakPolarHBondContact O-CB 3.45Å; N129-Q133 WeakPolarHBondContact O-CG 3.49Å; N129-Q133 PolarHBondContact O-N 3.3Å; N129-Q133 PolarHBondContact OD1-NE2 3.49Å; V130-Q133 PolarHBondContact O-N 2.93Å; C131-Q133 PolarHBondContact O-N 3.14Å; Q133-H135 VanDerWaalsContact C-N 3.35Å; Q133-H135 PolarHBondContact O-N 3.01Å; Q133-R136 PolarHBondContact O-N 3.47Å; Q133-L137 WeakPolarHBondContact O-CB 3.44Å; Q133-L137 PolarHBondContact O-N 3.07Å
134	T	94.2	Very high	91.7	Very high	84 Å²	84	83.4 Å²	83.4	52%	0.515	42%	0.423	S	S	.	.	H	α-helix	trans	-63.6	-41.3	176.9	-56.1	0	0	0	0	111.1	V130 C131 L137 Y138	V130-T134 WeakPolarHBondContact O-CB 3.39Å; V130-T134 PolarHBondContact O-N 3.48Å; V130-T134 PolarHBondContact O-OG1 2.95Å; C131-T134 PolarHBondContact O-N 2.82Å; T134-L137 PolarHBondContact O-N 3.2Å; T134-Y138 VanDerWaalsContact O-CB 3.31Å; T134-Y138 WeakPolarHBondContact O-CB 3.12Å; T134-Y138 PolarHBondContact O-N 2.7Å
135	H	91.8	Very high	90.5	Very high	115 Å²	115	87.6 Å²	87.6	53%	0.532	43%	0.432	S	S	.	.	H	α-helix	trans	-67.4	-36.9	176	-171.8	-113.9	0	0	0	112.4	C131 Q132 Q133 N139	C131-H135 WeakPolarHBondContact O-CB 3.46Å; C131-H135 PolarHBondContact O-N 3.42Å; Q132-H135 PolarHBondContact O-N 3.41Å; Q133-H135 VanDerWaalsContact C-N 3.35Å; Q133-H135 PolarHBondContact O-N 3.01Å; H135-N139 PolarHBondContact CE1-ND2 2.91Å; H135-N139 PolarHBondContact ND1-ND2 3.26Å; H135-N139 PolarHBondContact NE2-ND2 3.28Å; H135-N139 WeakPolarHBondContact O-CB 3.41Å; H135-N139 PolarHBondContact O-N 3Å; H135-N139 PolarHBondContact O-ND2 2.85Å
136	R	92.7	Very high	89.1	Confident	161 Å²	161	89.2 Å²	89.2	61%	0.608	45%	0.452	S	S	*	.	H	α-helix	trans	-62.9	-47	172.4	-72.1	173.4	-163.6	176.5	7.2	111	Q132 Q133 N139 E140	Q132-R136 VanDerWaalsContact O-CG 3.29Å; Q132-R136 WeakPolarHBondContact O-CG 3.31Å; Q132-R136 PolarHBondContact O-N 3.14Å; Q133-R136 PolarHBondContact O-N 3.47Å; R136-N139 PolarHBondContact O-N 2.88Å; R136-E140 PolarHBondContact O-N 3.26Å
137	L	94.2	Very high	87.5	Confident	107 Å²	107	95.7 Å²	95.7	56%	0.56	48%	0.481	S	S	*	.	H	α-helix	trans	-61.9	-45.1	176.4	-178.3	66.2	0	0	0	111.6	Q133 T134 N139 E140 V141	Q133-L137 WeakPolarHBondContact O-CB 3.44Å; Q133-L137 PolarHBondContact O-N 3.07Å; T134-L137 PolarHBondContact O-N 3.2Å; L137-N139 VanDerWaalsContact C-N 3.32Å; L137-N139 PolarHBondContact O-N 3.2Å; L137-E140 PolarHBondContact O-N 3.48Å; L137-E140 VanDerWaalsContact O-N 3.11Å; L137-V141 HydrophobicContact CD1-CG2 4.46Å; L137-V141 HydrophobicContact CG-CG2 4.48Å; L137-V141 WeakPolarHBondContact O-CG2 3.45Å; L137-V141 PolarHBondContact O-N 2.89Å
138	Y	92	Very high	85.6	Confident	134 Å²	134	102.8 Å²	102.8	53%	0.525	50%	0.5	S	S	.	.	H	α-helix	trans	-56.1	-46.9	175.3	173.4	-100.2	0	0	0	111.5	T134 E140 V141 L142	T134-Y138 VanDerWaalsContact O-CB 3.31Å; T134-Y138 WeakPolarHBondContact O-CB 3.12Å; T134-Y138 PolarHBondContact O-N 2.7Å; Y138-E140 VanDerWaalsContact C-N 3.31Å; Y138-E140 PolarHBondContact O-N 3.35Å; Y138-V141 PolarHBondContact O-N 2.74Å; Y138-L142 HydrophobicContact CD1-CD1 4.12Å; Y138-L142 HydrophobicContact CD2-CD1 3.83Å; Y138-L142 HydrophobicContact CE1-CD1 3.74Å; Y138-L142 HydrophobicContact CE1-CD2 3.99Å; Y138-L142 HydrophobicContact CE2-CD1 3.43Å; Y138-L142 VanDerWaalsContact CE2-CD1 3.43Å; Y138-L142 HydrophobicContact CG-CD1 4.16Å; Y138-L142 VanDerWaalsContact O-CD1 3.26Å; Y138-L142 WeakPolarHBondContact O-CD1 3.34Å; Y138-L142 PolarHBondContact O-N 3.48Å
139	N	89.8	Confident	83.5	Confident	48 Å²	48	103.1 Å²	103.1	26%	0.257	51%	0.514	S	S	.	.	H	α-helix	trans	-68.2	-29	177.5	-74.2	-52.2	0	0	0	113.3	H135 R136 L137 R143	H135-N139 PolarHBondContact CE1-ND2 2.91Å; H135-N139 PolarHBondContact ND1-ND2 3.26Å; H135-N139 PolarHBondContact NE2-ND2 3.28Å; H135-N139 WeakPolarHBondContact O-CB 3.41Å; H135-N139 PolarHBondContact O-N 3Å; H135-N139 PolarHBondContact O-ND2 2.85Å; R136-N139 PolarHBondContact O-N 2.88Å; L137-N139 VanDerWaalsContact C-N 3.32Å; L137-N139 PolarHBondContact O-N 3.2Å; N139-R143 WeakPolarHBondContact O-CB 3.32Å; N139-R143 VanDerWaalsContact O-CG 3.28Å; N139-R143 WeakPolarHBondContact O-CG 3.41Å; N139-R143 PolarHBondContact O-N 3.1Å; N139-R143 VanDerWaalsContact O-N 3.15Å; N139-R143 PolarHBondContact O-NH1 3.4Å
140	E	91.6	Very high	81	Confident	133 Å²	133	105.2 Å²	105.2	62%	0.621	53%	0.534	S	S	*	.	H	α-helix	trans	-72.9	-40.4	173.2	-174.5	164.1	-168.4	0	0	111.6	R136 L137 Y138 R143 S144	R136-E140 PolarHBondContact O-N 3.26Å; L137-E140 PolarHBondContact O-N 3.48Å; L137-E140 VanDerWaalsContact O-N 3.11Å; Y138-E140 VanDerWaalsContact C-N 3.31Å; Y138-E140 PolarHBondContact O-N 3.35Å; E140-R143 PolarHBondContact O-N 3.18Å; E140-S144 WeakPolarHBondContact O-CB 3.47Å; E140-S144 PolarHBondContact O-N 3.48Å
141	V	91.5	Very high	78.5	Confident	61 Å²	61	107.1 Å²	107.1	37%	0.37	55%	0.548	S	S	.	.	H	α-helix	trans	-61.7	-47.1	173.6	174.1	0	0	0	0	110.4	L137 Y138 R143 S144 E145	L137-V141 HydrophobicContact CD1-CG2 4.46Å; L137-V141 HydrophobicContact CG-CG2 4.48Å; L137-V141 WeakPolarHBondContact O-CG2 3.45Å; L137-V141 PolarHBondContact O-N 2.89Å; Y138-V141 PolarHBondContact O-N 2.74Å; V141-R143 VanDerWaalsContact C-N 3.3Å; V141-R143 PolarHBondContact O-N 2.93Å; V141-S144 WeakPolarHBondContact CA-OG 3.46Å; V141-S144 PolarHBondContact O-N 2.87Å; V141-S144 PolarHBondContact O-OG 3.48Å; V141-E145 HydrophobicContact CG1-CG 4.43Å; V141-E145 PolarHBondContact O-N 2.99Å
142	L	86.8	Confident	75.9	Confident	78 Å²	78	111 Å²	111	41%	0.408	56%	0.563	S	S	.	*	H	α-helix	trans	-58.8	-39.9	175	-96.9	73.9	0	0	0	112.5	Y138 G146	Y138-L142 HydrophobicContact CD1-CD1 4.12Å; Y138-L142 HydrophobicContact CD2-CD1 3.83Å; Y138-L142 HydrophobicContact CE1-CD1 3.74Å; Y138-L142 HydrophobicContact CE1-CD2 3.99Å; Y138-L142 HydrophobicContact CE2-CD1 3.43Å; Y138-L142 VanDerWaalsContact CE2-CD1 3.43Å; Y138-L142 HydrophobicContact CG-CD1 4.16Å; Y138-L142 VanDerWaalsContact O-CD1 3.26Å; Y138-L142 WeakPolarHBondContact O-CD1 3.34Å; Y138-L142 PolarHBondContact O-N 3.48Å; L142-G146 PolarHBondContact O-N 3.38Å
143	R	85.3	Confident	73.4	Confident	179 Å²	179	119 Å²	119	68%	0.675	59%	0.591	S	S	*	*	H	α-helix	trans	-68.1	-35.2	174.8	-75.8	-177.8	-178.3	98.1	-2.2	112.3	N139 E140 V141 K147	N139-R143 WeakPolarHBondContact O-CB 3.32Å; N139-R143 VanDerWaalsContact O-CG 3.28Å; N139-R143 WeakPolarHBondContact O-CG 3.41Å; N139-R143 PolarHBondContact O-N 3.1Å; N139-R143 VanDerWaalsContact O-N 3.15Å; N139-R143 PolarHBondContact O-NH1 3.4Å; E140-R143 PolarHBondContact O-N 3.18Å; V141-R143 VanDerWaalsContact C-N 3.3Å; V141-R143 PolarHBondContact O-N 2.93Å; R143-K147 PolarHBondContact O-N 3.01Å; R143-K147 VanDerWaalsContact O-N 3.11Å
144	S	78.5	Confident	70.9	Confident	47 Å²	47	116.5 Å²	116.5	33%	0.329	59%	0.594	S	S	.	*	H	α-helix	trans	-73.3	-36.5	178.6	79.4	0	0	0	0	112.6	E140 V141 K147 R148	E140-S144 WeakPolarHBondContact O-CB 3.47Å; E140-S144 PolarHBondContact O-N 3.48Å; V141-S144 WeakPolarHBondContact CA-OG 3.46Å; V141-S144 PolarHBondContact O-N 2.87Å; V141-S144 PolarHBondContact O-OG 3.48Å; S144-K147 PolarHBondContact O-N 3.33Å; S144-R148 WeakPolarHBondContact O-CG 2.89Å; S144-R148 PolarHBondContact O-N 2.86Å
145	E	68.7	Low	68.2	Low	128 Å²	128	119.8 Å²	119.8	60%	0.598	61%	0.608	S	S	*	*	H	α-helix	trans	-69	-39.6	173.1	-70.4	-168.7	160.6	0	0	111	V141 K147 R148 A149	V141-E145 HydrophobicContact CG1-CG 4.43Å; V141-E145 PolarHBondContact O-N 2.99Å; E145-K147 VanDerWaalsContact C-N 3.3Å; E145-K147 PolarHBondContact O-N 3.4Å; E145-R148 PolarHBondContact O-N 3.34Å; E145-A149 PolarHBondContact O-N 2.98Å; E145-A149 VanDerWaalsContact O-N 3.1Å
146	G	63.7	Low	65.4	Low	53 Å²	53	119.1 Å²	119.1	55%	0.546	62%	0.617	S	S	.	*	H	α-helix	trans	-62.5	-32.2	173.2	0	0	0	0	0	114	L142	L142-G146 PolarHBondContact O-N 3.38Å
147	K	59.9	Low	62.8	Low	179 Å²	179	115.1 Å²	115.1	78%	0.778	63%	0.625	S	S	*	*	H	α-helix	trans	-82.5	-22.7	175.3	-104.5	170.6	176.4	176.9	0	114.2	R143 S144 E145	R143-K147 PolarHBondContact O-N 3.01Å; R143-K147 VanDerWaalsContact O-N 3.11Å; S144-K147 PolarHBondContact O-N 3.33Å; E145-K147 VanDerWaalsContact C-N 3.3Å; E145-K147 PolarHBondContact O-N 3.4Å
148	R	56.2	Low	60	Low	219 Å²	219	119.7 Å²	119.7	83%	0.826	64%	0.644	S	S	*	*	H	α-helix	trans	-87.8	-18.2	177	-73.8	179.9	179	179.5	1.1	113.6	S144 E145 A150	S144-R148 WeakPolarHBondContact O-CG 2.89Å; S144-R148 PolarHBondContact O-N 2.86Å; E145-R148 PolarHBondContact O-N 3.34Å; R148-A150 VanDerWaalsContact C-N 3.33Å
149	A	50.6	Low	57.6	Low	83 Å²	83	119 Å²	119	69%	0.686	66%	0.659	S	S	*	*	S	Bend	trans	-80	-10.6	175.7	0	0	0	0	0	114.3	E145 P151	E145-A149 PolarHBondContact O-N 2.98Å; E145-A149 VanDerWaalsContact O-N 3.1Å; A149-P151 VanDerWaalsContact O-CD 3.32Å; A149-P151 WeakPolarHBondContact O-CD 3.35Å
150	A	40.1	Very low	55.1	Low	67 Å²	67	124.8 Å²	124.8	55%	0.554	68%	0.684	S	S	*	*	S	Bend	trans	-97.2	106	172.9	0	0	0	0	0	109.4	R148 D152	R148-A150 VanDerWaalsContact C-N 3.33Å; A150-D152 PolarHBondContact O-N 3.06Å
151	P	40.8	Very low	52.5	Low	112 Å²	112	126.5 Å²	126.5	73%	0.727	70%	0.698	S	S	*	*			trans	-66	133	166.8	28.6	-30.1	0	0	0	107.8	A149 R153	A149-P151 VanDerWaalsContact O-CD 3.32Å; A149-P151 WeakPolarHBondContact O-CD 3.35Å; P151-R153 PolarHBondContact O-N 2.89Å
152	D	38.7	Very low	50	Low	160 Å²	160	131.9 Å²	131.9	86%	0.856	72%	0.719	S	S	*	*			trans	-41.5	93.6	165.8	-167.2	14.7	0	0	0	110.6	A150	A150-D152 PolarHBondContact O-N 3.06Å
153	R	42.6	Very low	47.5	Very low	241 Å²	241	131.9 Å²	131.9	91%	0.909	74%	0.738	S	S	*	*			trans	-96.2	100	155.1	-83.6	-164.5	-176.4	-153.3	1.6	105.4	P151	P151-R153 PolarHBondContact O-N 2.89Å
154	G	38.7	Very low	45.3	Very low	58 Å²	58	129 Å²	129	60%	0.598	75%	0.745	S	S	*	*			trans	-56.5	161.6	169	0	0	0	0	0	112.3
155	D	37.6	Very low	43.2	Very low	152 Å²	152	131.6 Å²	131.6	81%	0.813	77%	0.769	S	S	*	*			trans	93.6	114.8	149.8	-142	19.9	0	0	0	117.8
156	S	34.1	Very low	41.5	Very low	102 Å²	102	129.1 Å²	129.1	71%	0.713	78%	0.778	S	S	*	*			trans	51.7	114.2	140.8	65.4	0	0	0	0	119.1
157	G	36.7	Very low	40	Very low	76 Å²	76	132 Å²	132	78%	0.784	79%	0.787	S	S	*	*			trans	-179.3	52	166.2	0	0	0	0	0	112.7	S159	G157-S159 PolarHBondContact O-N 3.21Å
158	E	36.6	Very low	39	Very low	203 Å²	203	132 Å²	132	95%	0.949	79%	0.79	S	S	*	*			trans	-63.6	113.1	153.9	-73.1	177.2	161.2	0	0	106.6
159	S	40.9	Very low	38	Very low	119 Å²	119	130.8 Å²	130.8	83%	0.832	79%	0.794	S	S	*	*			trans	-131.5	109.3	160.6	-166.2	0	0	0	0	107.6	G157	G157-S159 PolarHBondContact O-N 3.21Å
160	E	37.2	Very low	37.2	Very low	171 Å²	171	131.3 Å²	131.3	80%	0.799	80%	0.798	S	S	*	*			trans	-46.2	142.5	165.3	-60.8	161.8	160.1	0	0	110.6
161	N	37.6	Very low	37.2	Very low	169 Å²	169	135 Å²	135	90%	0.904	81%	0.813	S	S	*	*			trans	-134.4	102.2	147.7	-155.5	16.5	0	0	0	107.8
162	E	37.8	Very low	37.2	Very low	174 Å²	174	136.5 Å²	136.5	81%	0.813	81%	0.811	S	S	*	*			trans	-67.6	160	173.5	-63.4	-166.8	137	0	0	111.9
163	G	34.6	Very low	36.9	Very low	78 Å²	78	136.7 Å²	136.7	80%	0.804	80%	0.804	S	S	*	*			trans	121.3	80.3	144.4	0	0	0	0	0	115.7
164	S	38.7	Very low	36.4	Very low	117 Å²	117	135 Å²	135	82%	0.818	80%	0.803	S	S	*	*			trans	-170.3	107.1	130.3	-169.2	0	0	0	0	112.2
165	A	34.5	Very low	35.9	Very low	103 Å²	103	138.2 Å²	138.2	85%	0.851	81%	0.814	S	S	*	*			trans	51.1	114.6	137.8	0	0	0	0	0	121.3
166	G	33.5	Very low	35.8	Very low	75 Å²	75	140.4 Å²	140.4	77%	0.773	82%	0.816	S	S	*	*			trans	157.5	99.6	153.6	0	0	0	0	0	112.3
167	P	33.6	Very low	36.1	Very low	114 Å²	114	144.3 Å²	144.3	74%	0.74	82%	0.823	S	S	*	*			trans	-91.6	170.6	174.1	36.5	-29.3	0	0	0	111.8
168	E	36.9	Very low	35.8	Very low	180 Å²	180	151.2 Å²	151.2	84%	0.841	83%	0.831	S	S	*	*			trans	87.8	119.4	175	-50	179.1	-177.9	0	0	112.7
169	E	37.2	Very low	35.8	Very low	193 Å²	193	146.3 Å²	146.3	90%	0.902	83%	0.825	S	S	*	*			cis	-147.9	156.7	28.5	-69.9	178.9	132.2	0	0	111.9
170	A	33.3	Very low	35.8	Very low	94 Å²	94	150.5 Å²	150.5	78%	0.777	83%	0.829	S	S	*	*			trans	-92.2	130.3	-177.9	0	0	0	0	0	112.7
171	V	40.5	Very low	35.5	Very low	145 Å²	145	151.9 Å²	151.9	88%	0.879	83%	0.832	S	S	*	*			trans	-146	103.1	149.9	-174.2	0	0	0	0	111.8
172	E	39.1	Very low	35.4	Very low	143 Å²	143	149.8 Å²	149.8	67%	0.668	83%	0.828	S	S	*	*			trans	17.1	124.2	144.9	-58.8	-156.2	137.5	0	0	124.5
173	K	32.4	Very low	35.1	Very low	164 Å²	164	153.5 Å²	153.5	71%	0.713	83%	0.834	S	S	*	*				67.5	113.4	122.2	-63.1	171.2	-178.6	155.5	0	120.6
174	K	32.9	Very low	35.4	Very low	204 Å²	204	157.9 Å²	157.9	89%	0.887	84%	0.838	S	S	*	*				176.1	122.3	111.6	-95.4	169.4	-174.5	175.6	0	111.8
175	P	28.7	Very low	35.4	Very low	127 Å²	127	160.5 Å²	160.5	83%	0.825	84%	0.838	S	S	*	*			trans	-101.5	141.5	168.5	35.2	-26.2	0	0	0	111.7
176	K	35.9	Very low	35.5	Very low	197 Å²	197	160.7 Å²	160.7	86%	0.857	83%	0.833	S	S	*	*			trans	-134.2	103.5	166.5	-84	-172.9	176.3	-178.9	0	111.3
177	Q	40.5	Very low	36	Very low	184 Å²	184	165 Å²	165	86%	0.86	84%	0.837	S	S	*	*				48	109.7	129.9	-63.2	178	-15	0	0	119.3
178	K	29	Very low	36.3	Very low	222 Å²	222	166 Å²	166	97%	0.965	84%	0.836	S	S	*	*			trans	-64.4	125.5	156.3	-67.4	176.4	176.3	177.3	0	109.6
179	A	38	Very low	36.5	Very low	100 Å²	100	165.5 Å²	165.5	83%	0.826	84%	0.838	S	S	*	*			trans	-113.5	140.3	170.6	0	0	0	0	0	110.8
180	K	40.6	Very low	36.8	Very low	207 Å²	207	161.4 Å²	161.4	90%	0.9	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-69.9	146.6	-171.3	-67.7	167.5	173.4	176.7	0	112.3
181	K	29.3	Very low	37.4	Very low	199 Å²	199	162.2 Å²	162.2	87%	0.865	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-57.6	141.4	169.8	-70	177.5	175.4	-179.7	0	111.8
182	P	35.4	Very low	37.9	Very low	126 Å²	126	164.3 Å²	164.3	82%	0.818	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-84.1	130.1	157.7	31.1	-27.3	0	0	0	110.6
183	R	31.6	Very low	38.9	Very low	251 Å²	251	163.6 Å²	163.6	95%	0.947	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-73.2	128.3	161.7	-88.5	176.3	163.4	166.9	-6.4	107.4
184	L	41	Very low	40.9	Very low	170 Å²	170	160.8 Å²	160.8	89%	0.89	82%	0.819	S	S	*	*			trans	-109.5	145.9	162.2	-150.3	82.5	0	0	0	108.4
185	E	40.3	Very low	42.8	Very low	173 Å²	173	158.7 Å²	158.7	81%	0.808	81%	0.809	S	S	*	*			trans	-71.4	146.5	-153.1	-67.6	154.3	165.2	0	0	114.5	L187	E185-L187 PolarHBondContact O-N 3.2Å
186	S	35.6	Very low	44.7	Very low	106 Å²	106	156.3 Å²	156.3	74%	0.741	79%	0.79	S	S	*	*			trans	-57.3	118.7	164.6	44.5	0	0	0	0	110.7
187	L	44	Very low	46.2	Very low	166 Å²	166	153.2 Å²	153.2	87%	0.869	78%	0.782	S	S	*	*			trans	-98.4	115.3	156.3	-77.6	169.1	0	0	0	107.7	E185 L189	E185-L187 PolarHBondContact O-N 3.2Å; L187-L189 PolarHBondContact O-N 3.14Å; L187-L189 VanDerWaalsContact O-N 3.11Å
188	D	39.5	Very low	47.9	Very low	136 Å²	136	148 Å²	148	73%	0.727	77%	0.766	S	S	*	*			trans	-59.1	102.8	176.9	-68.8	-39.1	0	0	0	111
189	L	41.8	Very low	49.9	Very low	168 Å²	168	144 Å²	144	88%	0.88	75%	0.748	S	S	*	*			trans	-108.3	57.4	150.6	-96.5	86	0	0	0	108.2	L187	L187-L189 PolarHBondContact O-N 3.14Å; L187-L189 VanDerWaalsContact O-N 3.11Å
190	D	44	Very low	51.6	Low	107 Å²	107	144.9 Å²	144.9	57%	0.572	74%	0.738	S	S	*	*			trans	-97.3	84.2	168.9	-98.6	-13.1	0	0	0	108.8	K195	D190-K195 IonicContact OD1-NZ 3.1Å; D190-K195 PolarHBondContact OD1-NZ 2.77Å; D190-K195 IonicContact OD2-NZ 2.84Å
191	C	44.5	Very low	52.5	Low	111 Å²	111	138.7 Å²	138.7	75%	0.75	72%	0.718	S	S	*	*	S	Bend	trans	176	143.1	144.6	54.6	0	0	0	0	108.9
192	M	52	Low	53.6	Low	190 Å²	190	134.4 Å²	134.4	94%	0.936	71%	0.713	S	S	*	*	S	Bend	trans	95.2	-4.8	176.8	-52.5	-170.1	70.2	0	0	119.1
193	V	60.4	Low	54.5	Low	127 Å²	127	135.6 Å²	135.6	77%	0.77	71%	0.712	S	S	*	*	S	Bend	trans	-104.8	116.7	170.5	-173.9	0	0	0	0	109.4	K195	V193-K195 PolarHBondContact O-N 2.94Å; V193-K195 VanDerWaalsContact O-N 3.12Å
194	E	73.7	Confident	55.3	Low	106 Å²	106	130.2 Å²	130.2	50%	0.495	70%	0.702	S	S	.	*			trans	-56.4	114.7	174	-170	76.9	-151.3	0	0	108.7	K199	E194-K199 WeakPolarHBondContact OE1-CD 3.47Å; E194-K199 IonicContact OE1-NZ 2.95Å; E194-K199 PolarHBondContact OE1-NZ 2.88Å
195	K	72.5	Confident	55.6	Low	159 Å²	159	129.3 Å²	129.3	69%	0.691	70%	0.698	S	S	*	*			trans	-82	-16.2	-178.3	-65.7	-176.6	178.3	177.2	0	112.8	D190 V193 L197	D190-K195 IonicContact OD1-NZ 3.1Å; D190-K195 PolarHBondContact OD1-NZ 2.77Å; D190-K195 IonicContact OD2-NZ 2.84Å; V193-K195 PolarHBondContact O-N 2.94Å; V193-K195 VanDerWaalsContact O-N 3.12Å; K195-L197 PolarHBondContact O-N 3.26Å
196	D	68.7	Low	55.6	Low	78 Å²	78	124.1 Å²	124.1	42%	0.417	69%	0.692	S	S	.	*			trans	-82.2	95.5	175.1	-92.2	-26.6	0	0	0	110.5	S198 K199 I200	D196-S198 PolarHBondContact O-N 2.95Å; D196-K199 HydrophobicContact CB-CB 4.4Å; D196-K199 HydrophobicContact CB-CD 4.01Å; D196-K199 HydrophobicContact CB-CG 4.04Å; D196-K199 PolarHBondContact O-N 3.08Å; D196-K199 WeakPolarHBondContact OD2-CE 3.47Å; D196-K199 IonicContact OD2-NZ 2.95Å; D196-K199 PolarHBondContact OD2-NZ 2.91Å; D196-I200 WeakPolarHBondContact O-CG1 3.26Å
197	L	68.7	Low	56	Low	131 Å²	131	123.1 Å²	123.1	69%	0.686	70%	0.698	S	S	*	*	H	α-helix	trans	-55.6	-32.4	174.8	-80.1	143.2	0	0	0	112.5	K195 K199 I200 T201	K195-L197 PolarHBondContact O-N 3.26Å; L197-K199 PolarHBondContact O-N 2.94Å; L197-I200 PolarHBondContact O-N 2.78Å; L197-T201 PolarHBondContact O-N 3.05Å; L197-T201 VanDerWaalsContact O-N 3.09Å; L197-T201 PolarHBondContact O-OG1 2.93Å
198	S	76.2	Confident	56.3	Low	76 Å²	76	126.2 Å²	126.2	53%	0.531	70%	0.698	S	S	.	*	H	α-helix	trans	-64.3	-16.3	176.7	46.6	0	0	0	0	114.5	D196	D196-S198 PolarHBondContact O-N 2.95Å
199	K	70.4	Confident	57	Low	137 Å²	137	125.1 Å²	125.1	60%	0.596	70%	0.696	S	S	*	*	H	α-helix	trans	-94.9	-14.9	175.7	-66.6	-179.1	-160.2	152.2	0	113.9	E194 D196 L197	E194-K199 WeakPolarHBondContact OE1-CD 3.47Å; E194-K199 IonicContact OE1-NZ 2.95Å; E194-K199 PolarHBondContact OE1-NZ 2.88Å; D196-K199 HydrophobicContact CB-CB 4.4Å; D196-K199 HydrophobicContact CB-CD 4.01Å; D196-K199 HydrophobicContact CB-CG 4.04Å; D196-K199 PolarHBondContact O-N 3.08Å; D196-K199 WeakPolarHBondContact OD2-CE 3.47Å; D196-K199 IonicContact OD2-NZ 2.95Å; D196-K199 PolarHBondContact OD2-NZ 2.91Å; L197-K199 PolarHBondContact O-N 2.94Å
200	I	72.8	Confident	57.7	Low	118 Å²	118	123.3 Å²	123.3	61%	0.605	69%	0.694	S	S	*	*	H	α-helix	trans	-98.3	-19.5	177.4	-13.5	172.3	0	0	0	111	D196 L197	D196-I200 WeakPolarHBondContact O-CG1 3.26Å; L197-I200 PolarHBondContact O-N 2.78Å
201	T	60.2	Low	58.4	Low	78 Å²	78	120.9 Å²	120.9	48%	0.479	69%	0.685	S	S	.	*	S	Bend	trans	-96.6	117.9	176.1	35.7	0	0	0	0	109.4	L197 D203	L197-T201 PolarHBondContact O-N 3.05Å; L197-T201 VanDerWaalsContact O-N 3.09Å; L197-T201 PolarHBondContact O-OG1 2.93Å; T201-D203 PolarHBondContact O-N 3.34Å; T201-D203 VanDerWaalsContact O-N 3.11Å
202	S	52.6	Low	59.4	Low	108 Å²	108	117.1 Å²	117.1	76%	0.755	66%	0.657	S	S	*	*			trans	-62.6	107.6	161.5	46.2	0	0	0	0	108.1	D204	S202-D204 PolarHBondContact O-N 2.97Å
203	D	53.2	Low	60.5	Low	151 Å²	151	112 Å²	112	81%	0.807	64%	0.638	S	S	*	*			trans	-66.3	78	158	-73.3	-36.1	0	0	0	107.4	T201	T201-D203 PolarHBondContact O-N 3.34Å; T201-D203 VanDerWaalsContact O-N 3.11Å
204	D	49.4	Very low	61.1	Low	138 Å²	138	108 Å²	108	74%	0.738	61%	0.614	S	S	*	*			trans	-139.6	111.5	174.8	-150.4	15.7	0	0	0	111.3	S202	S202-D204 PolarHBondContact O-N 2.97Å
205	D	46.7	Very low	61.3	Low	151 Å²	151	109.1 Å²	109.1	81%	0.807	62%	0.615	S	S	*	*	S	Bend	trans	42.9	100	155.5	-149.3	24.3	0	0	0	118.4	G207	D205-G207 PolarHBondContact O-N 3.18Å
206	G	41.3	Very low	61.5	Low	65 Å²	65	104.6 Å²	104.6	67%	0.67	60%	0.602	S	S	*	*			trans	41.2	74	153.1	0	0	0	0	0	115.7	R208	G206-R208 PolarHBondContact O-N 3.2Å
207	G	44.2	Very low	61.8	Low	84 Å²	84	107 Å²	107	87%	0.866	61%	0.609	S	S	*	*			trans	-48.1	57.8	-175	0	0	0	0	0	118.5	D205 V209	D205-G207 PolarHBondContact O-N 3.18Å; G207-V209 PolarHBondContact O-N 2.98Å
208	R	49.6	Very low	62.2	Low	231 Å²	231	101.3 Å²	101.3	87%	0.872	58%	0.581	S	S	*	*			trans	-75.5	98.3	151.1	-68.3	-172.4	-166.6	-112.2	2.1	104.8	G206	G206-R208 PolarHBondContact O-N 3.2Å
209	V	55	Low	62.3	Low	113 Å²	113	104.1 Å²	104.1	69%	0.685	58%	0.584	S	S	*	*			trans	-39.7	129.4	154.8	177	0	0	0	0	106.5	G207 C211	G207-V209 PolarHBondContact O-N 2.98Å; V209-C211 PolarHBondContact O-N 3.06Å
210	P	55.7	Low	62.8	Low	130 Å²	130	104 Å²	104	84%	0.844	59%	0.585	S	S	*	*			trans	-60.5	88.9	177.4	23.3	-31.9	0	0	0	108
211	C	58.1	Low	62.9	Low	56 Å²	56	100.1 Å²	100.1	38%	0.378	57%	0.565	S	S	.	*			trans	-83.5	131.6	-177.6	-124.2	0	0	0	0	105.9	V209 Y215	V209-C211 PolarHBondContact O-N 3.06Å; C211-Y215 HydrophobicContact CB-CD1 4.21Å; C211-Y215 WeakPolarHBondContact SG-CD1 3.45Å; C211-Y215 WeakPolarHBondContact SG-CE1 3.11Å
212	N	66.4	Low	63.8	Low	33 Å²	33	100.6 Å²	100.6	18%	0.176	56%	0.564	C	S	.	*			trans	-47.6	127.5	176.6	-178	-18.9	0	0	0	108.7	V214 Y215 C216 M246	N212-V214 PolarHBondContact O-N 3.14Å; N212-V214 VanDerWaalsContact O-N 3.09Å; N212-V214 VanDerWaalsContact OD1-CB 3.31Å; N212-V214 WeakPolarHBondContact OD1-CB 3.48Å; N212-V214 WeakPolarHBondContact OD1-CG2 3.43Å; N212-V214 PolarHBondContact OD1-N 3.04Å; N212-Y215 CarbonylContact O-C 3.58Å; N212-Y215 WeakPolarHBondContact O-CA 3.48Å; N212-Y215 WeakPolarHBondContact O-CB 3.35Å; N212-Y215 PolarHBondContact O-N 3.46Å; N212-C216 PolarHBondContact O-N 3.41Å; N212-M246 PolarHBondContact ND2-O 3.37Å
213	P	74.8	Confident	65.1	Low	82 Å²	82	99.5 Å²	99.5	53%	0.532	56%	0.562	S	S	.	*	H	α-helix	trans	-54.2	-31.4	178.7	19.3	-31.8	0	0	0	112	C216 K217	P213-C216 PolarHBondContact O-N 3.48Å; P213-K217 WeakPolarHBondContact O-CB 3.23Å; P213-K217 PolarHBondContact O-N 2.81Å
214	V	73.7	Confident	66.1	Low	43 Å²	43	97.8 Å²	97.8	26%	0.261	55%	0.547	S	S	.	.	H	α-helix	trans	-63.5	-43.4	172.1	-175.5	0	0	0	0	111.2	N212 K217 A218 F235	N212-V214 PolarHBondContact O-N 3.14Å; N212-V214 VanDerWaalsContact O-N 3.09Å; N212-V214 VanDerWaalsContact OD1-CB 3.31Å; N212-V214 WeakPolarHBondContact OD1-CB 3.48Å; N212-V214 WeakPolarHBondContact OD1-CG2 3.43Å; N212-V214 PolarHBondContact OD1-N 3.04Å; V214-K217 PolarHBondContact O-N 3.07Å; V214-A218 VanDerWaalsContact O-CB 3.25Å; V214-A218 WeakPolarHBondContact O-CB 3.43Å; V214-A218 PolarHBondContact O-N 3.44Å; V214-F235 HydrophobicContact CG1-CD1 3.76Å; V214-F235 HydrophobicContact CG1-CE1 3.39Å
215	Y	77	Confident	67.3	Low	130 Å²	130	97.2 Å²	97.2	51%	0.51	54%	0.536	S	S	.	.	H	α-helix	trans	-64.8	-43	175.2	176.1	-89.1	0	0	0	112	C211 N212 K217 A218 K219	C211-Y215 HydrophobicContact CB-CD1 4.21Å; C211-Y215 WeakPolarHBondContact SG-CD1 3.45Å; C211-Y215 WeakPolarHBondContact SG-CE1 3.11Å; N212-Y215 CarbonylContact O-C 3.58Å; N212-Y215 WeakPolarHBondContact O-CA 3.48Å; N212-Y215 WeakPolarHBondContact O-CB 3.35Å; N212-Y215 PolarHBondContact O-N 3.46Å; Y215-K217 VanDerWaalsContact C-N 3.31Å; Y215-K217 PolarHBondContact O-N 3.31Å; Y215-A218 PolarHBondContact O-N 3.31Å; Y215-K219 HydrophobicContact CE1-CD 4.11Å; Y215-K219 VanDerWaalsContact O-CB 3.23Å; Y215-K219 WeakPolarHBondContact O-CB 3.39Å; Y215-K219 PolarHBondContact O-N 2.85Å
216	C	77.6	Confident	68.3	Low	63 Å²	63	95 Å²	95	43%	0.426	53%	0.529	S	S	.	.	H	α-helix	trans	-58.4	-44.7	175.2	-74	0	0	0	0	111.6	N212 P213 K219 E220	N212-C216 PolarHBondContact O-N 3.41Å; P213-C216 PolarHBondContact O-N 3.48Å; C216-K219 PolarHBondContact O-N 3.27Å; C216-E220 WeakPolarHBondContact O-CB 3.11Å; C216-E220 PolarHBondContact O-N 3.32Å
217	K	74.7	Confident	69.2	Low	128 Å²	128	100.5 Å²	100.5	56%	0.557	54%	0.54	S	S	*	.	H	α-helix	trans	-69.1	-42.5	179.1	-164	170.4	-175.9	-178.2	0	112	P213 V214 Y215 K219 E220 I221	P213-K217 WeakPolarHBondContact O-CB 3.23Å; P213-K217 PolarHBondContact O-N 2.81Å; V214-K217 PolarHBondContact O-N 3.07Å; Y215-K217 VanDerWaalsContact C-N 3.31Å; Y215-K217 PolarHBondContact O-N 3.31Å; K217-K219 VanDerWaalsContact C-N 3.34Å; K217-K219 PolarHBondContact O-N 2.89Å; K217-E220 PolarHBondContact O-N 2.78Å; K217-I221 HydrophobicContact CG-CD1 4.24Å; K217-I221 VanDerWaalsContact O-CG1 3.26Å; K217-I221 WeakPolarHBondContact O-CG1 3.12Å; K217-I221 PolarHBondContact O-N 3.29Å
218	A	76.8	Confident	69.8	Low	13 Å²	13	98 Å²	98	11%	0.107	51%	0.511	C	S	.	.	H	α-helix	trans	-60.5	-43.3	173.7	0	0	0	0	0	111.4	V214 Y215 I221 L222 L231 F235	V214-A218 VanDerWaalsContact O-CB 3.25Å; V214-A218 WeakPolarHBondContact O-CB 3.43Å; V214-A218 PolarHBondContact O-N 3.44Å; Y215-A218 PolarHBondContact O-N 3.31Å; A218-I221 PolarHBondContact O-N 3.02Å; A218-L222 WeakPolarHBondContact O-CB 3.26Å; A218-L222 PolarHBondContact O-N 3.47Å; A218-L231 HydrophobicContact CB-CD2 3.69Å; A218-F235 HydrophobicContact CB-CZ 4.22Å
219	K	78.9	Confident	70.2	Confident	134 Å²	134	92.8 Å²	92.8	58%	0.583	51%	0.505	S	S	*	.	H	α-helix	trans	-62.7	-41.5	175.4	-176.7	177.3	178.5	176.8	0	111.9	Y215 C216 K217 A223	Y215-K219 HydrophobicContact CE1-CD 4.11Å; Y215-K219 VanDerWaalsContact O-CB 3.23Å; Y215-K219 WeakPolarHBondContact O-CB 3.39Å; Y215-K219 PolarHBondContact O-N 2.85Å; C216-K219 PolarHBondContact O-N 3.27Å; K217-K219 VanDerWaalsContact C-N 3.34Å; K217-K219 PolarHBondContact O-N 2.89Å; K219-A223 VanDerWaalsContact O-CB 3.24Å; K219-A223 WeakPolarHBondContact O-CB 3.33Å; K219-A223 PolarHBondContact O-N 3.12Å
220	E	79.6	Confident	70.5	Confident	136 Å²	136	88.7 Å²	88.7	64%	0.636	48%	0.483	S	S	*	.	H	α-helix	trans	-64.9	-41.4	175.6	-168.3	-179.5	171.5	0	0	111.8	C216 K217 A223 K224	C216-E220 WeakPolarHBondContact O-CB 3.11Å; C216-E220 PolarHBondContact O-N 3.32Å; K217-E220 PolarHBondContact O-N 2.78Å; E220-A223 PolarHBondContact O-N 2.97Å; E220-K224 VanDerWaalsContact O-CB 3.29Å; E220-K224 WeakPolarHBondContact O-CB 3.31Å; E220-K224 PolarHBondContact O-N 3.28Å
221	I	76.4	Confident	70.8	Confident	35 Å²	35	84.9 Å²	84.9	18%	0.179	46%	0.456	C	S	.	.	H	α-helix	trans	-65	-45.4	176.4	-69.2	167.9	0	0	0	110.9	K217 A218 A223 K224 Y225 A230 T234	K217-I221 HydrophobicContact CG-CD1 4.24Å; K217-I221 VanDerWaalsContact O-CG1 3.26Å; K217-I221 WeakPolarHBondContact O-CG1 3.12Å; K217-I221 PolarHBondContact O-N 3.29Å; A218-I221 PolarHBondContact O-N 3.02Å; I221-A223 VanDerWaalsContact C-N 3.35Å; I221-A223 PolarHBondContact O-N 3.27Å; I221-K224 PolarHBondContact O-N 3.18Å; I221-K224 VanDerWaalsContact O-N 3.14Å; I221-Y225 PolarHBondContact O-N 3.49Å; I221-A230 HydrophobicContact CG2-CB 4.13Å; I221-T234 HydrophobicContact CD1-CG2 3.54Å; I221-T234 VanDerWaalsContact CD1-OG1 3.26Å; I221-T234 WeakPolarHBondContact CD1-OG1 3.25Å
222	L	77.8	Confident	71.2	Confident	88 Å²	88	86.3 Å²	86.3	46%	0.461	46%	0.463	S	S	.	.	H	α-helix	trans	-66.9	-36.7	179.2	-139.7	74.2	0	0	0	112	A218 K224 Y225 P226 L231	A218-L222 WeakPolarHBondContact O-CB 3.26Å; A218-L222 PolarHBondContact O-N 3.47Å; L222-K224 VanDerWaalsContact C-N 3.28Å; L222-K224 PolarHBondContact O-N 3.12Å; L222-Y225 CarbonylContact O-C 3.56Å; L222-P226 WeakPolarHBondContact O-CA 3.08Å; L222-L231 HydrophobicContact CD1-CD1 3.75Å; L222-L231 HydrophobicContact CD1-CD2 4.47Å; L222-L231 HydrophobicContact CD1-CG 3.98Å
223	A	79.6	Confident	71.1	Confident	86 Å²	86	91.7 Å²	91.7	71%	0.711	49%	0.492	S	S	*	.	H	α-helix	trans	-66.2	-32.2	173.2	0	0	0	0	0	112.2	K219 E220 I221	K219-A223 VanDerWaalsContact O-CB 3.24Å; K219-A223 WeakPolarHBondContact O-CB 3.33Å; K219-A223 PolarHBondContact O-N 3.12Å; E220-A223 PolarHBondContact O-N 2.97Å; I221-A223 VanDerWaalsContact C-N 3.35Å; I221-A223 PolarHBondContact O-N 3.27Å
224	K	75.3	Confident	70.6	Confident	114 Å²	114	89.8 Å²	89.8	50%	0.496	48%	0.478	S	S	.	.	H	α-helix	trans	-83.1	-31	179.8	-162.3	174.5	177.4	-174.8	0	112.7	E220 I221 L222	E220-K224 VanDerWaalsContact O-CB 3.29Å; E220-K224 WeakPolarHBondContact O-CB 3.31Å; E220-K224 PolarHBondContact O-N 3.28Å; I221-K224 PolarHBondContact O-N 3.18Å; I221-K224 VanDerWaalsContact O-N 3.14Å; L222-K224 VanDerWaalsContact C-N 3.28Å; L222-K224 PolarHBondContact O-N 3.12Å
225	Y	73.7	Confident	70.3	Confident	127 Å²	127	89.3 Å²	89.3	50%	0.498	47%	0.473	S	S	.	.			trans	-141.1	86.7	-179.1	-54.5	-82.2	0	0	0	111	I221 L222 M227 A228	I221-Y225 PolarHBondContact O-N 3.49Å; L222-Y225 CarbonylContact O-C 3.56Å; Y225-M227 PolarHBondContact O-N 3.36Å; Y225-A228 VanDerWaalsContact CB-CB 3.45Å; Y225-A228 HydrophobicContact CG-CB 4.35Å; Y225-A228 PolarHBondContact O-N 3.33Å; Y225-A228 VanDerWaalsContact O-N 3.14Å
226	P	67.1	Low	69.6	Low	103 Å²	103	89.9 Å²	89.9	67%	0.669	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-9.2	-174.4	24.6	-33.5	0	0	0	114.7	L222	L222-P226 WeakPolarHBondContact O-CA 3.08Å
227	M	62	Low	69	Low	181 Å²	181	91.9 Å²	91.9	89%	0.892	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.3	6.7	179.2	-70.4	-69.4	148.3	0	0	113	Y225 T229	Y225-M227 PolarHBondContact O-N 3.36Å; M227-T229 PolarHBondContact O-N 3.32Å
228	A	56.5	Low	68.3	Low	31 Å²	31	89.6 Å²	89.6	26%	0.256	49%	0.486	S	S	.	.			trans	-81.9	122.3	-173.6	0	0	0	0	0	111.7	Y225 A230	Y225-A228 VanDerWaalsContact CB-CB 3.45Å; Y225-A228 HydrophobicContact CG-CB 4.35Å; Y225-A228 PolarHBondContact O-N 3.33Å; Y225-A228 VanDerWaalsContact O-N 3.14Å; A228-A230 HydrophobicContact CB-CB 3.57Å; A228-A230 PolarHBondContact O-N 3.03Å
229	T	58.1	Low	67.3	Low	122 Å²	122	90.4 Å²	90.4	75%	0.748	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-6.4	153	39.8	0	0	0	0	113.2	M227 L231 T232	M227-T229 PolarHBondContact O-N 3.32Å; T229-L231 PolarHBondContact O-N 2.97Å; T229-T232 PolarHBondContact O-N 3.22Å; T229-T232 PolarHBondContact O-OG1 3.48Å
230	A	60.9	Low	66.4	Low	28 Å²	28	92 Å²	92	23%	0.231	51%	0.506	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-13.2	-178.4	0	0	0	0	0	115.8	I221 A228 T232 D233 T234	I221-A230 HydrophobicContact CG2-CB 4.13Å; A228-A230 HydrophobicContact CB-CB 3.57Å; A228-A230 PolarHBondContact O-N 3.03Å; A230-T232 VanDerWaalsContact C-N 3.26Å; A230-T232 PolarHBondContact O-N 3.18Å; A230-D233 PolarHBondContact O-N 3.24Å; A230-T234 PolarHBondContact O-N 3.35Å; A230-T234 PolarHBondContact O-OG1 3.5Å
231	L	62.7	Low	65.4	Low	50 Å²	50	94.4 Å²	94.4	26%	0.262	52%	0.515	S	S	.	.	H	α-helix	trans	-60	-37.9	169.6	-78.7	-174.5	0	0	0	111.6	A218 L222 T229 D233 T234 F235	A218-L231 HydrophobicContact CB-CD2 3.69Å; L222-L231 HydrophobicContact CD1-CD1 3.75Å; L222-L231 HydrophobicContact CD1-CD2 4.47Å; L222-L231 HydrophobicContact CD1-CG 3.98Å; T229-L231 PolarHBondContact O-N 2.97Å; L231-D233 VanDerWaalsContact C-N 3.27Å; L231-D233 PolarHBondContact O-N 3.22Å; L231-T234 PolarHBondContact O-N 3.39Å; L231-F235 HydrophobicContact CB-CD2 4.42Å; L231-F235 HydrophobicContact CB-CE2 3.94Å; L231-F235 HydrophobicContact CD2-CE2 4.03Å; L231-F235 HydrophobicContact CD2-CZ 4.34Å; L231-F235 HydrophobicContact CG-CE2 4.38Å; L231-F235 WeakPolarHBondContact O-CD2 3.25Å; L231-F235 PolarHBondContact O-N 2.87Å
232	T	65	Low	64.6	Low	86 Å²	86	95.3 Å²	95.3	53%	0.528	53%	0.533	S	S	.	.	H	α-helix	trans	-64.6	-32.4	179.9	57.5	0	0	0	0	112.6	T229 A230 T234	T229-T232 PolarHBondContact O-N 3.22Å; T229-T232 PolarHBondContact O-OG1 3.48Å; A230-T232 VanDerWaalsContact C-N 3.26Å; A230-T232 PolarHBondContact O-N 3.18Å; T232-T234 VanDerWaalsContact C-N 3.28Å; T232-T234 PolarHBondContact O-N 2.95Å
233	D	64.6	Low	63.9	Low	146 Å²	146	97.4 Å²	97.4	78%	0.781	54%	0.54	S	S	*	.	H	α-helix	trans	-78	-15.2	176.8	-63.7	-8.7	0	0	0	112.6	A230 L231	A230-D233 PolarHBondContact O-N 3.24Å; L231-D233 VanDerWaalsContact C-N 3.27Å; L231-D233 PolarHBondContact O-N 3.22Å
234	T	63.8	Low	63.2	Low	42 Å²	42	96.7 Å²	96.7	26%	0.258	52%	0.523	S	S	.	.	H	α-helix	trans	-91.8	-28.1	-176.4	-49.1	0	0	0	0	112.5	I221 A230 L231 T232	I221-T234 HydrophobicContact CD1-CG2 3.54Å; I221-T234 VanDerWaalsContact CD1-OG1 3.26Å; I221-T234 WeakPolarHBondContact CD1-OG1 3.25Å; A230-T234 PolarHBondContact O-N 3.35Å; A230-T234 PolarHBondContact O-OG1 3.5Å; L231-T234 PolarHBondContact O-N 3.39Å; T232-T234 VanDerWaalsContact C-N 3.28Å; T232-T234 PolarHBondContact O-N 2.95Å
235	F	67.3	Low	62.7	Low	32 Å²	32	94.3 Å²	94.3	14%	0.14	52%	0.516	C	S	.	.	S	Bend	trans	-90.3	126.9	-179.8	-63.9	-66.8	0	0	0	110.5	V214 A218 L231 M244 M246	V214-F235 HydrophobicContact CG1-CD1 3.76Å; V214-F235 HydrophobicContact CG1-CE1 3.39Å; A218-F235 HydrophobicContact CB-CZ 4.22Å; L231-F235 HydrophobicContact CB-CD2 4.42Å; L231-F235 HydrophobicContact CB-CE2 3.94Å; L231-F235 HydrophobicContact CD2-CE2 4.03Å; L231-F235 HydrophobicContact CD2-CZ 4.34Å; L231-F235 HydrophobicContact CG-CE2 4.38Å; L231-F235 WeakPolarHBondContact O-CD2 3.25Å; L231-F235 PolarHBondContact O-N 2.87Å; F235-M244 HydrophobicContact CB-CE 3.83Å; F235-M244 HydrophobicContact CB-CG 4.12Å; F235-M244 HydrophobicContact CB-SD 3.65Å; F235-M244 HydrophobicContact CD2-SD 4.11Å; F235-M244 HydrophobicContact CG-SD 4.15Å; F235-M246 HydrophobicContact CD1-CE 4.31Å; F235-M246 HydrophobicContact CD2-CE 4.25Å; F235-M246 HydrophobicContact CE1-CE 3.88Å; F235-M246 HydrophobicContact CE2-CE 3.85Å; F235-M246 HydrophobicContact CG-CE 4.49Å; F235-M246 HydrophobicContact CZ-CE 3.67Å
236	L	62.9	Low	62.3	Low	143 Å²	143	93.6 Å²	93.6	75%	0.749	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-75.7	133	168.2	-105.6	88.6	0	0	0	109.4	T238	L236-T238 PolarHBondContact O-N 3.48Å
237	I	64.3	Low	62	Low	105 Å²	105	96.6 Å²	96.6	54%	0.538	52%	0.521	S	S	.	.	B	Isolated β-bridge	trans	-74.2	118.4	162	-59.2	171.3	0	0	0	106.1	S239 M244	I237-S239 VanDerWaalsContact CG2-O 3.24Å; I237-S239 WeakPolarHBondContact CG2-O 3.21Å; I237-M244 HydrophobicContact CG1-CG 4.33Å
238	T	60.6	Low	61.5	Low	79 Å²	79	91.8 Å²	91.8	49%	0.485	51%	0.505	S	S	.	.			trans	-95.9	-7.6	-171.8	47.3	0	0	0	0	113.9	L236 E243 D245	L236-T238 PolarHBondContact O-N 3.48Å; T238-E243 PolarHBondContact N-O 3.01Å; T238-E243 VanDerWaalsContact N-O 3.13Å; T238-E243 PolarHBondContact OG1-O 3.16Å; T238-D245 HydrophobicContact CG2-CB 3.3Å; T238-D245 VanDerWaalsContact OG1-CB 3.28Å; T238-D245 WeakPolarHBondContact OG1-CB 3.42Å
239	S	56.8	Low	60.8	Low	30 Å²	30	100.6 Å²	100.6	21%	0.21	53%	0.532	C	S	.	.	S	Bend	trans	-144.6	156.1	179.2	69.5	0	0	0	0	111.2	I237 F241 G242	I237-S239 VanDerWaalsContact CG2-O 3.24Å; I237-S239 WeakPolarHBondContact CG2-O 3.21Å; S239-F241 PolarHBondContact O-N 3.45Å; S239-G242 PolarHBondContact O-N 3.01Å
240	D	60.3	Low	60.1	Low	169 Å²	169	105.7 Å²	105.7	90%	0.904	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-6	176.2	-50.5	-34.2	0	0	0	112.5
241	F	57.5	Low	58.9	Low	185 Å²	185	109.8 Å²	109.8	81%	0.811	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	3.4	177.8	-55.8	-71.7	0	0	0	114.3	S239 E243	S239-F241 PolarHBondContact O-N 3.45Å; F241-E243 VanDerWaalsContact C-N 3.26Å; F241-E243 PolarHBondContact O-N 3.26Å
242	G	59.2	Low	57.5	Low	54 Å²	54	110.4 Å²	110.4	56%	0.557	58%	0.583	S	S	*	*			trans	74.3	13.9	-178.3	0	0	0	0	0	114.2	S239 M244	S239-G242 PolarHBondContact O-N 3.01Å; G242-M244 PolarHBondContact O-N 3.33Å
243	E	62.6	Low	56.1	Low	133 Å²	133	112.5 Å²	112.5	62%	0.621	60%	0.598	S	S	*	*			trans	-74.2	121.8	172.5	-65.6	-168.7	154.9	0	0	110.5	T238 F241	T238-E243 PolarHBondContact N-O 3.01Å; T238-E243 VanDerWaalsContact N-O 3.13Å; T238-E243 PolarHBondContact OG1-O 3.16Å; F241-E243 VanDerWaalsContact C-N 3.26Å; F241-E243 PolarHBondContact O-N 3.26Å
244	M	66.8	Low	54.6	Low	71 Å²	71	112.2 Å²	112.2	35%	0.35	60%	0.601	S	S	.	*	B	Isolated β-bridge	trans	-81.5	112.6	165.2	-80.8	-176.6	168	0	0	109.4	F235 I237 G242 M246	F235-M244 HydrophobicContact CB-CE 3.83Å; F235-M244 HydrophobicContact CB-CG 4.12Å; F235-M244 HydrophobicContact CB-SD 3.65Å; F235-M244 HydrophobicContact CD2-SD 4.11Å; F235-M244 HydrophobicContact CG-SD 4.15Å; I237-M244 HydrophobicContact CG1-CG 4.33Å; G242-M244 PolarHBondContact O-N 3.33Å; M244-M246 PolarHBondContact O-N 3.48Å
245	D	64.1	Low	53	Low	64 Å²	64	114.1 Å²	114.1	34%	0.342	62%	0.621	S	S	.	*			trans	-70.5	101.2	174.8	-170.1	14.4	0	0	0	110.7	T238 K247	T238-D245 HydrophobicContact CG2-CB 3.3Å; T238-D245 VanDerWaalsContact OG1-CB 3.28Å; T238-D245 WeakPolarHBondContact OG1-CB 3.42Å; D245-K247 WeakPolarHBondContact OD1-CA 3.5Å; D245-K247 WeakPolarHBondContact OD1-CB 3.47Å; D245-K247 PolarHBondContact OD1-N 2.9Å
246	M	65.8	Low	51.3	Low	112 Å²	112	118.1 Å²	118.1	55%	0.552	65%	0.651	S	S	*	*			trans	-90	0.9	169.5	-66	-163.1	162.3	0	0	112.7	N212 F235 M244	N212-M246 PolarHBondContact ND2-O 3.37Å; F235-M246 HydrophobicContact CD1-CE 4.31Å; F235-M246 HydrophobicContact CD2-CE 4.25Å; F235-M246 HydrophobicContact CE1-CE 3.88Å; F235-M246 HydrophobicContact CE2-CE 3.85Å; F235-M246 HydrophobicContact CG-CE 4.49Å; F235-M246 HydrophobicContact CZ-CE 3.67Å; M244-M246 PolarHBondContact O-N 3.48Å
247	K	59.2	Low	49.9	Very low	165 Å²	165	118.8 Å²	118.8	72%	0.717	65%	0.654	S	S	*	*	S	Bend	trans	-86.3	129	-176.6	-59.1	175.6	-179.1	166	0	110.1	D245 R249	D245-K247 WeakPolarHBondContact OD1-CA 3.5Å; D245-K247 WeakPolarHBondContact OD1-CB 3.47Å; D245-K247 PolarHBondContact OD1-N 2.9Å; K247-R249 PolarHBondContact O-N 3.49Å
248	S	52.4	Low	48.4	Very low	81 Å²	81	119.4 Å²	119.4	57%	0.566	66%	0.664	S	S	*	*			trans	-67.2	90.6	177.5	51.3	0	0	0	0	111.4
249	R	42.2	Very low	47.2	Very low	215 Å²	215	124.8 Å²	124.8	81%	0.811	68%	0.681	S	S	*	*			trans	-107	11.6	165.1	-76.4	-167.1	177.9	-149.2	3.3	114.4	K247 S251	K247-R249 PolarHBondContact O-N 3.49Å; R249-S251 VanDerWaalsContact C-N 3.27Å; R249-S251 PolarHBondContact O-N 3.12Å; R249-S251 VanDerWaalsContact O-N 3.08Å
250	W	42.5	Very low	46.1	Very low	229 Å²	229	130 Å²	130	87%	0.867	71%	0.712	S	S	*	*			trans	-86	71.3	171.1	-65.5	78.5	0	0	0	109.9
251	S	36.9	Very low	44.7	Very low	114 Å²	114	126 Å²	126	80%	0.797	70%	0.702	S	S	*	*			trans	-128	88.9	165.8	64.1	0	0	0	0	108.4	R249	R249-S251 VanDerWaalsContact C-N 3.27Å; R249-S251 PolarHBondContact O-N 3.12Å; R249-S251 VanDerWaalsContact O-N 3.08Å
252	G	32.1	Very low	43.6	Very low	63 Å²	63	123.4 Å²	123.4	65%	0.649	70%	0.704	S	S	*	*			trans	-164.7	124	172	0	0	0	0	0	108.7
253	P	36.9	Very low	42.2	Very low	130 Å²	130	126.3 Å²	126.3	84%	0.844	71%	0.714	S	S	*	*			trans	-63.1	141.5	178	28.1	-31.9	0	0	0	109.1	A255	P253-A255 PolarHBondContact O-N 3.02Å
254	T	31.5	Very low	40.8	Very low	140 Å²	140	129.1 Å²	129.1	86%	0.859	73%	0.728	S	S	*	*			trans	-46.9	103.3	175.3	-42.7	0	0	0	0	110.6
255	A	30.2	Very low	39.6	Very low	82 Å²	82	133 Å²	133	68%	0.678	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-71.7	126.1	161.5	0	0	0	0	0	107.3	P253 I257	P253-A255 PolarHBondContact O-N 3.02Å; A255-I257 PolarHBondContact O-N 3.35Å
256	P	32.7	Very low	38.4	Very low	117 Å²	117	134.9 Å²	134.9	76%	0.76	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-69.2	121.6	177.8	13.8	-6.4	0	0	0	108.8
257	I	34.3	Very low	37.1	Very low	157 Å²	157	135.1 Å²	135.1	81%	0.805	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-60.6	128.1	170.7	-60.1	169.6	0	0	0	107.6	A255 K259	A255-I257 PolarHBondContact O-N 3.35Å; I257-K259 PolarHBondContact O-N 3.11Å
258	P	31.4	Very low	36	Very low	118 Å²	118	134.4 Å²	134.4	77%	0.766	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-64.1	129.8	178.3	-13.9	26.8	0	0	0	110.1
259	K	36.3	Very low	35.6	Very low	192 Å²	192	132.1 Å²	132.1	84%	0.835	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-68.2	134.5	166.9	-69.2	178.3	178.7	177.8	0	109.2	I257	I257-K259 PolarHBondContact O-N 3.11Å
260	T	33.3	Very low	35.5	Very low	140 Å²	140	126.7 Å²	126.7	86%	0.859	75%	0.754	S	S	*	*			trans	58.3	92.5	158	55	0	0	0	0	117.7
261	A	30.9	Very low	35.3	Very low	85 Å²	85	121 Å²	121	70%	0.702	74%	0.739	S	S	*	*			trans	-146	132	142.4	0	0	0	0	0	108.5	C263	A261-C263 PolarHBondContact O-N 2.92Å
262	P	33.5	Very low	35.3	Very low	129 Å²	129	118.2 Å²	118.2	84%	0.838	72%	0.72	S	S	*	*			trans	-74.1	111.9	-175.7	29.6	-30.3	0	0	0	109.2
263	C	31.4	Very low	35.5	Very low	116 Å²	116	121.2 Å²	121.2	78%	0.784	72%	0.716	S	S	*	*			trans	-88.5	106.5	166.3	-68.1	0	0	0	0	107.6	A261 L265	A261-C263 PolarHBondContact O-N 2.92Å; C263-L265 PolarHBondContact O-N 3.28Å
264	E	33.3	Very low	35.3	Very low	192 Å²	192	119.3 Å²	119.3	90%	0.897	70%	0.704	S	S	*	*			trans	-61.1	100.7	167	-66.5	-169.5	162.8	0	0	108.8
265	L	40.4	Very low	35.5	Very low	151 Å²	151	119.1 Å²	119.1	79%	0.791	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-83.9	130.1	161.8	-74.5	167.5	0	0	0	107.3	C263	C263-L265 PolarHBondContact O-N 3.28Å
266	P	38.6	Very low	35.7	Very low	105 Å²	105	123.6 Å²	123.6	68%	0.682	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-58.3	146.7	-179.1	24.3	-31.5	0	0	0	109.8	L268	P266-L268 PolarHBondContact O-N 3.08Å
267	P	39.5	Very low	35.9	Very low	116 Å²	116	126.6 Å²	126.6	75%	0.753	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-56.9	136.2	-173.1	22.4	-31.4	0	0	0	109.9	G269	P267-G269 PolarHBondContact O-N 3.08Å
268	L	36.8	Very low	36	Very low	150 Å²	150	129.4 Å²	129.4	79%	0.785	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	36.3	173.8	-99	106.2	0	0	0	113.7	P266 I271	P266-L268 PolarHBondContact O-N 3.08Å; L268-I271 HydrophobicContact CD2-CD1 4.24Å; L268-I271 HydrophobicContact CG-CD1 4.29Å
269	G	42.4	Very low	35.9	Very low	34 Å²	34	131.7 Å²	131.7	35%	0.351	70%	0.7	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.2	-27.9	173.7	0	0	0	0	0	113.5	P267 S272	P267-G269 PolarHBondContact O-N 3.08Å; G269-S272 PolarHBondContact O-OG 3.42Å
270	D	40.3	Very low	35.5	Very low	101 Å²	101	125.3 Å²	125.3	54%	0.54	69%	0.689	S	S	.	*	S	Bend	trans	-90.9	-14.3	-173.2	-71	-35.7	0	0	0	114.5	S272 K273 C274	D270-S272 PolarHBondContact O-N 3.34Å; D270-K273 PolarHBondContact O-N 2.86Å; D270-K273 IonicContact OD1-NZ 2.6Å; D270-K273 PolarHBondContact OD1-NZ 3.38Å; D270-C274 PolarHBondContact O-N 2.91Å
271	I	39.7	Very low	35.3	Very low	108 Å²	108	127.9 Å²	127.9	55%	0.554	69%	0.691	S	S	*	*	H	α-helix	trans	-72.4	-24.1	169.7	-52.5	175.7	0	0	0	110.5	L268 K273 C274 L275	L268-I271 HydrophobicContact CD2-CD1 4.24Å; L268-I271 HydrophobicContact CG-CD1 4.29Å; I271-K273 VanDerWaalsContact C-N 3.3Å; I271-K273 PolarHBondContact O-N 2.85Å; I271-C274 PolarHBondContact O-N 2.82Å; I271-L275 PolarHBondContact O-N 2.85Å
272	S	36.4	Very low	35.2	Very low	56 Å²	56	130 Å²	130	39%	0.392	70%	0.695	S	S	.	*	H	α-helix	trans	-77.9	-9.4	172.9	79.9	0	0	0	0	114.5	G269 D270	G269-S272 PolarHBondContact O-OG 3.42Å; D270-S272 PolarHBondContact O-N 3.34Å
273	K	36.6	Very low	35	Very low	127 Å²	127	129.8 Å²	129.8	55%	0.552	70%	0.697	S	S	*	*	H	α-helix	trans	-97.1	-26.4	170.2	-70.1	177.3	-166.9	148.2	0	112.3	D270 I271 R276	D270-K273 PolarHBondContact O-N 2.86Å; D270-K273 IonicContact OD1-NZ 2.6Å; D270-K273 PolarHBondContact OD1-NZ 3.38Å; I271-K273 VanDerWaalsContact C-N 3.3Å; I271-K273 PolarHBondContact O-N 2.85Å; K273-R276 PolarHBondContact O-N 2.99Å
274	C	32	Very low	34.8	Very low	89 Å²	89	130.2 Å²	130.2	60%	0.601	70%	0.695	S	S	*	*	H	α-helix	trans	-72.3	-32.9	171.1	-82.5	0	0	0	0	112.7	D270 I271 R276 K277	D270-C274 PolarHBondContact O-N 2.91Å; I271-C274 PolarHBondContact O-N 2.82Å; C274-R276 PolarHBondContact O-N 2.75Å; C274-K277 PolarHBondContact O-N 2.88Å
275	L	35.1	Very low	34.6	Very low	136 Å²	136	128 Å²	128	71%	0.712	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-14.4	169.7	-90.5	154.4	0	0	0	114	I271	I271-L275 PolarHBondContact O-N 2.85Å
276	R	35.2	Very low	34.1	Very low	176 Å²	176	126.7 Å²	126.7	66%	0.664	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	0.8	178.5	-111.5	-172.9	-82.1	-152.1	-4.6	114.3	K273 C274	K273-R276 PolarHBondContact O-N 2.99Å; C274-R276 PolarHBondContact O-N 2.75Å
277	K	37.4	Very low	33.7	Very low	181 Å²	181	127 Å²	127	79%	0.787	69%	0.694	S	S	*	*	S	Bend	trans	-109.8	2.5	179.4	-83	-175.5	174.2	-176.1	0	114.1	C274	C274-K277 PolarHBondContact O-N 2.88Å
278	Y	35.8	Very low	33.1	Very low	216 Å²	216	132.7 Å²	132.7	85%	0.847	70%	0.7	S	S	*	*			trans	-116.5	27.3	170.7	-85.7	-86.1	0	0	0	111.7
279	E	28.5	Very low	32.8	Very low	166 Å²	166	134.2 Å²	134.2	78%	0.776	70%	0.701	S	S	*	*			trans	-94.6	82.5	163.7	-75.7	-176.4	156.4	0	0	108
280	G	28.9	Very low	32.1	Very low	58 Å²	58	138.8 Å²	138.8	60%	0.598	72%	0.722	S	S	*	*	S	Bend	trans	179.4	107.3	177.4	0	0	0	0	0	109.3
281	E	29.4	Very low	31.7	Very low	193 Å²	193	144 Å²	144	90%	0.902	74%	0.736	S	S	*	*			trans	69.8	103.6	170.5	-53.6	167.9	-166.6	0	0	112
282	V	28.5	Very low	31.3	Very low	131 Å²	131	144.2 Å²	144.2	79%	0.794	74%	0.744	S	S	*	*				-157.4	117	78.1	167	0	0	0	0	109.9	V284	V282-V284 HydrophobicContact CG1-CG2 3.74Å
283	S	28.1	Very low	31.1	Very low	124 Å²	124	148.9 Å²	148.9	87%	0.867	77%	0.765	S	S	*	*			trans	-81.6	119.8	163	-82	0	0	0	0	109.5
284	V	27.8	Very low	30.8	Very low	124 Å²	124	148.3 Å²	148.3	75%	0.752	78%	0.777	S	S	*	*			trans	-139.1	73.8	156.8	-167.9	0	0	0	0	109.5	V282	V282-V284 HydrophobicContact CG1-CG2 3.74Å
285	L	29.1	Very low	30.9	Very low	146 Å²	146	150 Å²	150	76%	0.764	78%	0.784	S	S	*	*			trans	-135.2	98.9	154.1	-74.4	178.3	0	0	0	106.8
286	S	29.6	Very low	31	Very low	123 Å²	123	148 Å²	148	86%	0.86	79%	0.788	S	S	*	*			trans	-87.1	153	170.3	-96.1	0	0	0	0	111.3
287	P	31.5	Very low	31.2	Very low	111 Å²	111	146.4 Å²	146.4	72%	0.721	80%	0.797	S	S	*	*			trans	-115.9	145.4	-141.6	36.4	-23.2	0	0	0	112.8
288	R	26.5	Very low	31.2	Very low	236 Å²	236	141.2 Å²	141.2	89%	0.891	78%	0.782	S	S	*	*			trans	-143.5	130.7	163.1	-77.3	-166.4	167.5	146.3	-2.8	112.1
289	F	30.3	Very low	31.9	Very low	182 Å²	182	133.7 Å²	133.7	80%	0.798	76%	0.761	S	S	*	*			trans	88.3	92	172.4	-71.1	-82.7	0	0	0	118.9	Y291	F289-Y291 HydrophobicContact CD1-CD2 4.42Å; F289-Y291 HydrophobicContact CD1-CE2 4.45Å; F289-Y291 HydrophobicContact CE1-CE2 4.43Å
290	T	26.9	Very low	32.5	Very low	130 Å²	130	132.1 Å²	132.1	80%	0.798	76%	0.757	S	S	*	*			trans	-104.7	134.4	146.4	45.9	0	0	0	0	108.8
291	Y	32.7	Very low	33.7	Very low	212 Å²	212	134.9 Å²	134.9	83%	0.831	76%	0.758	S	S	*	*			trans	-133.8	151.4	146.6	-89.6	-79.6	0	0	0	110	F289	F289-Y291 HydrophobicContact CD1-CD2 4.42Å; F289-Y291 HydrophobicContact CD1-CE2 4.45Å; F289-Y291 HydrophobicContact CE1-CE2 4.43Å
292	P	30.3	Very low	34.8	Very low	112 Å²	112	129.5 Å²	129.5	73%	0.727	74%	0.736	S	S	*	*			trans	-96.3	172.9	-157.9	39.4	-34.2	0	0	0	112.8
293	D	33.1	Very low	35.7	Very low	154 Å²	154	129.1 Å²	129.1	82%	0.824	72%	0.724	S	S	*	*			trans	93.3	117.4	168.4	-94.1	-18.1	0	0	0	119.2
294	S	30.5	Very low	37.1	Very low	115 Å²	115	126.3 Å²	126.3	80%	0.804	70%	0.701	S	S	*	*			trans	-133.8	58.5	-162.8	174.6	0	0	0	0	107.5
295	T	33.8	Very low	38.2	Very low	123 Å²	123	128.5 Å²	128.5	76%	0.755	70%	0.696	S	S	*	*			trans	-153	69.6	178.4	57	0	0	0	0	112.8
296	A	36.6	Very low	39.3	Very low	95 Å²	95	129.8 Å²	129.8	79%	0.785	69%	0.691	S	S	*	*			trans	-175.7	81.2	155.3	0	0	0	0	0	110.6
297	V	40	Very low	40.1	Very low	143 Å²	143	129.1 Å²	129.1	87%	0.867	68%	0.677	S	S	*	*			trans	-104.4	112.5	170.3	-179	0	0	0	0	107.8
298	P	36.8	Very low	40.6	Very low	71 Å²	71	130.2 Å²	130.2	46%	0.461	67%	0.67	S	S	.	*			trans	-71.6	150.6	169.4	20.4	-12.1	0	0	0	109.6
299	S	50.4	Low	41.5	Very low	58 Å²	58	123.2 Å²	123.2	41%	0.406	65%	0.65	S	S	.	*			trans	-58.2	149.7	-176.5	77	0	0	0	0	111.9	D301 D302 F303	S299-D301 PolarHBondContact O-N 3.05Å; S299-D301 VanDerWaalsContact O-N 3.12Å; S299-D302 PolarHBondContact O-N 3.3Å; S299-D302 PolarHBondContact OG-N 3.32Å; S299-D302 PolarHBondContact OG-OD2 3.43Å; S299-F303 PolarHBondContact O-N 3.33Å; S299-F303 VanDerWaalsContact O-N 3.14Å
300	L	42.5	Very low	42.2	Very low	134 Å²	134	121.5 Å²	121.5	70%	0.702	65%	0.645	S	S	*	*	H	α-helix	trans	-54.5	-32.3	179.3	-176.8	65.3	0	0	0	112	V304	L300-V304 HydrophobicContact CD1-CG2 4.49Å; L300-V304 WeakPolarHBondContact O-CB 3.45Å; L300-V304 VanDerWaalsContact O-CG2 3.25Å; L300-V304 WeakPolarHBondContact O-CG2 3.34Å; L300-V304 PolarHBondContact O-N 3.04Å; L300-V304 VanDerWaalsContact O-N 3.08Å
301	D	52.8	Low	42.9	Very low	116 Å²	116	118.9 Å²	118.9	62%	0.62	64%	0.637	S	S	*	*	H	α-helix	trans	-71.1	-34.4	177.7	-68.1	-42.8	0	0	0	112.5	S299 R305	S299-D301 PolarHBondContact O-N 3.05Å; S299-D301 VanDerWaalsContact O-N 3.12Å; D301-R305 VanDerWaalsContact O-CB 3.22Å; D301-R305 WeakPolarHBondContact O-CB 3.31Å; D301-R305 WeakPolarHBondContact O-CG 3.47Å; D301-R305 PolarHBondContact O-N 2.75Å
302	D	53.7	Low	43.3	Very low	79 Å²	79	114 Å²	114	42%	0.422	63%	0.625	S	S	.	*	H	α-helix	trans	-75.3	-31.5	175.8	-70.9	-41.7	0	0	0	112.6	S299 R306	S299-D302 PolarHBondContact O-N 3.3Å; S299-D302 PolarHBondContact OG-N 3.32Å; S299-D302 PolarHBondContact OG-OD2 3.43Å; D302-R306 WeakPolarHBondContact O-CB 3.37Å; D302-R306 VanDerWaalsContact O-CG 3.3Å; D302-R306 WeakPolarHBondContact O-CG 3.2Å; D302-R306 PolarHBondContact O-N 3.48Å
303	F	48	Very low	43.8	Very low	123 Å²	123	114.4 Å²	114.4	54%	0.539	62%	0.621	S	S	.	*	H	α-helix	trans	-70.5	-43.1	174.5	-179.1	-100.5	0	0	0	111.4	S299 R306 L307	S299-F303 PolarHBondContact O-N 3.33Å; S299-F303 VanDerWaalsContact O-N 3.14Å; F303-R306 PolarHBondContact O-N 3.44Å; F303-L307 HydrophobicContact CE1-CD1 3.84Å; F303-L307 HydrophobicContact CE2-CD1 4.23Å; F303-L307 HydrophobicContact CZ-CD1 3.68Å; F303-L307 WeakPolarHBondContact O-CB 3.36Å; F303-L307 PolarHBondContact O-N 3.36Å
304	V	56.4	Low	44.1	Very low	65 Å²	65	114 Å²	114	39%	0.394	62%	0.619	S	S	.	*	H	α-helix	trans	-69.6	-38.3	177	174.3	0	0	0	0	111	L300 L307 F308	L300-V304 HydrophobicContact CD1-CG2 4.49Å; L300-V304 WeakPolarHBondContact O-CB 3.45Å; L300-V304 VanDerWaalsContact O-CG2 3.25Å; L300-V304 WeakPolarHBondContact O-CG2 3.34Å; L300-V304 PolarHBondContact O-N 3.04Å; L300-V304 VanDerWaalsContact O-N 3.08Å; V304-L307 PolarHBondContact O-N 2.91Å; V304-F308 HydrophobicContact CG1-CD2 4.03Å; V304-F308 HydrophobicContact CG1-CE2 4.38Å; V304-F308 WeakPolarHBondContact O-CB 3.4Å; V304-F308 WeakPolarHBondContact O-CD2 3.32Å; V304-F308 PolarHBondContact O-N 2.99Å
305	R	51.9	Low	44	Very low	171 Å²	171	116.3 Å²	116.3	65%	0.645	62%	0.619	S	S	*	*	H	α-helix	trans	-65.3	-43.2	173.5	-78.5	175	167.3	-169.1	-5	112.3	D301 L307 F308 D309	D301-R305 VanDerWaalsContact O-CB 3.22Å; D301-R305 WeakPolarHBondContact O-CB 3.31Å; D301-R305 WeakPolarHBondContact O-CG 3.47Å; D301-R305 PolarHBondContact O-N 2.75Å; R305-L307 PolarHBondContact O-N 3.01Å; R305-F308 PolarHBondContact O-N 2.93Å; R305-D309 VanDerWaalsContact O-CB 3.27Å; R305-D309 WeakPolarHBondContact O-CB 3.28Å; R305-D309 PolarHBondContact O-N 3.09Å
306	R	52.3	Low	43.8	Very low	173 Å²	173	118.1 Å²	118.1	65%	0.653	62%	0.623	S	S	*	*	H	α-helix	trans	-62.9	-39.2	173	-77.4	179.6	-178.9	171.4	1.2	112.5	D302 F303 F308 D309 E310	D302-R306 WeakPolarHBondContact O-CB 3.37Å; D302-R306 VanDerWaalsContact O-CG 3.3Å; D302-R306 WeakPolarHBondContact O-CG 3.2Å; D302-R306 PolarHBondContact O-N 3.48Å; F303-R306 PolarHBondContact O-N 3.44Å; R306-F308 VanDerWaalsContact C-N 3.3Å; R306-F308 PolarHBondContact O-N 3.43Å; R306-D309 PolarHBondContact O-N 2.82Å; R306-E310 WeakPolarHBondContact O-CB 3.27Å; R306-E310 PolarHBondContact O-N 2.96Å
307	L	45.7	Very low	43.3	Very low	109 Å²	109	120.4 Å²	120.4	57%	0.571	62%	0.622	S	S	*	*	H	α-helix	trans	-66	-32.7	176.1	-132.5	103.3	0	0	0	112.7	F303 V304 R305 A311	F303-L307 HydrophobicContact CE1-CD1 3.84Å; F303-L307 HydrophobicContact CE2-CD1 4.23Å; F303-L307 HydrophobicContact CZ-CD1 3.68Å; F303-L307 WeakPolarHBondContact O-CB 3.36Å; F303-L307 PolarHBondContact O-N 3.36Å; V304-L307 PolarHBondContact O-N 2.91Å; R305-L307 PolarHBondContact O-N 3.01Å; L307-A311 WeakPolarHBondContact O-CB 3.37Å
308	F	40.8	Very low	42.8	Very low	134 Å²	134	117.3 Å²	117.3	59%	0.588	61%	0.612	S	S	*	*	H	α-helix	trans	-83	-33	177.5	-98.9	-87.1	0	0	0	113.2	V304 R305 R306 N312	V304-F308 HydrophobicContact CG1-CD2 4.03Å; V304-F308 HydrophobicContact CG1-CE2 4.38Å; V304-F308 WeakPolarHBondContact O-CB 3.4Å; V304-F308 WeakPolarHBondContact O-CD2 3.32Å; V304-F308 PolarHBondContact O-N 2.99Å; R305-F308 PolarHBondContact O-N 2.93Å; R306-F308 VanDerWaalsContact C-N 3.3Å; R306-F308 PolarHBondContact O-N 3.43Å; F308-N312 VanDerWaalsContact O-CB 3.32Å; F308-N312 WeakPolarHBondContact O-CB 3.42Å; F308-N312 PolarHBondContact O-N 2.63Å; F308-N312 PolarHBondContact O-ND2 2.95Å
309	D	46.2	Very low	42.3	Very low	88 Å²	88	119.3 Å²	119.3	47%	0.471	62%	0.623	S	S	.	*	H	α-helix	trans	-78.3	-32.6	177.7	-70.1	-25.8	0	0	0	111.3	R305 R306 A311 N312 N313	R305-D309 VanDerWaalsContact O-CB 3.27Å; R305-D309 WeakPolarHBondContact O-CB 3.28Å; R305-D309 PolarHBondContact O-N 3.09Å; R306-D309 PolarHBondContact O-N 2.82Å; D309-A311 VanDerWaalsContact C-N 3.31Å; D309-N312 PolarHBondContact O-N 2.89Å; D309-N313 VanDerWaalsContact O-CB 3.28Å; D309-N313 WeakPolarHBondContact O-CB 3.47Å; D309-N313 VanDerWaalsContact O-CG 3.27Å; D309-N313 PolarHBondContact O-N 3.11Å; D309-N313 VanDerWaalsContact O-N 3.13Å; D309-N313 PolarHBondContact O-ND2 2.79Å
310	E	46	Very low	41.4	Very low	147 Å²	147	124.7 Å²	124.7	69%	0.687	65%	0.646	S	S	*	*	H	α-helix	trans	-70.4	-28	172.5	-157.5	79.7	-148.9	0	0	111.9	R306	R306-E310 WeakPolarHBondContact O-CB 3.27Å; R306-E310 PolarHBondContact O-N 2.96Å
311	A	41.2	Very low	40.7	Very low	75 Å²	75	124.1 Å²	124.1	62%	0.62	64%	0.644	S	S	*	*	H	α-helix	trans	-84.3	-22.1	177.2	0	0	0	0	0	113.7	L307 D309	L307-A311 WeakPolarHBondContact O-CB 3.37Å; D309-A311 VanDerWaalsContact C-N 3.31Å
312	N	40.6	Very low	39.6	Very low	108 Å²	108	127.3 Å²	127.3	58%	0.578	66%	0.655	S	S	*	*	H	α-helix	trans	-105.3	-13.3	-175.6	-78.8	-27.1	0	0	0	114.7	F308 D309	F308-N312 VanDerWaalsContact O-CB 3.32Å; F308-N312 WeakPolarHBondContact O-CB 3.42Å; F308-N312 PolarHBondContact O-N 2.63Å; F308-N312 PolarHBondContact O-ND2 2.95Å; D309-N312 PolarHBondContact O-N 2.89Å
313	N	40.5	Very low	38.5	Very low	122 Å²	122	130.5 Å²	130.5	65%	0.652	68%	0.677	S	S	*	*	S	Bend	trans	-94.6	1.1	-176.6	-73.4	-43.9	0	0	0	115.7	D309	D309-N313 VanDerWaalsContact O-CB 3.28Å; D309-N313 WeakPolarHBondContact O-CB 3.47Å; D309-N313 VanDerWaalsContact O-CG 3.27Å; D309-N313 PolarHBondContact O-N 3.11Å; D309-N313 VanDerWaalsContact O-N 3.13Å; D309-N313 PolarHBondContact O-ND2 2.79Å
314	N	38.9	Very low	37.6	Very low	144 Å²	144	127.9 Å²	127.9	77%	0.77	69%	0.685	S	S	*	*	S	Bend	trans	-103.1	25	176	-76.1	-20.2	0	0	0	113.8
315	M	29.5	Very low	36.3	Very low	164 Å²	164	133.3 Å²	133.3	81%	0.808	71%	0.71	S	S	*	*			trans	-122.4	83.5	174.6	-167.3	162.6	68.8	0	0	110.7
316	L	29.2	Very low	35.2	Very low	161 Å²	161	128 Å²	128	84%	0.843	71%	0.709	S	S	*	*			trans	177.7	127.2	159.8	-91.2	141.7	0	0	0	103.5
317	D	26.8	Very low	34.1	Very low	144 Å²	144	127.2 Å²	127.2	77%	0.77	72%	0.718	S	S	*	*				-173.4	162	51.1	-149.5	-13.5	0	0	0	110
318	A	28.5	Very low	33.3	Very low	78 Å²	78	128.2 Å²	128.2	65%	0.645	72%	0.723	S	S	*	*			trans	71	129.2	152.8	0	0	0	0	0	119.3
319	T	27.7	Very low	32.7	Very low	113 Å²	113	131.2 Å²	131.2	69%	0.693	74%	0.739	S	S	*	*			cis	179.8	130.3	-6.8	4.5	0	0	0	0	104.8
320	L	30.1	Very low	31.9	Very low	170 Å²	170	134.1 Å²	134.1	89%	0.89	75%	0.754	S	S	*	*			trans	-177.6	70.9	145	-99.2	154.8	0	0	0	110.4
321	N	28.1	Very low	31	Very low	123 Å²	123	133.3 Å²	133.3	66%	0.658	75%	0.754	S	S	*	*				45.5	105.1	122.1	-50.7	7.6	0	0	0	118.3
322	E	30.7	Very low	30.5	Very low	182 Å²	182	134.7 Å²	134.7	85%	0.85	75%	0.754	S	S	*	*				50.1	112.2	128.2	-58.6	-170	170.8	0	0	119.1
323	T	29.9	Very low	29.8	Very low	147 Å²	147	135 Å²	135	90%	0.902	76%	0.76	S	S	*	*				-166.7	129.6	113.5	21.2	0	0	0	0	109.5
324	G	28.3	Very low	29.4	Very low	68 Å²	68	135.1 Å²	135.1	70%	0.701	76%	0.76	S	S	*	*			trans	-68.7	171.3	-166.2	0	0	0	0	0	115.5
325	I	30.6	Very low	28.8	Very low	178 Å²	178	139.4 Å²	139.4	91%	0.913	77%	0.765	S	S	*	*				-176.9	122.9	125.6	-83.7	146.3	0	0	0	105.7
326	G	28.2	Very low	28.8	Very low	61 Å²	61	139.3 Å²	139.3	63%	0.629	77%	0.768	S	S	*	*			trans	-76.4	175.1	-170	0	0	0	0	0	116
327	D	28.7	Very low	28.7	Very low	156 Å²	156	138.7 Å²	138.7	83%	0.834	76%	0.76	S	S	*	*			trans	57.8	105.9	148.4	-59.1	-18.5	0	0	0	118.4
328	L	29.8	Very low	28.9	Very low	130 Å²	130	140.3 Å²	140.3	68%	0.681	76%	0.761	S	S	*	*			trans	-173.7	78.4	137.2	-95.4	147.7	0	0	0	109	L330	L328-L330 PolarHBondContact O-N 2.84Å
329	Q	28.2	Very low	28.9	Very low	196 Å²	196	145.9 Å²	145.9	92%	0.916	77%	0.773	S	S	*	*			trans	-86	103.1	166	-161.3	170.3	21.4	0	0	107.7
330	L	29.2	Very low	29	Very low	150 Å²	150	146.5 Å²	146.5	79%	0.785	78%	0.78	S	S	*	*			trans	-94.2	99.9	174.7	-154.6	78.5	0	0	0	108.6	L328	L328-L330 PolarHBondContact O-N 2.84Å
331	D	26.6	Very low	28.9	Very low	130 Å²	130	145.5 Å²	145.5	70%	0.695	77%	0.772	S	S	*	*			trans	-81.1	116.9	177.1	-163.2	14.1	0	0	0	109.8
332	V	30.8	Very low	29.1	Very low	104 Å²	104	148.4 Å²	148.4	63%	0.63	78%	0.779	S	S	*	*			trans	-132.4	82.3	171.4	-175.6	0	0	0	0	107.7	I334	V332-I334 HydrophobicContact CG1-CD1 4.42Å; V332-I334 HydrophobicContact CG1-CG1 4.25Å
333	T	26.2	Very low	29.1	Very low	113 Å²	113	146.3 Å²	146.3	69%	0.693	77%	0.769	S	S	*	*			trans	-88.1	99.2	169.5	43.5	0	0	0	0	109.4
334	I	31.5	Very low	29.2	Very low	126 Å²	126	143.5 Å²	143.5	65%	0.646	76%	0.756	S	S	*	*			trans	-97.9	104.7	161.5	-59.3	176.3	0	0	0	106.6	V332	V332-I334 HydrophobicContact CG1-CD1 4.42Å; V332-I334 HydrophobicContact CG1-CG1 4.25Å
335	R	26.2	Very low	29.4	Very low	233 Å²	233	145.7 Å²	145.7	88%	0.879	75%	0.751	S	S	*	*			trans	-67	127.2	168.3	-76.9	178.7	167.8	174.5	-3.4	108.4
336	D	30.2	Very low	29.4	Very low	162 Å²	162	142.9 Å²	142.9	87%	0.866	74%	0.738	S	S	*	*			trans	-148.6	139.1	152.5	-126.1	-19.4	0	0	0	110.6
337	E	27.2	Very low	29.6	Very low	148 Å²	148	144.2 Å²	144.2	69%	0.692	74%	0.743	S	S	*	*			trans	-89.3	159.1	-163.3	-55.8	-175.2	149.4	0	0	113.1
338	K	30.7	Very low	29.7	Very low	178 Å²	178	142.4 Å²	142.4	77%	0.774	74%	0.74	S	S	*	*			trans	76	95.4	153.5	-66.1	159.8	-171.3	170.9	0	119
339	Q	27.2	Very low	29.5	Very low	195 Å²	195	142 Å²	142	91%	0.911	75%	0.747	S	S	*	*			trans	-150.9	125.8	135.5	-72.4	-163.2	-57.2	0	0	110
340	P	30.8	Very low	29.7	Very low	127 Å²	127	138.6 Å²	138.6	83%	0.825	74%	0.739	S	S	*	*			trans	-95	148.9	164.8	24.6	-9.8	0	0	0	112
341	M	28.8	Very low	29.6	Very low	149 Å²	149	136.4 Å²	136.4	73%	0.734	74%	0.736	S	S	*	*			trans	-77.6	146.7	-170.5	-51.8	-176.4	-41.6	0	0	112.8	E343	M341-E343 HydrophobicContact CE-CG 4.21Å; M341-E343 WeakPolarHBondContact CE-OE1 3.29Å
342	F	30.6	Very low	29.8	Very low	183 Å²	183	138.2 Å²	138.2	80%	0.803	75%	0.745	S	S	*	*			trans	-91.9	112.3	158.1	-93.9	-95.3	0	0	0	108.3
343	E	30.9	Very low	29.7	Very low	139 Å²	139	141.7 Å²	141.7	65%	0.65	75%	0.754	S	S	*	*			trans	-102.4	113.5	164.6	-83.3	178.9	175.5	0	0	108.8	M341	M341-E343 HydrophobicContact CE-CG 4.21Å; M341-E343 WeakPolarHBondContact CE-OE1 3.29Å
344	S	32.6	Very low	29.9	Very low	88 Å²	88	145.3 Å²	145.3	62%	0.615	76%	0.763	S	S	*	*			trans	-84	110.6	172.2	38.9	0	0	0	0	109.7	N346	S344-N346 PolarHBondContact O-N 3.16Å
345	N	33.4	Very low	29.9	Very low	113 Å²	113	143.6 Å²	143.6	60%	0.604	77%	0.768	S	S	*	*			trans	-83.5	102.8	168.7	-75.8	-38.2	0	0	0	109.3
346	N	29.6	Very low	30.3	Very low	120 Å²	120	139.9 Å²	139.9	64%	0.642	77%	0.766	S	S	*	*			trans	-83.6	116.2	160.3	-74.9	-14.3	0	0	0	107.6	S344	S344-N346 PolarHBondContact O-N 3.16Å
347	A	33.1	Very low	30.3	Very low	88 Å²	88	139.3 Å²	139.3	73%	0.727	76%	0.763	S	S	*	*			trans	-107.1	136.9	163.7	0	0	0	0	0	108.4	C349	A347-C349 PolarHBondContact O-N 3.41Å
348	P	31.1	Very low	30.6	Very low	118 Å²	118	139.6 Å²	139.6	77%	0.766	77%	0.769	S	S	*	*			trans	-71.1	131.1	-176.9	29.2	-31.2	0	0	0	109.7	V350	P348-V350 PolarHBondContact O-N 2.97Å; P348-V350 VanDerWaalsContact O-N 3.11Å
349	C	25.7	Very low	30.7	Very low	123 Å²	123	134.4 Å²	134.4	83%	0.831	77%	0.766	S	S	*	*			trans	-61.8	109.8	165.8	-175.4	0	0	0	0	107.6	A347 S351	A347-C349 PolarHBondContact O-N 3.41Å; C349-S351 PolarHBondContact O-N 2.95Å
350	V	30.8	Very low	30.8	Very low	123 Å²	123	132.9 Å²	132.9	75%	0.745	76%	0.764	S	S	*	*			trans	-79.2	107.5	170.3	-172.7	0	0	0	0	106.1	P348 L352	P348-V350 PolarHBondContact O-N 2.97Å; P348-V350 VanDerWaalsContact O-N 3.11Å; V350-L352 PolarHBondContact O-N 3.16Å; V350-L352 VanDerWaalsContact O-N 3.17Å
351	S	28.1	Very low	31.2	Very low	104 Å²	104	134.5 Å²	134.5	73%	0.727	77%	0.766	S	S	*	*			trans	-63.1	110.7	169.1	-55.9	0	0	0	0	108.8	C349	C349-S351 PolarHBondContact O-N 2.95Å
352	L	30.4	Very low	31.6	Very low	169 Å²	169	136 Å²	136	89%	0.885	78%	0.775	S	S	*	*			trans	-94	87.6	166.9	-165.6	81.5	0	0	0	107.4	V350	V350-L352 PolarHBondContact O-N 3.16Å; V350-L352 VanDerWaalsContact O-N 3.17Å
353	E	28.4	Very low	32	Very low	176 Å²	176	132.3 Å²	132.3	82%	0.822	77%	0.771	S	S	*	*			trans	-113.5	104.6	162.7	-74.1	-169.9	169.2	0	0	107.4
354	Q	31	Very low	32.5	Very low	190 Å²	190	132.2 Å²	132.2	89%	0.888	78%	0.775	S	S	*	*			trans	160	102.8	147.6	-91.4	170.7	-15.1	0	0	109.5
355	A	31.8	Very low	33.2	Very low	90 Å²	90	132.5 Å²	132.5	74%	0.744	77%	0.769	S	S	*	*			trans	176.3	104	136.3	0	0	0	0	0	109.5
356	D	33.5	Very low	33.9	Very low	155 Å²	155	133.3 Å²	133.3	83%	0.829	77%	0.768	S	S	*	*			trans	50.3	107.2	130.5	-55	-23.5	0	0	0	119.6	N358	D356-N358 PolarHBondContact O-N 2.96Å
357	D	30.9	Very low	34.9	Very low	150 Å²	150	130.8 Å²	130.8	80%	0.802	75%	0.752	S	S	*	*			trans	5.2	96.7	132.2	-160.7	30.1	0	0	0	114.8
358	N	32.6	Very low	35.8	Very low	153 Å²	153	129.7 Å²	129.7	82%	0.818	74%	0.739	S	S	*	*			trans	166.9	117.4	141.4	-84.8	-47.6	0	0	0	111.4	D356	D356-N358 PolarHBondContact O-N 2.96Å
359	G	32.7	Very low	36.8	Very low	69 Å²	69	128.2 Å²	128.2	71%	0.711	73%	0.728	S	S	*	*			trans	75.5	103.1	146	0	0	0	0	0	119.3
360	D	31	Very low	38.1	Very low	163 Å²	163	126 Å²	126	87%	0.872	70%	0.704	S	S	*	*			trans	33.9	89.5	132.5	-54.5	-26.2	0	0	0	118.7
361	D	38	Very low	39.2	Very low	161 Å²	161	122.5 Å²	122.5	86%	0.861	69%	0.688	S	S	*	*			trans	179.3	91.9	141.1	-105.5	-17.4	0	0	0	110.7	C363	D361-C363 PolarHBondContact O-N 3.31Å; D361-C363 VanDerWaalsContact O-N 3.14Å
362	L	36.8	Very low	40.6	Very low	180 Å²	180	122.3 Å²	122.3	94%	0.942	69%	0.687	S	S	*	*			trans	-83.1	85.2	165.9	-108.2	88.9	0	0	0	109.4	L364	L362-L364 PolarHBondContact O-N 2.97Å
363	C	40.3	Very low	41.7	Very low	106 Å²	106	116 Å²	116	72%	0.716	65%	0.654	S	S	*	*			trans	-62	118.6	165	-171.8	0	0	0	0	108.5	D361 D365	D361-C363 PolarHBondContact O-N 3.31Å; D361-C363 VanDerWaalsContact O-N 3.14Å; C363-D365 PolarHBondContact O-N 3.14Å
364	L	40.5	Very low	43.1	Very low	137 Å²	137	109.2 Å²	109.2	72%	0.717	63%	0.626	S	S	*	*			trans	-54.2	105.1	165.4	-76.2	167	0	0	0	107.2	L362 F366	L362-L364 PolarHBondContact O-N 2.97Å; L364-F366 VanDerWaalsContact O-CD2 3.26Å; L364-F366 WeakPolarHBondContact O-CD2 3.46Å; L364-F366 PolarHBondContact O-N 2.89Å
365	D	46.9	Very low	44.3	Very low	95 Å²	95	105.6 Å²	105.6	51%	0.508	60%	0.604	S	S	.	*			trans	-68.4	90.2	178.2	-175.9	22.2	0	0	0	108	C363 Q367 S368	C363-D365 PolarHBondContact O-N 3.14Å; D365-Q367 PolarHBondContact O-N 2.83Å; D365-Q367 WeakPolarHBondContact OD1-CB 3.38Å; D365-Q367 PolarHBondContact OD1-N 3.45Å; D365-Q367 WeakPolarHBondContact OD2-CB 3.33Å; D365-S368 WeakPolarHBondContact O-CB 3.22Å; D365-S368 PolarHBondContact O-N 3.15Å; D365-S368 PolarHBondContact O-OG 3.09Å
366	F	49	Very low	45.6	Very low	130 Å²	130	107.1 Å²	107.1	57%	0.57	59%	0.594	S	S	*	*	H	α-helix	trans	-47.2	-31.7	175.1	-74.2	-79.1	0	0	0	110.9	L364 S368 V369 F370	L364-F366 VanDerWaalsContact O-CD2 3.26Å; L364-F366 WeakPolarHBondContact O-CD2 3.46Å; L364-F366 PolarHBondContact O-N 2.89Å; F366-S368 VanDerWaalsContact C-N 3.3Å; F366-S368 PolarHBondContact O-N 3.24Å; F366-V369 PolarHBondContact O-N 3.23Å; F366-F370 VanDerWaalsContact C-CD2 3.45Å; F366-F370 HydrophobicContact CB-CD2 3.91Å; F366-F370 HydrophobicContact CB-CE2 3.64Å; F366-F370 HydrophobicContact CD1-CE2 4.12Å; F366-F370 HydrophobicContact CD1-CZ 4.46Å; F366-F370 HydrophobicContact CG-CE2 4.3Å; F366-F370 WeakPolarHBondContact O-CB 3.28Å; F366-F370 WeakPolarHBondContact O-CD2 3.23Å; F366-F370 VanDerWaalsContact O-CG 3.23Å; F366-F370 WeakPolarHBondContact O-CG 3.28Å; F366-F370 PolarHBondContact O-N 3.36Å
367	Q	51.1	Low	46.6	Very low	66 Å²	66	101.8 Å²	101.8	31%	0.308	57%	0.567	S	S	.	*	H	α-helix	trans	-56.6	-40.7	176.2	-148.8	85.4	-10.8	0	0	113.1	D365 F370 A371	D365-Q367 PolarHBondContact O-N 2.83Å; D365-Q367 WeakPolarHBondContact OD1-CB 3.38Å; D365-Q367 PolarHBondContact OD1-N 3.45Å; D365-Q367 WeakPolarHBondContact OD2-CB 3.33Å; Q367-F370 PolarHBondContact O-N 3.38Å; Q367-A371 WeakPolarHBondContact O-CB 3.21Å; Q367-A371 PolarHBondContact O-N 3.03Å
368	S	52	Low	47.9	Very low	65 Å²	65	99.9 Å²	99.9	46%	0.455	56%	0.557	S	S	.	*	H	α-helix	trans	-69	-44	-179.7	69.4	0	0	0	0	112	D365 F366 F370 A371 S372	D365-S368 WeakPolarHBondContact O-CB 3.22Å; D365-S368 PolarHBondContact O-N 3.15Å; D365-S368 PolarHBondContact O-OG 3.09Å; F366-S368 VanDerWaalsContact C-N 3.3Å; F366-S368 PolarHBondContact O-N 3.24Å; S368-F370 VanDerWaalsContact C-N 3.34Å; S368-F370 PolarHBondContact O-N 3.08Å; S368-A371 PolarHBondContact O-N 2.77Å; S368-S372 PolarHBondContact O-N 3.36Å; S368-S372 PolarHBondContact O-OG 3.16Å
369	V	51	Low	49	Very low	88 Å²	88	97 Å²	97	53%	0.533	54%	0.538	S	S	.	.	H	α-helix	trans	-65.5	-38.9	176.1	-178.4	0	0	0	0	110.7	F366 S372	F366-V369 PolarHBondContact O-N 3.23Å; V369-S372 PolarHBondContact O-N 2.98Å
370	F	52.4	Low	50	Low	76 Å²	76	97.5 Å²	97.5	33%	0.333	52%	0.519	S	S	.	.	H	α-helix	trans	-73.5	-25.8	178.6	-68.9	-51.5	0	0	0	113.3	F366 Q367 S368 S372 L373 M485	F366-F370 VanDerWaalsContact C-CD2 3.45Å; F366-F370 HydrophobicContact CB-CD2 3.91Å; F366-F370 HydrophobicContact CB-CE2 3.64Å; F366-F370 HydrophobicContact CD1-CE2 4.12Å; F366-F370 HydrophobicContact CD1-CZ 4.46Å; F366-F370 HydrophobicContact CG-CE2 4.3Å; F366-F370 WeakPolarHBondContact O-CB 3.28Å; F366-F370 WeakPolarHBondContact O-CD2 3.23Å; F366-F370 VanDerWaalsContact O-CG 3.23Å; F366-F370 WeakPolarHBondContact O-CG 3.28Å; F366-F370 PolarHBondContact O-N 3.36Å; Q367-F370 PolarHBondContact O-N 3.38Å; S368-F370 VanDerWaalsContact C-N 3.34Å; S368-F370 PolarHBondContact O-N 3.08Å; F370-S372 VanDerWaalsContact C-N 3.29Å; F370-S372 PolarHBondContact O-N 3.11Å; F370-L373 HydrophobicContact CD1-CD1 3.61Å; F370-L373 HydrophobicContact CE1-CD1 4.34Å; F370-L373 PolarHBondContact O-N 3.36Å; F370-M485 HydrophobicContact CD1-SD 4.3Å; F370-M485 HydrophobicContact CE1-SD 3.91Å
371	A	55.7	Low	51.1	Low	49 Å²	49	92 Å²	92	41%	0.405	49%	0.494	S	S	.	.	H	α-helix	trans	-69.3	-26.3	174.1	0	0	0	0	0	112.9	Q367 S368 L373 R487	Q367-A371 WeakPolarHBondContact O-CB 3.21Å; Q367-A371 PolarHBondContact O-N 3.03Å; S368-A371 PolarHBondContact O-N 2.77Å; A371-L373 VanDerWaalsContact C-N 3.3Å; A371-R487 PolarHBondContact O-NH1 2.92Å
372	S	56.3	Low	52	Low	101 Å²	101	94.3 Å²	94.3	71%	0.706	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-7.3	176.9	-55	0	0	0	0	114.2	S368 V369 F370	S368-S372 PolarHBondContact O-N 3.36Å; S368-S372 PolarHBondContact O-OG 3.16Å; V369-S372 PolarHBondContact O-N 2.98Å; F370-S372 VanDerWaalsContact C-N 3.29Å; F370-S372 PolarHBondContact O-N 3.11Å
373	L	54.1	Low	52.9	Low	36 Å²	36	89.2 Å²	89.2	19%	0.188	47%	0.465	C	S	.	.	S	Bend	trans	-82.2	138.3	-177.6	-63.8	172	0	0	0	112.8	F370 A371 Y380 M485	F370-L373 HydrophobicContact CD1-CD1 3.61Å; F370-L373 HydrophobicContact CE1-CD1 4.34Å; F370-L373 PolarHBondContact O-N 3.36Å; A371-L373 VanDerWaalsContact C-N 3.3Å; L373-Y380 VanDerWaalsContact CA-OH 3.32Å; L373-Y380 WeakPolarHBondContact CA-OH 3.44Å; L373-Y380 VanDerWaalsContact CD2-OH 3.28Å; L373-Y380 WeakPolarHBondContact CD2-OH 3.49Å; L373-M485 HydrophobicContact CD1-CE 3.51Å; L373-M485 HydrophobicContact CD1-CG 3.83Å; L373-M485 HydrophobicContact CD1-SD 3.37Å; L373-M485 WeakPolarHBondContact CD1-SD 3.4Å; L373-M485 HydrophobicContact CD2-CE 3.7Å; L373-M485 HydrophobicContact CG-CE 4.26Å
374	S	58.6	Low	53.5	Low	33 Å²	33	88.3 Å²	88.3	23%	0.231	45%	0.45	C	S	.	.			trans	-62.4	147.9	174.1	-177.3	0	0	0	0	112.5	K376 E379 Y380	S374-K376 WeakPolarHBondContact CB-O 3.09Å; S374-K376 PolarHBondContact O-N 3.02Å; S374-K376 PolarHBondContact OG-N 2.71Å; S374-K376 PolarHBondContact OG-O 3.33Å; S374-K376 VanDerWaalsContact OG-O 3.07Å; S374-E379 WeakPolarHBondContact OG-CB 3.48Å; S374-E379 PolarHBondContact OG-OE2 2.88Å; S374-Y380 PolarHBondContact N-OH 2.79Å
375	R	55.5	Low	54.2	Low	115 Å²	115	85.8 Å²	85.8	43%	0.434	45%	0.449	S	S	.	.	S	Bend	trans	-65.1	-27.3	177.4	-67.6	-178.8	-178.5	174.1	2	112.2
376	K	58.5	Low	54.6	Low	122 Å²	122	87 Å²	87	53%	0.53	45%	0.452	S	S	.	.	S	Bend	trans	-120.2	126.1	166.2	-52.3	-172.2	-171.3	111.8	0	109.1	S374 L378 E379	S374-K376 WeakPolarHBondContact CB-O 3.09Å; S374-K376 PolarHBondContact O-N 3.02Å; S374-K376 PolarHBondContact OG-N 2.71Å; S374-K376 PolarHBondContact OG-O 3.33Å; S374-K376 VanDerWaalsContact OG-O 3.07Å; K376-L378 PolarHBondContact O-N 2.94Å; K376-E379 HydrophobicContact CB-CB 4.02Å; K376-E379 HydrophobicContact CB-CG 3.67Å; K376-E379 HydrophobicContact CD-CG 4.08Å; K376-E379 WeakPolarHBondContact CD-OE1 3.47Å; K376-E379 WeakPolarHBondContact CE-OE1 3.45Å; K376-E379 VanDerWaalsContact CG-CD 3.46Å; K376-E379 HydrophobicContact CG-CG 4.09Å; K376-E379 WeakPolarHBondContact CG-OE1 2.98Å; K376-E379 PolarHBondContact N-OE2 3.21Å; K376-E379 IonicContact NZ-OE1 2.89Å; K376-E379 PolarHBondContact NZ-OE1 3.03Å; K376-E379 WeakPolarHBondContact O-CB 3.41Å; K376-E379 PolarHBondContact O-N 2.9Å
377	P	55.7	Low	55	Low	42 Å²	42	81.9 Å²	81.9	27%	0.273	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-16.5	173.9	22.5	-30.7	0	0	0	112.8	Y380	P377-Y380 VanDerWaalsContact O-CD2 3.22Å; P377-Y380 WeakPolarHBondContact O-CD2 3.41Å
378	L	57.2	Low	55.2	Low	111 Å²	111	81.5 Å²	81.5	58%	0.581	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-6.3	172.9	-65.2	169.6	0	0	0	114.1	K376 Y380 A471	K376-L378 PolarHBondContact O-N 2.94Å; L378-Y380 VanDerWaalsContact C-N 3.31Å; L378-A471 HydrophobicContact CD2-CB 3.56Å
379	E	55.2	Low	55.3	Low	91 Å²	91	81.8 Å²	81.8	43%	0.425	43%	0.431	S	S	.	.			trans	-84.3	-5.1	176.7	-85.2	167.1	-179.5	0	0	112.8	S374 K376 S381	S374-E379 WeakPolarHBondContact OG-CB 3.48Å; S374-E379 PolarHBondContact OG-OE2 2.88Å; K376-E379 HydrophobicContact CB-CB 4.02Å; K376-E379 HydrophobicContact CB-CG 3.67Å; K376-E379 HydrophobicContact CD-CG 4.08Å; K376-E379 WeakPolarHBondContact CD-OE1 3.47Å; K376-E379 WeakPolarHBondContact CE-OE1 3.45Å; K376-E379 VanDerWaalsContact CG-CD 3.46Å; K376-E379 HydrophobicContact CG-CG 4.09Å; K376-E379 WeakPolarHBondContact CG-OE1 2.98Å; K376-E379 PolarHBondContact N-OE2 3.21Å; K376-E379 IonicContact NZ-OE1 2.89Å; K376-E379 PolarHBondContact NZ-OE1 3.03Å; K376-E379 WeakPolarHBondContact O-CB 3.41Å; K376-E379 PolarHBondContact O-N 2.9Å; E379-S381 VanDerWaalsContact C-N 3.29Å; E379-S381 PolarHBondContact O-N 3.48Å
380	Y	55.2	Low	55.6	Low	80 Å²	80	81.6 Å²	81.6	31%	0.314	43%	0.426	S	S	.	.			trans	-63.3	100.1	164.6	-63.7	-63.6	0	0	0	107.4	L373 S374 P377 L378 Y382 I383	L373-Y380 VanDerWaalsContact CA-OH 3.32Å; L373-Y380 WeakPolarHBondContact CA-OH 3.44Å; L373-Y380 VanDerWaalsContact CD2-OH 3.28Å; L373-Y380 WeakPolarHBondContact CD2-OH 3.49Å; S374-Y380 PolarHBondContact N-OH 2.79Å; P377-Y380 VanDerWaalsContact O-CD2 3.22Å; P377-Y380 WeakPolarHBondContact O-CD2 3.41Å; L378-Y380 VanDerWaalsContact C-N 3.31Å; Y380-Y382 PolarHBondContact O-N 2.84Å; Y380-I383 PolarHBondContact O-N 3Å
381	S	53.6	Low	55.8	Low	48 Å²	48	81.1 Å²	81.1	34%	0.336	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-13.7	-177.4	-174.5	0	0	0	0	113.9	E379	E379-S381 VanDerWaalsContact C-N 3.29Å; E379-S381 PolarHBondContact O-N 3.48Å
382	Y	57.1	Low	55.8	Low	210 Å²	210	81 Å²	81	82%	0.824	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-14.4	178.3	-55.4	-70.4	0	0	0	114.2	Y380 T387	Y380-Y382 PolarHBondContact O-N 2.84Å; Y382-T387 PolarHBondContact O-OG1 3.45Å
383	I	55.3	Low	56	Low	72 Å²	72	77.7 Å²	77.7	37%	0.369	41%	0.414	S	S	.	.	S	Bend	trans	-118.2	62.8	178.5	-47	175.2	0	0	0	108.3	Y380	Y380-I383 PolarHBondContact O-N 3Å
384	Q	52.7	Low	56.3	Low	87 Å²	87	80.3 Å²	80.3	41%	0.407	44%	0.442	S	S	.	.			trans	-83.8	148.9	170.6	-69.2	-177.8	-31.8	0	0	109.3	E386 T387 L388	Q384-E386 HydrophobicContact CB-CB 4.41Å; Q384-E386 PolarHBondContact O-N 3.31Å; Q384-T387 HydrophobicContact CB-CG2 4.32Å; Q384-T387 PolarHBondContact N-OG1 3.27Å; Q384-T387 VanDerWaalsContact N-OG1 3.09Å; Q384-T387 WeakPolarHBondContact O-CA 3.3Å; Q384-T387 WeakPolarHBondContact O-CB 3.49Å; Q384-T387 PolarHBondContact O-N 3.13Å; Q384-T387 PolarHBondContact O-OG1 3.42Å; Q384-L388 PolarHBondContact O-N 2.87Å
385	A	55.2	Low	56.6	Low	84 Å²	84	86.1 Å²	86.1	69%	0.694	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-23.5	170.7	0	0	0	0	0	112.8	L388	A385-L388 WeakPolarHBondContact O-CB 3.38Å
386	E	56.2	Low	57.1	Low	121 Å²	121	84.5 Å²	84.5	57%	0.565	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-17	176.7	-61.9	169	-166.8	0	0	113.6	Q384 P389	Q384-E386 HydrophobicContact CB-CB 4.41Å; Q384-E386 PolarHBondContact O-N 3.31Å; E386-P389 WeakPolarHBondContact O-CD 3.34Å
387	T	55.7	Low	57.7	Low	22 Å²	22	84.1 Å²	84.1	14%	0.135	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-12.4	173.9	62.2	0	0	0	0	113.1	Y382 Q384 P389 I390 L404	Y382-T387 PolarHBondContact O-OG1 3.45Å; Q384-T387 HydrophobicContact CB-CG2 4.32Å; Q384-T387 PolarHBondContact N-OG1 3.27Å; Q384-T387 VanDerWaalsContact N-OG1 3.09Å; Q384-T387 WeakPolarHBondContact O-CA 3.3Å; Q384-T387 WeakPolarHBondContact O-CB 3.49Å; Q384-T387 PolarHBondContact O-N 3.13Å; Q384-T387 PolarHBondContact O-OG1 3.42Å; T387-P389 VanDerWaalsContact C-N 3.3Å; T387-I390 VanDerWaalsContact O-CB 3.25Å; T387-I390 WeakPolarHBondContact O-CB 3.46Å; T387-I390 WeakPolarHBondContact O-CD1 3.5Å; T387-I390 WeakPolarHBondContact O-CG1 3.43Å; T387-I390 PolarHBondContact O-N 2.82Å; T387-L404 HydrophobicContact CG2-CD1 4.19Å; T387-L404 HydrophobicContact CG2-CD2 3.83Å
388	L	55.9	Low	58.4	Low	58 Å²	58	88.2 Å²	88.2	30%	0.304	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-59.3	-23.2	174.8	-88.6	152.3	0	0	0	115.8	Q384 A385 I390 V391 F469	Q384-L388 PolarHBondContact O-N 2.87Å; A385-L388 WeakPolarHBondContact O-CB 3.38Å; L388-I390 PolarHBondContact O-N 3.46Å; L388-V391 HydrophobicContact CD2-CG2 4.08Å; L388-V391 VanDerWaalsContact O-CB 3.23Å; L388-V391 WeakPolarHBondContact O-CB 3.45Å; L388-V391 VanDerWaalsContact O-CG2 3.28Å; L388-V391 WeakPolarHBondContact O-CG2 3.38Å; L388-V391 PolarHBondContact O-N 2.69Å; L388-F469 HydrophobicContact CD2-CB 4.13Å; L388-F469 WeakPolarHBondContact CD2-O 3.46Å
389	P	55	Low	58.8	Low	72 Å²	72	87.2 Å²	87.2	47%	0.468	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-61.2	-14.5	170.4	-23.5	34.6	0	0	0	114.3	E386 T387 V391 G392 V400	E386-P389 WeakPolarHBondContact O-CD 3.34Å; T387-P389 VanDerWaalsContact C-N 3.3Å; P389-V391 PolarHBondContact O-N 3.23Å; P389-G392 PolarHBondContact O-N 2.9Å; P389-V400 HydrophobicContact CB-CG1 4.22Å; P389-V400 HydrophobicContact CB-CG2 3.99Å
390	I	57.3	Low	59.3	Low	84 Å²	84	83.6 Å²	83.6	43%	0.431	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-59.6	-23.4	171.5	-62.5	170.3	0	0	0	111	T387 L388 G392 V400 L404	T387-I390 VanDerWaalsContact O-CB 3.25Å; T387-I390 WeakPolarHBondContact O-CB 3.46Å; T387-I390 WeakPolarHBondContact O-CD1 3.5Å; T387-I390 WeakPolarHBondContact O-CG1 3.43Å; T387-I390 PolarHBondContact O-N 2.82Å; L388-I390 PolarHBondContact O-N 3.46Å; I390-G392 PolarHBondContact O-N 3.31Å; I390-V400 HydrophobicContact CB-CG1 4.43Å; I390-V400 HydrophobicContact CD1-CG1 4.42Å; I390-V400 HydrophobicContact CG1-CB 4.21Å; I390-V400 HydrophobicContact CG1-CG1 3.4Å; I390-V400 VanDerWaalsContact CG1-CG1 3.4Å; I390-L404 HydrophobicContact CD1-CD1 3.94Å; I390-L404 HydrophobicContact CG1-CD1 4.4Å
391	V	55.9	Low	59.9	Low	66 Å²	66	82.8 Å²	82.8	40%	0.4	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-73.6	-11.9	-179.6	-179.4	0	0	0	0	112.8	L388 P389 G393 F469	L388-V391 HydrophobicContact CD2-CG2 4.08Å; L388-V391 VanDerWaalsContact O-CB 3.23Å; L388-V391 WeakPolarHBondContact O-CB 3.45Å; L388-V391 VanDerWaalsContact O-CG2 3.28Å; L388-V391 WeakPolarHBondContact O-CG2 3.38Å; L388-V391 PolarHBondContact O-N 2.69Å; P389-V391 PolarHBondContact O-N 3.23Å; V391-G393 PolarHBondContact O-N 3.16Å; V391-F469 HydrophobicContact CG1-CD2 3.47Å; V391-F469 VanDerWaalsContact CG1-CD2 3.47Å; V391-F469 HydrophobicContact CG1-CE2 4.07Å; V391-F469 HydrophobicContact CG1-CG 4.42Å; V391-F469 HydrophobicContact CG2-CB 4.36Å; V391-F469 HydrophobicContact CG2-CD2 4.25Å
392	G	55.8	Low	60.6	Low	45 Å²	45	85.6 Å²	85.6	46%	0.464	46%	0.459	S	S	.	.	S	Bend	trans	-69.2	28.4	177.8	0	0	0	0	0	116.1	P389 I390 N396	P389-G392 PolarHBondContact O-N 2.9Å; I390-G392 PolarHBondContact O-N 3.31Å; G392-N396 PolarHBondContact O-ND2 3.4Å
393	G	60.6	Low	61	Low	32 Å²	32	83.6 Å²	83.6	33%	0.33	45%	0.45	S	S	.	.			trans	86.1	164.8	172.6	0	0	0	0	0	115.9	V391 K395 N396	V391-G393 PolarHBondContact O-N 3.16Å; G393-K395 PolarHBondContact O-N 3.49Å; G393-N396 PolarHBondContact O-N 3.3Å; G393-N396 VanDerWaalsContact O-N 3.13Å
394	A	61	Low	61.3	Low	92 Å²	92	81.7 Å²	81.7	76%	0.76	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-8.4	-174.3	0	0	0	0	0	115.5
395	K	65	Low	62	Low	155 Å²	155	84 Å²	84	67%	0.674	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-28.5	176.2	-68.2	-179.7	-179.9	174.3	0	112.7	G393	G393-K395 PolarHBondContact O-N 3.49Å
396	N	65.6	Low	62.4	Low	81 Å²	81	88.7 Å²	88.7	43%	0.433	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-8.1	-169.2	-65.6	-22.4	0	0	0	114.3	G392 G393 K398 D399 V400	G392-N396 PolarHBondContact O-ND2 3.4Å; G393-N396 PolarHBondContact O-N 3.3Å; G393-N396 VanDerWaalsContact O-N 3.13Å; N396-K398 PolarHBondContact O-N 2.89Å; N396-D399 PolarHBondContact O-N 3.44Å; N396-V400 WeakPolarHBondContact O-CG2 3.18Å; N396-V400 PolarHBondContact O-N 2.89Å; N396-V400 VanDerWaalsContact O-N 3.15Å
397	W	70.1	Confident	62.7	Low	114 Å²	114	88 Å²	88	43%	0.432	45%	0.448	S	S	.	.	H	α-helix	trans	-58.5	-34	-177.1	74.9	-89.7	0	0	0	113.3	L401	W397-L401 HydrophobicContact CE3-CD1 4.41Å; W397-L401 HydrophobicContact CZ3-CD1 4.49Å; W397-L401 VanDerWaalsContact O-CB 3.28Å; W397-L401 WeakPolarHBondContact O-CB 3.38Å; W397-L401 PolarHBondContact O-N 3.27Å
398	K	70.7	Confident	62.8	Low	127 Å²	127	92 Å²	92	55%	0.552	47%	0.473	S	S	*	.	H	α-helix	trans	-66.2	-42.5	-179.6	-68	-174.9	-179.4	176.8	0	111.8	N396 L401 Q402	N396-K398 PolarHBondContact O-N 2.89Å; K398-L401 PolarHBondContact O-N 3.41Å; K398-Q402 PolarHBondContact O-N 2.75Å
399	D	66.8	Low	62.6	Low	91 Å²	91	92.2 Å²	92.2	49%	0.487	48%	0.483	S	S	.	.	H	α-helix	trans	-69.9	-39	179.7	-71.7	-12.6	0	0	0	111.2	N396 L401 Q402 R403	N396-D399 PolarHBondContact O-N 3.44Å; D399-L401 VanDerWaalsContact C-N 3.35Å; D399-Q402 PolarHBondContact O-N 3.04Å; D399-R403 WeakPolarHBondContact O-CG 3.35Å; D399-R403 PolarHBondContact O-N 2.92Å
400	V	65.3	Low	62.3	Low	15 Å²	15	97.5 Å²	97.5	9%	0.091	50%	0.499	C	S	.	.	H	α-helix	trans	-64.7	-41.6	174	-178	0	0	0	0	110.6	P389 I390 N396 Q402 R403 L404	P389-V400 HydrophobicContact CB-CG1 4.22Å; P389-V400 HydrophobicContact CB-CG2 3.99Å; I390-V400 HydrophobicContact CB-CG1 4.43Å; I390-V400 HydrophobicContact CD1-CG1 4.42Å; I390-V400 HydrophobicContact CG1-CB 4.21Å; I390-V400 HydrophobicContact CG1-CG1 3.4Å; I390-V400 VanDerWaalsContact CG1-CG1 3.4Å; N396-V400 WeakPolarHBondContact O-CG2 3.18Å; N396-V400 PolarHBondContact O-N 2.89Å; N396-V400 VanDerWaalsContact O-N 3.15Å; V400-Q402 VanDerWaalsContact C-N 3.32Å; V400-Q402 PolarHBondContact O-N 2.99Å; V400-R403 PolarHBondContact O-N 2.99Å; V400-L404 HydrophobicContact CG1-CD1 3.97Å; V400-L404 HydrophobicContact CG1-CG 4.34Å; V400-L404 WeakPolarHBondContact O-CB 3.45Å; V400-L404 VanDerWaalsContact O-CG 3.31Å; V400-L404 WeakPolarHBondContact O-CG 3.49Å; V400-L404 PolarHBondContact O-N 3.49Å
401	L	66.2	Low	61.9	Low	62 Å²	62	99 Å²	99	33%	0.325	51%	0.514	S	S	.	.	H	α-helix	trans	-63.1	-37.5	175.5	-155.8	109.3	0	0	0	112	W397 K398 D399 K405	W397-L401 HydrophobicContact CE3-CD1 4.41Å; W397-L401 HydrophobicContact CZ3-CD1 4.49Å; W397-L401 VanDerWaalsContact O-CB 3.28Å; W397-L401 WeakPolarHBondContact O-CB 3.38Å; W397-L401 PolarHBondContact O-N 3.27Å; K398-L401 PolarHBondContact O-N 3.41Å; D399-L401 VanDerWaalsContact C-N 3.35Å; L401-K405 WeakPolarHBondContact O-CB 3.45Å; L401-K405 WeakPolarHBondContact O-CG 3.36Å; L401-K405 PolarHBondContact O-N 3.48Å
402	Q	68.9	Low	61.6	Low	108 Å²	108	104.1 Å²	104.1	51%	0.505	53%	0.534	S	S	.	.	H	α-helix	trans	-67	-41.6	173.6	-76.9	-168.6	7.8	0	0	112.2	K398 D399 V400 K405 R406	K398-Q402 PolarHBondContact O-N 2.75Å; D399-Q402 PolarHBondContact O-N 3.04Å; V400-Q402 VanDerWaalsContact C-N 3.32Å; V400-Q402 PolarHBondContact O-N 2.99Å; Q402-K405 PolarHBondContact O-N 2.73Å; Q402-R406 PolarHBondContact O-N 3.03Å
403	R	65.7	Low	61.1	Low	168 Å²	168	108.7 Å²	108.7	63%	0.634	55%	0.552	S	S	*	*	H	α-helix	trans	-62.5	-45.4	175.1	-72.2	177.9	-177.3	-164.1	1.8	111.1	D399 V400 K405 R406 I407	D399-R403 WeakPolarHBondContact O-CG 3.35Å; D399-R403 PolarHBondContact O-N 2.92Å; V400-R403 PolarHBondContact O-N 2.99Å; R403-K405 VanDerWaalsContact C-N 3.34Å; R403-K405 PolarHBondContact O-N 2.99Å; R403-R406 WeakPolarHBondContact O-CB 2.74Å; R403-R406 PolarHBondContact O-N 2.92Å; R403-R406 VanDerWaalsContact O-N 3.07Å; R403-I407 WeakPolarHBondContact O-CG1 3.46Å; R403-I407 PolarHBondContact O-N 3.08Å; R403-I407 VanDerWaalsContact O-N 3.14Å
404	L	62.7	Low	60.5	Low	31 Å²	31	110.5 Å²	110.5	16%	0.162	56%	0.564	C	S	.	*	H	α-helix	trans	-62.7	-37.8	176.3	-70.8	170.1	0	0	0	112.4	T387 I390 V400 R406 I407 T408	T387-L404 HydrophobicContact CG2-CD1 4.19Å; T387-L404 HydrophobicContact CG2-CD2 3.83Å; I390-L404 HydrophobicContact CD1-CD1 3.94Å; I390-L404 HydrophobicContact CG1-CD1 4.4Å; V400-L404 HydrophobicContact CG1-CD1 3.97Å; V400-L404 HydrophobicContact CG1-CG 4.34Å; V400-L404 WeakPolarHBondContact O-CB 3.45Å; V400-L404 VanDerWaalsContact O-CG 3.31Å; V400-L404 WeakPolarHBondContact O-CG 3.49Å; V400-L404 PolarHBondContact O-N 3.49Å; L404-R406 VanDerWaalsContact C-N 3.3Å; L404-R406 PolarHBondContact O-N 3.26Å; L404-I407 PolarHBondContact O-N 2.92Å; L404-T408 WeakPolarHBondContact O-CB 3.37Å; L404-T408 WeakPolarHBondContact O-CG2 3.48Å; L404-T408 PolarHBondContact O-N 3.18Å; L404-T408 PolarHBondContact O-OG1 3.36Å
405	K	65.4	Low	59.7	Low	136 Å²	136	117.4 Å²	117.4	59%	0.591	57%	0.57	S	S	*	*	H	α-helix	trans	-60	-37.6	171.8	-82.2	-177.8	176.9	-172.7	0	112.7	L401 Q402 R403 I407 A409	L401-K405 WeakPolarHBondContact O-CB 3.45Å; L401-K405 WeakPolarHBondContact O-CG 3.36Å; L401-K405 PolarHBondContact O-N 3.48Å; Q402-K405 PolarHBondContact O-N 2.73Å; R403-K405 VanDerWaalsContact C-N 3.34Å; R403-K405 PolarHBondContact O-N 2.99Å; K405-I407 VanDerWaalsContact C-N 3.34Å; K405-A409 WeakPolarHBondContact O-CB 3.28Å; K405-A409 PolarHBondContact O-N 3.47Å
406	R	64.3	Low	59.2	Low	182 Å²	182	115.7 Å²	115.7	69%	0.687	57%	0.573	S	S	*	*	H	α-helix	trans	-70.1	-31.9	176.8	-67.2	-179.9	-168.5	140.5	6.3	112.5	Q402 R403 L404	Q402-R406 PolarHBondContact O-N 3.03Å; R403-R406 WeakPolarHBondContact O-CB 2.74Å; R403-R406 PolarHBondContact O-N 2.92Å; R403-R406 VanDerWaalsContact O-N 3.07Å; L404-R406 VanDerWaalsContact C-N 3.3Å; L404-R406 PolarHBondContact O-N 3.26Å
407	I	62.7	Low	58.4	Low	108 Å²	108	121.5 Å²	121.5	55%	0.554	59%	0.594	S	S	*	*	H	α-helix	trans	-79.5	-37	-179.9	-62.5	163.7	0	0	0	111.1	R403 L404 K405	R403-I407 WeakPolarHBondContact O-CG1 3.46Å; R403-I407 PolarHBondContact O-N 3.08Å; R403-I407 VanDerWaalsContact O-N 3.14Å; L404-I407 PolarHBondContact O-N 2.92Å; K405-I407 VanDerWaalsContact C-N 3.34Å
408	T	57.3	Low	57.7	Low	105 Å²	105	127 Å²	127	64%	0.644	62%	0.615	S	S	*	*	H	α-helix	trans	-89.8	-16.5	-177	54.5	0	0	0	0	114.1	L404 F410	L404-T408 WeakPolarHBondContact O-CB 3.37Å; L404-T408 WeakPolarHBondContact O-CG2 3.48Å; L404-T408 PolarHBondContact O-N 3.18Å; L404-T408 PolarHBondContact O-OG1 3.36Å; T408-F410 PolarHBondContact O-N 3.02Å
409	A	53.2	Low	56.8	Low	63 Å²	63	130.7 Å²	130.7	52%	0.521	63%	0.631	S	S	.	*	S	Bend	trans	-70.1	117.3	173	0	0	0	0	0	109.8	K405	K405-A409 WeakPolarHBondContact O-CB 3.28Å; K405-A409 PolarHBondContact O-N 3.47Å
410	F	47.8	Very low	56.4	Low	183 Å²	183	132.3 Å²	132.3	80%	0.803	64%	0.644	S	S	*	*			trans	-45.5	137.1	165.3	-77.1	-88.4	0	0	0	109.6	T408 Q412	T408-F410 PolarHBondContact O-N 3.02Å; F410-Q412 VanDerWaalsContact C-N 3.25Å; F410-Q412 PolarHBondContact O-N 3.05Å
411	P	48.4	Very low	56.1	Low	116 Å²	116	139.7 Å²	139.7	75%	0.753	68%	0.677	S	S	*	*			trans	-65.4	91.2	177.6	27	-31.8	0	0	0	108.2	V413	P411-V413 PolarHBondContact O-N 3.43Å; P411-V413 VanDerWaalsContact O-N 3.13Å
412	Q	50.6	Low	55.9	Low	173 Å²	173	145.5 Å²	145.5	81%	0.808	70%	0.7	S	S	*	*			trans	-66.2	114	160.9	-75.4	-152.4	-17	0	0	105.7	F410 A414	F410-Q412 VanDerWaalsContact C-N 3.25Å; F410-Q412 PolarHBondContact O-N 3.05Å; Q412-A414 PolarHBondContact O-N 3.23Å
413	V	45.2	Very low	56	Low	141 Å²	141	145.5 Å²	145.5	86%	0.855	71%	0.708	S	S	*	*			trans	-68.5	62.8	170.5	-171.4	0	0	0	0	108	P411 R415	P411-V413 PolarHBondContact O-N 3.43Å; P411-V413 VanDerWaalsContact O-N 3.13Å; V413-R415 PolarHBondContact O-N 3.38Å
414	A	47.1	Very low	56	Low	69 Å²	69	142 Å²	142	57%	0.57	71%	0.707	S	S	*	*			trans	-90	98	168.9	0	0	0	0	0	106.3	Q412 T416	Q412-A414 PolarHBondContact O-N 3.23Å; A414-T416 PolarHBondContact O-N 3.19Å
415	R	45.7	Very low	56.2	Low	237 Å²	237	148.4 Å²	148.4	89%	0.894	74%	0.74	S	S	*	*			trans	-61.6	85.3	166.9	-76.7	176.5	143	166.5	-5.9	108.6	V413 K417	V413-R415 PolarHBondContact O-N 3.38Å; R415-K417 PolarHBondContact O-N 3.5Å; R415-K417 VanDerWaalsContact O-N 3.1Å
416	T	53.6	Low	56.5	Low	119 Å²	119	149.3 Å²	149.3	73%	0.73	75%	0.752	S	S	*	*			trans	-68.4	108	164	51.5	0	0	0	0	106.8	A414 R418	A414-T416 PolarHBondContact O-N 3.19Å; T416-R418 PolarHBondContact O-N 2.8Å
417	K	50	Low	56.7	Low	204 Å²	204	147.3 Å²	147.3	89%	0.887	75%	0.754	S	S	*	*			trans	-54.6	107.6	168.7	-66.9	-178.7	178.7	-179.3	0	107.1	R415 K419	R415-K417 PolarHBondContact O-N 3.5Å; R415-K417 VanDerWaalsContact O-N 3.1Å; K417-K419 PolarHBondContact O-N 3.36Å
418	R	53.5	Low	57	Low	230 Å²	230	147.2 Å²	147.2	87%	0.868	75%	0.754	S	S	*	*			trans	-62.6	111.1	167.8	-76.6	-177.5	178.8	158.6	-0.5	106.2	T416 V420	T416-R418 PolarHBondContact O-N 2.8Å; R418-V420 VanDerWaalsContact C-N 3.35Å; R418-V420 PolarHBondContact O-N 3.21Å
419	K	51.8	Low	57.5	Low	203 Å²	203	150.7 Å²	150.7	88%	0.883	76%	0.761	S	S	*	*			trans	-66.8	101.8	165.6	-157.1	179.4	-175.3	-172.8	0	104.9	K417 E421	K417-K419 PolarHBondContact O-N 3.36Å; K419-E421 PolarHBondContact O-N 3.01Å; K419-E421 VanDerWaalsContact O-N 3.16Å
420	V	58.9	Low	58.2	Low	125 Å²	125	156.2 Å²	156.2	76%	0.758	78%	0.776	S	S	*	*			trans	-67.6	109	169.7	177.9	0	0	0	0	105	R418 F422	R418-V420 VanDerWaalsContact C-N 3.35Å; R418-V420 PolarHBondContact O-N 3.21Å; V420-F422 PolarHBondContact O-N 3.29Å
421	E	58.4	Low	58.9	Low	170 Å²	170	150.4 Å²	150.4	79%	0.794	76%	0.758	S	S	*	*			trans	-61.6	116.4	162.4	-89.9	178.6	159.7	0	0	106.8	K419 V423	K419-E421 PolarHBondContact O-N 3.01Å; K419-E421 VanDerWaalsContact O-N 3.16Å; E421-V423 PolarHBondContact O-N 3.34Å
422	F	63.3	Low	59.4	Low	184 Å²	184	151.9 Å²	151.9	81%	0.807	75%	0.749	S	S	*	*			trans	-69	100.2	171	-166.5	-92.5	0	0	0	106.6	V420 P424	V420-F422 PolarHBondContact O-N 3.29Å; F422-P424 VanDerWaalsContact O-CD 3.29Å; F422-P424 WeakPolarHBondContact O-CD 3.45Å
423	V	70	Confident	60	Low	109 Å²	109	150 Å²	150	66%	0.661	75%	0.745	S	S	*	*			trans	-75.2	112.9	166.7	-179.1	0	0	0	0	105.8	E421 L425	E421-V423 PolarHBondContact O-N 3.34Å; V423-L425 PolarHBondContact O-N 3.01Å; V423-L425 VanDerWaalsContact O-N 3.14Å
424	P	66.7	Low	60.8	Low	94 Å²	94	147.4 Å²	147.4	61%	0.61	73%	0.73	S	S	*	*			trans	-61.1	119.9	177.4	23.2	-29.7	0	0	0	108.8	F422 D426	F422-P424 VanDerWaalsContact O-CD 3.29Å; F422-P424 WeakPolarHBondContact O-CD 3.45Å; P424-D426 VanDerWaalsContact C-N 3.33Å
425	L	67.4	Low	61.6	Low	165 Å²	165	150.7 Å²	150.7	86%	0.864	73%	0.732	S	S	*	*			trans	-85.1	-8.1	178.2	-80.5	153.5	0	0	0	112.6	V423	V423-L425 PolarHBondContact O-N 3.01Å; V423-L425 VanDerWaalsContact O-N 3.14Å
426	D	71.1	Confident	62.6	Low	156 Å²	156	143 Å²	143	83%	0.834	71%	0.707	S	S	*	*			trans	-93.3	110.9	173.2	-93.5	-23.2	0	0	0	110.6	P424	P424-D426 VanDerWaalsContact C-N 3.33Å
427	L	68	Low	63.3	Low	140 Å²	140	142.7 Å²	142.7	73%	0.733	70%	0.701	S	S	*	*			trans	-85.5	105.2	167.4	-72.4	159.7	0	0	0	108	F429	L427-F429 HydrophobicContact CB-CE2 3.99Å; L427-F429 HydrophobicContact CB-CZ 4.09Å; L427-F429 HydrophobicContact CD1-CZ 4.5Å; L427-F429 VanDerWaalsContact O-CD2 3.3Å; L427-F429 WeakPolarHBondContact O-CD2 3.32Å; L427-F429 PolarHBondContact O-N 3.05Å
428	N	70.2	Confident	64.1	Low	106 Å²	106	138.1 Å²	138.1	57%	0.567	69%	0.686	S	S	*	*			trans	-81.8	102.9	172.4	-171	1.3	0	0	0	110.4	E430 S431	N428-E430 PolarHBondContact O-N 2.81Å; N428-E430 PolarHBondContact OD1-N 3.24Å; N428-S431 PolarHBondContact O-OG 3.03Å; N428-S431 VanDerWaalsContact O-OG 3.09Å
429	F	67.3	Low	64.8	Low	178 Å²	178	130.2 Å²	130.2	78%	0.781	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-7.2	-179.1	-66.4	-83.9	0	0	0	114.5	L427 S431	L427-F429 HydrophobicContact CB-CE2 3.99Å; L427-F429 HydrophobicContact CB-CZ 4.09Å; L427-F429 HydrophobicContact CD1-CZ 4.5Å; L427-F429 VanDerWaalsContact O-CD2 3.3Å; L427-F429 WeakPolarHBondContact O-CD2 3.32Å; L427-F429 PolarHBondContact O-N 3.05Å; F429-S431 VanDerWaalsContact C-N 3.29Å; F429-S431 PolarHBondContact O-N 3.25Å
430	E	67.8	Low	65.4	Low	179 Å²	179	128 Å²	128	84%	0.836	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-5.5	-179.7	-64.7	-176.2	161.1	0	0	113.6	N428 Y432	N428-E430 PolarHBondContact O-N 2.81Å; N428-E430 PolarHBondContact OD1-N 3.24Å; E430-Y432 PolarHBondContact O-N 2.67Å
431	S	61.8	Low	65.5	Low	61 Å²	61	131.2 Å²	131.2	43%	0.427	66%	0.661	S	S	.	*			trans	-98.6	41.8	-178.8	63.6	0	0	0	0	113.6	N428 F429 D433 T434	N428-S431 PolarHBondContact O-OG 3.03Å; N428-S431 VanDerWaalsContact O-OG 3.09Å; F429-S431 VanDerWaalsContact C-N 3.29Å; F429-S431 PolarHBondContact O-N 3.25Å; S431-D433 PolarHBondContact O-N 3.36Å; S431-D433 VanDerWaalsContact O-N 3.14Å; S431-T434 PolarHBondContact O-N 3.31Å; S431-T434 PolarHBondContact O-OG1 2.91Å
432	Y	59	Low	65.7	Low	146 Å²	146	125.9 Å²	125.9	57%	0.573	65%	0.651	S	S	*	*	H	α-helix	trans	-57.2	-30.5	-176.4	-162.3	-98.9	0	0	0	113.1	E430 T434 F435 M436	E430-Y432 PolarHBondContact O-N 2.67Å; Y432-T434 PolarHBondContact O-N 2.93Å; Y432-F435 PolarHBondContact O-N 3.39Å; Y432-M436 HydrophobicContact CE1-CE 3.46Å; Y432-M436 VanDerWaalsContact CE1-CE 3.46Å; Y432-M436 HydrophobicContact CE1-CG 4.28Å; Y432-M436 WeakPolarHBondContact OH-CE 3.49Å
433	D	62.5	Low	65.7	Low	134 Å²	134	122.1 Å²	122.1	72%	0.717	65%	0.645	S	S	*	*	H	α-helix	trans	-70.5	-31.9	-175.8	-61	-28	0	0	0	113	S431	S431-D433 PolarHBondContact O-N 3.36Å; S431-D433 VanDerWaalsContact O-N 3.14Å
434	T	63.6	Low	65.3	Low	87 Å²	87	126.4 Å²	126.4	53%	0.534	66%	0.655	S	S	.	*	H	α-helix	trans	-73.7	-25.1	174.7	29.2	0	0	0	0	113.7	S431 Y432 D438	S431-T434 PolarHBondContact O-N 3.31Å; S431-T434 PolarHBondContact O-OG1 2.91Å; Y432-T434 PolarHBondContact O-N 2.93Å; T434-D438 PolarHBondContact O-N 3.22Å
435	F	63.8	Low	65	Low	138 Å²	138	128.6 Å²	128.6	61%	0.605	66%	0.657	S	S	*	*	H	α-helix	trans	-70.9	-36.3	177.9	178.6	-96.9	0	0	0	111.6	Y432 D438 A439	Y432-F435 PolarHBondContact O-N 3.39Å; F435-D438 PolarHBondContact O-N 3.21Å; F435-A439 VanDerWaalsContact O-CB 3.29Å; F435-A439 WeakPolarHBondContact O-CB 3.5Å; F435-A439 PolarHBondContact O-N 3.45Å
436	M	66.5	Low	65	Low	75 Å²	75	126.6 Å²	126.6	37%	0.369	65%	0.652	S	S	.	*	H	α-helix	trans	-68.5	-37.6	178.1	-71.9	-64.8	177.4	0	0	111.9	Y432 D438 A439 E440	Y432-M436 HydrophobicContact CE1-CE 3.46Å; Y432-M436 VanDerWaalsContact CE1-CE 3.46Å; Y432-M436 HydrophobicContact CE1-CG 4.28Å; Y432-M436 WeakPolarHBondContact OH-CE 3.49Å; M436-D438 VanDerWaalsContact C-N 3.34Å; M436-D438 PolarHBondContact O-N 2.99Å; M436-A439 PolarHBondContact O-N 3.32Å; M436-E440 WeakPolarHBondContact O-CB 3.4Å; M436-E440 WeakPolarHBondContact O-CG 3.32Å; M436-E440 PolarHBondContact O-N 3.23Å
437	D	67.8	Low	65.1	Low	113 Å²	113	124.1 Å²	124.1	60%	0.604	64%	0.643	S	S	*	*	H	α-helix	trans	-63.1	-37.6	175.4	-75.1	-18.9	0	0	0	113	R441	D437-R441 PolarHBondContact O-N 2.82Å
438	D	67	Low	65.1	Low	107 Å²	107	121.9 Å²	121.9	57%	0.572	63%	0.631	S	S	*	*	H	α-helix	trans	-78.9	-25.3	175.3	-87.2	-22	0	0	0	112.8	T434 F435 M436 R441	T434-D438 PolarHBondContact O-N 3.22Å; F435-D438 PolarHBondContact O-N 3.21Å; M436-D438 VanDerWaalsContact C-N 3.34Å; M436-D438 PolarHBondContact O-N 2.99Å; D438-R441 WeakPolarHBondContact O-CB 3.24Å; D438-R441 IonicContact OD1-NH1 3.36Å; D438-R441 PolarHBondContact OD1-NH1 2.99Å
439	A	67.2	Low	65.6	Low	64 Å²	64	122.4 Å²	122.4	53%	0.529	63%	0.628	S	S	.	*	H	α-helix	trans	-75.9	-29.3	172.7	0	0	0	0	0	112.9	F435 M436 R441	F435-A439 VanDerWaalsContact O-CB 3.29Å; F435-A439 WeakPolarHBondContact O-CB 3.5Å; F435-A439 PolarHBondContact O-N 3.45Å; M436-A439 PolarHBondContact O-N 3.32Å; A439-R441 VanDerWaalsContact C-N 3.32Å
440	E	65.4	Low	66	Low	157 Å²	157	123.9 Å²	123.9	73%	0.734	63%	0.629	S	S	*	*	S	Bend	trans	-81.4	-10	174.3	-72.5	-170.4	-179.4	0	0	113.3	M436 G442	M436-E440 WeakPolarHBondContact O-CB 3.4Å; M436-E440 WeakPolarHBondContact O-CG 3.32Å; M436-E440 PolarHBondContact O-N 3.23Å; E440-G442 PolarHBondContact O-N 3.39Å
441	R	61.5	Low	66.4	Low	192 Å²	192	121.2 Å²	121.2	73%	0.725	62%	0.619	S	S	*	*	S	Bend	trans	-67.9	95.8	170.2	-115.9	172	-174.9	164.2	3.3	109.6	D437 D438 A439	D437-R441 PolarHBondContact O-N 2.82Å; D438-R441 WeakPolarHBondContact O-CB 3.24Å; D438-R441 IonicContact OD1-NH1 3.36Å; D438-R441 PolarHBondContact OD1-NH1 2.99Å; A439-R441 VanDerWaalsContact C-N 3.32Å
442	G	61.3	Low	67	Low	58 Å²	58	122.6 Å²	122.6	60%	0.598	62%	0.619	S	S	*	*			trans	-43.9	149.3	-178.6	0	0	0	0	0	114	E440 K444	E440-G442 PolarHBondContact O-N 3.39Å; G442-K444 PolarHBondContact O-N 3.39Å; G442-K444 VanDerWaalsContact O-N 3.12Å
443	P	64.4	Low	67.7	Low	105 Å²	105	119.9 Å²	119.9	68%	0.682	61%	0.614	S	S	*	*			trans	-60.9	119.8	-164.2	25.6	-33.2	0	0	0	110.3	E445 T446	P443-E445 PolarHBondContact O-N 3.29Å; P443-T446 HydrophobicContact CB-CG2 4.05Å
444	K	60.8	Low	68.2	Low	200 Å²	200	117.9 Å²	117.9	87%	0.87	60%	0.603	S	S	*	*	S	Bend	trans	-52.7	122.1	151.5	-76	175.3	178.4	171.1	0	106	G442 T446	G442-K444 PolarHBondContact O-N 3.39Å; G442-K444 VanDerWaalsContact O-N 3.12Å; K444-T446 PolarHBondContact O-N 2.97Å
445	E	61.3	Low	68.5	Low	139 Å²	139	120.4 Å²	120.4	65%	0.65	61%	0.607	S	S	*	*			trans	-26.7	100.6	-173.2	-75	177.4	150.8	0	0	112.3	P443 T447 K449	P443-E445 PolarHBondContact O-N 3.29Å; E445-T447 PolarHBondContact O-N 3.06Å; E445-K449 WeakPolarHBondContact OE2-CE 3.28Å; E445-K449 IonicContact OE2-NZ 3.75Å
446	T	66.6	Low	68.5	Low	123 Å²	123	120 Å²	120	76%	0.755	60%	0.604	S	S	*	*			trans	-79.8	1	178.9	50.4	0	0	0	0	112.4	P443 K444	P443-T446 HydrophobicContact CB-CG2 4.05Å; K444-T446 PolarHBondContact O-N 2.97Å
447	T	73.2	Confident	68.4	Low	105 Å²	105	120.9 Å²	120.9	64%	0.644	61%	0.614	S	S	*	*	S	Bend	trans	-121.3	134.2	-178.6	56.1	0	0	0	0	109.4	E445 K449	E445-T447 PolarHBondContact O-N 3.06Å; T447-K449 PolarHBondContact O-N 3.05Å
448	L	68.6	Low	68.1	Low	93 Å²	93	120 Å²	120	49%	0.487	62%	0.617	S	S	.	*			trans	-61.2	135.2	173.4	-72.9	166.7	0	0	0	109.1	R450 Q452 L453 F456	L448-R450 PolarHBondContact O-N 2.88Å; L448-Q452 HydrophobicContact CB-CB 4.29Å; L448-Q452 HydrophobicContact CD2-CB 4.33Å; L448-Q452 VanDerWaalsContact CD2-OE1 3.26Å; L448-L453 HydrophobicContact CB-CD1 4.07Å; L448-L453 HydrophobicContact CD1-CD1 4.41Å; L448-F456 HydrophobicContact CD1-CD2 4.31Å; L448-F456 HydrophobicContact CD1-CE2 4.19Å
449	K	79.3	Confident	67.6	Low	116 Å²	116	119.3 Å²	119.3	50%	0.504	61%	0.612	S	S	.	*			trans	-55.1	143.6	174.2	-67.3	-174.1	179.1	-177.6	0	109.2	E445 T447 I451 Q452 L453	E445-K449 WeakPolarHBondContact OE2-CE 3.28Å; E445-K449 IonicContact OE2-NZ 3.75Å; T447-K449 PolarHBondContact O-N 3.05Å; K449-I451 PolarHBondContact O-N 3.46Å; K449-Q452 WeakPolarHBondContact O-CA 3.43Å; K449-Q452 WeakPolarHBondContact O-CB 3.5Å; K449-Q452 PolarHBondContact O-N 3.3Å; K449-L453 PolarHBondContact O-N 3.27Å
450	R	76.9	Confident	67.2	Low	210 Å²	210	124.6 Å²	124.6	79%	0.792	63%	0.625	S	S	*	*	H	α-helix	trans	-51.9	-35.6	-178.2	-156	168.8	-169.4	135.8	-0	113.1	L448 Q452 L453 D454	L448-R450 PolarHBondContact O-N 2.88Å; R450-Q452 PolarHBondContact O-N 2.9Å; R450-L453 WeakPolarHBondContact O-CB 3.32Å; R450-L453 PolarHBondContact O-N 3.07Å; R450-D454 PolarHBondContact O-N 3.42Å
451	I	75.7	Confident	66.9	Low	123 Å²	123	125 Å²	125	63%	0.631	63%	0.627	S	S	*	*	H	α-helix	trans	-64.1	-35.3	174	-57.6	169.9	0	0	0	112.7	K449 K455	K449-I451 PolarHBondContact O-N 3.46Å; I451-K455 WeakPolarHBondContact O-CG 3.22Å; I451-K455 PolarHBondContact O-N 3.43Å
452	Q	73.6	Confident	67	Low	90 Å²	90	120 Å²	120	42%	0.421	62%	0.622	S	S	.	*	H	α-helix	trans	-71.9	-42.1	172.2	-69.9	-176.4	-43.7	0	0	110.4	L448 K449 R450 D454 K455 F456	L448-Q452 HydrophobicContact CB-CB 4.29Å; L448-Q452 HydrophobicContact CD2-CB 4.33Å; L448-Q452 VanDerWaalsContact CD2-OE1 3.26Å; K449-Q452 WeakPolarHBondContact O-CA 3.43Å; K449-Q452 WeakPolarHBondContact O-CB 3.5Å; K449-Q452 PolarHBondContact O-N 3.3Å; R450-Q452 PolarHBondContact O-N 2.9Å; Q452-D454 VanDerWaalsContact C-N 3.32Å; Q452-D454 PolarHBondContact O-N 3.17Å; Q452-K455 WeakPolarHBondContact O-CB 3.44Å; Q452-K455 PolarHBondContact O-N 3.35Å; Q452-K455 VanDerWaalsContact O-N 3.15Å; Q452-F456 WeakPolarHBondContact O-CD2 3.35Å; Q452-F456 PolarHBondContact O-N 3.34Å; Q452-F456 VanDerWaalsContact O-N 3.14Å
453	L	73.9	Confident	67.1	Low	89 Å²	89	125.3 Å²	125.3	47%	0.466	64%	0.635	S	S	.	*	H	α-helix	trans	-58.2	-44.8	175.1	-138.7	90.1	0	0	0	111.5	L448 K449 R450 K455 F456 T457	L448-L453 HydrophobicContact CB-CD1 4.07Å; L448-L453 HydrophobicContact CD1-CD1 4.41Å; K449-L453 PolarHBondContact O-N 3.27Å; R450-L453 WeakPolarHBondContact O-CB 3.32Å; R450-L453 PolarHBondContact O-N 3.07Å; L453-K455 VanDerWaalsContact C-N 3.28Å; L453-K455 PolarHBondContact O-N 3.21Å; L453-F456 CarbonylContact O-C 3.58Å; L453-F456 WeakPolarHBondContact O-CA 3.41Å; L453-F456 PolarHBondContact O-N 2.66Å; L453-T457 WeakPolarHBondContact O-CG2 3.42Å; L453-T457 PolarHBondContact O-N 3.21Å; L453-T457 PolarHBondContact O-OG1 2.99Å
454	D	73.7	Confident	67	Low	91 Å²	91	126.6 Å²	126.6	49%	0.487	64%	0.636	S	S	.	*	H	α-helix	trans	-63.7	-31.7	177.6	-73.1	-17.9	0	0	0	112.5	R450 Q452 F456 T457 S458	R450-D454 PolarHBondContact O-N 3.42Å; Q452-D454 VanDerWaalsContact C-N 3.32Å; Q452-D454 PolarHBondContact O-N 3.17Å; D454-F456 VanDerWaalsContact C-N 3.34Å; D454-T457 WeakPolarHBondContact CA-OG1 3.39Å; D454-T457 PolarHBondContact O-OG1 3.48Å; D454-S458 WeakPolarHBondContact O-CB 3.48Å; D454-S458 PolarHBondContact O-N 3.47Å; D454-S458 VanDerWaalsContact O-N 3.08Å; D454-S458 PolarHBondContact O-OG 3.27Å
455	K	69.2	Low	67	Low	141 Å²	141	122.6 Å²	122.6	61%	0.613	63%	0.631	S	S	*	*	H	α-helix	trans	-69.3	-30.4	171.8	-75.2	174.5	-178.5	-176.7	0	112.8	I451 Q452 L453	I451-K455 WeakPolarHBondContact O-CG 3.22Å; I451-K455 PolarHBondContact O-N 3.43Å; Q452-K455 WeakPolarHBondContact O-CB 3.44Å; Q452-K455 PolarHBondContact O-N 3.35Å; Q452-K455 VanDerWaalsContact O-N 3.15Å; L453-K455 VanDerWaalsContact C-N 3.28Å; L453-K455 PolarHBondContact O-N 3.21Å
456	F	64.5	Low	67	Low	128 Å²	128	123.8 Å²	123.8	56%	0.561	64%	0.637	S	S	*	*	H	α-helix	trans	-82.3	-29	176.3	-73.4	-70.2	0	0	0	112.6	L448 Q452 L453 D454	L448-F456 HydrophobicContact CD1-CD2 4.31Å; L448-F456 HydrophobicContact CD1-CE2 4.19Å; Q452-F456 WeakPolarHBondContact O-CD2 3.35Å; Q452-F456 PolarHBondContact O-N 3.34Å; Q452-F456 VanDerWaalsContact O-N 3.14Å; L453-F456 CarbonylContact O-C 3.58Å; L453-F456 WeakPolarHBondContact O-CA 3.41Å; L453-F456 PolarHBondContact O-N 2.66Å; D454-F456 VanDerWaalsContact C-N 3.34Å
457	T	65.1	Low	66.7	Low	94 Å²	94	123.5 Å²	123.5	58%	0.577	63%	0.629	S	S	*	*	H	α-helix	trans	-86.6	-22.8	179.5	54	0	0	0	0	113.8	L453 D454	L453-T457 WeakPolarHBondContact O-CG2 3.42Å; L453-T457 PolarHBondContact O-N 3.21Å; L453-T457 PolarHBondContact O-OG1 2.99Å; D454-T457 WeakPolarHBondContact CA-OG1 3.39Å; D454-T457 PolarHBondContact O-OG1 3.48Å
458	S	60.7	Low	66.1	Low	96 Å²	96	123.7 Å²	123.7	67%	0.671	63%	0.627	S	S	*	*	S	Bend	trans	-85.6	-6.4	177.4	51.5	0	0	0	0	114.7	D454	D454-S458 WeakPolarHBondContact O-CB 3.48Å; D454-S458 PolarHBondContact O-N 3.47Å; D454-S458 VanDerWaalsContact O-N 3.08Å; D454-S458 PolarHBondContact O-OG 3.27Å
459	M	57.2	Low	65.8	Low	91 Å²	91	123.7 Å²	123.7	45%	0.448	62%	0.623	S	S	.	*			trans	-100.6	90.1	168.4	-79.5	-163.7	56.4	0	0	109.3	H461	M459-H461 PolarHBondContact O-N 2.97Å; M459-H461 VanDerWaalsContact O-N 3.09Å
460	E	59	Low	65	Low	175 Å²	175	121.5 Å²	121.5	82%	0.818	62%	0.616	S	S	*	*			trans	-57.8	115.9	156.9	-75	-174.7	161.7	0	0	107.2	S462	E460-S462 PolarHBondContact O-N 3.33Å
461	H	58.1	Low	64.3	Low	165 Å²	165	112.2 Å²	112.2	76%	0.764	59%	0.585	S	S	*	*			trans	-71.9	49.9	179.5	-65.2	-81.4	0	0	0	111.7	M459	M459-H461 PolarHBondContact O-N 2.97Å; M459-H461 VanDerWaalsContact O-N 3.09Å
462	S	63.1	Low	63.7	Low	89 Å²	89	113 Å²	113	62%	0.622	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-88.8	131.6	164.7	73	0	0	0	0	108.9	E460 D464	E460-S462 PolarHBondContact O-N 3.33Å; S462-D464 PolarHBondContact O-N 2.92Å
463	L	63.1	Low	63.2	Low	168 Å²	168	115.1 Å²	115.1	88%	0.88	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-58.8	131.6	164	-76	151.3	0	0	0	108
464	D	63.9	Low	62.9	Low	132 Å²	132	116 Å²	116	71%	0.706	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-52.7	143.6	164.5	-72.1	-34.1	0	0	0	107.8	S462 E466	S462-D464 PolarHBondContact O-N 2.92Å; D464-E466 PolarHBondContact O-N 3.37Å
465	P	60.9	Low	62.3	Low	117 Å²	117	113 Å²	113	76%	0.76	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-52.4	116.4	178.5	21.2	-31.7	0	0	0	108.6	I467	P465-I467 PolarHBondContact O-N 3.5Å
466	E	60.1	Low	62.1	Low	164 Å²	164	108 Å²	108	77%	0.766	57%	0.566	S	S	*	*			trans	-58.8	104.9	-175	-152.6	163.9	-160.4	0	0	107.2	D464 D468	D464-E466 PolarHBondContact O-N 3.37Å; E466-D468 VanDerWaalsContact C-N 3.27Å; E466-D468 PolarHBondContact O-N 3.13Å
467	I	60.9	Low	62.3	Low	117 Å²	117	106.6 Å²	106.6	60%	0.6	56%	0.56	S	S	*	*			trans	-72	98.9	167.2	-57	175.3	0	0	0	103.7	P465 F469	P465-I467 PolarHBondContact O-N 3.5Å; I467-F469 HydrophobicContact CB-CD2 3.99Å; I467-F469 HydrophobicContact CB-CE2 3.71Å; I467-F469 HydrophobicContact CD1-CE2 4.45Å; I467-F469 HydrophobicContact CG2-CD2 3.71Å; I467-F469 HydrophobicContact CG2-CE2 3.38Å; I467-F469 HydrophobicContact CG2-CG 4.44Å; I467-F469 HydrophobicContact CG2-CZ 3.83Å; I467-F469 WeakPolarHBondContact O-CD2 3.32Å; I467-F469 PolarHBondContact O-N 2.96Å
468	D	61	Low	62.6	Low	109 Å²	109	112.1 Å²	112.1	58%	0.583	58%	0.577	S	S	*	*			trans	-62	84.5	176.9	-79.7	-20.2	0	0	0	109.6	E466 D470	E466-D468 VanDerWaalsContact C-N 3.27Å; E466-D468 PolarHBondContact O-N 3.13Å; D468-D470 PolarHBondContact O-N 3.31Å
469	F	61.7	Low	63.2	Low	93 Å²	93	113.5 Å²	113.5	41%	0.408	58%	0.581	S	S	.	*			trans	-73.9	66	169.1	-77	-82.9	0	0	0	109	L388 V391 I467 A471 L474	L388-F469 HydrophobicContact CD2-CB 4.13Å; L388-F469 WeakPolarHBondContact CD2-O 3.46Å; V391-F469 HydrophobicContact CG1-CD2 3.47Å; V391-F469 VanDerWaalsContact CG1-CD2 3.47Å; V391-F469 HydrophobicContact CG1-CE2 4.07Å; V391-F469 HydrophobicContact CG1-CG 4.42Å; V391-F469 HydrophobicContact CG2-CB 4.36Å; V391-F469 HydrophobicContact CG2-CD2 4.25Å; I467-F469 HydrophobicContact CB-CD2 3.99Å; I467-F469 HydrophobicContact CB-CE2 3.71Å; I467-F469 HydrophobicContact CD1-CE2 4.45Å; I467-F469 HydrophobicContact CG2-CD2 3.71Å; I467-F469 HydrophobicContact CG2-CE2 3.38Å; I467-F469 HydrophobicContact CG2-CG 4.44Å; I467-F469 HydrophobicContact CG2-CZ 3.83Å; I467-F469 WeakPolarHBondContact O-CD2 3.32Å; I467-F469 PolarHBondContact O-N 2.96Å; F469-A471 PolarHBondContact O-N 2.91Å; F469-L474 HydrophobicContact CD1-CD2 4.37Å
470	D	62.7	Low	63.8	Low	69 Å²	69	111.3 Å²	111.3	37%	0.369	57%	0.573	S	S	.	*			trans	-63.3	124.1	170.2	-175.9	-0.9	0	0	0	108	D468 K472 Q473 L474	D468-D470 PolarHBondContact O-N 3.31Å; D470-K472 PolarHBondContact O-N 3.3Å; D470-K472 PolarHBondContact OD1-N 3.28Å; D470-Q473 HydrophobicContact CB-CG 4.21Å; D470-Q473 WeakPolarHBondContact O-CA 3.38Å; D470-Q473 WeakPolarHBondContact O-CB 3.3Å; D470-Q473 PolarHBondContact O-N 3.05Å; D470-L474 PolarHBondContact O-N 2.77Å
471	A	61.3	Low	64.1	Low	16 Å²	16	107.1 Å²	107.1	13%	0.132	56%	0.561	C	S	.	*	H	α-helix	trans	-55.1	-23.4	176.9	0	0	0	0	0	112.2	L378 F469 S475	L378-A471 HydrophobicContact CD2-CB 3.56Å; F469-A471 PolarHBondContact O-N 2.91Å; A471-S475 PolarHBondContact O-N 2.9Å
472	K	62.9	Low	64.3	Low	138 Å²	138	106.2 Å²	106.2	60%	0.6	56%	0.562	S	S	*	*	H	α-helix	trans	-67.4	-41	171.1	-63.2	175.4	-174.4	164.1	0	112.6	D470 L474 S475 C476	D470-K472 PolarHBondContact O-N 3.3Å; D470-K472 PolarHBondContact OD1-N 3.28Å; K472-L474 VanDerWaalsContact C-N 3.3Å; K472-L474 PolarHBondContact O-N 3.22Å; K472-S475 PolarHBondContact O-N 3.5Å; K472-S475 VanDerWaalsContact O-N 3.13Å; K472-S475 PolarHBondContact O-OG 3.32Å; K472-C476 PolarHBondContact O-N 3.19Å; K472-C476 PolarHBondContact O-SG 3.5Å
473	Q	64.6	Low	64.2	Low	135 Å²	135	106.4 Å²	106.4	63%	0.631	55%	0.551	S	S	*	*	H	α-helix	trans	-65	-35.8	177.4	-70.2	-169.6	3.4	0	0	111.7	D470 S475 C476	D470-Q473 HydrophobicContact CB-CG 4.21Å; D470-Q473 WeakPolarHBondContact O-CA 3.38Å; D470-Q473 WeakPolarHBondContact O-CB 3.3Å; D470-Q473 PolarHBondContact O-N 3.05Å; Q473-S475 VanDerWaalsContact C-N 3.25Å; Q473-S475 PolarHBondContact O-N 3.45Å; Q473-C476 PolarHBondContact O-N 3.03Å
474	L	66.2	Low	64.1	Low	108 Å²	108	100.4 Å²	100.4	57%	0.565	53%	0.53	S	S	*	.	H	α-helix	trans	-66.2	-27.5	174.4	-64.5	177	0	0	0	113	F469 D470 K472 C476	F469-L474 HydrophobicContact CD1-CD2 4.37Å; D470-L474 PolarHBondContact O-N 2.77Å; K472-L474 VanDerWaalsContact C-N 3.3Å; K472-L474 PolarHBondContact O-N 3.22Å; L474-C476 VanDerWaalsContact C-N 3.33Å
475	S	61.6	Low	63.9	Low	28 Å²	28	97.8 Å²	97.8	20%	0.196	51%	0.514	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-8.6	177.4	73.8	0	0	0	0	114	A471 K472 Q473 G484 M485	A471-S475 PolarHBondContact O-N 2.9Å; K472-S475 PolarHBondContact O-N 3.5Å; K472-S475 VanDerWaalsContact O-N 3.13Å; K472-S475 PolarHBondContact O-OG 3.32Å; Q473-S475 VanDerWaalsContact C-N 3.25Å; Q473-S475 PolarHBondContact O-N 3.45Å; S475-G484 CarbonylContact O-C 3.38Å; S475-G484 VanDerWaalsContact O-CA 3.22Å; S475-G484 WeakPolarHBondContact O-CA 3.35Å; S475-M485 PolarHBondContact O-N 3.45Å
476	C	65.6	Low	63.7	Low	35 Å²	35	96.8 Å²	96.8	24%	0.236	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	153.1	-176.4	-67.7	0	0	0	0	112.4	K472 Q473 L474 P481 K483	K472-C476 PolarHBondContact O-N 3.19Å; K472-C476 PolarHBondContact O-SG 3.5Å; Q473-C476 PolarHBondContact O-N 3.03Å; L474-C476 VanDerWaalsContact C-N 3.33Å; C476-P481 WeakPolarHBondContact CB-O 3.46Å; C476-P481 PolarHBondContact SG-O 3.41Å; C476-K483 VanDerWaalsContact CA-O 3.32Å; C476-K483 WeakPolarHBondContact CA-O 3.19Å
477	F	69.6	Low	63	Low	99 Å²	99	92.3 Å²	92.3	43%	0.434	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	138.9	173.2	-64	-75.4	0	0	0	111.3	T479 V480 K483	F477-T479 PolarHBondContact O-N 3.39Å; F477-V480 HydrophobicContact CB-CB 4.36Å; F477-V480 CarbonylContact O-C 3.59Å; F477-V480 PolarHBondContact O-N 3.34Å; F477-K483 HydrophobicContact CD2-CB 3.82Å; F477-K483 VanDerWaalsContact CD2-O 3.25Å; F477-K483 WeakPolarHBondContact CD2-O 3.4Å; F477-K483 HydrophobicContact CE2-CB 4.31Å; F477-K483 PolarHBondContact N-O 2.82Å; F477-K483 VanDerWaalsContact N-O 3.16Å
478	F	69.8	Low	62.4	Low	211 Å²	211	94.1 Å²	94.1	93%	0.925	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-36.2	176.9	-171.7	-96.5	0	0	0	112.7
479	T	74	Confident	61.9	Low	124 Å²	124	94.9 Å²	94.9	76%	0.761	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-18.6	178	52.4	0	0	0	0	113.3	F477	F477-T479 PolarHBondContact O-N 3.39Å
480	V	68.9	Low	61.2	Low	45 Å²	45	93.4 Å²	93.4	27%	0.273	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	82.8	-179	-159.5	0	0	0	0	110.2	F477 N482 K483	F477-V480 HydrophobicContact CB-CB 4.36Å; F477-V480 CarbonylContact O-C 3.59Å; F477-V480 PolarHBondContact O-N 3.34Å; V480-N482 PolarHBondContact O-N 3.39Å; V480-K483 HydrophobicContact CB-CB 4.19Å; V480-K483 HydrophobicContact CB-CD 4Å; V480-K483 HydrophobicContact CB-CG 4.21Å; V480-K483 HydrophobicContact CG1-CB 4.06Å; V480-K483 HydrophobicContact CG1-CD 3.53Å; V480-K483 HydrophobicContact CG1-CG 3.59Å; V480-K483 HydrophobicContact CG2-CD 4.37Å; V480-K483 PolarHBondContact O-N 3.07Å
481	P	65	Low	60.7	Low	88 Å²	88	96.8 Å²	96.8	57%	0.571	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.8	-13.1	-173.4	24.6	-34.3	0	0	0	113.8	C476	C476-P481 WeakPolarHBondContact CB-O 3.46Å; C476-P481 PolarHBondContact SG-O 3.41Å
482	N	64.4	Low	60.1	Low	146 Å²	146	102.4 Å²	102.4	78%	0.781	52%	0.522	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	2.3	178.1	-63.8	-30.4	0	0	0	113.7	V480	V480-N482 PolarHBondContact O-N 3.39Å
483	K	59.5	Low	59	Low	92 Å²	92	100.4 Å²	100.4	40%	0.4	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	112.6	-179.4	-70.2	-178.1	-172.1	171.8	0	109	C476 F477 V480	C476-K483 VanDerWaalsContact CA-O 3.32Å; C476-K483 WeakPolarHBondContact CA-O 3.19Å; F477-K483 HydrophobicContact CD2-CB 3.82Å; F477-K483 VanDerWaalsContact CD2-O 3.25Å; F477-K483 WeakPolarHBondContact CD2-O 3.4Å; F477-K483 HydrophobicContact CE2-CB 4.31Å; F477-K483 PolarHBondContact N-O 2.82Å; F477-K483 VanDerWaalsContact N-O 3.16Å; V480-K483 HydrophobicContact CB-CB 4.19Å; V480-K483 HydrophobicContact CB-CD 4Å; V480-K483 HydrophobicContact CB-CG 4.21Å; V480-K483 HydrophobicContact CG1-CB 4.06Å; V480-K483 HydrophobicContact CG1-CD 3.53Å; V480-K483 HydrophobicContact CG1-CG 3.59Å; V480-K483 HydrophobicContact CG2-CD 4.37Å; V480-K483 PolarHBondContact O-N 3.07Å
484	G	62.1	Low	57.9	Low	42 Å²	42	97.8 Å²	97.8	43%	0.433	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	153.4	177.5	0	0	0	0	0	112.8	S475	S475-G484 CarbonylContact O-C 3.38Å; S475-G484 VanDerWaalsContact O-CA 3.22Å; S475-G484 WeakPolarHBondContact O-CA 3.35Å
485	M	59.4	Low	56.6	Low	77 Å²	77	102.5 Å²	102.5	38%	0.379	52%	0.523	S	S	.	.			trans	-85.2	113.2	173.6	-168.9	169.3	64.7	0	0	110.1	F370 L373 S475	F370-M485 HydrophobicContact CD1-SD 4.3Å; F370-M485 HydrophobicContact CE1-SD 3.91Å; L373-M485 HydrophobicContact CD1-CE 3.51Å; L373-M485 HydrophobicContact CD1-CG 3.83Å; L373-M485 HydrophobicContact CD1-SD 3.37Å; L373-M485 WeakPolarHBondContact CD1-SD 3.4Å; L373-M485 HydrophobicContact CD2-CE 3.7Å; L373-M485 HydrophobicContact CG-CE 4.26Å; S475-M485 PolarHBondContact O-N 3.45Å
486	V	56.2	Low	55.2	Low	96 Å²	96	111.4 Å²	111.4	58%	0.582	55%	0.553	S	S	*	*			trans	-139.1	131.6	-179.3	-176.5	0	0	0	0	110.3
487	R	45.9	Very low	53.8	Low	70 Å²	70	118.4 Å²	118.4	26%	0.264	58%	0.579	S	S	.	*			trans	-80.9	117.2	173.6	-170.7	174.9	178.4	-175.3	3.5	110.3	A371	A371-R487 PolarHBondContact O-NH1 2.92Å
488	Y	48	Very low	52.3	Low	156 Å²	156	120.1 Å²	120.1	61%	0.612	59%	0.592	S	S	*	*			trans	-105.1	113.5	174.2	-153.7	-102.5	0	0	0	110
489	K	50.9	Low	50.7	Low	124 Å²	124	115.2 Å²	115.2	54%	0.539	57%	0.574	S	S	.	*			trans	70.5	140.4	177.9	-60	-177.1	176.1	-177.1	0	116.9
490	P	46.7	Very low	48.9	Very low	62 Å²	62	113.9 Å²	113.9	40%	0.403	58%	0.576	S	S	.	*	S	Bend	trans	-75.9	-24.2	-176.9	25.2	-27.2	0	0	0	114.5
491	D	53	Low	47.2	Very low	140 Å²	140	113.9 Å²	113.9	75%	0.749	58%	0.584	S	S	*	*	S	Bend	trans	-112	11.2	-160.1	-44.9	-41.8	0	0	0	114.9
492	Q	46.9	Very low	46.1	Very low	134 Å²	134	120 Å²	120	63%	0.626	60%	0.602	S	S	*	*	S	Bend	trans	-122.3	127.4	178.9	-76.5	-173	-10.8	0	0	111.6	L494	Q492-L494 PolarHBondContact O-N 3.41Å; Q492-L494 VanDerWaalsContact O-N 3.11Å
493	P	41.2	Very low	44.6	Very low	96 Å²	96	120.2 Å²	120.2	62%	0.623	60%	0.603	S	S	*	*			trans	-60.3	117.4	163.8	25.6	-31	0	0	0	107.7	R495	P493-R495 PolarHBondContact O-N 3.14Å
494	L	41.6	Very low	43.5	Very low	80 Å²	80	125 Å²	125	42%	0.419	62%	0.624	S	S	.	*			trans	-69.3	75.2	-178.5	-76.9	165.6	0	0	0	110.9	Q492 R496	Q492-L494 PolarHBondContact O-N 3.41Å; Q492-L494 VanDerWaalsContact O-N 3.11Å; L494-R496 PolarHBondContact O-N 3.49Å
495	R	38	Very low	42	Very low	207 Å²	207	132.9 Å²	132.9	78%	0.781	65%	0.647	S	S	*	*			trans	-78	-2.3	166.4	-79.2	-169.4	173.7	-161.9	-0.7	113	P493	P493-R495 PolarHBondContact O-N 3.14Å
496	R	33.4	Very low	40.5	Very low	215 Å²	215	137.4 Å²	137.4	81%	0.811	67%	0.669	S	S	*	*	S	Bend	trans	-136.2	114.9	-175.2	-87.2	177.8	172.9	159.2	-2.4	112.4	L494 I498	L494-R496 PolarHBondContact O-N 3.49Å; R496-I498 PolarHBondContact O-N 3.42Å
497	F	35.9	Very low	39.4	Very low	182 Å²	182	140 Å²	140	80%	0.798	68%	0.679	S	S	*	*			trans	-65.2	112.5	164.6	-64.2	-84.7	0	0	0	109.4
498	I	37	Very low	38.6	Very low	135 Å²	135	144.2 Å²	144.2	69%	0.692	71%	0.706	S	S	*	*			trans	-90.8	108.1	162.9	-59.3	177.4	0	0	0	106.7	R496 A500	R496-I498 PolarHBondContact O-N 3.42Å; I498-A500 VanDerWaalsContact C-N 3.33Å; I498-A500 PolarHBondContact O-N 2.9Å
499	I	36.3	Very low	37.6	Very low	108 Å²	108	147.9 Å²	147.9	55%	0.554	72%	0.719	S	S	*	*			trans	-70.7	90.1	175	-57.6	170.4	0	0	0	107.4	G501	I499-G501 VanDerWaalsContact C-N 3.26Å; I499-G501 PolarHBondContact O-N 3Å
500	A	37	Very low	36.8	Very low	97 Å²	97	150.6 Å²	150.6	80%	0.802	74%	0.739	S	S	*	*			trans	-83	72	174.6	0	0	0	0	0	110.3	I498	I498-A500 VanDerWaalsContact C-N 3.33Å; I498-A500 PolarHBondContact O-N 2.9Å
501	G	33.2	Very low	36.1	Very low	44 Å²	44	159.1 Å²	159.1	45%	0.454	76%	0.763	S	S	.	*			trans	-93	144.5	164.4	0	0	0	0	0	110.3	I499 N503	I499-G501 VanDerWaalsContact C-N 3.26Å; I499-G501 PolarHBondContact O-N 3Å; G501-N503 PolarHBondContact O-N 3.42Å
502	K	40.9	Very low	35.1	Very low	218 Å²	218	159 Å²	159	95%	0.948	76%	0.762	S	S	*	*	S	Bend	trans	-61.3	2.6	178.8	-80.1	-178.7	175.5	177.3	0	115.5
503	N	34.5	Very low	34.5	Very low	149 Å²	149	160.7 Å²	160.7	80%	0.797	77%	0.77	S	S	*	*	S	Bend	trans	-131.1	113.1	178.6	-75.1	-18.4	0	0	0	110.4	G501	G501-N503 PolarHBondContact O-N 3.42Å
504	K	35.2	Very low	34.3	Very low	192 Å²	192	160.7 Å²	160.7	84%	0.835	78%	0.778	S	S	*	*			trans	60.9	117.4	147.9	-117.6	169.8	179.7	175.2	0	118.5	M506	K504-M506 PolarHBondContact O-N 3.01Å
505	F	30.4	Very low	33.9	Very low	209 Å²	209	165.5 Å²	165.5	92%	0.917	80%	0.798	S	S	*	*			trans	-37.1	115.2	156.7	-62.7	-92.9	0	0	0	112.2
506	M	28.1	Very low	33.8	Very low	172 Å²	172	160.6 Å²	160.6	85%	0.847	79%	0.793	S	S	*	*			trans	-141.6	84.5	165.5	-75.3	-68.3	-74.6	0	0	108.2	K504	K504-M506 PolarHBondContact O-N 3.01Å
507	L	32.8	Very low	33.8	Very low	150 Å²	150	159 Å²	159	79%	0.785	80%	0.795	S	S	*	*			trans	-148.1	76.8	161.3	-121.7	155.4	0	0	0	107.1
508	N	29	Very low	33.7	Very low	158 Å²	158	154.5 Å²	154.5	85%	0.845	79%	0.792	S	S	*	*			trans	-146	141.7	161.8	-92.3	-17.9	0	0	0	107.8
509	R	28.5	Very low	33.8	Very low	234 Å²	234	153.6 Å²	153.6	88%	0.883	80%	0.795	S	S	*	*			trans	85.5	98.2	178.2	-62.3	-178	-178.9	174.6	0.2	116.2
510	L	34.2	Very low	33.8	Very low	181 Å²	181	153.9 Å²	153.9	95%	0.948	80%	0.801	S	S	*	*	S	Bend		-162.3	83.4	127.1	-94	175.2	0	0	0	108.1
511	R	31.5	Very low	33.7	Very low	241 Å²	241	156.7 Å²	156.7	91%	0.909	80%	0.803	S	S	*	*			trans	178.2	84.6	138.2	-151.4	98.6	-175.6	-166.4	1.1	109.2
512	D	30.8	Very low	33.6	Very low	138 Å²	138	158 Å²	158	74%	0.738	82%	0.816	S	S	*	*			trans	-95.6	153.8	151.8	-97.3	-31.6	0	0	0	106.8
513	E	35.6	Very low	33.3	Very low	169 Å²	169	152.7 Å²	152.7	79%	0.79	81%	0.813	S	S	*	*			trans	94	119.3	165.1	-48.5	-52.1	139.9	0	0	119.7
514	A	37	Very low	33.1	Very low	96 Å²	96	152 Å²	152	79%	0.793	81%	0.814	S	S	*	*			trans	96.8	82.9	151.2	0	0	0	0	0	120
515	E	32.9	Very low	33.3	Very low	180 Å²	180	148.5 Å²	148.5	84%	0.841	81%	0.812	S	S	*	*			trans	-65.9	158.5	135.8	-123.1	-167.1	161.2	0	0	109.4
516	P	34.9	Very low	33.3	Very low	104 Å²	104	147.2 Å²	147.2	68%	0.675	81%	0.806	S	S	*	*				-155.9	162.9	64.4	37.7	-14.6	0	0	0	119.1
517	Q	34.4	Very low	33.6	Very low	181 Å²	181	143.9 Å²	143.9	85%	0.846	80%	0.795	S	S	*	*			trans	83.1	115.1	142.6	-76.5	170.6	29.1	0	0	122.6
518	A	34.2	Very low	33.5	Very low	88 Å²	88	142.2 Å²	142.2	73%	0.727	79%	0.791	S	S	*	*			trans	-74.3	-178.1	157.8	0	0	0	0	0	110.7
519	P	38.8	Very low	33.6	Very low	116 Å²	116	141.5 Å²	141.5	75%	0.753	79%	0.787	S	S	*	*			cis	-159.3	-172.3	40.6	37.4	-9.4	0	0	0	119.3
520	V	36.5	Very low	33.8	Very low	114 Å²	114	137 Å²	137	69%	0.691	79%	0.786	S	S	*	*			trans	84	128	148.3	-118.8	0	0	0	0	124.7
521	D	34.3	Very low	33.5	Very low	156 Å²	156	138.2 Å²	138.2	83%	0.834	78%	0.778	S	S	*	*			trans	99.1	116.8	136.2	-78.4	-27.8	0	0	0	121.9
522	G	30.9	Very low	33.5	Very low	72 Å²	72	132.4 Å²	132.4	74%	0.742	77%	0.769	S	S	*	*				129.6	89.3	121.7	0	0	0	0	0	119.4
523	A	34.3	Very low	33.5	Very low	107 Å²	107	130.1 Å²	130.1	88%	0.884	77%	0.77	S	S	*	*			trans	73	111.6	140.7	0	0	0	0	0	121.8
524	T	30.7	Very low	33.6	Very low	133 Å²	133	130.5 Å²	130.5	82%	0.816	78%	0.776	S	S	*	*			trans	-95.2	-173.5	146.4	56	0	0	0	0	109
525	P	40	Very low	33.4	Very low	120 Å²	120	134.9 Å²	134.9	78%	0.779	78%	0.78	S	S	*	*				-128.2	176.6	-50.3	29.5	-10.3	0	0	0	111.4
526	F	30.7	Very low	33.8	Very low	181 Å²	181	135.1 Å²	135.1	79%	0.794	78%	0.781	S	S	*	*			trans	-143.8	118.7	164.1	-168.2	-101	0	0	0	112.2
527	V	32.9	Very low	33.9	Very low	102 Å²	102	138 Å²	138	62%	0.618	79%	0.791	S	S	*	*			trans	-5.4	156.4	144.4	-81.8	0	0	0	0	117.3
528	T	31.8	Very low	33.8	Very low	116 Å²	116	132.6 Å²	132.6	71%	0.712	78%	0.783	S	S	*	*				-177.3	154.8	53.4	-21.9	0	0	0	0	110.7
529	D	29.9	Very low	33.9	Very low	142 Å²	142	137 Å²	137	76%	0.759	79%	0.793	S	S	*	*			trans	-69.5	148.4	178.9	-158.4	-1.8	0	0	0	114.7
530	V	33.3	Very low	33.5	Very low	141 Å²	141	137 Å²	137	86%	0.855	79%	0.791	S	S	*	*			trans	-141.3	82.8	164.7	-176.1	0	0	0	0	110.8
531	R	28.5	Very low	33.4	Very low	206 Å²	206	139.4 Å²	139.4	78%	0.777	80%	0.799	S	S	*	*				19.4	131.5	128.2	-115.9	-163.4	164.4	130.1	-6	121.4
532	T	30.7	Very low	33.5	Very low	119 Å²	119	135.4 Å²	135.4	73%	0.73	79%	0.794	S	S	*	*			trans	74	119	131.6	49	0	0	0	0	121.7
533	A	32.1	Very low	33.7	Very low	90 Å²	90	140 Å²	140	74%	0.744	80%	0.802	S	S	*	*				170.3	115.4	102.4	0	0	0	0	0	112
534	L	37.5	Very low	33.7	Very low	177 Å²	177	142.2 Å²	142.2	93%	0.927	80%	0.796	S	S	*	*				170.3	103.9	125.4	-119.3	71.2	0	0	0	109.6
535	E	33.1	Very low	34	Very low	188 Å²	188	140.6 Å²	140.6	88%	0.879	79%	0.788	S	S	*	*			trans	-89.3	142.9	158.8	-69.1	171.6	159.1	0	0	108.1
536	E	39.8	Very low	33.6	Very low	185 Å²	185	142.8 Å²	142.8	86%	0.864	79%	0.789	S	S	*	*			trans	-174.8	103.3	138.9	-104.4	174.8	-164.6	0	0	109.1
537	D	37.3	Very low	33.5	Very low	165 Å²	165	140 Å²	140	88%	0.882	78%	0.783	S	S	*	*			trans	151.2	96.8	135.1	-83.7	-15.1	0	0	0	110.5
538	G	32.4	Very low	33.3	Very low	66 Å²	66	142.5 Å²	142.5	68%	0.68	79%	0.788	S	S	*	*			trans	-85.5	165.2	173.4	0	0	0	0	0	113
539	I	36	Very low	33.3	Very low	180 Å²	180	142 Å²	142	92%	0.923	79%	0.789	S	S	*	*				-145.4	123.4	129.9	-80	127.5	0	0	0	106.5
540	T	31	Very low	33.3	Very low	116 Å²	116	140.7 Å²	140.7	71%	0.712	79%	0.786	S	S	*	*			trans	-88.5	154	-178.9	47.7	0	0	0	0	113
541	L	35.2	Very low	33.1	Very low	166 Å²	166	141.6 Å²	141.6	87%	0.869	79%	0.786	S	S	*	*				168.5	109.8	126.2	-110.3	79.9	0	0	0	106.2
542	G	34.9	Very low	33.4	Very low	71 Å²	71	135.6 Å²	135.6	73%	0.732	79%	0.788	S	S	*	*				90	132.7	71.7	0	0	0	0	0	108.5
543	D	36	Very low	33.4	Very low	169 Å²	169	138.3 Å²	138.3	90%	0.904	79%	0.793	S	S	*	*			cis	-161.4	156.5	2.1	-104.6	-37.5	0	0	0	106.5
544	M	35.2	Very low	33.4	Very low	153 Å²	153	141.8 Å²	141.8	75%	0.754	79%	0.793	S	S	*	*			trans	-61	-171.3	167.9	-90.4	-156.5	90.2	0	0	113.2	M546	M544-M546 HydrophobicContact CE-CG 4.36Å
545	P	35.9	Very low	33.1	Very low	100 Å²	100	138.4 Å²	138.4	65%	0.649	79%	0.785	S	S	*	*			cis	-139.6	171.7	-9.2	15.4	12.5	0	0	0	116.9
546	M	31.6	Very low	32.8	Very low	165 Å²	165	138.3 Å²	138.3	81%	0.813	78%	0.784	S	S	*	*			trans	46.3	118.3	137.6	-54.9	-69.8	-140.8	0	0	122.6	M544	M544-M546 HydrophobicContact CE-CG 4.36Å
547	N	29.5	Very low	32.3	Very low	124 Å²	124	139 Å²	139	66%	0.663	79%	0.787	S	S	*	*				141.1	129.6	102	-153.9	30.1	0	0	0	115.2
548	E	28.4	Very low	31.9	Very low	154 Å²	154	134.3 Å²	134.3	72%	0.72	77%	0.772	S	S	*	*			trans	66.9	129	143.2	-93.2	167.6	-162.1	0	0	124.1
549	S	30.3	Very low	31.9	Very low	106 Å²	106	137.7 Å²	137.7	74%	0.741	77%	0.773	S	S	*	*			trans	83.4	143.6	149.9	-39.9	0	0	0	0	117.2
550	V	31.1	Very low	31.5	Very low	113 Å²	113	137 Å²	137	69%	0.685	77%	0.771	S	S	*	*			cis	-177.5	146	-10.7	134.4	0	0	0	0	103
551	D	29.2	Very low	31.5	Very low	161 Å²	161	140.2 Å²	140.2	86%	0.861	78%	0.778	S	S	*	*			trans	59.2	103.9	163	-57.8	-22.4	0	0	0	119.9
552	G	34.6	Very low	31.2	Very low	79 Å²	79	136.5 Å²	136.5	81%	0.814	77%	0.771	S	S	*	*			trans	-157	102.3	168.3	0	0	0	0	0	110.1
553	E	30.9	Very low	30.9	Very low	177 Å²	177	137.9 Å²	137.9	83%	0.827	78%	0.775	S	S	*	*			trans	-61.7	167.9	178.2	-58.7	173.5	133.7	0	0	113.2
554	Q	32.1	Very low	30.7	Very low	162 Å²	162	135.1 Å²	135.1	76%	0.757	77%	0.77	S	S	*	*			trans	102.1	70.7	156.1	-57.2	176.6	15.1	0	0	117.3
555	S	29.8	Very low	30.4	Very low	107 Å²	107	135 Å²	135	75%	0.748	78%	0.778	S	S	*	*				43.6	83	113	64.3	0	0	0	0	117.1	E557	S555-E557 PolarHBondContact O-N 3.04Å
556	E	28.1	Very low	30.6	Very low	186 Å²	186	138.9 Å²	138.9	87%	0.869	79%	0.787	S	S	*	*			trans	-71.9	103.9	146.9	-68.6	-170.9	150.4	0	0	108.8	A558	E556-A558 PolarHBondContact O-N 3.26Å
557	E	29.2	Very low	30.7	Very low	198 Å²	198	137 Å²	137	93%	0.925	79%	0.787	S	S	*	*			trans	-75.3	74.6	156.8	-83.1	-173.8	157.8	0	0	108.2	S555 I559	S555-E557 PolarHBondContact O-N 3.04Å; E557-I559 PolarHBondContact O-N 3.16Å
558	A	29.2	Very low	31	Very low	68 Å²	68	139.5 Å²	139.5	56%	0.562	80%	0.795	S	S	*	*			trans	-82.9	103.1	164.4	0	0	0	0	0	108.8	E556	E556-A558 PolarHBondContact O-N 3.26Å
559	I	31.8	Very low	31.2	Very low	137 Å²	137	140.1 Å²	140.1	70%	0.703	80%	0.802	S	S	*	*				57.8	84.2	129.6	-50.1	159	0	0	0	114.5	E557 E561	E557-I559 PolarHBondContact O-N 3.16Å; I559-E561 VanDerWaalsContact C-N 3.26Å; I559-E561 HydrophobicContact CG2-CB 4Å; I559-E561 HydrophobicContact CG2-CG 3.92Å; I559-E561 PolarHBondContact O-N 3.35Å
560	D	27.3	Very low	31.5	Very low	165 Å²	165	138.9 Å²	138.9	88%	0.882	80%	0.798	S	S	*	*			trans	-78.7	78.2	165.5	-148.9	4.4	0	0	0	109.2	A562	D560-A562 PolarHBondContact O-N 3.23Å
561	E	30.9	Very low	31.9	Very low	184 Å²	184	138.3 Å²	138.3	86%	0.86	80%	0.795	S	S	*	*			trans	-77.1	65	-179.9	-125	-174.8	178.1	0	0	110.9	I559	I559-E561 VanDerWaalsContact C-N 3.26Å; I559-E561 HydrophobicContact CG2-CB 4Å; I559-E561 HydrophobicContact CG2-CG 3.92Å; I559-E561 PolarHBondContact O-N 3.35Å
562	A	28.3	Very low	32.3	Very low	87 Å²	87	139.4 Å²	139.4	72%	0.719	80%	0.8	S	S	*	*			trans	-91.7	112.9	174.1	0	0	0	0	0	111.2	D560	D560-A562 PolarHBondContact O-N 3.23Å
563	A	30	Very low	32.6	Very low	100 Å²	100	140.7 Å²	140.7	83%	0.826	80%	0.797	S	S	*	*	S	Bend	trans	98	120	164.2	0	0	0	0	0	118.2
564	S	30.5	Very low	33.4	Very low	112 Å²	112	141.6 Å²	141.6	78%	0.783	80%	0.798	S	S	*	*			trans	99.9	78.4	153.7	-170.7	0	0	0	0	117.9
565	T	30.3	Very low	34.5	Very low	151 Å²	151	138 Å²	138	93%	0.926	80%	0.796	S	S	*	*			trans	-126.8	91.5	158.6	7.3	0	0	0	0	109.5
566	Q	39.1	Very low	36.1	Very low	181 Å²	181	139.7 Å²	139.7	85%	0.846	79%	0.79	S	S	*	*			trans	-99.5	133.9	163.7	-73.3	-141.2	-19.9	0	0	109.4	E568	Q566-E568 PolarHBondContact O-N 3.07Å
567	P	35.2	Very low	38	Very low	124 Å²	124	141.8 Å²	141.8	81%	0.805	79%	0.79	S	S	*	*			trans	-79.1	103.9	168.6	31.2	-27.5	0	0	0	109.5
568	E	34.2	Very low	40.2	Very low	178 Å²	178	135.9 Å²	135.9	83%	0.832	76%	0.764	S	S	*	*			trans	10.4	110.8	131.4	-156	170.8	-163.3	0	0	116.4	Q566	Q566-E568 PolarHBondContact O-N 3.07Å
569	L	33.3	Very low	42.6	Very low	166 Å²	166	136.2 Å²	136.2	87%	0.869	76%	0.756	S	S	*	*				168.5	133.1	129.5	-83.6	156.4	0	0	0	110.6
570	A	37.5	Very low	45.1	Very low	80 Å²	80	133.3 Å²	133.3	66%	0.661	74%	0.741	S	S	*	*	S	Bend	trans	79.6	56.7	164.4	0	0	0	0	0	119.7
571	T	37.8	Very low	47.8	Very low	102 Å²	102	130.1 Å²	130.1	63%	0.626	73%	0.729	S	S	*	*			trans	-131.8	132	132.4	57.9	0	0	0	0	107.2	S573	T571-S573 PolarHBondContact O-N 2.72Å
572	L	38.3	Very low	50.3	Low	183 Å²	183	124.8 Å²	124.8	96%	0.958	70%	0.701	S	S	*	*			trans	-59.2	94.8	169.3	-92.8	144.8	0	0	0	107.4	K574	L572-K574 PolarHBondContact O-N 3.13Å
573	S	41.9	Very low	53.1	Low	106 Å²	106	120.7 Å²	120.7	74%	0.741	67%	0.667	S	S	*	*			trans	-55	108.9	178.9	179.4	0	0	0	0	108	T571 A575	T571-S573 PolarHBondContact O-N 2.72Å; S573-A575 PolarHBondContact O-N 2.92Å; S573-A575 VanDerWaalsContact O-N 3.15Å
574	K	47.2	Very low	55.8	Low	197 Å²	197	117.5 Å²	117.5	86%	0.857	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-57.4	123.5	169.2	-84.8	176.5	177.4	165.9	0	106.7	L572 K576	L572-K574 PolarHBondContact O-N 3.13Å; K574-K576 PolarHBondContact O-N 3.34Å; K574-K576 VanDerWaalsContact O-N 3.08Å
575	A	54.3	Low	58.4	Low	86 Å²	86	119.1 Å²	119.1	71%	0.711	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-48.7	119.6	178.3	0	0	0	0	0	110.5	S573 R577	S573-A575 PolarHBondContact O-N 2.92Å; S573-A575 VanDerWaalsContact O-N 3.15Å; A575-R577 PolarHBondContact O-N 3.4Å
576	K	64	Low	61	Low	143 Å²	143	113.1 Å²	113.1	62%	0.622	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-63.2	117.4	178.4	-169.2	171.4	-179.6	-176.5	0	108.8	K574 K634 D635	K574-K576 PolarHBondContact O-N 3.34Å; K574-K576 VanDerWaalsContact O-N 3.08Å; K576-K634 PolarHBondContact NZ-O 2.87Å; K576-D635 VanDerWaalsContact CE-CG 3.41Å; K576-D635 WeakPolarHBondContact CE-OD1 3.24Å; K576-D635 IonicContact NZ-OD1 3.74Å; K576-D635 PolarHBondContact NZ-OD1 3.48Å
577	R	68.6	Low	63.1	Low	230 Å²	230	104.5 Å²	104.5	87%	0.868	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-92.5	119.4	-177	-67.5	-171.2	175.9	-165.5	-2	110.3	A575	A575-R577 PolarHBondContact O-N 3.4Å
578	I	74.5	Confident	65.5	Low	74 Å²	74	103.5 Å²	103.5	38%	0.379	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-86.1	130.1	173.2	-57	169	0	0	0	108.4	I580 M583	I578-I580 VanDerWaalsContact C-N 3.31Å; I578-I580 PolarHBondContact O-N 3.31Å; I578-M583 HydrophobicContact CG2-SD 3.78Å
579	D	79.9	Confident	67.7	Low	74 Å²	74	100.1 Å²	100.1	40%	0.396	52%	0.517	S	S	.	.			trans	-79	76.2	178.2	-170.5	-3.8	0	0	0	111.3	P581 R582 M583	D579-P581 WeakPolarHBondContact OD1-CD 3.49Å; D579-R582 HydrophobicContact CB-CB 4.22Å; D579-R582 PolarHBondContact O-N 2.84Å; D579-R582 WeakPolarHBondContact OD1-CB 3.3Å; D579-R582 PolarHBondContact OD1-N 3.5Å; D579-R582 WeakPolarHBondContact OD2-CB 3.02Å; D579-R582 WeakPolarHBondContact OD2-CD 3.25Å; D579-M583 PolarHBondContact O-N 3.48Å
580	I	84.3	Confident	69.9	Low	76 Å²	76	93.3 Å²	93.3	39%	0.39	48%	0.481	S	S	.	.	H	α-helix	trans	-55.9	-45.4	178.2	-60.4	175.4	0	0	0	112.2	I578 R582 M583 K584	I578-I580 VanDerWaalsContact C-N 3.31Å; I578-I580 PolarHBondContact O-N 3.31Å; I580-R582 VanDerWaalsContact C-N 3.3Å; I580-R582 PolarHBondContact O-N 3.36Å; I580-M583 PolarHBondContact O-N 3.11Å; I580-K584 HydrophobicContact CG2-CD 3.74Å; I580-K584 HydrophobicContact CG2-CG 4.21Å; I580-K584 WeakPolarHBondContact O-CG 3.34Å; I580-K584 PolarHBondContact O-N 3.38Å
581	P	84.3	Confident	71.8	Confident	98 Å²	98	89.6 Å²	89.6	64%	0.636	45%	0.45	S	S	*	.	H	α-helix	trans	-56.9	-41.8	179.1	-25.7	33.9	0	0	0	113.2	D579 K584 K585	D579-P581 WeakPolarHBondContact OD1-CD 3.49Å; P581-K584 PolarHBondContact O-N 3.49Å; P581-K585 PolarHBondContact O-N 3.39Å
582	R	83.3	Confident	73.3	Confident	73 Å²	73	87.1 Å²	87.1	28%	0.275	43%	0.434	S	S	.	.	H	α-helix	trans	-70.2	-39.9	179.8	-172	159.7	175.3	-100.2	-11	112.5	D579 I580 K585 I586	D579-R582 HydrophobicContact CB-CB 4.22Å; D579-R582 PolarHBondContact O-N 2.84Å; D579-R582 WeakPolarHBondContact OD1-CB 3.3Å; D579-R582 PolarHBondContact OD1-N 3.5Å; D579-R582 WeakPolarHBondContact OD2-CB 3.02Å; D579-R582 WeakPolarHBondContact OD2-CD 3.25Å; I580-R582 VanDerWaalsContact C-N 3.3Å; I580-R582 PolarHBondContact O-N 3.36Å; R582-K585 PolarHBondContact O-N 3.07Å; R582-I586 HydrophobicContact CG-CD1 4.32Å; R582-I586 WeakPolarHBondContact O-CG1 3.38Å; R582-I586 PolarHBondContact O-N 3.36Å; R582-I586 VanDerWaalsContact O-N 3.12Å
583	M	86.3	Confident	74.5	Confident	0 Å²	0	83 Å²	83	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-60	-47.4	172.9	-73.2	177.5	64.8	0	0	111.7	I578 D579 I580 K585 I586 I587 L626 L632 I636 A641 C644	I578-M583 HydrophobicContact CG2-SD 3.78Å; D579-M583 PolarHBondContact O-N 3.48Å; I580-M583 PolarHBondContact O-N 3.11Å; M583-K585 VanDerWaalsContact C-N 3.32Å; M583-K585 PolarHBondContact O-N 2.9Å; M583-I586 PolarHBondContact O-N 2.77Å; M583-I587 WeakPolarHBondContact O-CG1 3.32Å; M583-I587 PolarHBondContact O-N 2.91Å; M583-L626 HydrophobicContact CB-CD2 4.41Å; M583-L626 HydrophobicContact CG-CD2 4.31Å; M583-L632 HydrophobicContact CG-CD1 4.26Å; M583-L632 HydrophobicContact CG-CD2 4.17Å; M583-I636 HydrophobicContact CE-CD1 3.99Å; M583-I636 HydrophobicContact CE-CG1 4.04Å; M583-I636 HydrophobicContact CG-CD1 4.18Å; M583-I636 HydrophobicContact SD-CD1 4.11Å; M583-I636 HydrophobicContact SD-CG1 4.01Å; M583-A641 HydrophobicContact CE-CB 4.37Å; M583-C644 HydrophobicContact CE-CB 4.22Å; M583-C644 VanDerWaalsContact CE-SG 3.56Å
584	K	87.4	Confident	74.6	Confident	33 Å²	33	88.9 Å²	88.9	14%	0.143	42%	0.415	C	S	.	.	H	α-helix	trans	-61.7	-38.5	178.4	-69.7	176.4	78.3	178.2	0	111.9	I580 P581 I587 R588 C644 H647 M648 E651	I580-K584 HydrophobicContact CG2-CD 3.74Å; I580-K584 HydrophobicContact CG2-CG 4.21Å; I580-K584 WeakPolarHBondContact O-CG 3.34Å; I580-K584 PolarHBondContact O-N 3.38Å; P581-K584 PolarHBondContact O-N 3.49Å; K584-I587 PolarHBondContact O-N 2.92Å; K584-R588 VanDerWaalsContact O-CB 3.26Å; K584-R588 WeakPolarHBondContact O-CB 3.22Å; K584-R588 PolarHBondContact O-N 3.45Å; K584-C644 HydrophobicContact CG-CB 4.36Å; K584-H647 HydrophobicContact CD-CB 4.42Å; K584-M648 HydrophobicContact CB-CE 4.42Å; K584-M648 HydrophobicContact CB-SD 4.1Å; K584-E651 WeakPolarHBondContact CE-OE2 3.35Å; K584-E651 IonicContact NZ-OE1 3.81Å; K584-E651 PolarHBondContact NZ-OE1 2.99Å; K584-E651 IonicContact NZ-OE2 2.71Å; K584-E651 PolarHBondContact NZ-OE2 3.43Å; K584-E651 VanDerWaalsContact NZ-OE2 3.1Å
585	K	85.1	Confident	73.9	Confident	147 Å²	147	85.8 Å²	85.8	64%	0.639	41%	0.408	S	S	*	.	H	α-helix	trans	-62	-44.2	175.2	-169.6	174.2	-176.6	175.8	0	112.2	P581 R582 M583 R588 L589	P581-K585 PolarHBondContact O-N 3.39Å; R582-K585 PolarHBondContact O-N 3.07Å; M583-K585 VanDerWaalsContact C-N 3.32Å; M583-K585 PolarHBondContact O-N 2.9Å; K585-R588 PolarHBondContact O-N 3.06Å; K585-L589 HydrophobicContact CG-CD1 4.29Å; K585-L589 WeakPolarHBondContact O-CB 3.39Å; K585-L589 VanDerWaalsContact O-CG 3.28Å; K585-L589 WeakPolarHBondContact O-CG 3.37Å; K585-L589 PolarHBondContact O-N 3.31Å
586	I	83.9	Confident	72.8	Confident	24 Å²	24	84.8 Å²	84.8	12%	0.123	41%	0.406	C	S	.	.	H	α-helix	trans	-65.1	-46.2	177.6	-65.3	161.4	0	0	0	110.8	R582 M583 R588 L589 L590 L626 Q629 L632	R582-I586 HydrophobicContact CG-CD1 4.32Å; R582-I586 WeakPolarHBondContact O-CG1 3.38Å; R582-I586 PolarHBondContact O-N 3.36Å; R582-I586 VanDerWaalsContact O-N 3.12Å; M583-I586 PolarHBondContact O-N 2.77Å; I586-R588 PolarHBondContact O-N 3.41Å; I586-L589 PolarHBondContact O-N 2.95Å; I586-L590 HydrophobicContact CG2-CD1 4.08Å; I586-L590 WeakPolarHBondContact O-CG 3.33Å; I586-L590 PolarHBondContact O-N 3.47Å; I586-L626 HydrophobicContact CB-CD2 4.31Å; I586-L626 HydrophobicContact CG2-CD2 4.09Å; I586-Q629 HydrophobicContact CD1-CG 4.12Å; I586-L632 HydrophobicContact CD1-CD1 3.75Å
587	I	84.9	Confident	71.3	Confident	0 Å²	0	86.2 Å²	86.2	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-61	-45.6	177.9	-66.3	164.2	0	0	0	110.5	M583 K584 L589 L590 L591 I622 L626 C644 V645 M648	M583-I587 WeakPolarHBondContact O-CG1 3.32Å; M583-I587 PolarHBondContact O-N 2.91Å; K584-I587 PolarHBondContact O-N 2.92Å; I587-L589 PolarHBondContact O-N 3.38Å; I587-L590 PolarHBondContact O-N 2.87Å; I587-L590 VanDerWaalsContact O-N 3.16Å; I587-L591 HydrophobicContact CG2-CD1 3.87Å; I587-L591 HydrophobicContact CG2-CG 4.47Å; I587-L591 WeakPolarHBondContact O-CG 3.15Å; I587-L591 PolarHBondContact O-N 3.48Å; I587-L591 VanDerWaalsContact O-N 3.11Å; I587-I622 HydrophobicContact CG1-CG2 4.02Å; I587-L626 HydrophobicContact CD1-CD1 4.03Å; I587-L626 HydrophobicContact CG1-CD1 3.88Å; I587-L626 HydrophobicContact CG1-CD2 4.36Å; I587-L626 HydrophobicContact CG1-CG 4.47Å; I587-C644 HydrophobicContact CD1-CB 3.52Å; I587-V645 HydrophobicContact CD1-CG2 4.15Å; I587-V645 HydrophobicContact CG2-CG2 4.41Å; I587-M648 HydrophobicContact CB-CG 4.44Å; I587-M648 HydrophobicContact CG2-CB 4.48Å; I587-M648 HydrophobicContact CG2-CG 3.97Å
588	R	83.8	Confident	69.6	Low	104 Å²	104	83.3 Å²	83.3	39%	0.392	42%	0.416	S	S	.	.	H	α-helix	trans	-57.2	-50.7	176.6	-171.6	-179.7	-72.9	-127.9	-2.4	110.9	K584 K585 I586 L590 L591 T592 M648 E651 N652	K584-R588 VanDerWaalsContact O-CB 3.26Å; K584-R588 WeakPolarHBondContact O-CB 3.22Å; K584-R588 PolarHBondContact O-N 3.45Å; K585-R588 PolarHBondContact O-N 3.06Å; I586-R588 PolarHBondContact O-N 3.41Å; R588-L590 VanDerWaalsContact C-N 3.26Å; R588-L590 PolarHBondContact O-N 3.49Å; R588-L591 PolarHBondContact O-N 3.2Å; R588-L591 VanDerWaalsContact O-N 3.08Å; R588-T592 HydrophobicContact CG-CG2 4.44Å; R588-T592 PolarHBondContact O-N 3.29Å; R588-T592 PolarHBondContact O-OG1 2.97Å; R588-M648 HydrophobicContact CB-SD 4.09Å; R588-E651 IonicContact NH2-OE2 2.66Å; R588-N652 PolarHBondContact NH2-OD1 3.06Å
589	L	82.1	Confident	67.4	Low	107 Å²	107	87.3 Å²	87.3	56%	0.56	44%	0.438	S	S	*	.	H	α-helix	trans	-58.1	-34.6	177	-74.6	167.3	0	0	0	113.4	K585 I586 I587	K585-L589 HydrophobicContact CG-CD1 4.29Å; K585-L589 WeakPolarHBondContact O-CB 3.39Å; K585-L589 VanDerWaalsContact O-CG 3.28Å; K585-L589 WeakPolarHBondContact O-CG 3.37Å; K585-L589 PolarHBondContact O-N 3.31Å; I586-L589 PolarHBondContact O-N 2.95Å; I587-L589 PolarHBondContact O-N 3.38Å
590	L	78.2	Confident	65.1	Low	23 Å²	23	87.1 Å²	87.1	12%	0.12	45%	0.454	C	S	.	.	H	α-helix	trans	-71.8	-30.6	177.6	-73.8	169.6	0	0	0	113.3	I586 I587 R588 R617 I622 V625	I586-L590 HydrophobicContact CG2-CD1 4.08Å; I586-L590 WeakPolarHBondContact O-CG 3.33Å; I586-L590 PolarHBondContact O-N 3.47Å; I587-L590 PolarHBondContact O-N 2.87Å; I587-L590 VanDerWaalsContact O-N 3.16Å; R588-L590 VanDerWaalsContact C-N 3.26Å; R588-L590 PolarHBondContact O-N 3.49Å; L590-R617 WeakPolarHBondContact O-CD 3.43Å; L590-R617 PolarHBondContact O-NE 2.87Å; L590-I622 HydrophobicContact CD1-CG2 4.45Å; L590-V625 HydrophobicContact CD1-CB 3.94Å; L590-V625 HydrophobicContact CD1-CG1 3.81Å; L590-V625 HydrophobicContact CD2-CG1 4.07Å; L590-V625 HydrophobicContact CD2-CG2 4.4Å; L590-V625 HydrophobicContact CG-CG1 4.46Å
591	L	76.7	Confident	62.7	Low	1 Å²	1	92.8 Å²	92.8	1%	0.005	48%	0.478	C	S	.	.	H	α-helix	trans	-87	-28.1	179.8	-64.8	173.7	0	0	0	112.5	I587 R588 F614 Q615 R617 I622 F654 V666	I587-L591 HydrophobicContact CG2-CD1 3.87Å; I587-L591 HydrophobicContact CG2-CG 4.47Å; I587-L591 WeakPolarHBondContact O-CG 3.15Å; I587-L591 PolarHBondContact O-N 3.48Å; I587-L591 VanDerWaalsContact O-N 3.11Å; R588-L591 PolarHBondContact O-N 3.2Å; R588-L591 VanDerWaalsContact O-N 3.08Å; L591-F614 HydrophobicContact CB-CD2 4.47Å; L591-F614 HydrophobicContact CB-CE2 3.88Å; L591-F614 HydrophobicContact CB-CZ 4.34Å; L591-F614 HydrophobicContact CD1-CE2 4.39Å; L591-F614 HydrophobicContact CD2-CE2 4.24Å; L591-F614 HydrophobicContact CD2-CZ 3.85Å; L591-F614 HydrophobicContact CG-CE2 4.38Å; L591-F614 HydrophobicContact CG-CZ 4.47Å; L591-Q615 PolarHBondContact O-N 2.98Å; L591-R617 HydrophobicContact CD2-CB 4.44Å; L591-I622 HydrophobicContact CD2-CD1 4.23Å; L591-F654 HydrophobicContact CD1-CD2 3.84Å; L591-F654 HydrophobicContact CD1-CE2 3.62Å; L591-F654 HydrophobicContact CD1-CZ 4.43Å; L591-V666 HydrophobicContact CD1-CG1 4.19Å; L591-V666 HydrophobicContact CD2-CB 4.22Å; L591-V666 HydrophobicContact CD2-CG1 4.3Å
592	T	71.3	Confident	60.2	Low	50 Å²	50	97 Å²	97	31%	0.307	49%	0.49	S	S	.	.	S	Bend	trans	-110.9	37.3	-175	64.5	0	0	0	0	113.8	R588 R594	R588-T592 HydrophobicContact CG-CG2 4.44Å; R588-T592 PolarHBondContact O-N 3.29Å; R588-T592 PolarHBondContact O-OG1 2.97Å; T592-R594 PolarHBondContact O-N 3.34Å; T592-R594 VanDerWaalsContact O-N 3.08Å
593	K	62.6	Low	57.7	Low	98 Å²	98	101.9 Å²	101.9	43%	0.426	52%	0.516	S	S	.	.			trans	-58.3	118.3	-172.1	-135.6	-170.7	-176.2	-161.8	0	111.4	N595	K593-N595 PolarHBondContact O-N 2.94Å
594	R	43.6	Very low	54.9	Low	229 Å²	229	108.5 Å²	108.5	86%	0.864	55%	0.551	S	S	*	*			trans	-62	114.6	170.6	-176.7	176	168	113.4	-3	108.7	T592	T592-R594 PolarHBondContact O-N 3.34Å; T592-R594 VanDerWaalsContact O-N 3.08Å
595	N	32.3	Very low	52.4	Low	131 Å²	131	114.2 Å²	114.2	70%	0.701	58%	0.578	S	S	*	*			trans	-62.3	141.5	163.1	-75	-14.7	0	0	0	108.2	K593	K593-N595 PolarHBondContact O-N 2.94Å
596	G	31.3	Very low	49.8	Very low	66 Å²	66	116.8 Å²	116.8	68%	0.68	59%	0.593	S	S	*	*			trans	124.5	78.5	169.1	0	0	0	0	0	113.4
597	L	33.3	Very low	47.2	Very low	172 Å²	172	123.9 Å²	123.9	90%	0.901	63%	0.625	S	S	*	*			trans	-129	49.3	159	-122.3	170.2	0	0	0	108.1
598	E	31.7	Very low	44.7	Very low	169 Å²	169	132 Å²	132	79%	0.79	66%	0.663	S	S	*	*	S	Bend	trans	-144.2	129.9	158.2	-67.3	-170.3	175.6	0	0	106.5
599	N	29.8	Very low	42.2	Very low	158 Å²	158	135.4 Å²	135.4	85%	0.845	68%	0.683	S	S	*	*			trans	83.8	103.8	174.2	-45.9	-32.4	0	0	0	115.2
600	G	31	Very low	39.9	Very low	71 Å²	71	141.4 Å²	141.4	73%	0.732	70%	0.699	S	S	*	*			trans	-71.8	143.2	164.3	0	0	0	0	0	110.3
601	E	33.2	Very low	38	Very low	194 Å²	194	149.6 Å²	149.6	91%	0.907	74%	0.736	S	S	*	*			trans	-167.9	123.5	138.4	-101.2	161	-160.8	0	0	105
602	E	33.2	Very low	36.6	Very low	188 Å²	188	155 Å²	155	88%	0.879	77%	0.77	S	S	*	*			trans	-64.6	131.1	166.4	-65.3	177.6	159.5	0	0	106.9
603	E	29.5	Very low	35.5	Very low	174 Å²	174	155.7 Å²	155.7	81%	0.813	78%	0.776	S	S	*	*			trans	173.6	133.5	135.6	-94.3	165.1	-157.6	0	0	109.1
604	N	28.2	Very low	35.5	Very low	140 Å²	140	152.5 Å²	152.5	75%	0.749	76%	0.762	S	S	*	*			trans	42.5	125.6	155.4	-61.2	-35.6	0	0	0	119.2
605	E	34.3	Very low	36.5	Very low	153 Å²	153	146 Å²	146	72%	0.715	74%	0.741	S	S	*	*				-178	101.7	128.5	-98.4	157.9	-156.6	0	0	111.7	Q607	E605-Q607 PolarHBondContact O-N 3Å
606	E	31.7	Very low	38.5	Very low	200 Å²	200	143.5 Å²	143.5	94%	0.935	73%	0.732	S	S	*	*	S	Bend	trans	-69	64.9	151	-66.8	-178.9	149.6	0	0	108.9
607	Q	28.9	Very low	40.7	Very low	174 Å²	174	143.2 Å²	143.2	81%	0.813	71%	0.71	S	S	*	*			trans	-169.7	40.6	177	-115.6	161.4	47.1	0	0	116.2	E605	E605-Q607 PolarHBondContact O-N 3Å
608	E	31.5	Very low	43.1	Very low	169 Å²	169	137.3 Å²	137.3	79%	0.79	68%	0.68	S	S	*	*			trans	-126.4	67.6	170.6	-75	-169.2	150.3	0	0	112.3
609	E	32.2	Very low	45.8	Very low	176 Å²	176	130.1 Å²	130.1	82%	0.822	65%	0.646	S	S	*	*			trans	-86.3	116.8	152.7	-71.5	-174.7	168.6	0	0	107.6
610	R	34.5	Very low	48.5	Very low	234 Å²	234	125.3 Å²	125.3	88%	0.883	62%	0.623	S	S	*	*	S	Bend	trans	124.5	124.5	163.2	-65.6	155.3	-165.6	-150	3.8	111.4
611	E	38	Very low	51	Low	195 Å²	195	127.9 Å²	127.9	91%	0.911	61%	0.614	S	S	*	*			trans	96.6	50.8	173.9	-54.4	-173.3	-174.8	0	0	117.9	C613	E611-C613 PolarHBondContact O-N 3.14Å
612	T	45.6	Very low	53.5	Low	115 Å²	115	118.7 Å²	118.7	71%	0.706	57%	0.571	S	S	*	*			trans	-73.4	103.9	156.7	55.3	0	0	0	0	110	F614	T612-F614 PolarHBondContact O-N 2.99Å; T612-F614 VanDerWaalsContact O-N 3.14Å
613	C	49.6	Very low	56.1	Low	64 Å²	64	112.9 Å²	112.9	43%	0.432	54%	0.541	S	S	.	.			trans	-56.6	113.7	174.1	173	0	0	0	0	111.1	E611	E611-C613 PolarHBondContact O-N 3.14Å
614	F	62.2	Low	58.8	Low	31 Å²	31	113.2 Å²	113.2	14%	0.136	54%	0.535	C	S	.	.			trans	-83.2	126.4	177.1	-176.4	-80.4	0	0	0	110	L591 T612 P616 F654 V666 S667 N668	L591-F614 HydrophobicContact CB-CD2 4.47Å; L591-F614 HydrophobicContact CB-CE2 3.88Å; L591-F614 HydrophobicContact CB-CZ 4.34Å; L591-F614 HydrophobicContact CD1-CE2 4.39Å; L591-F614 HydrophobicContact CD2-CE2 4.24Å; L591-F614 HydrophobicContact CD2-CZ 3.85Å; L591-F614 HydrophobicContact CG-CE2 4.38Å; L591-F614 HydrophobicContact CG-CZ 4.47Å; T612-F614 PolarHBondContact O-N 2.99Å; T612-F614 VanDerWaalsContact O-N 3.14Å; F614-P616 WeakPolarHBondContact O-CD 3.35Å; F614-F654 AromaticContact CD2-CD1 3.85Å; F614-F654 HydrophobicContact CD2-CD1 3.85Å; F614-F654 AromaticContact CD2-CE1 3.48Å; F614-F654 HydrophobicContact CD2-CE1 3.48Å; F614-F654 VanDerWaalsContact CD2-CE1 3.48Å; F614-F654 HydrophobicContact CD2-CZ 4.08Å; F614-F654 AromaticContact CE2-CD1 3.27Å; F614-F654 HydrophobicContact CE2-CD1 3.27Å; F614-F654 HydrophobicContact CE2-CD2 4.17Å; F614-F654 AromaticContact CE2-CE1 3.22Å; F614-F654 HydrophobicContact CE2-CE1 3.22Å; F614-F654 HydrophobicContact CE2-CE2 4.1Å; F614-F654 AromaticContact CE2-CG 3.78Å; F614-F654 HydrophobicContact CE2-CG 3.78Å; F614-F654 AromaticContact CE2-CZ 3.65Å; F614-F654 HydrophobicContact CE2-CZ 3.65Å; F614-F654 HydrophobicContact CZ-CD1 4.06Å; F614-F654 HydrophobicContact CZ-CE1 4.38Å; F614-F654 HydrophobicContact CZ-CG 4.27Å; F614-V666 VanDerWaalsContact CE1-O 3.29Å; F614-V666 WeakPolarHBondContact CE1-O 3.3Å; F614-V666 HydrophobicContact CZ-CG1 4.14Å; F614-S667 VanDerWaalsContact CZ-C 3.48Å; F614-N668 HydrophobicContact CB-CB 3.85Å; F614-N668 HydrophobicContact CD1-CB 3.82Å; F614-N668 VanDerWaalsContact CD1-N 3.27Å; F614-N668 HydrophobicContact CD2-CB 4.07Å; F614-N668 HydrophobicContact CE1-CB 4.44Å; F614-N668 HydrophobicContact CG-CB 3.63Å
615	Q	65.3	Low	61.4	Low	92 Å²	92	109 Å²	109	43%	0.43	51%	0.514	S	S	.	.			trans	-101.3	110.8	177.8	-75.7	-82.7	-17.5	0	0	110.1	L591 R617	L591-Q615 PolarHBondContact O-N 2.98Å; Q615-R617 PolarHBondContact O-N 3.27Å
616	P	72.6	Confident	63.8	Low	78 Å²	78	101.8 Å²	101.8	51%	0.506	48%	0.48	S	S	.	.			trans	-62.1	122.3	176.2	23.1	-29.4	0	0	0	110.6	F614 T665 V666	F614-P616 WeakPolarHBondContact O-CD 3.35Å; P616-T665 HydrophobicContact CB-CG2 4.02Å; P616-V666 WeakPolarHBondContact CA-O 3.33Å
617	R	78.3	Confident	66.2	Low	60 Å²	60	93.9 Å²	93.9	23%	0.226	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	138.6	180	-74	-172.5	-177.4	-113.9	-5.9	110.7	L590 L591 Q615 I622 V666	L590-R617 WeakPolarHBondContact O-CD 3.43Å; L590-R617 PolarHBondContact O-NE 2.87Å; L591-R617 HydrophobicContact CD2-CB 4.44Å; Q615-R617 PolarHBondContact O-N 3.27Å; R617-I622 HydrophobicContact CB-CD1 4.17Å; R617-I622 HydrophobicContact CB-CG1 4.08Å; R617-V666 PolarHBondContact N-O 2.97Å; R617-V666 PolarHBondContact O-N 2.94Å
618	N	84.1	Confident	68.7	Low	48 Å²	48	88.4 Å²	88.4	26%	0.257	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	143.5	169.3	-60.6	9.7	0	0	0	110	T620 K621 I622	N618-T620 VanDerWaalsContact C-N 3.25Å; N618-T620 PolarHBondContact O-N 2.87Å; N618-K621 WeakPolarHBondContact O-CB 3.35Å; N618-K621 PolarHBondContact O-N 3.35Å; N618-I622 PolarHBondContact O-N 2.96Å
619	F	87.5	Confident	71	Confident	18 Å²	18	83.1 Å²	83.1	8%	0.079	41%	0.409	C	S	.	.	H	α-helix	trans	-60.1	-36.3	178.7	175.3	-104.1	0	0	0	112	K621 I622 Y623 V638 A641 F642 V645 D663 F664	F619-K621 VanDerWaalsContact C-N 3.27Å; F619-K621 PolarHBondContact O-N 2.74Å; F619-I622 WeakPolarHBondContact O-CB 3.41Å; F619-I622 PolarHBondContact O-N 2.65Å; F619-Y623 WeakPolarHBondContact O-CB 3.45Å; F619-Y623 PolarHBondContact O-N 3.26Å; F619-V638 HydrophobicContact CE1-CG1 4.01Å; F619-V638 HydrophobicContact CZ-CG1 4.32Å; F619-A641 HydrophobicContact CE2-CB 4.19Å; F619-A641 HydrophobicContact CZ-CB 4.07Å; F619-F642 HydrophobicContact CE2-CB 4.43Å; F619-F642 HydrophobicContact CZ-CB 4.17Å; F619-V645 HydrophobicContact CD2-CG2 4.06Å; F619-V645 HydrophobicContact CE2-CG2 4.04Å; F619-D663 VanDerWaalsContact CB-OD1 3.32Å; F619-D663 WeakPolarHBondContact CB-OD1 3.28Å; F619-D663 PolarHBondContact N-OD1 3.14Å; F619-F664 HydrophobicContact CB-CD1 4.14Å; F619-F664 HydrophobicContact CB-CD2 4.01Å; F619-F664 HydrophobicContact CB-CE1 3.76Å; F619-F664 HydrophobicContact CB-CE2 3.63Å; F619-F664 HydrophobicContact CB-CG 4.25Å; F619-F664 HydrophobicContact CB-CZ 3.49Å; F619-F664 VanDerWaalsContact CB-CZ 3.49Å; F619-F664 AromaticContact CD1-CE1 3.84Å; F619-F664 HydrophobicContact CD1-CE1 3.84Å; F619-F664 AromaticContact CD1-CZ 3.99Å; F619-F664 HydrophobicContact CD1-CZ 3.99Å; F619-F664 AromaticContact CD2-CE1 3.97Å; F619-F664 HydrophobicContact CD2-CE1 3.97Å; F619-F664 AromaticContact CD2-CE2 3.84Å; F619-F664 HydrophobicContact CD2-CE2 3.84Å; F619-F664 AromaticContact CD2-CZ 3.24Å; F619-F664 HydrophobicContact CD2-CZ 3.24Å; F619-F664 HydrophobicContact CE1-CE1 4.39Å; F619-F664 HydrophobicContact CE2-CE1 4.5Å; F619-F664 AromaticContact CE2-CZ 3.86Å; F619-F664 HydrophobicContact CE2-CZ 3.86Å; F619-F664 HydrophobicContact CG-CD1 4.41Å; F619-F664 AromaticContact CG-CE1 3.59Å; F619-F664 HydrophobicContact CG-CE1 3.59Å; F619-F664 AromaticContact CG-CE2 3.92Å; F619-F664 HydrophobicContact CG-CE2 3.92Å; F619-F664 AromaticContact CG-CZ 3.29Å; F619-F664 HydrophobicContact CG-CZ 3.29Å; F619-F664 HydrophobicContact CZ-CZ 4.46Å; F619-F664 PolarHBondContact N-O 3.41Å
620	T	86.5	Confident	72.7	Confident	58 Å²	58	79.8 Å²	79.8	36%	0.356	40%	0.403	S	S	.	.	H	α-helix	trans	-54.4	-40.8	172.9	-57.5	0	0	0	0	113	N618 R624 D663	N618-T620 VanDerWaalsContact C-N 3.25Å; N618-T620 PolarHBondContact O-N 2.87Å; T620-R624 WeakPolarHBondContact O-CB 3.43Å; T620-R624 WeakPolarHBondContact O-CG 3.47Å; T620-R624 PolarHBondContact O-N 2.94Å; T620-D663 WeakPolarHBondContact CB-OD2 3.18Å; T620-D663 PolarHBondContact N-OD1 2.97Å; T620-D663 VanDerWaalsContact OG1-CG 3.26Å; T620-D663 PolarHBondContact OG1-OD2 3.12Å
621	K	84.2	Confident	74.4	Confident	125 Å²	125	75.1 Å²	75.1	54%	0.543	39%	0.389	S	S	.	.	H	α-helix	trans	-70.4	-37.5	177.7	-70.6	-177.2	179.3	178.2	0	111.6	N618 F619 V625	N618-K621 WeakPolarHBondContact O-CB 3.35Å; N618-K621 PolarHBondContact O-N 3.35Å; F619-K621 VanDerWaalsContact C-N 3.27Å; F619-K621 PolarHBondContact O-N 2.74Å; K621-V625 WeakPolarHBondContact O-CG2 3.31Å; K621-V625 PolarHBondContact O-N 3.4Å
622	I	85.3	Confident	75.9	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-66.2	-45.8	177	-61.1	170.5	0	0	0	109.9	I587 L590 L591 R617 N618 F619 V625 L626 V666	I587-I622 HydrophobicContact CG1-CG2 4.02Å; L590-I622 HydrophobicContact CD1-CG2 4.45Å; L591-I622 HydrophobicContact CD2-CD1 4.23Å; R617-I622 HydrophobicContact CB-CD1 4.17Å; R617-I622 HydrophobicContact CB-CG1 4.08Å; N618-I622 PolarHBondContact O-N 2.96Å; F619-I622 WeakPolarHBondContact O-CB 3.41Å; F619-I622 PolarHBondContact O-N 2.65Å; I622-V625 PolarHBondContact O-N 3.5Å; I622-L626 HydrophobicContact CG2-CD1 3.85Å; I622-L626 WeakPolarHBondContact O-CB 3.48Å; I622-L626 WeakPolarHBondContact O-CG 3.43Å; I622-L626 PolarHBondContact O-N 2.98Å; I622-V666 HydrophobicContact CD1-CG2 4.05Å
623	Y	88.4	Confident	76.9	Confident	66 Å²	66	67.1 Å²	67.1	26%	0.259	34%	0.342	S	S	.	.	H	α-helix	trans	-62.4	-44.8	178.2	-177.1	-103	0	0	0	112.3	F619 V625 L626 A627 I636 V638 A641	F619-Y623 WeakPolarHBondContact O-CB 3.45Å; F619-Y623 PolarHBondContact O-N 3.26Å; Y623-V625 VanDerWaalsContact C-N 3.31Å; Y623-V625 PolarHBondContact O-N 2.93Å; Y623-L626 PolarHBondContact O-N 3.17Å; Y623-A627 HydrophobicContact CE1-CB 4.46Å; Y623-A627 VanDerWaalsContact O-CB 3.28Å; Y623-A627 WeakPolarHBondContact O-CB 3.35Å; Y623-A627 PolarHBondContact O-N 3.13Å; Y623-I636 HydrophobicContact CD2-CG2 4.44Å; Y623-I636 HydrophobicContact CE2-CG2 3.77Å; Y623-V638 HydrophobicContact CE1-CG2 4.32Å; Y623-V638 HydrophobicContact CE2-CB 4.37Å; Y623-V638 HydrophobicContact CE2-CG2 3.89Å; Y623-A641 HydrophobicContact CD2-CB 3.89Å; Y623-A641 HydrophobicContact CE2-CB 4.4Å
624	R	85.7	Confident	77.8	Confident	182 Å²	182	73.1 Å²	73.1	69%	0.687	36%	0.36	S	S	*	.	H	α-helix	trans	-58.6	-41.4	176.5	-76.9	-178	-176.9	-164.4	1.6	112.5	T620 A628	T620-R624 WeakPolarHBondContact O-CB 3.43Å; T620-R624 WeakPolarHBondContact O-CG 3.47Å; T620-R624 PolarHBondContact O-N 2.94Å; R624-A628 WeakPolarHBondContact O-CB 3.25Å; R624-A628 PolarHBondContact O-N 3.41Å
625	V	83.5	Confident	78.1	Confident	52 Å²	52	74.1 Å²	74.1	32%	0.315	37%	0.367	S	S	.	.	H	α-helix	trans	-69.8	-38.9	177.9	177.5	0	0	0	0	111.7	L590 K621 I622 Y623 A628	L590-V625 HydrophobicContact CD1-CB 3.94Å; L590-V625 HydrophobicContact CD1-CG1 3.81Å; L590-V625 HydrophobicContact CD2-CG1 4.07Å; L590-V625 HydrophobicContact CD2-CG2 4.4Å; L590-V625 HydrophobicContact CG-CG1 4.46Å; K621-V625 WeakPolarHBondContact O-CG2 3.31Å; K621-V625 PolarHBondContact O-N 3.4Å; I622-V625 PolarHBondContact O-N 3.5Å; Y623-V625 VanDerWaalsContact C-N 3.31Å; Y623-V625 PolarHBondContact O-N 2.93Å; V625-A628 PolarHBondContact O-N 2.89Å
626	L	83.5	Confident	78.8	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-64.6	-44.1	174.7	-82	164.2	0	0	0	112	M583 I586 I587 I622 Y623 A628 Q629 I636 A641	M583-L626 HydrophobicContact CB-CD2 4.41Å; M583-L626 HydrophobicContact CG-CD2 4.31Å; I586-L626 HydrophobicContact CB-CD2 4.31Å; I586-L626 HydrophobicContact CG2-CD2 4.09Å; I587-L626 HydrophobicContact CD1-CD1 4.03Å; I587-L626 HydrophobicContact CG1-CD1 3.88Å; I587-L626 HydrophobicContact CG1-CD2 4.36Å; I587-L626 HydrophobicContact CG1-CG 4.47Å; I622-L626 HydrophobicContact CG2-CD1 3.85Å; I622-L626 WeakPolarHBondContact O-CB 3.48Å; I622-L626 WeakPolarHBondContact O-CG 3.43Å; I622-L626 PolarHBondContact O-N 2.98Å; Y623-L626 PolarHBondContact O-N 3.17Å; L626-A628 VanDerWaalsContact C-N 3.28Å; L626-A628 PolarHBondContact O-N 3.37Å; L626-Q629 WeakPolarHBondContact O-CB 3.35Å; L626-Q629 PolarHBondContact O-N 2.98Å; L626-I636 HydrophobicContact CB-CD1 3.85Å; L626-I636 HydrophobicContact CD2-CD1 4.02Å; L626-I636 HydrophobicContact CG-CD1 4.48Å; L626-A641 HydrophobicContact CD1-CB 4.16Å
627	A	83.2	Confident	79.4	Confident	34 Å²	34	70.6 Å²	70.6	28%	0.281	35%	0.35	S	S	.	.	H	α-helix	trans	-68.8	-25.4	177.8	0	0	0	0	0	112.6	Y623 Q629 K633	Y623-A627 HydrophobicContact CE1-CB 4.46Å; Y623-A627 VanDerWaalsContact O-CB 3.28Å; Y623-A627 WeakPolarHBondContact O-CB 3.35Å; Y623-A627 PolarHBondContact O-N 3.13Å; A627-Q629 PolarHBondContact O-N 3.26Å; A627-K633 WeakPolarHBondContact O-CG 3.42Å
628	A	81.2	Confident	79.8	Confident	60 Å²	60	71.2 Å²	71.2	50%	0.496	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-15.1	174.6	0	0	0	0	0	113.5	R624 V625 L626 K633	R624-A628 WeakPolarHBondContact O-CB 3.25Å; R624-A628 PolarHBondContact O-N 3.41Å; V625-A628 PolarHBondContact O-N 2.89Å; L626-A628 VanDerWaalsContact C-N 3.28Å; L626-A628 PolarHBondContact O-N 3.37Å; A628-K633 VanDerWaalsContact O-CE 3.3Å; A628-K633 WeakPolarHBondContact O-CE 3.39Å
629	Q	79.2	Confident	80	Confident	58 Å²	58	76.2 Å²	76.2	27%	0.271	38%	0.382	S	S	.	.			trans	-73.4	119	-175.2	-69	-70.6	-31.7	0	0	112.2	I586 L626 A627 K631 L632 K633	I586-Q629 HydrophobicContact CD1-CG 4.12Å; L626-Q629 WeakPolarHBondContact O-CB 3.35Å; L626-Q629 PolarHBondContact O-N 2.98Å; A627-Q629 PolarHBondContact O-N 3.26Å; Q629-K631 PolarHBondContact O-N 2.69Å; Q629-K631 VanDerWaalsContact O-N 3.08Å; Q629-L632 HydrophobicContact CB-CB 4.08Å; Q629-L632 HydrophobicContact CB-CD1 3.97Å; Q629-L632 HydrophobicContact CB-CG 4.37Å; Q629-L632 HydrophobicContact CG-CD1 4.35Å; Q629-L632 PolarHBondContact O-N 3.21Å; Q629-K633 WeakPolarHBondContact O-CG 3.26Å; Q629-K633 PolarHBondContact O-N 3.05Å
630	P	69.1	Low	80	Confident	106 Å²	106	76.1 Å²	76.1	69%	0.688	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-29.1	-171.4	21.5	-32	0	0	0	113.7
631	K	69.3	Low	80.1	Confident	136 Å²	136	73.3 Å²	73.3	59%	0.591	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-4.8	178.5	-69.2	-174.7	-177	-178.4	0	114.2	Q629	Q629-K631 PolarHBondContact O-N 2.69Å; Q629-K631 VanDerWaalsContact O-N 3.08Å
632	L	69.8	Low	80.4	Confident	5 Å²	5	71.4 Å²	71.4	3%	0.026	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.8	-11.4	-176.9	-66.8	164	0	0	0	112.8	M583 I586 Q629 K634 D635 I636	M583-L632 HydrophobicContact CG-CD1 4.26Å; M583-L632 HydrophobicContact CG-CD2 4.17Å; I586-L632 HydrophobicContact CD1-CD1 3.75Å; Q629-L632 HydrophobicContact CB-CB 4.08Å; Q629-L632 HydrophobicContact CB-CD1 3.97Å; Q629-L632 HydrophobicContact CB-CG 4.37Å; Q629-L632 HydrophobicContact CG-CD1 4.35Å; Q629-L632 PolarHBondContact O-N 3.21Å; L632-K634 VanDerWaalsContact C-N 3.26Å; L632-K634 PolarHBondContact O-N 2.96Å; L632-K634 VanDerWaalsContact O-N 3.14Å; L632-D635 PolarHBondContact O-N 3.49Å; L632-I636 HydrophobicContact CB-CD1 3.59Å; L632-I636 HydrophobicContact CB-CG1 4Å; L632-I636 HydrophobicContact CD1-CD1 4.04Å; L632-I636 HydrophobicContact CD2-CD1 4.38Å; L632-I636 HydrophobicContact CG-CD1 4.2Å; L632-I636 PolarHBondContact O-N 3.11Å
633	K	66.4	Low	80.6	Confident	136 Å²	136	74.7 Å²	74.7	59%	0.591	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-37.7	-177.5	-91.8	179.1	-176.1	-169.8	0	115.2	A627 A628 Q629	A627-K633 WeakPolarHBondContact O-CG 3.42Å; A628-K633 VanDerWaalsContact O-CE 3.3Å; A628-K633 WeakPolarHBondContact O-CE 3.39Å; Q629-K633 WeakPolarHBondContact O-CG 3.26Å; Q629-K633 PolarHBondContact O-N 3.05Å
634	K	68.6	Low	80.6	Confident	190 Å²	190	71.8 Å²	71.8	83%	0.826	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-7	-176.4	-64.7	-174.3	178.6	-176.1	0	113.8	K576 L632	K576-K634 PolarHBondContact NZ-O 2.87Å; L632-K634 VanDerWaalsContact C-N 3.26Å; L632-K634 PolarHBondContact O-N 2.96Å; L632-K634 VanDerWaalsContact O-N 3.14Å
635	D	69.4	Low	80.8	Confident	53 Å²	53	63.1 Å²	63.1	28%	0.283	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.1	-5.8	-165.6	-60.5	-8.6	0	0	0	113.3	K576 L632	K576-D635 VanDerWaalsContact CE-CG 3.41Å; K576-D635 WeakPolarHBondContact CE-OD1 3.24Å; K576-D635 IonicContact NZ-OD1 3.74Å; K576-D635 PolarHBondContact NZ-OD1 3.48Å; L632-D635 PolarHBondContact O-N 3.49Å
636	I	78.3	Confident	81	Confident	19 Å²	19	64.1 Å²	64.1	10%	0.097	34%	0.337	C	S	.	.			trans	-93.7	119.2	177.7	-85.1	-175.9	0	0	0	110.8	M583 Y623 L626 L632	M583-I636 HydrophobicContact CE-CD1 3.99Å; M583-I636 HydrophobicContact CE-CG1 4.04Å; M583-I636 HydrophobicContact CG-CD1 4.18Å; M583-I636 HydrophobicContact SD-CD1 4.11Å; M583-I636 HydrophobicContact SD-CG1 4.01Å; Y623-I636 HydrophobicContact CD2-CG2 4.44Å; Y623-I636 HydrophobicContact CE2-CG2 3.77Å; L626-I636 HydrophobicContact CB-CD1 3.85Å; L626-I636 HydrophobicContact CD2-CD1 4.02Å; L626-I636 HydrophobicContact CG-CD1 4.48Å; L632-I636 HydrophobicContact CB-CD1 3.59Å; L632-I636 HydrophobicContact CB-CG1 4Å; L632-I636 HydrophobicContact CD1-CD1 4.04Å; L632-I636 HydrophobicContact CD2-CD1 4.38Å; L632-I636 HydrophobicContact CG-CD1 4.2Å; L632-I636 PolarHBondContact O-N 3.11Å
637	T	85.2	Confident	81.3	Confident	76 Å²	76	68.1 Å²	68.1	47%	0.466	36%	0.356	S	S	.	.			trans	-105.6	156.6	165.2	62.6	0	0	0	0	109.9	H639 S640 A641	T637-H639 PolarHBondContact O-N 2.82Å; T637-S640 PolarHBondContact N-OG 2.68Å; T637-S640 PolarHBondContact O-N 3.21Å; T637-S640 VanDerWaalsContact O-N 3.09Å; T637-S640 PolarHBondContact O-OG 2.93Å; T637-S640 WeakPolarHBondContact OG1-CB 2.84Å; T637-S640 PolarHBondContact OG1-N 3.14Å; T637-S640 VanDerWaalsContact OG1-N 3.16Å; T637-S640 PolarHBondContact OG1-OG 3.01Å; T637-A641 PolarHBondContact O-N 2.99Å; T637-A641 VanDerWaalsContact O-N 3.11Å
638	V	87.7	Confident	81.4	Confident	73 Å²	73	66.5 Å²	66.5	44%	0.442	34%	0.343	S	S	.	.	H	α-helix	trans	-51.4	-40.9	173.6	-179	0	0	0	0	111.1	F619 Y623 A641 F642	F619-V638 HydrophobicContact CE1-CG1 4.01Å; F619-V638 HydrophobicContact CZ-CG1 4.32Å; Y623-V638 HydrophobicContact CE1-CG2 4.32Å; Y623-V638 HydrophobicContact CE2-CB 4.37Å; Y623-V638 HydrophobicContact CE2-CG2 3.89Å; V638-A641 PolarHBondContact O-N 3.46Å; V638-F642 WeakPolarHBondContact O-CB 3.35Å; V638-F642 PolarHBondContact O-N 2.89Å
639	H	88.5	Confident	81.6	Confident	154 Å²	154	64.5 Å²	64.5	71%	0.713	32%	0.324	S	S	*	.	H	α-helix	trans	-62.2	-48.1	177.6	-71.9	73.6	0	0	0	112.6	T637 A641 F642 V643	T637-H639 PolarHBondContact O-N 2.82Å; H639-A641 VanDerWaalsContact C-N 3.28Å; H639-A641 PolarHBondContact O-N 3.17Å; H639-F642 PolarHBondContact O-N 3.08Å; H639-V643 WeakPolarHBondContact O-CG2 3.44Å; H639-V643 PolarHBondContact O-N 3.13Å
640	S	87.9	Confident	82	Confident	15 Å²	15	68.3 Å²	68.3	11%	0.105	35%	0.347	C	S	.	.	H	α-helix	trans	-62.2	-36.7	178.6	68	0	0	0	0	112.5	T637 C644	T637-S640 PolarHBondContact N-OG 2.68Å; T637-S640 PolarHBondContact O-N 3.21Å; T637-S640 VanDerWaalsContact O-N 3.09Å; T637-S640 PolarHBondContact O-OG 2.93Å; T637-S640 WeakPolarHBondContact OG1-CB 2.84Å; T637-S640 PolarHBondContact OG1-N 3.14Å; T637-S640 VanDerWaalsContact OG1-N 3.16Å; T637-S640 PolarHBondContact OG1-OG 3.01Å; S640-C644 PolarHBondContact O-N 3.25Å; S640-C644 PolarHBondContact O-SG 3.45Å
641	A	88.3	Confident	82.7	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-68.7	-42.4	175.9	0	0	0	0	0	111.4	M583 F619 Y623 L626 T637 V638 H639 C644 V645	M583-A641 HydrophobicContact CE-CB 4.37Å; F619-A641 HydrophobicContact CE2-CB 4.19Å; F619-A641 HydrophobicContact CZ-CB 4.07Å; Y623-A641 HydrophobicContact CD2-CB 3.89Å; Y623-A641 HydrophobicContact CE2-CB 4.4Å; L626-A641 HydrophobicContact CD1-CB 4.16Å; T637-A641 PolarHBondContact O-N 2.99Å; T637-A641 VanDerWaalsContact O-N 3.11Å; V638-A641 PolarHBondContact O-N 3.46Å; H639-A641 VanDerWaalsContact C-N 3.28Å; H639-A641 PolarHBondContact O-N 3.17Å; A641-C644 PolarHBondContact O-N 3.45Å; A641-V645 WeakPolarHBondContact O-CG2 3.23Å; A641-V645 PolarHBondContact O-N 3.44Å
642	F	90.2	Very high	83.2	Confident	84 Å²	84	63.8 Å²	63.8	37%	0.368	32%	0.32	S	S	.	.	H	α-helix	trans	-60.3	-46.3	176.3	-176.9	-114.9	0	0	0	112.1	F619 V638 H639 C644 V645 L646 F664	F619-F642 HydrophobicContact CE2-CB 4.43Å; F619-F642 HydrophobicContact CZ-CB 4.17Å; V638-F642 WeakPolarHBondContact O-CB 3.35Å; V638-F642 PolarHBondContact O-N 2.89Å; H639-F642 PolarHBondContact O-N 3.08Å; F642-C644 VanDerWaalsContact C-N 3.29Å; F642-C644 PolarHBondContact O-N 3.22Å; F642-V645 PolarHBondContact O-N 2.71Å; F642-V645 VanDerWaalsContact O-N 3.12Å; F642-L646 HydrophobicContact CD1-CD1 3.85Å; F642-L646 HydrophobicContact CD1-CG 4.39Å; F642-L646 HydrophobicContact CE1-CD1 3.47Å; F642-L646 VanDerWaalsContact CE1-CD1 3.47Å; F642-L646 HydrophobicContact CE1-CD2 4.49Å; F642-L646 HydrophobicContact CE1-CG 4.06Å; F642-L646 HydrophobicContact CE2-CG 4.41Å; F642-L646 HydrophobicContact CZ-CD1 3.93Å; F642-L646 HydrophobicContact CZ-CD2 4.11Å; F642-L646 HydrophobicContact CZ-CG 4.05Å; F642-L646 PolarHBondContact O-N 3.22Å; F642-F664 AromaticContact CD2-CE1 3.59Å; F642-F664 HydrophobicContact CD2-CE1 3.59Å; F642-F664 AromaticContact CD2-CZ 3.49Å; F642-F664 HydrophobicContact CD2-CZ 3.49Å; F642-F664 VanDerWaalsContact CD2-CZ 3.49Å; F642-F664 HydrophobicContact CE2-CD1 4.42Å; F642-F664 AromaticContact CE2-CE1 3.57Å; F642-F664 HydrophobicContact CE2-CE1 3.57Å; F642-F664 AromaticContact CE2-CZ 3.63Å; F642-F664 HydrophobicContact CE2-CZ 3.63Å
643	V	89.7	Confident	83.6	Confident	70 Å²	70	67.6 Å²	67.6	42%	0.424	35%	0.347	S	S	.	.	H	α-helix	trans	-59.6	-40.2	176	173.2	0	0	0	0	111.6	H639 V645 L646 H647	H639-V643 WeakPolarHBondContact O-CG2 3.44Å; H639-V643 PolarHBondContact O-N 3.13Å; V643-V645 VanDerWaalsContact C-N 3.35Å; V643-V645 PolarHBondContact O-N 3.47Å; V643-L646 PolarHBondContact O-N 3.2Å; V643-H647 PolarHBondContact O-N 2.92Å
644	C	88.4	Confident	84.3	Confident	4 Å²	4	62.1 Å²	62.1	3%	0.027	32%	0.323	C	S	.	.	H	α-helix	trans	-66.4	-36.5	176.7	-68.4	0	0	0	0	112.5	M583 K584 I587 S640 A641 F642 H647 M648	M583-C644 HydrophobicContact CE-CB 4.22Å; M583-C644 VanDerWaalsContact CE-SG 3.56Å; K584-C644 HydrophobicContact CG-CB 4.36Å; I587-C644 HydrophobicContact CD1-CB 3.52Å; S640-C644 PolarHBondContact O-N 3.25Å; S640-C644 PolarHBondContact O-SG 3.45Å; A641-C644 PolarHBondContact O-N 3.45Å; F642-C644 VanDerWaalsContact C-N 3.29Å; F642-C644 PolarHBondContact O-N 3.22Å; C644-H647 PolarHBondContact O-N 2.94Å; C644-M648 VanDerWaalsContact O-CG 3.27Å; C644-M648 WeakPolarHBondContact O-CG 3.29Å; C644-M648 PolarHBondContact O-N 3.42Å
645	V	88.3	Confident	85.1	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.006	31%	0.312	C	S	.	.	H	α-helix	trans	-67.1	-43.6	174.3	173.8	0	0	0	0	110.9	I587 F619 A641 F642 V643 H647 M648 C649 L656 F664 V666	I587-V645 HydrophobicContact CD1-CG2 4.15Å; I587-V645 HydrophobicContact CG2-CG2 4.41Å; F619-V645 HydrophobicContact CD2-CG2 4.06Å; F619-V645 HydrophobicContact CE2-CG2 4.04Å; A641-V645 WeakPolarHBondContact O-CG2 3.23Å; A641-V645 PolarHBondContact O-N 3.44Å; F642-V645 PolarHBondContact O-N 2.71Å; F642-V645 VanDerWaalsContact O-N 3.12Å; V643-V645 VanDerWaalsContact C-N 3.35Å; V643-V645 PolarHBondContact O-N 3.47Å; V645-H647 VanDerWaalsContact C-N 3.31Å; V645-H647 PolarHBondContact O-N 3.28Å; V645-M648 CarbonylContact O-C 3.45Å; V645-M648 WeakPolarHBondContact O-CA 3.47Å; V645-M648 WeakPolarHBondContact O-CB 3.37Å; V645-M648 PolarHBondContact O-N 3.32Å; V645-C649 PolarHBondContact O-N 3.46Å; V645-C649 PolarHBondContact O-SG 3.37Å; V645-C649 VanDerWaalsContact O-SG 3.35Å; V645-L656 HydrophobicContact CG1-CD2 4.1Å; V645-F664 HydrophobicContact CG1-CE2 4.01Å; V645-F664 HydrophobicContact CG1-CZ 4.49Å; V645-V666 HydrophobicContact CG1-CG2 3.75Å
646	L	89.4	Confident	85.9	Confident	73 Å²	73	61 Å²	61	38%	0.382	31%	0.314	S	S	.	.	H	α-helix	trans	-57.5	-44	174.4	-74.2	174.5	0	0	0	112.1	F642 V643 M648 C649 N650 L656	F642-L646 HydrophobicContact CD1-CD1 3.85Å; F642-L646 HydrophobicContact CD1-CG 4.39Å; F642-L646 HydrophobicContact CE1-CD1 3.47Å; F642-L646 VanDerWaalsContact CE1-CD1 3.47Å; F642-L646 HydrophobicContact CE1-CD2 4.49Å; F642-L646 HydrophobicContact CE1-CG 4.06Å; F642-L646 HydrophobicContact CE2-CG 4.41Å; F642-L646 HydrophobicContact CZ-CD1 3.93Å; F642-L646 HydrophobicContact CZ-CD2 4.11Å; F642-L646 HydrophobicContact CZ-CG 4.05Å; F642-L646 PolarHBondContact O-N 3.22Å; V643-L646 PolarHBondContact O-N 3.2Å; L646-M648 VanDerWaalsContact C-N 3.29Å; L646-M648 PolarHBondContact O-N 2.76Å; L646-C649 PolarHBondContact O-N 3.27Å; L646-N650 PolarHBondContact O-N 3.05Å; L646-L656 HydrophobicContact CD2-CD1 3.83Å
647	H	88.4	Confident	86.2	Confident	83 Å²	83	63.3 Å²	63.3	38%	0.384	33%	0.326	S	S	.	.	H	α-helix	trans	-62.8	-34.3	173.6	-80.6	-29.2	0	0	0	113	K584 V643 C644 V645 N650 E651	K584-H647 HydrophobicContact CD-CB 4.42Å; V643-H647 PolarHBondContact O-N 2.92Å; C644-H647 PolarHBondContact O-N 2.94Å; V645-H647 VanDerWaalsContact C-N 3.31Å; V645-H647 PolarHBondContact O-N 3.28Å; H647-N650 PolarHBondContact O-N 3Å; H647-E651 WeakPolarHBondContact O-CB 3.28Å; H647-E651 WeakPolarHBondContact O-CG 3.14Å; H647-E651 PolarHBondContact O-N 3.38Å
648	M	86.9	Confident	86.1	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-72.7	-35.7	176.1	-68.5	-79.2	71.7	0	0	113.4	K584 I587 R588 C644 V645 L646 N650 E651 N652 F654	K584-M648 HydrophobicContact CB-CE 4.42Å; K584-M648 HydrophobicContact CB-SD 4.1Å; I587-M648 HydrophobicContact CB-CG 4.44Å; I587-M648 HydrophobicContact CG2-CB 4.48Å; I587-M648 HydrophobicContact CG2-CG 3.97Å; R588-M648 HydrophobicContact CB-SD 4.09Å; C644-M648 VanDerWaalsContact O-CG 3.27Å; C644-M648 WeakPolarHBondContact O-CG 3.29Å; C644-M648 PolarHBondContact O-N 3.42Å; V645-M648 CarbonylContact O-C 3.45Å; V645-M648 WeakPolarHBondContact O-CA 3.47Å; V645-M648 WeakPolarHBondContact O-CB 3.37Å; V645-M648 PolarHBondContact O-N 3.32Å; L646-M648 VanDerWaalsContact C-N 3.29Å; L646-M648 PolarHBondContact O-N 2.76Å; M648-N650 VanDerWaalsContact C-N 3.31Å; M648-E651 HydrophobicContact CE-CB 4.07Å; M648-E651 WeakPolarHBondContact CE-OE2 3.5Å; M648-E651 PolarHBondContact O-N 3.49Å; M648-N652 PolarHBondContact O-N 2.91Å; M648-N652 PolarHBondContact O-ND2 2.94Å; M648-F654 HydrophobicContact CB-CD2 4.35Å; M648-F654 HydrophobicContact CB-CE2 4.43Å; M648-F654 WeakPolarHBondContact O-CD2 2.99Å
649	C	85.6	Confident	85.2	Confident	17 Å²	17	66.9 Å²	66.9	12%	0.115	34%	0.34	C	S	.	.	H	α-helix	trans	-61.8	-42	171	-67.5	0	0	0	0	111.2	V645 L646 S653 F654	V645-C649 PolarHBondContact O-N 3.46Å; V645-C649 PolarHBondContact O-SG 3.37Å; V645-C649 VanDerWaalsContact O-SG 3.35Å; L646-C649 PolarHBondContact O-N 3.27Å; C649-S653 VanDerWaalsContact O-CA 3.27Å; C649-S653 WeakPolarHBondContact O-CA 3.25Å; C649-S653 PolarHBondContact O-N 3.47Å; C649-F654 HydrophobicContact CB-CB 4.41Å; C649-F654 WeakPolarHBondContact CB-O 3.17Å; C649-F654 PolarHBondContact O-N 3.17Å
650	N	86	Confident	84.1	Confident	139 Å²	139	66.4 Å²	66.4	74%	0.743	34%	0.343	S	S	*	.	H	α-helix	trans	-70.4	-37.7	178.6	-163.8	49.1	0	0	0	113.1	L646 H647 M648	L646-N650 PolarHBondContact O-N 3.05Å; H647-N650 PolarHBondContact O-N 3Å; M648-N650 VanDerWaalsContact C-N 3.31Å
651	E	85.4	Confident	83.3	Confident	102 Å²	102	75.4 Å²	75.4	48%	0.477	38%	0.383	S	S	.	.	H	α-helix	trans	-80.6	-30.8	-177.6	-77.5	176.6	-174.7	0	0	114.4	K584 R588 H647 M648	K584-E651 WeakPolarHBondContact CE-OE2 3.35Å; K584-E651 IonicContact NZ-OE1 3.81Å; K584-E651 PolarHBondContact NZ-OE1 2.99Å; K584-E651 IonicContact NZ-OE2 2.71Å; K584-E651 PolarHBondContact NZ-OE2 3.43Å; K584-E651 VanDerWaalsContact NZ-OE2 3.1Å; R588-E651 IonicContact NH2-OE2 2.66Å; H647-E651 WeakPolarHBondContact O-CB 3.28Å; H647-E651 WeakPolarHBondContact O-CG 3.14Å; H647-E651 PolarHBondContact O-N 3.38Å; M648-E651 HydrophobicContact CE-CB 4.07Å; M648-E651 WeakPolarHBondContact CE-OE2 3.5Å; M648-E651 PolarHBondContact O-N 3.49Å
652	N	78.2	Confident	82.6	Confident	44 Å²	44	82.1 Å²	82.1	24%	0.235	42%	0.424	C	S	.	.	H	α-helix	trans	-121.4	15.2	-174.2	-50.3	-62.2	0	0	0	113.1	R588 M648 F654	R588-N652 PolarHBondContact NH2-OD1 3.06Å; M648-N652 PolarHBondContact O-N 2.91Å; M648-N652 PolarHBondContact O-ND2 2.94Å; N652-F654 VanDerWaalsContact C-N 3.31Å; N652-F654 HydrophobicContact CB-CD1 4.18Å; N652-F654 HydrophobicContact CB-CD2 4.05Å; N652-F654 HydrophobicContact CB-CE1 3.66Å; N652-F654 HydrophobicContact CB-CE2 3.55Å; N652-F654 HydrophobicContact CB-CG 4.36Å; N652-F654 HydrophobicContact CB-CZ 3.34Å; N652-F654 WeakPolarHBondContact ND2-CE2 3.32Å; N652-F654 WeakPolarHBondContact O-CD1 3.39Å; N652-F654 PolarHBondContact O-N 2.77Å
653	S	78.2	Confident	82.3	Confident	85 Å²	85	79.8 Å²	79.8	59%	0.594	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	38.7	179.5	-55	0	0	0	0	114.3	C649 A669	C649-S653 VanDerWaalsContact O-CA 3.27Å; C649-S653 WeakPolarHBondContact O-CA 3.25Å; C649-S653 PolarHBondContact O-N 3.47Å; S653-A669 WeakPolarHBondContact O-CB 3.49Å
654	F	82.7	Confident	82.2	Confident	21 Å²	21	78 Å²	78	9%	0.092	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	141.9	174.5	-52.8	-40.6	0	0	0	111.3	L591 F614 M648 C649 N652 V666 S667	L591-F654 HydrophobicContact CD1-CD2 3.84Å; L591-F654 HydrophobicContact CD1-CE2 3.62Å; L591-F654 HydrophobicContact CD1-CZ 4.43Å; F614-F654 AromaticContact CD2-CD1 3.85Å; F614-F654 HydrophobicContact CD2-CD1 3.85Å; F614-F654 AromaticContact CD2-CE1 3.48Å; F614-F654 HydrophobicContact CD2-CE1 3.48Å; F614-F654 VanDerWaalsContact CD2-CE1 3.48Å; F614-F654 HydrophobicContact CD2-CZ 4.08Å; F614-F654 AromaticContact CE2-CD1 3.27Å; F614-F654 HydrophobicContact CE2-CD1 3.27Å; F614-F654 HydrophobicContact CE2-CD2 4.17Å; F614-F654 AromaticContact CE2-CE1 3.22Å; F614-F654 HydrophobicContact CE2-CE1 3.22Å; F614-F654 HydrophobicContact CE2-CE2 4.1Å; F614-F654 AromaticContact CE2-CG 3.78Å; F614-F654 HydrophobicContact CE2-CG 3.78Å; F614-F654 AromaticContact CE2-CZ 3.65Å; F614-F654 HydrophobicContact CE2-CZ 3.65Å; F614-F654 HydrophobicContact CZ-CD1 4.06Å; F614-F654 HydrophobicContact CZ-CE1 4.38Å; F614-F654 HydrophobicContact CZ-CG 4.27Å; M648-F654 HydrophobicContact CB-CD2 4.35Å; M648-F654 HydrophobicContact CB-CE2 4.43Å; M648-F654 WeakPolarHBondContact O-CD2 2.99Å; C649-F654 HydrophobicContact CB-CB 4.41Å; C649-F654 WeakPolarHBondContact CB-O 3.17Å; C649-F654 PolarHBondContact O-N 3.17Å; N652-F654 VanDerWaalsContact C-N 3.31Å; N652-F654 HydrophobicContact CB-CD1 4.18Å; N652-F654 HydrophobicContact CB-CD2 4.05Å; N652-F654 HydrophobicContact CB-CE1 3.66Å; N652-F654 HydrophobicContact CB-CE2 3.55Å; N652-F654 HydrophobicContact CB-CG 4.36Å; N652-F654 HydrophobicContact CB-CZ 3.34Å; N652-F654 WeakPolarHBondContact ND2-CE2 3.32Å; N652-F654 WeakPolarHBondContact O-CD1 3.39Å; N652-F654 PolarHBondContact O-N 2.77Å; F654-V666 HydrophobicContact CB-CG1 3.79Å; F654-V666 HydrophobicContact CD2-CG1 4.37Å; F654-V666 HydrophobicContact CG-CG1 4.32Å; F654-S667 CarbonylContact C-O 3.43Å; F654-S667 WeakPolarHBondContact CA-O 3.44Å; F654-S667 WeakPolarHBondContact CB-O 3.44Å
655	R	84	Confident	82	Confident	158 Å²	158	78.8 Å²	78.8	60%	0.596	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	139.4	177	-171.7	178.6	-166.1	-142.4	1.8	111	I657 S667	R655-I657 HydrophobicContact CG-CG1 4.49Å; R655-S667 PolarHBondContact N-O 3.21Å; R655-S667 PolarHBondContact O-N 3.42Å
656	L	86	Confident	81.8	Confident	61 Å²	61	78.8 Å²	78.8	32%	0.319	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	117.1	173.3	-66	161.1	0	0	0	108.7	V645 L646 F664 V666	V645-L656 HydrophobicContact CG1-CD2 4.1Å; L646-L656 HydrophobicContact CD2-CD1 3.83Å; L656-F664 HydrophobicContact CD2-CD2 3.41Å; L656-F664 VanDerWaalsContact CD2-CD2 3.41Å; L656-F664 HydrophobicContact CD2-CE2 3.44Å; L656-F664 VanDerWaalsContact CD2-CE2 3.44Å; L656-F664 HydrophobicContact CD2-CG 4.42Å; L656-F664 HydrophobicContact CD2-CZ 4.48Å; L656-V666 HydrophobicContact CD2-CG2 4.09Å
657	I	84.5	Confident	81.3	Confident	69 Å²	69	76.1 Å²	76.1	35%	0.354	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	110.3	176	-56.5	176.1	0	0	0	107.5	R655 K659 F664 T665 S667	R655-I657 HydrophobicContact CG-CG1 4.49Å; I657-K659 PolarHBondContact O-N 3.47Å; I657-F664 CarbonylContact O-C 3.06Å; I657-F664 WeakPolarHBondContact O-CA 3.22Å; I657-T665 PolarHBondContact N-O 3.13Å; I657-T665 PolarHBondContact O-N 2.94Å; I657-S667 WeakPolarHBondContact CD1-OG 3.27Å
658	P	83	Confident	80.7	Confident	109 Å²	109	76.2 Å²	76.2	71%	0.708	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.6	136.7	176.4	26	-31.9	0	0	0	109.8
659	K	69	Low	79.5	Confident	115 Å²	115	81.8 Å²	81.8	50%	0.5	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	103.8	177.1	-160.8	-179.4	-175.4	-177.2	0	108.2	I657 D663	I657-K659 PolarHBondContact O-N 3.47Å; K659-D663 CarbonylContact C-O 3.51Å; K659-D663 PolarHBondContact N-O 3.08Å; K659-D663 CarbonylContact O-C 3.53Å
660	D	66.5	Low	79.2	Confident	143 Å²	143	85.1 Å²	85.1	77%	0.765	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	168.7	-170.4	-50.9	-41.6	0	0	0	112.9	V662	D660-V662 PolarHBondContact O-N 2.82Å
661	E	70.8	Confident	78.9	Confident	204 Å²	204	82.2 Å²	82.2	95%	0.953	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-7.7	-171.1	-69.6	-176.5	164.4	0	0	114.6
662	V	72.9	Confident	78.5	Confident	142 Å²	142	81.1 Å²	81.1	86%	0.861	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.8	-12.7	-164.2	-143.8	0	0	0	0	114.8	D660	D660-V662 PolarHBondContact O-N 2.82Å
663	D	83.7	Confident	78.5	Confident	34 Å²	34	83.3 Å²	83.3	18%	0.182	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	165.3	-178.6	-157.1	-2	0	0	0	112.2	F619 T620 K659	F619-D663 VanDerWaalsContact CB-OD1 3.32Å; F619-D663 WeakPolarHBondContact CB-OD1 3.28Å; F619-D663 PolarHBondContact N-OD1 3.14Å; T620-D663 WeakPolarHBondContact CB-OD2 3.18Å; T620-D663 PolarHBondContact N-OD1 2.97Å; T620-D663 VanDerWaalsContact OG1-CG 3.26Å; T620-D663 PolarHBondContact OG1-OD2 3.12Å; K659-D663 CarbonylContact C-O 3.51Å; K659-D663 PolarHBondContact N-O 3.08Å; K659-D663 CarbonylContact O-C 3.53Å
664	F	87.9	Confident	78.5	Confident	33 Å²	33	83.2 Å²	83.2	15%	0.145	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	150	174.9	60.5	-91	0	0	0	111.1	F619 F642 V645 L656 I657 V666	F619-F664 HydrophobicContact CB-CD1 4.14Å; F619-F664 HydrophobicContact CB-CD2 4.01Å; F619-F664 HydrophobicContact CB-CE1 3.76Å; F619-F664 HydrophobicContact CB-CE2 3.63Å; F619-F664 HydrophobicContact CB-CG 4.25Å; F619-F664 HydrophobicContact CB-CZ 3.49Å; F619-F664 VanDerWaalsContact CB-CZ 3.49Å; F619-F664 AromaticContact CD1-CE1 3.84Å; F619-F664 HydrophobicContact CD1-CE1 3.84Å; F619-F664 AromaticContact CD1-CZ 3.99Å; F619-F664 HydrophobicContact CD1-CZ 3.99Å; F619-F664 AromaticContact CD2-CE1 3.97Å; F619-F664 HydrophobicContact CD2-CE1 3.97Å; F619-F664 AromaticContact CD2-CE2 3.84Å; F619-F664 HydrophobicContact CD2-CE2 3.84Å; F619-F664 AromaticContact CD2-CZ 3.24Å; F619-F664 HydrophobicContact CD2-CZ 3.24Å; F619-F664 HydrophobicContact CE1-CE1 4.39Å; F619-F664 HydrophobicContact CE2-CE1 4.5Å; F619-F664 AromaticContact CE2-CZ 3.86Å; F619-F664 HydrophobicContact CE2-CZ 3.86Å; F619-F664 HydrophobicContact CG-CD1 4.41Å; F619-F664 AromaticContact CG-CE1 3.59Å; F619-F664 HydrophobicContact CG-CE1 3.59Å; F619-F664 AromaticContact CG-CE2 3.92Å; F619-F664 HydrophobicContact CG-CE2 3.92Å; F619-F664 AromaticContact CG-CZ 3.29Å; F619-F664 HydrophobicContact CG-CZ 3.29Å; F619-F664 HydrophobicContact CZ-CZ 4.46Å; F619-F664 PolarHBondContact N-O 3.41Å; F642-F664 AromaticContact CD2-CE1 3.59Å; F642-F664 HydrophobicContact CD2-CE1 3.59Å; F642-F664 AromaticContact CD2-CZ 3.49Å; F642-F664 HydrophobicContact CD2-CZ 3.49Å; F642-F664 VanDerWaalsContact CD2-CZ 3.49Å; F642-F664 HydrophobicContact CE2-CD1 4.42Å; F642-F664 AromaticContact CE2-CE1 3.57Å; F642-F664 HydrophobicContact CE2-CE1 3.57Å; F642-F664 AromaticContact CE2-CZ 3.63Å; F642-F664 HydrophobicContact CE2-CZ 3.63Å; V645-F664 HydrophobicContact CG1-CE2 4.01Å; V645-F664 HydrophobicContact CG1-CZ 4.49Å; L656-F664 HydrophobicContact CD2-CD2 3.41Å; L656-F664 VanDerWaalsContact CD2-CD2 3.41Å; L656-F664 HydrophobicContact CD2-CE2 3.44Å; L656-F664 VanDerWaalsContact CD2-CE2 3.44Å; L656-F664 HydrophobicContact CD2-CG 4.42Å; L656-F664 HydrophobicContact CD2-CZ 4.48Å; I657-F664 CarbonylContact O-C 3.06Å; I657-F664 WeakPolarHBondContact O-CA 3.22Å; F664-V666 HydrophobicContact CD2-CG2 4.26Å; F664-V666 HydrophobicContact CE2-CG2 4.03Å
665	T	85.8	Confident	78.3	Confident	20 Å²	20	87.3 Å²	87.3	12%	0.123	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	129.8	176.6	-48.4	0	0	0	0	108.8	P616 I657	P616-T665 HydrophobicContact CB-CG2 4.02Å; I657-T665 PolarHBondContact N-O 3.13Å; I657-T665 PolarHBondContact O-N 2.94Å
666	V	83.4	Confident	77.9	Confident	1 Å²	1	82.3 Å²	82.3	1%	0.006	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	116.2	171.7	-169.8	0	0	0	0	107.2	L591 F614 P616 R617 I622 V645 F654 L656 F664	L591-V666 HydrophobicContact CD1-CG1 4.19Å; L591-V666 HydrophobicContact CD2-CB 4.22Å; L591-V666 HydrophobicContact CD2-CG1 4.3Å; F614-V666 VanDerWaalsContact CE1-O 3.29Å; F614-V666 WeakPolarHBondContact CE1-O 3.3Å; F614-V666 HydrophobicContact CZ-CG1 4.14Å; P616-V666 WeakPolarHBondContact CA-O 3.33Å; R617-V666 PolarHBondContact N-O 2.97Å; R617-V666 PolarHBondContact O-N 2.94Å; I622-V666 HydrophobicContact CD1-CG2 4.05Å; V645-V666 HydrophobicContact CG1-CG2 3.75Å; F654-V666 HydrophobicContact CB-CG1 3.79Å; F654-V666 HydrophobicContact CD2-CG1 4.37Å; F654-V666 HydrophobicContact CG-CG1 4.32Å; L656-V666 HydrophobicContact CD2-CG2 4.09Å; F664-V666 HydrophobicContact CD2-CG2 4.26Å; F664-V666 HydrophobicContact CE2-CG2 4.03Å
667	S	79.5	Confident	77.2	Confident	18 Å²	18	83.9 Å²	83.9	13%	0.126	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	159.6	176.3	77.3	0	0	0	0	110.9	F614 F654 R655 I657	F614-S667 VanDerWaalsContact CZ-C 3.48Å; F654-S667 CarbonylContact C-O 3.43Å; F654-S667 WeakPolarHBondContact CA-O 3.44Å; F654-S667 WeakPolarHBondContact CB-O 3.44Å; R655-S667 PolarHBondContact N-O 3.21Å; R655-S667 PolarHBondContact O-N 3.42Å; I657-S667 WeakPolarHBondContact CD1-OG 3.27Å
668	N	75.2	Confident	76.6	Confident	84 Å²	84	85.2 Å²	85.2	45%	0.449	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	149.2	163.3	-152.3	-1.3	0	0	0	108.6	F614	F614-N668 HydrophobicContact CB-CB 3.85Å; F614-N668 HydrophobicContact CD1-CB 3.82Å; F614-N668 VanDerWaalsContact CD1-N 3.27Å; F614-N668 HydrophobicContact CD2-CB 4.07Å; F614-N668 HydrophobicContact CE1-CB 4.44Å; F614-N668 HydrophobicContact CG-CB 3.63Å
669	A	61.9	Low	76	Confident	119 Å²	119	83 Å²	83	98%	0.983	46%	0.463	S	S	*	.			trans	-70	0	174.1	0	0	0	0	0	111.9	S653	S653-A669 WeakPolarHBondContact O-CB 3.49Å

Retrieved 669 of 669 residues in 197.8 ms (Link to these results)

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